ch resi resn atom iso s obs. error shiftx error delta dbase error delta Critique
A 9 MET N 15N 120.02 0.79 120.08 4.24
A 9 MET H 1H 8.16 0.00 8.26 0.61
A 9 MET CA 13C 55.29 0.29 56.23 2.41
A 9 MET HA 1H 4.27 0.06 4.38 0.51
A 9 MET CB 13C 33.89 0.29 33.07 2.97
A 9 MET HB2 1H 2.04 0.06 2.05 0.98
A 9 MET HB3 1H 2.10 0.09 2.04 0.77
A 9 MET QB 1H 2.07 0.07 2.04 0.88
A 9 MET CG 13C 32.06 2.47
A 9 MET HG2 1H 2.47 0.07 2.18 3.64
A 9 MET HG3 1H 2.42 0.08 2.11 3.92
A 9 MET QG 1H 2.44 0.07 2.15 3.78
A 9 MET ME 1H -0.57 0.17 1.13 4.01
A 9 MET CE 13C 17.45 3.91
A 9 MET C 13C 177.02 0.61 176.17 4.64
A 10 ALA N 15N 121.03 1.63 123.26 4.61
A 10 ALA H 1H 8.10 0.24 8.19 0.63
A 10 ALA CA 13C 54.81 0.53 53.20 2.14
A 10 ALA HA 1H 3.82 0.12 4.26 0.45
A 10 ALA MB 1H 1.35 0.01 1.37 0.28
A 10 ALA CB 13C 18.23 0.37 19.04 2.58
A 10 ALA C 13C 176.13 0.25 177.77 2.70
A 11 GLU N 15N 116.97 0.46 120.74 5.49
A 11 GLU H 1H 8.45 0.05 8.35 0.90
A 11 GLU CA 13C 59.68 0.11 57.45 2.24
A 11 GLU HA 1H 4.03 0.21 4.25 0.50
A 11 GLU CB 13C 29.92 0.08 30.08 2.74
A 11 GLU HB2 1H 2.10 0.04 2.04 0.24
A 11 GLU HB3 1H 2.09 0.06 2.02 0.24
A 11 GLU QB 1H 2.09 0.04 2.03 0.24
A 11 GLU CG 13C 36.13 2.61
A 11 GLU HG2 1H 2.43 0.02 2.30 0.23
A 11 GLU HG3 1H 2.42 0.03 2.28 0.24
A 11 GLU QG 1H 2.42 0.02 2.29 0.23
A 11 GLU CD 13C 181.63 12.57
A 11 GLU C 13C 178.03 0.26 176.96 3.39
A 12 VAL N 15N 117.76 0.55 121.36 9.45
A 12 VAL H 1H 7.75 0.30 8.28 0.71
A 12 VAL CA 13C 65.78 0.14 62.50 2.95
A 12 VAL HA 1H 3.63 0.06 4.16 0.64
A 12 VAL CB 13C 31.73 0.11 32.71 2.48
A 12 VAL HB 1H 2.08 0.05 1.99 0.51
A 12 VAL MG1 1H 0.99 0.09 0.83 0.51
A 12 VAL MG2 1H 0.79 0.12 0.80 0.54
A 12 VAL CG1 13C 21.63 3.16
A 12 VAL CG2 13C 21.47 3.04
A 12 VAL C 13C 177.78 0.13 175.76 1.94
A 13 GLU N 15N 118.56 0.50 120.74 5.49
A 13 GLU H 1H 8.43 0.43 8.35 0.90
A 13 GLU CA 13C 59.37 0.08 57.45 2.24
A 13 GLU HA 1H 3.91 0.04 4.25 0.50
A 13 GLU CB 13C 29.10 0.33 30.08 2.74
A 13 GLU HB2 1H 2.12 0.06 2.04 0.24
A 13 GLU HB3 1H 1.96 0.01 2.02 0.24
A 13 GLU QB 1H 2.04 0.03 2.03 0.24
A 13 GLU CG 13C 36.13 2.61
A 13 GLU HG2 1H 2.31 0.03 2.30 0.23
A 13 GLU HG3 1H 2.40 0.07 2.28 0.24
A 13 GLU QG 1H 2.35 0.02 2.29 0.23
A 13 GLU CD 13C 181.63 12.57
A 13 GLU C 13C 178.66 0.12 176.96 3.39
A 14 GLU N 15N 120.02 0.28 120.74 5.49
A 14 GLU H 1H 9.20 0.18 8.35 0.90
A 14 GLU CA 13C 59.95 0.07 57.45 2.24
A 14 GLU HA 1H 3.91 0.01 4.25 0.50
A 14 GLU CB 13C 29.62 0.07 30.08 2.74
A 14 GLU HB2 1H 2.18 0.10 2.04 0.24
A 14 GLU HB3 1H 1.96 0.01 2.02 0.24
A 14 GLU QB 1H 2.07 0.05 2.03 0.24
A 14 GLU CG 13C 36.13 2.61
A 14 GLU HG2 1H 2.31 0.00 2.30 0.23
A 14 GLU HG3 1H 2.42 0.05 2.28 0.24
A 14 GLU QG 1H 2.36 0.02 2.29 0.23
A 14 GLU CD 13C 181.63 12.57
A 14 GLU C 13C 179.14 0.12 176.96 3.39
A 15 THR N 15N 114.49 1.04 115.66 5.40
A 15 THR H 1H 7.79 0.13 8.26 0.66
A 15 THR CA 13C 65.84 0.59 62.19 2.75
A 15 THR HA 1H 3.97 0.13 4.47 0.50
A 15 THR CB 13C 67.90 0.49 69.62 7.53
A 15 THR HB 1H 4.45 0.04 4.19 1.09
A 15 THR MG 1H 1.23 0.02 1.16 0.41
A 15 THR HG1 1H 5.24 1.93
A 15 THR CG2 13C 21.61 2.80
A 15 THR C 13C 176.42 0.33 174.63 1.79
A 16 LEU N 15N 122.31 0.71 121.95 7.60
A 16 LEU H 1H 8.01 0.21 8.22 0.67
A 16 LEU CA 13C 57.96 0.29 55.63 2.21
A 16 LEU HA 1H 3.97 0.09 4.32 0.49
A 16 LEU CB 13C 41.79 0.23 42.32 2.44
A 16 LEU HB2 1H 1.93 0.05 1.64 0.40
A 16 LEU HB3 1H 1.70 0.05 1.55 0.40
A 16 LEU QB 1H 1.81 0.03 1.59 0.40
A 16 LEU CG 13C 26.80 2.46
A 16 LEU HG 1H 1.61 0.17 1.52 0.37
A 16 LEU MD1 1H 0.91 0.03 0.76 0.38
A 16 LEU MD2 1H 0.64 0.17 0.73 0.40
A 16 LEU CD1 13C 24.71 2.86
A 16 LEU CD2 13C 24.22 2.87
A 16 LEU C 13C 179.19 0.24 177.00 2.02
A 17 LYS N 15N 118.15 0.66 121.13 4.38
A 17 LYS H 1H 8.00 0.17 8.19 0.64
A 17 LYS CA 13C 59.52 0.20 56.90 2.29
A 17 LYS HA 1H 3.99 0.17 4.27 0.47
A 17 LYS CB 13C 31.91 0.20 32.82 2.49
A 17 LYS HB2 1H 1.88 0.12 1.79 0.29
A 17 LYS HB3 1H 1.86 0.04 1.76 0.30
A 17 LYS QB 1H 1.87 0.06 1.77 0.29
A 17 LYS CG 13C 24.99 2.52
A 17 LYS HG2 1H 1.46 0.01 1.38 0.29
A 17 LYS HG3 1H 1.48 0.04 1.36 0.31
A 17 LYS QG 1H 1.47 0.02 1.37 0.30
A 17 LYS CD 13C 28.97 2.41
A 17 LYS HD2 1H 1.69 0.09 1.63 1.43
A 17 LYS HD3 1H 1.60 0.04 1.60 0.27
A 17 LYS QD 1H 1.64 0.06 1.61 0.85
A 17 LYS CE 13C 41.92 2.26
A 17 LYS HE2 1H 2.97 0.04 2.93 0.24
A 17 LYS HE3 1H 2.95 0.04 2.92 0.25
A 17 LYS QE 1H 2.96 0.03 2.92 0.24
A 17 LYS NZ 15N 48.17 36.38
A 17 LYS HZ1 1H 7.81 0.00 7.43 1.14
A 17 LYS HZ2 1H 3.34 0.23
A 17 LYS HZ3 1H 3.49 0.37
A 17 LYS QZ 1H 7.43 1.14
A 17 LYS C 13C 178.98 0.35 176.81 10.32
A 18 ARG N 15N 117.27 1.14 120.72 4.01
A 18 ARG H 1H 7.43 0.22 8.24 0.61
A 18 ARG CA 13C 59.42 0.18 56.84 2.52
A 18 ARG HA 1H 3.96 0.08 4.29 0.48
A 18 ARG CB 13C 30.04 0.23 30.71 2.60
A 18 ARG HB2 1H 1.90 0.15 1.80 0.30
A 18 ARG HB3 1H 2.10 0.05 1.78 0.29
A 18 ARG QB 1H 2.00 0.07 1.79 0.29
A 18 ARG CG 13C 27.38 2.59
A 18 ARG HG2 1H 1.65 0.05 1.58 0.28
A 18 ARG HG3 1H 1.69 0.04 1.56 0.30
A 18 ARG QG 1H 1.67 0.03 1.57 0.29
A 18 ARG CD 13C 43.21 2.27
A 18 ARG HD2 1H 3.21 0.11 3.12 0.30
A 18 ARG HD3 1H 3.20 0.03 3.11 0.28
A 18 ARG QD 1H 3.20 0.07 3.12 0.29
A 18 ARG NE 15N 93.79 15.46
A 18 ARG HE 1H 7.55 0.01 7.33 0.64
A 18 ARG CZ 13C 159.16 1.00
A 18 ARG NH1 15N 74.22 7.70
A 18 ARG HH11 1H 6.85 0.51
A 18 ARG HH12 1H 6.79 0.48
A 18 ARG QH1 1H 6.82 0.49
A 18 ARG NH2 15N 75.18 10.68
A 18 ARG HH21 1H 6.79 0.47
A 18 ARG HH22 1H 6.77 0.50
A 18 ARG QH2 1H 6.78 0.48
A 18 ARG C 13C 178.41 0.19 176.43 4.30
A 19 LEU N 15N 119.04 0.47 121.95 7.60
A 19 LEU H 1H 8.23 0.27 8.22 0.67
A 19 LEU CA 13C 57.90 0.13 55.63 2.21
A 19 LEU HA 1H 4.08 0.06 4.32 0.49
A 19 LEU CB 13C 41.56 0.07 42.32 2.44
A 19 LEU HB2 1H 1.84 0.09 1.64 0.40
A 19 LEU HB3 1H 1.69 0.02 1.55 0.40
A 19 LEU QB 1H 1.76 0.05 1.59 0.40
A 19 LEU CG 13C 26.80 2.46
A 19 LEU HG 1H 1.65 0.12 1.52 0.37
A 19 LEU MD1 1H 0.94 0.03 0.76 0.38
A 19 LEU MD2 1H 0.92 0.28 0.73 0.40
A 19 LEU CD1 13C 24.71 2.86
A 19 LEU CD2 13C 24.22 2.87
A 19 LEU C 13C 179.33 0.13 177.00 2.02
A 20 GLN N 15N 116.88 0.59 119.84 4.03
A 20 GLN H 1H 8.93 0.27 8.21 0.62
A 20 GLN CA 13C 58.13 0.42 56.56 2.32
A 20 GLN HA 1H 3.98 0.30 4.29 0.45
A 20 GLN CB 13C 28.71 0.05 29.26 2.44
A 20 GLN HB2 1H 2.10 0.06 2.05 0.28
A 20 GLN HB3 1H 2.16 0.01 2.04 0.40
A 20 GLN QB 1H 2.13 0.03 2.04 0.34
A 20 GLN CG 13C 33.81 2.59
A 20 GLN HG2 1H 2.47 0.08 2.32 0.30
A 20 GLN HG3 1H 2.49 0.05 2.30 0.32
A 20 GLN QG 1H 2.48 0.06 2.31 0.31
A 20 GLN CD 13C 179.63 1.41
A 20 GLN NE2 15N 111.79 3.40
A 20 GLN HE21 1H 7.37 0.20 7.19 0.51
A 20 GLN HE22 1H 6.80 0.10 7.05 0.50
A 20 GLN QE 1H 7.12 0.51
A 20 GLN C 13C 178.08 0.49 176.38 1.95
A 21 SER N 15N 114.50 1.06 116.35 3.99
A 21 SER H 1H 7.69 0.23 8.29 0.67
A 21 SER CA 13C 57.98 0.88 58.64 2.21
A 21 SER HA 1H 4.55 0.10 4.50 0.43
A 21 SER CB 13C 63.64 0.49 63.81 2.44
A 21 SER HB2 1H 4.11 0.06 3.88 0.30
A 21 SER HB3 1H 3.90 0.01 3.85 0.31
A 21 SER QB 1H 4.00 0.03 3.87 0.30
A 21 SER HG 1H 5.65 1.54
A 21 SER C 13C 173.75 0.23 174.69 1.79
A 22 GLN N 15N 121.24 0.70 119.84 4.03
A 22 GLN H 1H 7.99 0.34 8.21 0.62
A 22 GLN CA 13C 54.04 0.52 56.56 2.32
A 22 GLN HA 1H 4.50 0.18 4.29 0.45
A 22 GLN CB 13C 30.02 0.58 29.26 2.44
A 22 GLN HB2 1H 2.12 0.07 2.05 0.28
A 22 GLN HB3 1H 2.20 0.13 2.04 0.40
A 22 GLN QB 1H 2.16 0.08 2.04 0.34
A 22 GLN CG 13C 33.81 2.59
A 22 GLN HG2 1H 2.36 0.03 2.32 0.30
A 22 GLN HG3 1H 2.34 0.12 2.30 0.32
A 22 GLN QG 1H 2.35 0.06 2.31 0.31
A 22 GLN CD 13C 179.63 1.41
A 22 GLN NE2 15N 111.79 3.40
A 22 GLN HE21 1H 7.57 0.32 7.19 0.51
A 22 GLN HE22 1H 6.87 0.14 7.05 0.50
A 22 GLN QE 1H 7.12 0.51
A 22 GLN C 13C 175.34 0.42 176.38 1.95
A 23 LYS N 15N 121.99 1.79 121.13 4.38
A 23 LYS H 1H 8.48 0.26 8.19 0.64
A 23 LYS CA 13C 56.71 1.16 56.90 2.29
A 23 LYS HA 1H 4.23 0.14 4.27 0.47
A 23 LYS CB 13C 33.05 0.51 32.82 2.49
A 23 LYS HB2 1H 1.74 0.04 1.79 0.29
A 23 LYS HB3 1H 1.75 0.04 1.76 0.30
A 23 LYS QB 1H 1.74 0.04 1.77 0.29
A 23 LYS CG 13C 24.99 2.52
A 23 LYS HG2 1H 1.40 0.05 1.38 0.29
A 23 LYS HG3 1H 1.43 0.03 1.36 0.31
A 23 LYS QG 1H 1.41 0.04 1.37 0.30
A 23 LYS CD 13C 28.97 2.41
A 23 LYS HD2 1H 1.74 0.07 1.63 1.43
A 23 LYS HD3 1H 1.71 0.00 1.60 0.27
A 23 LYS QD 1H 1.72 0.04 1.61 0.85
A 23 LYS CE 13C 41.92 2.26
A 23 LYS HE2 1H 3.03 0.04 2.93 0.24
A 23 LYS HE3 1H 3.06 0.04 2.92 0.25
A 23 LYS QE 1H 3.05 0.03 2.92 0.24
A 23 LYS NZ 15N 48.17 36.38
A 23 LYS HZ1 1H 7.81 0.00 7.43 1.14
A 23 LYS HZ2 1H 3.02 0.30
A 23 LYS HZ3 1H 2.60 0.52
A 23 LYS QZ 1H 7.43 1.14
A 23 LYS C 13C 175.45 0.85 176.81 10.32
A 24 GLY N 15N 114.48 5.10 109.71 4.79
A 24 GLY H 1H 9.04 0.34 8.33 1.28
A 24 GLY CA 13C 45.95 0.46 45.42 2.23
A 24 GLY HA2 1H 3.97 0.02 3.96 0.44
A 24 GLY HA3 1H 3.96 0.00 3.89 0.48
A 24 GLY QA 1H 3.97 0.01 3.92 0.46
A 24 GLY C 13C 173.11 1.23 173.97 4.12
A 25 VAL N 15N 119.64 0.91 121.36 9.45
A 25 VAL H 1H 7.25 0.40 8.28 0.71
A 25 VAL CA 13C 62.44 1.10 62.50 2.95
A 25 VAL HA 1H 3.98 0.36 4.16 0.64
A 25 VAL CB 13C 31.77 0.85 32.71 2.48
A 25 VAL HB 1H 2.11 0.06 1.99 0.51
A 25 VAL MG1 1H 0.88 0.15 0.83 0.51
A 25 VAL MG2 1H 0.99 0.04 0.80 0.54
A 25 VAL CG1 13C 21.63 3.16
A 25 VAL CG2 13C 21.47 3.04
A 25 VAL C 13C 175.31 0.28 175.76 1.94
A 26 GLN N 15N 127.25 0.78 119.84 4.03
A 26 GLN H 1H 9.02 0.40 8.21 0.62
A 26 GLN CA 13C 57.75 0.42 56.56 2.32
A 26 GLN HA 1H 4.17 0.12 4.29 0.45
A 26 GLN CB 13C 29.36 0.50 29.26 2.44
A 26 GLN HB2 1H 2.06 0.09 2.05 0.28
A 26 GLN HB3 1H 2.16 0.03 2.04 0.40
A 26 GLN QB 1H 2.11 0.05 2.04 0.34
A 26 GLN CG 13C 33.81 2.59
A 26 GLN HG2 1H 2.39 0.03 2.32 0.30
A 26 GLN HG3 1H 2.44 0.09 2.30 0.32
A 26 GLN QG 1H 2.41 0.05 2.31 0.31
A 26 GLN CD 13C 179.63 1.41
A 26 GLN NE2 15N 111.79 3.40
A 26 GLN HE21 1H 7.60 0.17 7.19 0.51
A 26 GLN HE22 1H 6.69 0.10 7.05 0.50
A 26 GLN QE 1H 7.12 0.51
A 26 GLN C 13C 176.59 0.56 176.38 1.95
A 27 GLY N 15N 103.31 0.97 109.71 4.79
A 27 GLY H 1H 7.05 0.22 8.33 1.28
A 27 GLY CA 13C 46.13 0.36 45.42 2.23
A 27 GLY HA2 1H 3.91 0.05 3.96 0.44
A 27 GLY HA3 1H 3.95 0.06 3.89 0.48
A 27 GLY QA 1H 3.93 0.05 3.92 0.46
A 27 GLY C 13C 172.12 0.30 173.97 4.12
A 28 ILE N 15N 120.51 1.29 121.59 4.86
A 28 ILE H 1H 7.94 0.37 8.28 0.71
A 28 ILE CA 13C 59.45 0.11 61.60 2.78
A 28 ILE HA 1H 4.98 0.13 4.19 0.58
A 28 ILE CB 13C 40.88 0.39 38.66 2.75
A 28 ILE HB 1H 1.83 0.01 1.80 0.54
A 28 ILE MG 1H 0.92 0.03 0.78 0.40
A 28 ILE CG2 13C 17.67 2.92
A 28 ILE CG1 13C 27.80 3.81
A 28 ILE HG12 1H 1.24 0.06 1.26 0.62
A 28 ILE HG13 1H 0.84 0.17 1.22 0.73
A 28 ILE QG 1H 1.04 0.09 1.24 0.68
A 28 ILE MD 1H 0.84 0.01 0.67 0.45
A 28 ILE CD1 13C 13.69 3.60
A 28 ILE C 13C 174.92 0.17 175.94 1.93
A 29 ILE N 15N 126.34 2.88 121.59 4.86
A 29 ILE H 1H 8.77 0.36 8.28 0.71
A 29 ILE CA 13C 59.49 0.40 61.60 2.78
A 29 ILE HA 1H 5.12 0.14 4.19 0.58
A 29 ILE CB 13C 41.54 0.79 38.66 2.75
A 29 ILE HB 1H 1.76 0.06 1.80 0.54
A 29 ILE MG 1H 0.94 0.04 0.78 0.40
A 29 ILE CG2 13C 17.67 2.92
A 29 ILE CG1 13C 27.80 3.81
A 29 ILE HG12 1H 1.21 0.10 1.26 0.62
A 29 ILE HG13 1H 0.85 0.22 1.22 0.73
A 29 ILE QG 1H 1.03 0.12 1.24 0.68
A 29 ILE MD 1H 0.66 0.21 0.67 0.45
A 29 ILE CD1 13C 13.69 3.60
A 29 ILE C 13C 175.12 0.39 175.94 1.93
A 30 VAL N 15N 124.18 0.68 121.36 9.45
A 30 VAL H 1H 8.49 0.18 8.28 0.71
A 30 VAL CA 13C 60.80 0.29 62.50 2.95
A 30 VAL HA 1H 4.63 0.24 4.16 0.64
A 30 VAL CB 13C 34.15 0.48 32.71 2.48
A 30 VAL HB 1H 1.99 0.03 1.99 0.51
A 30 VAL MG1 1H 0.68 0.09 0.83 0.51
A 30 VAL MG2 1H 0.66 0.09 0.80 0.54
A 30 VAL CG1 13C 21.63 3.16
A 30 VAL CG2 13C 21.47 3.04
A 30 VAL C 13C 174.17 0.55 175.76 1.94
A 31 VAL N 15N 123.28 3.48 121.36 9.45
A 31 VAL H 1H 8.39 0.21 8.28 0.71
A 31 VAL CA 13C 60.54 1.17 62.50 2.95
A 31 VAL HA 1H 4.90 0.33 4.16 0.64
A 31 VAL CB 13C 34.67 0.96 32.71 2.48
A 31 VAL HB 1H 2.23 0.07 1.99 0.51
A 31 VAL MG1 1H 1.02 0.22 0.83 0.51
A 31 VAL MG2 1H 1.00 0.05 0.80 0.54
A 31 VAL CG1 13C 21.63 3.16
A 31 VAL CG2 13C 21.47 3.04
A 31 VAL C 13C 174.75 0.65 175.76 1.94
A 32 ASN N 15N 122.28 1.24 119.08 4.27
A 32 ASN H 1H 8.89 0.27 8.41 5.00
A 32 ASN CA 13C 52.11 0.68 53.52 2.25
A 32 ASN HA 1H 5.03 0.20 4.68 0.38
A 32 ASN CB 13C 39.62 0.88 38.77 2.92
A 32 ASN HB2 1H 2.86 0.11 2.81 0.35
A 32 ASN HB3 1H 2.83 0.13 2.76 0.36
A 32 ASN QB 1H 2.85 0.09 2.79 0.35
A 32 ASN CG 13C 176.69 3.20
A 32 ASN ND2 15N 112.86 3.42
A 32 ASN HD21 1H 6.82 0.45 7.33 0.54
A 32 ASN HD22 1H 7.29 0.48 7.17 0.55
A 32 ASN QD 1H 7.25 0.55
A 32 ASN C 13C 175.95 0.40 175.31 3.37
A 33 THR N 15N 112.61 3.23 115.66 5.40
A 33 THR H 1H 8.52 0.38 8.26 0.66
A 33 THR CA 13C 65.50 0.73 62.19 2.75
A 33 THR HA 1H 3.89 0.24 4.47 0.50
A 33 THR CB 13C 68.06 0.41 69.62 7.53
A 33 THR HB 1H 4.22 0.10 4.19 1.09
A 33 THR MG 1H 1.17 0.12 1.16 0.41
A 33 THR HG1 1H 5.24 1.93
A 33 THR CG2 13C 21.61 2.80
A 33 THR C 13C 174.85 0.40 174.63 1.79
A 34 GLU N 15N 120.82 0.70 120.74 5.49
A 34 GLU H 1H 7.87 0.44 8.35 0.90
A 34 GLU CA 13C 57.51 2.06 57.45 2.24
A 34 GLU HA 1H 4.10 0.11 4.25 0.50
A 34 GLU CB 13C 29.84 0.26 30.08 2.74
A 34 GLU HB2 1H 2.01 0.07 2.04 0.24
A 34 GLU HB3 1H 2.00 0.11 2.02 0.24
A 34 GLU QB 1H 2.01 0.07 2.03 0.24
A 34 GLU CG 13C 36.13 2.61
A 34 GLU HG2 1H 2.33 0.01 2.30 0.23
A 34 GLU HG3 1H 2.30 0.05 2.28 0.24
A 34 GLU QG 1H 2.32 0.03 2.29 0.23
A 34 GLU CD 13C 181.63 12.57
A 34 GLU C 13C 177.09 0.47 176.96 3.39
A 35 GLY N 15N 111.38 6.54 109.71 4.79
A 35 GLY H 1H 7.76 0.88 8.33 1.28
A 35 GLY CA 13C 46.03 0.80 45.42 2.23
A 35 GLY HA2 1H 4.00 0.04 3.96 0.44
A 35 GLY HA3 1H 4.05 0.06 3.89 0.48
A 35 GLY QA 1H 4.02 0.05 3.92 0.46
A 35 GLY C 13C 172.90 0.59 173.97 4.12
A 36 ILE N 15N 121.75 0.97 121.59 4.86
A 36 ILE H 1H 7.70 0.57 8.28 0.71
A 36 ILE CA 13C 58.84 0.65 61.60 2.78
A 36 ILE HA 1H 4.30 0.17 4.19 0.58
A 36 ILE CB 13C 38.63 0.79 38.66 2.75
A 36 ILE HB 1H 1.91 0.04 1.80 0.54
A 36 ILE MG 1H 0.92 0.01 0.78 0.40
A 36 ILE CG2 13C 17.67 2.92
A 36 ILE CG1 13C 27.80 3.81
A 36 ILE HG12 1H 1.46 0.05 1.26 0.62
A 36 ILE HG13 1H 0.80 0.17 1.22 0.73
A 36 ILE QG 1H 1.13 0.08 1.24 0.68
A 36 ILE MD 1H 0.87 0.01 0.67 0.45
A 36 ILE CD1 13C 13.69 3.60
A 36 ILE C 13C 174.04 0.54 175.94 1.93
A 37 PRO N 15N 132.86 19.46
A 37 PRO CD 13C 50.38 3.59
A 37 PRO CA 13C 61.68 0.90 63.25 1.89
A 37 PRO HA 1H 5.14 0.30 4.40 0.38
A 37 PRO CB 13C 30.47 1.25 31.75 0.98
A 37 PRO HB2 1H 2.18 0.01 2.07 0.41
A 37 PRO HB3 1H 2.09 0.03 2.02 0.44
A 37 PRO QB 1H 2.13 0.02 2.04 0.42
A 37 PRO CG 13C 27.26 1.05
A 37 PRO HG2 1H 1.99 0.01 1.92 0.38
A 37 PRO HG3 1H 1.95 0.02 1.90 0.40
A 37 PRO QG 1H 1.97 0.01 1.91 0.39
A 37 PRO HD2 1H 3.61 0.17 3.60 0.69
A 37 PRO HD3 1H 4.17 0.35 3.58 0.69
A 37 PRO QD 1H 3.89 0.09 3.59 0.69
A 37 PRO C 13C 175.57 0.22 176.75 1.69
A 38 ILE N 15N 118.13 1.91 121.59 4.86
A 38 ILE H 1H 8.34 0.59 8.28 0.71
A 38 ILE CA 13C 63.12 1.17 61.60 2.78
A 38 ILE HA 1H 3.99 0.22 4.19 0.58
A 38 ILE CB 13C 38.57 0.68 38.66 2.75
A 38 ILE HB 1H 1.79 0.02 1.80 0.54
A 38 ILE MG 1H 0.89 0.03 0.78 0.40
A 38 ILE CG2 13C 17.67 2.92
A 38 ILE CG1 13C 27.80 3.81
A 38 ILE HG12 1H 1.15 0.11 1.26 0.62
A 38 ILE HG13 1H 0.64 0.05 1.22 0.73
A 38 ILE QG 1H 0.90 0.06 1.24 0.68
A 38 ILE MD 1H 0.59 0.07 0.67 0.45
A 38 ILE CD1 13C 13.69 3.60
A 38 ILE C 13C 176.33 0.52 175.94 1.93
A 39 LYS N 15N 121.62 0.75 121.13 4.38
A 39 LYS H 1H 7.52 0.10 8.19 0.64
A 39 LYS CA 13C 54.56 0.14 56.90 2.29
A 39 LYS HA 1H 4.70 0.05 4.27 0.47
A 39 LYS CB 13C 36.12 0.11 32.82 2.49
A 39 LYS HB2 1H 1.71 0.05 1.79 0.29
A 39 LYS HB3 1H 1.57 0.02 1.76 0.30
A 39 LYS QB 1H 1.64 0.02 1.77 0.29
A 39 LYS CG 13C 24.99 2.52
A 39 LYS HG2 1H 1.34 0.01 1.38 0.29
A 39 LYS HG3 1H 1.35 0.07 1.36 0.31
A 39 LYS QG 1H 1.35 0.03 1.37 0.30
A 39 LYS CD 13C 28.97 2.41
A 39 LYS HD2 1H 1.68 0.09 1.63 1.43
A 39 LYS HD3 1H 1.74 0.05 1.60 0.27
A 39 LYS QD 1H 1.71 0.05 1.61 0.85
A 39 LYS CE 13C 41.92 2.26
A 39 LYS HE2 1H 2.88 0.12 2.93 0.24
A 39 LYS HE3 1H 3.00 0.08 2.92 0.25
A 39 LYS QE 1H 2.94 0.06 2.92 0.24
A 39 LYS NZ 15N 48.17 36.38
A 39 LYS HZ1 1H 7.81 0.00 7.43 1.14
A 39 LYS HZ2 1H 3.22 0.18
A 39 LYS HZ3 1H 4.32 0.19
A 39 LYS QZ 1H 7.43 1.14
A 39 LYS C 13C 175.26 0.22 176.81 10.32
A 40 SER N 15N 115.90 1.02 116.35 3.99
A 40 SER H 1H 8.21 0.12 8.29 0.67
A 40 SER CA 13C 57.94 0.42 58.64 2.21
A 40 SER HA 1H 4.90 0.24 4.50 0.43
A 40 SER CB 13C 65.21 0.79 63.81 2.44
A 40 SER HB2 1H 3.82 0.05 3.88 0.30
A 40 SER HB3 1H 3.70 0.05 3.85 0.31
A 40 SER QB 1H 3.76 0.04 3.87 0.30
A 40 SER HG 1H 5.65 1.54
A 40 SER C 13C 175.02 0.42 174.69 1.79
A 41 THR N 15N 118.88 3.67 115.66 5.40
A 41 THR H 1H 8.82 0.42 8.26 0.66
A 41 THR CA 13C 62.29 0.62 62.19 2.75
A 41 THR HA 1H 4.25 0.11 4.47 0.50
A 41 THR CB 13C 68.33 1.32 69.62 7.53
A 41 THR HB 1H 4.22 0.01 4.19 1.09
A 41 THR MG 1H 1.23 0.04 1.16 0.41
A 41 THR HG1 1H 5.24 1.93
A 41 THR CG2 13C 21.61 2.80
A 41 THR C 13C 174.70 0.78 174.63 1.79
A 42 MET N 15N 120.88 1.45 120.08 4.24
A 42 MET H 1H 8.34 0.20 8.26 0.61
A 42 MET CA 13C 56.56 1.16 56.23 2.41
A 42 MET HA 1H 4.04 0.21 4.38 0.51
A 42 MET CB 13C 32.43 0.93 33.07 2.97
A 42 MET HB2 1H 2.04 0.09 2.05 0.98
A 42 MET HB3 1H 1.97 0.07 2.04 0.77
A 42 MET QB 1H 2.00 0.07 2.04 0.88
A 42 MET CG 13C 32.06 2.47
A 42 MET HG2 1H 2.52 0.21 2.18 3.64
A 42 MET HG3 1H 2.49 0.15 2.11 3.92
A 42 MET QG 1H 2.50 0.17 2.15 3.78
A 42 MET ME 1H 0.35 0.12 1.13 4.01
A 42 MET CE 13C 17.45 3.91
A 42 MET C 13C 175.73 0.86 176.17 4.64
A 43 ASP N 15N 121.65 3.35 120.78 4.25
A 43 ASP H 1H 7.02 0.59 8.33 0.60
A 43 ASP CA 13C 53.48 0.55 54.66 2.13
A 43 ASP HA 1H 4.61 0.22 4.61 0.34
A 43 ASP CB 13C 46.81 0.84 40.88 2.57
A 43 ASP HB2 1H 2.66 0.07 2.77 1.04
A 43 ASP HB3 1H 2.57 0.04 2.71 1.05
A 43 ASP QB 1H 2.62 0.04 2.74 1.04
A 43 ASP CG 13C 179.34 1.44
A 43 ASP C 13C 177.08 0.80 176.48 1.76
A 44 ASN N 15N 124.66 3.69 119.08 4.27
A 44 ASN H 1H 7.96 0.43 8.41 5.00
A 44 ASN CA 13C 54.50 0.86 53.52 2.25
A 44 ASN HA 1H 4.99 0.32 4.68 0.38
A 44 ASN CB 13C 38.80 0.35 38.77 2.92
A 44 ASN HB2 1H 2.84 0.06 2.81 0.35
A 44 ASN HB3 1H 2.86 0.04 2.76 0.36
A 44 ASN QB 1H 2.85 0.04 2.79 0.35
A 44 ASN CG 13C 176.69 3.20
A 44 ASN ND2 15N 112.86 3.42
A 44 ASN HD21 1H 6.79 0.11 7.33 0.54
A 44 ASN HD22 1H 7.95 0.14 7.17 0.55
A 44 ASN QD 1H 7.25 0.55
A 44 ASN C 13C 175.20 0.42 175.31 3.37
A 45 PRO N 15N 132.86 19.46
A 45 PRO CD 13C 50.38 3.59
A 45 PRO CA 13C 66.29 0.15 63.25 1.89
A 45 PRO HA 1H 4.25 0.11 4.40 0.38
A 45 PRO CB 13C 31.91 0.23 31.75 0.98
A 45 PRO HB2 1H 2.25 0.03 2.07 0.41
A 45 PRO HB3 1H 2.29 0.01 2.02 0.44
A 45 PRO QB 1H 2.27 0.02 2.04 0.42
A 45 PRO CG 13C 27.26 1.05
A 45 PRO HG2 1H 2.07 0.02 1.92 0.38
A 45 PRO HG3 1H 2.03 0.03 1.90 0.40
A 45 PRO QG 1H 2.05 0.02 1.91 0.39
A 45 PRO HD2 1H 3.76 0.07 3.60 0.69
A 45 PRO HD3 1H 3.78 0.03 3.58 0.69
A 45 PRO QD 1H 3.77 0.05 3.59 0.69
A 45 PRO C 13C 178.28 0.10 176.75 1.69
A 46 THR N 15N 116.06 0.40 115.66 5.40
A 46 THR H 1H 8.03 0.08 8.26 0.66
A 46 THR CA 13C 66.51 0.15 62.19 2.75
A 46 THR HA 1H 3.85 0.12 4.47 0.50
A 46 THR CB 13C 68.13 0.13 69.62 7.53
A 46 THR HB 1H 4.28 0.08 4.19 1.09
A 46 THR MG 1H 1.28 0.23 1.16 0.41
A 46 THR HG1 1H 5.24 1.93
A 46 THR CG2 13C 21.61 2.80
A 46 THR C 13C 176.39 0.06 174.63 1.79
A 47 THR N 15N 116.74 0.94 115.66 5.40
A 47 THR H 1H 7.71 0.18 8.26 0.66
A 47 THR CA 13C 66.58 0.14 62.19 2.75
A 47 THR HA 1H 4.07 0.08 4.47 0.50
A 47 THR CB 13C 68.38 0.08 69.62 7.53
A 47 THR HB 1H 4.45 0.09 4.19 1.09
A 47 THR MG 1H 1.24 0.02 1.16 0.41
A 47 THR HG1 1H 5.24 1.93
A 47 THR CG2 13C 21.61 2.80
A 47 THR C 13C 176.49 0.14 174.63 1.79
A 48 THR N 15N 115.63 0.20 115.66 5.40
A 48 THR H 1H 8.24 0.26 8.26 0.66
A 48 THR CA 13C 65.13 0.07 62.19 2.75
A 48 THR HA 1H 3.92 0.13 4.47 0.50
A 48 THR CB 13C 67.30 0.14 69.62 7.53
A 48 THR HB 1H 4.35 0.07 4.19 1.09
A 48 THR MG 1H 1.24 0.03 1.16 0.41
A 48 THR HG1 1H 5.24 1.93
A 48 THR CG2 13C 21.61 2.80
A 48 THR C 13C 175.83 0.13 174.63 1.79
A 49 GLN N 15N 120.80 0.16 119.84 4.03
A 49 GLN H 1H 7.94 0.11 8.21 0.62
A 49 GLN CA 13C 59.52 0.11 56.56 2.32
A 49 GLN HA 1H 3.87 0.05 4.29 0.45
A 49 GLN CB 13C 28.98 0.12 29.26 2.44
A 49 GLN HB2 1H 2.02 0.11 2.05 0.28
A 49 GLN HB3 1H 1.76 0.21 2.04 0.40
A 49 GLN QB 1H 1.89 0.16 2.04 0.34
A 49 GLN CG 13C 33.81 2.59
A 49 GLN HG2 1H 2.33 0.06 2.32 0.30
A 49 GLN HG3 1H 2.36 0.06 2.30 0.32
A 49 GLN QG 1H 2.34 0.05 2.31 0.31
A 49 GLN CD 13C 179.63 1.41
A 49 GLN NE2 15N 111.79 3.40
A 49 GLN HE21 1H 7.27 0.08 7.19 0.51
A 49 GLN HE22 1H 6.53 0.08 7.05 0.50
A 49 GLN QE 1H 7.12 0.51
A 49 GLN C 13C 177.66 0.18 176.38 1.95
A 50 TYR N 15N 115.94 0.45 121.13 12.29
A 50 TYR H 1H 7.59 0.36 8.34 0.75
A 50 TYR CA 13C 60.96 0.15 58.05 2.79
A 50 TYR HA 1H 4.16 0.15 4.63 0.58
A 50 TYR CB 13C 37.95 0.06 39.40 3.08
A 50 TYR HB2 1H 3.09 0.09 2.91 0.50
A 50 TYR HB3 1H 2.87 0.05 2.88 0.50
A 50 TYR QB 1H 2.98 0.04 2.90 0.50
A 50 TYR QD 1H 6.89 0.54
A 50 TYR QE 1H 6.67 0.49
A 50 TYR CG 13C 129.12 2.53
A 50 TYR CD1 13C 131.95 7.41
A 50 TYR HD1 1H 6.90 0.52
A 50 TYR CE1 13C 117.57 4.52
A 50 TYR HE1 1H 6.68 0.47
A 50 TYR CZ 13C 153.34 18.84
A 50 TYR CE2 13C 117.46 5.18
A 50 TYR HE2 1H 6.67 0.51
A 50 TYR CD2 13C 131.52 9.26
A 50 TYR HD2 1H 6.89 0.57
A 50 TYR HH 1H 9.08 3.03
A 50 TYR C 13C 177.88 0.12 175.41 3.96
A 51 ALA N 15N 121.59 0.40 123.26 4.61
A 51 ALA H 1H 8.72 0.20 8.19 0.63
A 51 ALA CA 13C 55.79 0.11 53.20 2.14
A 51 ALA HA 1H 4.17 0.03 4.26 0.45
A 51 ALA MB 1H 1.37 0.02 1.37 0.28
A 51 ALA CB 13C 18.48 0.32 19.04 2.58
A 51 ALA C 13C 179.53 0.12 177.77 2.70
A 52 SER N 15N 110.21 1.12 116.35 3.99
A 52 SER H 1H 8.03 0.16 8.29 0.67
A 52 SER CA 13C 60.06 0.48 58.64 2.21
A 52 SER HA 1H 4.27 0.05 4.50 0.43
A 52 SER CB 13C 63.62 0.32 63.81 2.44
A 52 SER HB2 1H 4.00 0.08 3.88 0.30
A 52 SER HB3 1H 3.92 0.03 3.85 0.31
A 52 SER QB 1H 3.96 0.04 3.87 0.30
A 52 SER HG 1H 5.65 1.54
A 52 SER C 13C 174.55 0.41 174.69 1.79
A 53 LEU N 15N 124.31 0.93 121.95 7.60
A 53 LEU H 1H 8.12 0.28 8.22 0.67
A 53 LEU CA 13C 54.83 0.55 55.63 2.21
A 53 LEU HA 1H 4.66 0.15 4.32 0.49
A 53 LEU CB 13C 40.40 0.95 42.32 2.44
A 53 LEU HB2 1H 1.73 0.10 1.64 0.40
A 53 LEU HB3 1H 1.66 0.09 1.55 0.40
A 53 LEU QB 1H 1.70 0.08 1.59 0.40
A 53 LEU CG 13C 26.80 2.46
A 53 LEU HG 1H 1.59 0.23 1.52 0.37
A 53 LEU MD1 1H 1.00 0.06 0.76 0.38
A 53 LEU MD2 1H 0.81 0.24 0.73 0.40
A 53 LEU CD1 13C 24.71 2.86
A 53 LEU CD2 13C 24.22 2.87
A 53 LEU C 13C 174.66 0.41 177.00 2.02
A 54 MET N 15N 119.41 2.16 120.08 4.24
A 54 MET H 1H 7.31 0.33 8.26 0.61
A 54 MET CA 13C 56.52 0.49 56.23 2.41
A 54 MET HA 1H 4.40 0.10 4.38 0.51
A 54 MET CB 13C 35.98 1.54 33.07 2.97
A 54 MET HB2 1H 2.00 0.06 2.05 0.98
A 54 MET HB3 1H 2.20 0.06 2.04 0.77
A 54 MET QB 1H 2.10 0.05 2.04 0.88
A 54 MET CG 13C 32.06 2.47
A 54 MET HG2 1H 2.31 0.08 2.18 3.64
A 54 MET HG3 1H 2.48 0.05 2.11 3.92
A 54 MET QG 1H 2.39 0.06 2.15 3.78
A 54 MET ME 1H 0.07 0.12 1.13 4.01
A 54 MET CE 13C 17.45 3.91
A 54 MET C 13C 176.21 0.45 176.17 4.64
A 55 HIS N 15N 117.20 1.81 119.52 4.34
A 55 HIS H 1H 8.26 0.10 8.27 0.82
A 55 HIS CA 13C 59.33 0.25 56.49 3.05
A 55 HIS HA 1H 3.84 0.20 4.65 0.77
A 55 HIS CB 13C 29.79 0.75 30.25 2.94
A 55 HIS HB2 1H 3.29 0.18 3.37 2.23
A 55 HIS HB3 1H 3.40 0.12 3.28 2.03
A 55 HIS QB 1H 3.34 0.14 3.33 2.13
A 55 HIS CG 13C 130.40 8.34
A 55 HIS ND1 15N 189.56 36.14
A 55 HIS CD2 13C 119.20 7.50
A 55 HIS HD1 1H 12.97 14.20
A 55 HIS CE1 13C 135.98 8.42
A 55 HIS NE2 15N 176.81 24.54
A 55 HIS HD2 1H 5.78 0.14 12.97 14.20
A 55 HIS HE1 1H 6.97 0.09 7.65 4.29
A 55 HIS C 13C 177.42 0.27 175.17 4.51
A 56 SER N 15N 115.18 1.45 116.35 3.99
A 56 SER H 1H 7.77 0.35 8.29 0.67
A 56 SER CA 13C 60.68 0.39 58.64 2.21
A 56 SER HA 1H 4.17 0.10 4.50 0.43
A 56 SER CB 13C 62.58 0.37 63.81 2.44
A 56 SER HB2 1H 3.98 0.12 3.88 0.30
A 56 SER HB3 1H 3.96 0.12 3.85 0.31
A 56 SER QB 1H 3.97 0.11 3.87 0.30
A 56 SER HG 1H 5.65 1.54
A 56 SER C 13C 175.44 0.21 174.69 1.79
A 57 PHE N 15N 123.57 0.62 120.72 4.83
A 57 PHE H 1H 8.21 0.21 8.37 0.73
A 57 PHE CA 13C 61.57 0.24 58.17 2.74
A 57 PHE HA 1H 4.07 0.14 4.63 1.67
A 57 PHE CB 13C 38.65 0.07 40.01 2.82
A 57 PHE HB2 1H 3.17 0.08 2.99 0.40
A 57 PHE HB3 1H 3.06 0.06 2.96 0.43
A 57 PHE QB 1H 3.12 0.06 2.98 0.42
A 57 PHE QD 1H 6.99 0.62
A 57 PHE QE 1H 7.02 0.73
A 57 PHE QR 1H 7.00 0.87
A 57 PHE CG 13C 135.57 14.85
A 57 PHE CD1 13C 131.02 5.71
A 57 PHE HD1 1H 6.99 0.60
A 57 PHE CE1 13C 130.02 6.40
A 57 PHE HE1 1H 7.02 0.71
A 57 PHE CZ 13C 128.51 6.83
A 57 PHE HZ 1H 7.01 1.25
A 57 PHE CE2 13C 129.94 7.60
A 57 PHE HE2 1H 7.02 0.75
A 57 PHE CD2 13C 130.86 6.72
A 57 PHE HD2 1H 6.98 0.64
A 57 PHE C 13C 177.00 0.15 175.56 2.19
A 58 ILE N 15N 117.46 0.91 121.59 4.86
A 58 ILE H 1H 7.64 0.15 8.28 0.71
A 58 ILE CA 13C 63.44 0.12 61.60 2.78
A 58 ILE HA 1H 3.58 0.30 4.19 0.58
A 58 ILE CB 13C 36.96 0.61 38.66 2.75
A 58 ILE HB 1H 1.96 0.11 1.80 0.54
A 58 ILE MG 1H 0.98 0.05 0.78 0.40
A 58 ILE CG2 13C 17.67 2.92
A 58 ILE CG1 13C 27.80 3.81
A 58 ILE HG12 1H 1.65 0.08 1.26 0.62
A 58 ILE HG13 1H 0.94 0.10 1.22 0.73
A 58 ILE QG 1H 1.30 0.07 1.24 0.68
A 58 ILE MD 1H 0.25 0.58 0.67 0.45
A 58 ILE CD1 13C 13.69 3.60
A 58 ILE C 13C 177.15 0.17 175.94 1.93
A 59 LEU N 15N 118.38 0.39 121.95 7.60
A 59 LEU H 1H 7.46 0.07 8.22 0.67
A 59 LEU CA 13C 55.90 0.33 55.63 2.21
A 59 LEU HA 1H 4.46 0.04 4.32 0.49
A 59 LEU CB 13C 42.76 0.31 42.32 2.44
A 59 LEU HB2 1H 1.79 0.09 1.64 0.40
A 59 LEU HB3 1H 1.64 0.02 1.55 0.40
A 59 LEU QB 1H 1.72 0.05 1.59 0.40
A 59 LEU CG 13C 26.80 2.46
A 59 LEU HG 1H 1.85 0.01 1.52 0.37
A 59 LEU MD1 1H 0.93 0.02 0.76 0.38
A 59 LEU MD2 1H 0.91 0.10 0.73 0.40
A 59 LEU CD1 13C 24.71 2.86
A 59 LEU CD2 13C 24.22 2.87
A 59 LEU C 13C 178.62 0.14 177.00 2.02
A 60 LYS N 15N 118.56 0.52 121.13 4.38
A 60 LYS H 1H 9.71 0.23 8.19 0.64
A 60 LYS CA 13C 59.78 0.19 56.90 2.29
A 60 LYS HA 1H 3.84 0.10 4.27 0.47
A 60 LYS CB 13C 32.09 0.10 32.82 2.49
A 60 LYS HB2 1H 1.84 0.05 1.79 0.29
A 60 LYS HB3 1H 1.76 0.04 1.76 0.30
A 60 LYS QB 1H 1.80 0.03 1.77 0.29
A 60 LYS CG 13C 24.99 2.52
A 60 LYS HG2 1H 1.42 0.02 1.38 0.29
A 60 LYS HG3 1H 1.52 0.07 1.36 0.31
A 60 LYS QG 1H 1.47 0.04 1.37 0.30
A 60 LYS CD 13C 28.97 2.41
A 60 LYS HD2 1H 1.62 0.07 1.63 1.43
A 60 LYS HD3 1H 1.62 0.02 1.60 0.27
A 60 LYS QD 1H 1.62 0.03 1.61 0.85
A 60 LYS CE 13C 41.92 2.26
A 60 LYS HE2 1H 2.98 0.05 2.93 0.24
A 60 LYS HE3 1H 2.97 0.04 2.92 0.25
A 60 LYS QE 1H 2.98 0.01 2.92 0.24
A 60 LYS NZ 15N 48.17 36.38
A 60 LYS HZ1 1H 7.81 0.00 7.43 1.14
A 60 LYS HZ2 1H 3.12 0.18
A 60 LYS HZ3 1H 3.05 0.08
A 60 LYS QZ 1H 7.43 1.14
A 60 LYS C 13C 179.30 0.34 176.81 10.32
A 61 ALA N 15N 122.92 0.37 123.26 4.61
A 61 ALA H 1H 8.15 0.31 8.19 0.63
A 61 ALA CA 13C 55.31 0.19 53.20 2.14
A 61 ALA HA 1H 3.56 0.11 4.26 0.45
A 61 ALA MB 1H 0.42 0.16 1.37 0.28
A 61 ALA CB 13C 18.43 0.16 19.04 2.58
A 61 ALA C 13C 179.62 0.17 177.77 2.70
A 62 ARG N 15N 114.19 0.58 120.72 4.01
A 62 ARG H 1H 6.95 0.27 8.24 0.61
A 62 ARG CA 13C 59.01 0.23 56.84 2.52
A 62 ARG HA 1H 3.75 0.12 4.29 0.48
A 62 ARG CB 13C 30.53 0.24 30.71 2.60
A 62 ARG HB2 1H 1.85 0.10 1.80 0.30
A 62 ARG HB3 1H 1.93 0.02 1.78 0.29
A 62 ARG QB 1H 1.89 0.05 1.79 0.29
A 62 ARG CG 13C 27.38 2.59
A 62 ARG HG2 1H 1.60 0.02 1.58 0.28
A 62 ARG HG3 1H 1.59 0.04 1.56 0.30
A 62 ARG QG 1H 1.59 0.02 1.57 0.29
A 62 ARG CD 13C 43.21 2.27
A 62 ARG HD2 1H 3.17 0.02 3.12 0.30
A 62 ARG HD3 1H 3.11 0.01 3.11 0.28
A 62 ARG QD 1H 3.14 0.01 3.12 0.29
A 62 ARG NE 15N 93.79 15.46
A 62 ARG HE 1H 7.39 0.10 7.33 0.64
A 62 ARG CZ 13C 159.16 1.00
A 62 ARG NH1 15N 74.22 7.70
A 62 ARG HH11 1H 6.85 0.51
A 62 ARG HH12 1H 6.79 0.48
A 62 ARG QH1 1H 6.82 0.49
A 62 ARG NH2 15N 75.18 10.68
A 62 ARG HH21 1H 6.79 0.47
A 62 ARG HH22 1H 6.77 0.50
A 62 ARG QH2 1H 6.78 0.48
A 62 ARG C 13C 176.69 0.32 176.43 4.30
A 63 SER N 15N 110.04 0.65 116.35 3.99
A 63 SER H 1H 9.31 1.01 8.29 0.67
A 63 SER CA 13C 59.67 0.47 58.64 2.21
A 63 SER HA 1H 4.47 0.04 4.50 0.43
A 63 SER CB 13C 64.24 0.37 63.81 2.44
A 63 SER HB2 1H 3.81 0.03 3.88 0.30
A 63 SER HB3 1H 3.72 0.02 3.85 0.31
A 63 SER QB 1H 3.76 0.02 3.87 0.30
A 63 SER HG 1H 5.65 1.54
A 63 SER C 13C 175.69 0.25 174.69 1.79
A 64 THR N 15N 116.22 0.89 115.66 5.40
A 64 THR H 1H 8.05 0.73 8.26 0.66
A 64 THR CA 13C 65.62 0.45 62.19 2.75
A 64 THR HA 1H 3.95 0.10 4.47 0.50
A 64 THR CB 13C 67.91 0.21 69.62 7.53
A 64 THR HB 1H 4.21 0.05 4.19 1.09
A 64 THR MG 1H 1.20 0.05 1.16 0.41
A 64 THR HG1 1H 5.24 1.93
A 64 THR CG2 13C 21.61 2.80
A 64 THR C 13C 175.97 0.10 174.63 1.79
A 65 VAL N 15N 121.15 0.50 121.36 9.45
A 65 VAL H 1H 8.04 0.20 8.28 0.71
A 65 VAL CA 13C 65.97 0.25 62.50 2.95
A 65 VAL HA 1H 3.46 0.25 4.16 0.64
A 65 VAL CB 13C 31.17 0.20 32.71 2.48
A 65 VAL HB 1H 2.09 0.05 1.99 0.51
A 65 VAL MG1 1H 0.95 0.12 0.83 0.51
A 65 VAL MG2 1H 0.80 0.04 0.80 0.54
A 65 VAL CG1 13C 21.63 3.16
A 65 VAL CG2 13C 21.47 3.04
A 65 VAL C 13C 177.73 0.34 175.76 1.94
A 66 ARG N 15N 118.06 1.61 120.72 4.01
A 66 ARG H 1H 7.76 0.19 8.24 0.61
A 66 ARG CA 13C 58.71 0.60 56.84 2.52
A 66 ARG HA 1H 4.56 0.30 4.29 0.48
A 66 ARG CB 13C 29.88 0.20 30.71 2.60
A 66 ARG HB2 1H 1.94 0.09 1.80 0.30
A 66 ARG HB3 1H 1.93 0.06 1.78 0.29
A 66 ARG QB 1H 1.93 0.05 1.79 0.29
A 66 ARG CG 13C 27.38 2.59
A 66 ARG HG2 1H 1.66 0.07 1.58 0.28
A 66 ARG HG3 1H 1.51 0.05 1.56 0.30
A 66 ARG QG 1H 1.58 0.05 1.57 0.29
A 66 ARG CD 13C 43.21 2.27
A 66 ARG HD2 1H 3.16 0.04 3.12 0.30
A 66 ARG HD3 1H 3.17 0.19 3.11 0.28
A 66 ARG QD 1H 3.16 0.09 3.12 0.29
A 66 ARG NE 15N 93.79 15.46
A 66 ARG HE 1H 7.17 0.10 7.33 0.64
A 66 ARG CZ 13C 159.16 1.00
A 66 ARG NH1 15N 74.22 7.70
A 66 ARG HH11 1H 6.85 0.51
A 66 ARG HH12 1H 6.79 0.48
A 66 ARG QH1 1H 6.82 0.49
A 66 ARG NH2 15N 75.18 10.68
A 66 ARG HH21 1H 6.79 0.47
A 66 ARG HH22 1H 6.77 0.50
A 66 ARG QH2 1H 6.78 0.48
A 66 ARG C 13C 177.70 0.33 176.43 4.30
A 67 ASP N 15N 118.77 1.55 120.78 4.25
A 67 ASP H 1H 8.40 0.38 8.33 0.60
A 67 ASP CA 13C 57.14 0.48 54.66 2.13
A 67 ASP HA 1H 4.42 0.08 4.61 0.34
A 67 ASP CB 13C 40.88 0.17 40.88 2.57
A 67 ASP HB2 1H 2.80 0.06 2.77 1.04
A 67 ASP HB3 1H 2.70 0.05 2.71 1.05
A 67 ASP QB 1H 2.75 0.04 2.74 1.04
A 67 ASP CG 13C 179.34 1.44
A 67 ASP C 13C 178.26 0.28 176.48 1.76
A 68 ILE N 15N 119.37 1.53 121.59 4.86
A 68 ILE H 1H 7.38 0.27 8.28 0.71
A 68 ILE CA 13C 62.99 1.06 61.60 2.78
A 68 ILE HA 1H 3.96 0.21 4.19 0.58
A 68 ILE CB 13C 38.02 0.27 38.66 2.75
A 68 ILE HB 1H 1.93 0.05 1.80 0.54
A 68 ILE MG 1H 1.00 0.05 0.78 0.40
A 68 ILE CG2 13C 17.67 2.92
A 68 ILE CG1 13C 27.80 3.81
A 68 ILE HG12 1H 1.63 0.14 1.26 0.62
A 68 ILE HG13 1H 0.63 0.15 1.22 0.73
A 68 ILE QG 1H 1.13 0.11 1.24 0.68
A 68 ILE MD 1H 1.09 0.10 0.67 0.45
A 68 ILE CD1 13C 13.69 3.60
A 68 ILE C 13C 175.95 0.26 175.94 1.93
A 69 ASP N 15N 117.07 1.27 120.78 4.25
A 69 ASP H 1H 7.59 0.50 8.33 0.60
A 69 ASP CA 13C 52.81 0.49 54.66 2.13
A 69 ASP HA 1H 4.56 0.18 4.61 0.34
A 69 ASP CB 13C 44.95 0.39 40.88 2.57
A 69 ASP HB2 1H 2.65 0.08 2.77 1.04
A 69 ASP HB3 1H 2.58 0.09 2.71 1.05
A 69 ASP QB 1H 2.61 0.06 2.74 1.04
A 69 ASP CG 13C 179.34 1.44
A 69 ASP C 13C 174.68 0.54 176.48 1.76
A 70 PRO N 15N 132.86 19.46
A 70 PRO CD 13C 50.38 3.59
A 70 PRO CA 13C 65.49 0.24 63.25 1.89
A 70 PRO HA 1H 4.21 0.11 4.40 0.38
A 70 PRO CB 13C 31.85 0.30 31.75 0.98
A 70 PRO HB2 1H 2.18 0.02 2.07 0.41
A 70 PRO HB3 1H 2.14 0.04 2.02 0.44
A 70 PRO QB 1H 2.16 0.02 2.04 0.42
A 70 PRO CG 13C 27.26 1.05
A 70 PRO HG2 1H 1.98 0.00 1.92 0.38
A 70 PRO HG3 1H 1.98 0.00 1.90 0.40
A 70 PRO QG 1H 1.98 0.00 1.91 0.39
A 70 PRO HD2 1H 3.75 0.03 3.60 0.69
A 70 PRO HD3 1H 3.66 0.05 3.58 0.69
A 70 PRO QD 1H 3.71 0.03 3.59 0.69
A 70 PRO C 13C 177.14 0.58 176.75 1.69
A 71 GLN N 15N 121.86 4.39 119.84 4.03
A 71 GLN H 1H 7.60 0.16 8.21 0.62
A 71 GLN CA 13C 53.67 0.71 56.56 2.32
A 71 GLN HA 1H 4.34 0.08 4.29 0.45
A 71 GLN CB 13C 28.69 1.84 29.26 2.44
A 71 GLN HB2 1H 2.05 0.02 2.05 0.28
A 71 GLN HB3 1H 2.09 0.03 2.04 0.40
A 71 GLN QB 1H 2.07 0.03 2.04 0.34
A 71 GLN CG 13C 33.81 2.59
A 71 GLN HG2 1H 2.30 0.05 2.32 0.30
A 71 GLN HG3 1H 2.31 0.02 2.30 0.32
A 71 GLN QG 1H 2.30 0.03 2.31 0.31
A 71 GLN CD 13C 179.63 1.41
A 71 GLN NE2 15N 111.79 3.40
A 71 GLN HE21 1H 7.39 0.08 7.19 0.51
A 71 GLN HE22 1H 6.66 0.41 7.05 0.50
A 71 GLN QE 1H 7.12 0.51
A 71 GLN C 13C 174.12 0.99 176.38 1.95
A 72 ASN N 15N 118.27 2.66 119.08 4.27
A 72 ASN H 1H 7.89 0.66 8.41 5.00
A 72 ASN CA 13C 52.96 0.69 53.52 2.25
A 72 ASN HA 1H 4.50 0.30 4.68 0.38
A 72 ASN CB 13C 40.29 1.32 38.77 2.92
A 72 ASN HB2 1H 2.74 0.08 2.81 0.35
A 72 ASN HB3 1H 2.77 0.10 2.76 0.36
A 72 ASN QB 1H 2.75 0.08 2.79 0.35
A 72 ASN CG 13C 176.69 3.20
A 72 ASN ND2 15N 112.86 3.42
A 72 ASN HD21 1H 6.55 0.42 7.33 0.54
A 72 ASN HD22 1H 8.27 0.21 7.17 0.55
A 72 ASN QD 1H 7.25 0.55
A 72 ASN C 13C 173.20 0.88 175.31 3.37
A 73 ASP N 15N 118.98 2.90 120.78 4.25
A 73 ASP H 1H 8.28 0.25 8.33 0.60
A 73 ASP CA 13C 52.90 0.71 54.66 2.13
A 73 ASP HA 1H 4.81 0.15 4.61 0.34
A 73 ASP CB 13C 44.34 0.82 40.88 2.57
A 73 ASP HB2 1H 2.63 0.06 2.77 1.04
A 73 ASP HB3 1H 2.48 0.06 2.71 1.05
A 73 ASP QB 1H 2.56 0.03 2.74 1.04
A 73 ASP CG 13C 179.34 1.44
A 73 ASP C 13C 174.94 0.73 176.48 1.76
A 74 LEU N 15N 121.35 2.14 121.95 7.60
A 74 LEU H 1H 8.10 0.31 8.22 0.67
A 74 LEU CA 13C 53.76 1.12 55.63 2.21
A 74 LEU HA 1H 4.63 0.32 4.32 0.49
A 74 LEU CB 13C 42.76 1.20 42.32 2.44
A 74 LEU HB2 1H 1.56 0.13 1.64 0.40
A 74 LEU HB3 1H 1.53 0.11 1.55 0.40
A 74 LEU QB 1H 1.55 0.11 1.59 0.40
A 74 LEU CG 13C 26.80 2.46
A 74 LEU HG 1H 1.47 0.20 1.52 0.37
A 74 LEU MD1 1H 0.98 0.06 0.76 0.38
A 74 LEU MD2 1H 0.84 0.14 0.73 0.40
A 74 LEU CD1 13C 24.71 2.86
A 74 LEU CD2 13C 24.22 2.87
A 74 LEU C 13C 176.45 0.62 177.00 2.02
A 75 THR N 15N 111.84 2.34 115.66 5.40
A 75 THR H 1H 8.04 0.33 8.26 0.66
A 75 THR CA 13C 63.43 0.66 62.19 2.75
A 75 THR HA 1H 3.74 0.26 4.47 0.50
A 75 THR CB 13C 69.63 0.72 69.62 7.53
A 75 THR HB 1H 3.58 0.52 4.19 1.09
A 75 THR MG 1H 1.12 0.11 1.16 0.41
A 75 THR HG1 1H 5.24 1.93
A 75 THR CG2 13C 21.61 2.80
A 75 THR C 13C 174.98 1.03 174.63 1.79
A 76 PHE N 15N 118.42 2.19 120.72 4.83
A 76 PHE H 1H 7.40 0.48 8.37 0.73
A 76 PHE CA 13C 56.55 0.56 58.17 2.74
A 76 PHE HA 1H 4.88 0.16 4.63 1.67
A 76 PHE CB 13C 41.83 1.06 40.01 2.82
A 76 PHE HB2 1H 3.04 0.03 2.99 0.40
A 76 PHE HB3 1H 2.93 0.10 2.96 0.43
A 76 PHE QB 1H 2.99 0.05 2.98 0.42
A 76 PHE QD 1H 6.99 0.62
A 76 PHE QE 1H 7.02 0.73
A 76 PHE QR 1H 7.00 0.87
A 76 PHE CG 13C 135.57 14.85
A 76 PHE CD1