#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1maj s VAL 2 N 0.00 4.54 0.75 2.12 1.01 -1.26 -4.86 120.40 122.69 1maj s VAL 2 Ca 0.00 -1.96 -0.13 0.00 0.00 0.00 0.00 61.98 59.89 1maj s VAL 2 Cb 0.00 -5.00 0.05 0.00 0.00 0.00 0.00 36.38 31.43 1maj s VAL 2 CO 0.00 -1.77 1.13 -0.69 0.00 0.00 0.00 175.10 173.76 1maj s VAL 3 N 3.08 2.91 -0.16 2.92 1.01 -1.26 -4.73 120.40 124.17 1maj s VAL 3 Ca 0.45 0.37 -0.02 0.00 0.00 0.00 0.00 61.98 62.78 1maj s VAL 3 Cb -0.01 -2.81 0.05 0.00 0.00 0.00 0.00 36.38 33.61 1maj s VAL 3 CO -0.01 -0.32 0.01 -0.04 0.00 0.00 0.00 175.10 174.74 1maj s MET 4 N -4.39 0.84 -0.03 2.72 -1.94 -1.26 -0.39 119.30 114.85 1maj s MET 4 Ca 0.67 -0.34 -0.30 0.00 -1.71 0.00 0.00 55.69 54.01 1maj s MET 4 Cb -0.21 -1.84 -0.03 0.00 2.01 0.00 0.00 34.83 34.75 1maj s MET 4 CO 0.49 -0.52 1.08 0.99 -0.01 0.00 0.00 175.02 177.06 1maj s THR 5 N 1.82 4.54 -0.12 2.05 2.01 -0.45 -4.57 115.64 120.92 1maj s THR 5 Ca 0.01 1.82 -0.06 0.00 0.31 0.00 0.00 61.69 63.77 1maj s THR 5 Cb -0.16 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 1maj s THR 5 CO -0.07 0.07 0.11 -1.58 -0.69 0.00 0.00 174.62 172.46 1maj s GLN 6 N 1.57 3.39 -0.16 4.92 2.00 -1.26 -1.70 119.66 128.42 1maj s GLN 6 Ca 0.53 -0.20 -0.28 0.00 -2.00 0.00 0.00 55.36 53.41 1maj s GLN 6 Cb -0.23 -3.12 0.08 0.00 0.80 0.00 0.00 33.01 30.55 1maj s GLN 6 CO 0.24 0.73 0.78 0.99 -0.50 0.00 0.00 175.29 177.53 1maj s THR 7 N -0.90 0.00 1.03 -0.34 2.01 -0.76 -4.65 115.64 112.04 1maj s THR 7 Ca 0.14 0.00 -0.18 0.00 0.31 0.00 0.00 61.69 61.96 1maj s THR 7 Cb -0.12 -1.00 0.24 0.00 0.01 0.00 0.00 72.50 71.63 1maj s THR 7 CO 0.03 0.00 1.32 -0.81 -0.69 0.00 0.00 174.62 174.48 1maj n PRO 8 N 1.57 -1.58 0.08 4.92 -0.04 -1.26 0.13 135.00 138.83 1maj n PRO 8 Ca -0.15 -2.05 -0.05 0.00 -0.04 0.00 0.00 63.50 61.20 1maj n PRO 8 Cb 0.56 -1.43 -0.04 0.00 -0.04 0.00 0.00 33.50 32.55 1maj n PRO 8 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1maj h LEU 9 N 0.00 0.00 -8.21 1.53 4.07 -1.90 -3.42 115.31 107.38 1maj h LEU 9 Ca -0.44 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.22 1maj h LEU 9 Cb 1.22 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 42.74 1maj h LEU 9 CO 0.30 0.88 -0.74 -0.44 -1.08 0.00 0.00 178.44 177.36 1maj s SER 10 N -6.73 1.02 -0.40 -0.43 0.01 -1.26 -0.10 113.70 105.81 1maj s SER 10 Ca 0.01 -0.55 0.03 0.00 1.31 0.00 0.00 55.95 56.75 1maj s SER 10 Cb 0.11 0.01 0.16 0.00 0.21 0.00 0.00 66.02 66.51 1maj s SER 10 CO 0.80 -0.17 0.34 -0.22 0.41 0.00 0.00 173.24 174.41 1maj s LEU 11 N -1.56 0.95 -0.21 2.44 2.96 0.46 -4.89 118.68 118.83 1maj s LEU 11 Ca -0.08 -2.65 -0.29 0.00 -0.22 0.00 0.00 54.13 50.90 1maj s LEU 11 Cb -0.10 -0.16 -0.03 0.00 0.50 0.00 0.00 46.19 46.40 1maj s LEU 11 CO 0.01 -0.20 1.77 -2.16 -1.32 0.00 0.00 176.35 174.45 1maj s PRO 12 N 0.46 3.67 0.11 0.98 0.04 -1.25 -3.70 135.00 135.30 1maj s PRO 12 Ca 0.28 1.78 -0.04 0.00 0.04 0.00 0.00 61.00 63.05 1maj s PRO 12 Cb -0.04 -4.12 -0.03 0.00 0.04 0.00 0.00 34.50 30.35 1maj s PRO 12 CO -0.13 -1.46 0.11 0.14 0.04 0.00 0.00 177.00 175.70 1maj s VAL 13 N 5.82 0.14 0.23 -0.36 -7.23 -1.03 -4.69 120.40 113.28 1maj s VAL 13 Ca 0.79 -1.61 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 1maj s VAL 13 Cb -0.28 -1.70 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 1maj s VAL 13 CO 0.32 -0.62 0.37 -0.44 -0.31 0.00 0.00 175.10 174.42 1maj s SER 14 N -2.95 6.33 -0.88 4.85 0.01 -1.26 0.17 113.70 119.97 1maj s SER 14 Ca 0.14 0.15 -0.25 0.00 1.31 0.00 0.00 55.95 57.30 1maj s SER 14 Cb 0.06 -1.90 0.03 0.00 0.21 0.00 0.00 66.02 64.43 1maj s SER 14 CO -0.05 -0.07 1.43 -0.76 0.41 0.00 0.00 173.24 174.20 1maj s LEU 15 N -3.83 3.33 0.00 2.44 1.43 -1.26 -2.86 118.68 117.93 1maj s LEU 15 Ca 0.35 -0.91 0.00 0.00 -1.03 0.00 0.00 54.13 52.54 1maj s LEU 15 Cb -0.10 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1maj s LEU 15 CO 0.30 -1.76 0.00 0.61 0.23 0.00 0.00 176.35 175.73 1maj n GLY 16 N 6.20 0.45 0.00 -3.19 0.00 0.52 -4.89 105.19 104.28 1maj n GLY 16 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1maj n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1maj n ASP 17 N 0.00 0.00 -4.00 1.61 9.92 -1.13 -4.74 116.55 118.20 1maj n ASP 17 Ca 0.00 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 54.11 1maj n ASP 17 Cb 0.00 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.38 1maj n ASP 17 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1maj s GLN 18 N 4.17 1.38 0.17 -1.24 -0.21 -1.26 -2.40 119.66 120.27 1maj s GLN 18 Ca 0.00 -1.76 -0.07 0.00 0.02 0.00 0.00 55.36 53.55 1maj s GLN 18 Cb 0.00 0.20 -0.02 0.00 1.00 0.00 0.00 33.01 34.19 1maj s GLN 18 CO 0.00 -0.45 0.24 0.00 -2.12 0.00 0.00 175.29 172.96 1maj s ALA 19 N -3.91 0.27 -0.50 6.09 0.00 -0.72 -4.80 121.76 118.19 1maj s ALA 19 Ca 0.39 -1.08 0.06 0.00 0.00 0.00 0.00 51.96 51.33 1maj s ALA 19 Cb 0.06 0.93 0.19 0.00 0.00 0.00 0.00 23.12 24.30 1maj s ALA 19 CO 0.16 -0.63 0.74 -1.54 0.00 0.00 0.00 175.76 174.49 1maj s SER 20 N -3.01 -1.40 -0.19 0.00 1.04 -1.21 -1.39 113.70 107.54 1maj s SER 20 Ca 0.21 -1.57 -0.19 0.00 0.48 0.00 0.00 55.95 54.87 1maj s SER 20 Cb 0.04 1.82 -0.03 0.00 0.10 0.00 0.00 66.02 67.96 1maj s SER 20 CO 0.02 -0.06 0.56 -0.63 0.98 0.00 0.00 173.24 174.12 1maj s ILE 21 N 0.97 5.07 0.33 -1.02 1.01 -0.98 -4.76 121.20 121.83 1maj s ILE 21 Ca 0.28 1.05 -0.12 0.00 0.00 0.00 0.00 60.65 61.87 1maj s ILE 21 Cb 0.00 -3.88 -0.08 0.00 0.01 0.00 0.00 42.46 38.51 1maj s ILE 21 CO -0.06 0.16 0.71 -0.44 0.00 0.00 0.00 174.94 175.31 1maj s SER 22 N 1.15 6.64 -0.30 3.58 0.01 0.35 0.13 113.70 125.27 1maj s SER 22 Ca 0.26 1.14 -0.03 0.00 1.31 0.00 0.00 55.95 58.63 1maj s SER 22 Cb -0.16 -2.32 0.18 0.00 0.21 0.00 0.00 66.02 63.94 1maj s SER 22 CO 0.10 -0.25 0.63 0.00 0.41 0.00 0.00 173.24 174.13 1maj s ARG 24 N 2.87 2.25 0.19 0.00 1.70 -0.69 -2.16 118.95 123.10 1maj s ARG 24 Ca 0.17 -1.83 0.08 0.00 -0.47 0.00 0.00 55.73 53.67 1maj s ARG 24 Cb -0.14 -2.01 -0.04 0.00 -0.57 0.00 0.00 34.95 32.19 1maj s ARG 24 CO -0.20 -0.14 -0.01 0.45 -1.08 0.00 0.00 175.30 174.32 1maj s SER 25 N -3.93 4.71 -0.06 -2.89 0.15 0.14 -1.34 113.70 110.48 1maj s SER 25 Ca 0.41 -0.44 -0.26 0.00 0.70 0.00 0.00 55.95 56.36 1maj s SER 25 Cb 0.03 -0.97 -0.22 0.00 -1.71 0.00 0.00 66.02 63.15 1maj s SER 25 CO 0.23 0.08 1.08 0.28 1.20 0.00 0.00 173.24 176.11 1maj h SER 26 N 2.62 0.09 0.00 5.45 0.02 -1.02 -3.42 113.55 117.29 1maj h SER 26 Ca -0.47 -0.70 0.00 0.00 -0.84 0.00 0.00 61.79 59.78 1maj h SER 26 Cb 1.21 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1maj h SER 26 CO 0.58 0.78 -0.13 1.67 -1.14 0.00 0.00 176.83 178.59 1maj n GLN 27 N -4.67 0.07 0.00 3.45 -0.06 -1.26 -5.03 117.38 109.87 1maj n GLN 27 Ca -0.09 0.09 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1maj n GLN 27 Cb 0.39 -0.69 0.00 0.00 -4.06 0.00 0.00 30.24 25.88 1maj n GLN 27 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1maj n SER 28 N -2.73 0.00 -0.24 1.69 2.88 -1.26 -4.83 113.62 109.12 1maj n SER 28 Ca -0.02 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.59 1maj n SER 28 Cb 0.07 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 63.63 1maj n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1maj n LEU 29 N 0.00 1.72 -4.62 2.46 4.77 -1.26 -5.00 117.00 115.07 1maj n LEU 29 Ca 0.00 -2.56 -0.41 0.00 -0.03 0.00 0.00 56.01 53.01 1maj n LEU 29 Cb 0.00 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 40.72 1maj n LEU 29 CO 0.00 0.62 0.41 -0.69 -1.33 0.00 0.00 177.39 176.40 1maj s VAL 30 N -2.07 4.96 0.87 4.08 1.01 -1.26 -1.82 120.40 126.17 1maj s VAL 30 Ca 0.24 1.08 -0.11 0.00 0.00 0.00 0.00 61.98 63.19 1maj s VAL 30 Cb 0.21 -3.96 0.12 0.00 0.00 0.00 0.00 36.38 32.75 1maj s VAL 30 CO 0.01 -0.02 1.17 -2.28 0.00 0.00 0.00 175.10 173.98 1maj s HIS 31 N 2.56 1.66 0.00 5.22 2.46 -1.23 -4.79 115.29 121.17 1maj s HIS 31 Ca 0.26 1.75 0.00 0.00 0.47 0.00 0.00 55.06 57.55 1maj s HIS 31 Cb -0.15 -3.41 0.00 0.00 -0.13 0.00 0.00 32.58 28.88 1maj s HIS 31 CO 0.09 -2.87 0.00 0.45 -2.47 0.00 0.00 174.74 169.95 1maj n SER 32 N -3.88 0.00 -2.75 9.88 2.88 -1.26 -2.26 113.62 116.23 1maj n SER 32 Ca 0.13 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.57 1maj n SER 32 Cb 0.51 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.04 1maj n SER 32 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1maj n ASN 33 N -1.55 -0.67 0.00 -3.46 6.94 -1.26 -5.09 115.26 110.17 1maj n ASN 33 Ca 0.00 -2.81 0.00 0.00 -0.02 0.00 0.00 54.58 51.75 1maj n ASN 33 Cb 0.00 0.52 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1maj n ASN 33 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1maj n GLY 34 N -0.18 1.85 3.81 4.83 0.00 -0.96 -5.16 105.19 109.38 1maj n GLY 34 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1maj n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1maj s ASN 35 N 0.88 4.40 -0.19 1.61 0.01 -1.26 -4.87 114.94 115.52 1maj s ASN 35 Ca 0.00 -1.33 -0.29 0.00 -0.71 0.00 0.00 52.86 50.52 1maj s ASN 35 Cb 0.00 0.19 0.00 0.00 0.41 0.00 0.00 41.25 41.85 1maj s ASN 35 CO 0.00 -0.86 1.06 -0.89 -1.51 0.00 0.00 177.10 174.90 1maj s THR 36 N -2.76 4.65 0.27 1.60 2.01 -1.26 -3.51 115.64 116.64 1maj s THR 36 Ca 0.27 1.97 0.03 0.00 0.31 0.00 0.00 61.69 64.27 1maj s THR 36 Cb 0.01 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.22 1maj s THR 36 CO 0.16 -0.13 0.42 -0.31 -0.69 0.00 0.00 174.62 174.07 1maj s TYR 37 N 2.92 3.47 0.00 4.92 1.51 -0.76 -4.46 117.35 124.95 1maj s TYR 37 Ca 0.47 0.13 0.00 0.00 -1.01 0.00 0.00 57.07 56.66 1maj s TYR 37 Cb -0.17 -1.70 0.00 0.00 -0.11 0.00 0.00 41.96 39.98 1maj s TYR 37 CO 0.10 0.33 0.00 -0.11 -1.11 0.00 0.00 175.55 174.77 1maj n LEU 38 N -1.45 0.00 -4.02 -1.29 7.94 -1.26 -4.71 117.00 112.21 1maj n LEU 38 Ca -0.07 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.71 1maj n LEU 38 Cb 0.56 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 44.40 1maj n LEU 38 CO 0.47 0.00 -0.38 0.20 -1.11 0.00 0.00 177.39 176.56 1maj s ASN 39 N 0.00 0.57 0.24 1.96 -0.87 0.74 -1.41 114.94 116.17 1maj s ASN 39 Ca 0.00 -0.49 0.11 0.00 -1.57 0.00 0.00 52.86 50.92 1maj s ASN 39 Cb 0.00 0.05 -0.05 0.00 -0.02 0.00 0.00 41.25 41.24 1maj s ASN 39 CO 0.00 -0.22 -0.22 0.26 -2.57 0.00 0.00 177.10 174.36 1maj s TRP 40 N -1.29 2.26 0.26 2.20 0.52 0.14 -0.84 118.94 122.18 1maj s TRP 40 Ca -0.11 -0.36 -0.07 0.00 0.02 0.00 0.00 56.10 55.58 1maj s TRP 40 Cb -0.09 -1.05 -0.01 0.00 -1.15 0.00 0.00 33.47 31.17 1maj s TRP 40 CO -0.00 0.60 0.38 0.71 0.02 0.00 0.00 176.95 178.66 1maj s TYR 41 N -2.14 0.74 -0.30 -1.98 2.02 0.44 -3.46 117.35 112.68 1maj s TYR 41 Ca 0.25 -1.04 -0.11 0.00 -0.37 0.00 0.00 57.07 55.81 1maj s TYR 41 Cb -0.06 -0.08 0.13 0.00 -0.40 0.00 0.00 41.96 41.55 1maj s TYR 41 CO 0.12 -0.93 0.68 -1.17 -1.57 0.00 0.00 175.55 172.68 1maj s LEU 42 N -3.11 -1.10 -0.31 -1.29 2.96 -1.26 -1.04 118.68 113.54 1maj s LEU 42 Ca 0.29 1.52 -0.20 0.00 -0.22 0.00 0.00 54.13 55.51 1maj s LEU 42 Cb 0.01 2.27 -0.01 0.00 0.50 0.00 0.00 46.19 48.97 1maj s LEU 42 CO 0.13 -0.21 0.64 -1.58 -1.32 0.00 0.00 176.35 174.00 1maj s GLN 43 N 2.78 3.86 0.22 1.98 0.74 0.14 -3.97 119.66 125.40 1maj s GLN 43 Ca -0.06 0.27 -0.10 0.00 0.05 0.00 0.00 55.36 55.52 1maj s GLN 43 Cb -0.11 -3.74 -0.01 0.00 1.10 0.00 0.00 33.01 30.25 1maj s GLN 43 CO -0.19 -0.61 0.36 0.21 -0.55 0.00 0.00 175.29 174.52 1maj s LYS 44 N 2.65 1.37 -0.47 1.67 2.20 -1.26 -2.36 119.74 123.55 1maj s LYS 44 Ca 0.25 -1.29 -0.28 0.00 -0.36 0.00 0.00 55.97 54.29 1maj s LYS 44 Cb -0.15 0.41 -0.09 0.00 -1.51 0.00 0.00 37.83 36.49 1maj s LYS 44 CO 0.12 -0.54 2.37 0.00 -0.36 0.00 0.00 175.35 176.95 1maj n ALA 45 N -0.32 1.00 -1.12 3.13 0.00 -1.26 -0.99 120.51 120.95 1maj n ALA 45 Ca -0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 53.44 52.79 1maj n ALA 45 Cb 0.63 -2.95 -0.02 0.00 0.00 0.00 0.00 19.45 17.11 1maj n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1maj n GLY 46 N 6.09 0.65 0.00 0.00 0.00 -1.26 -4.82 105.19 105.86 1maj n GLY 46 Ca 0.39 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1maj n GLY 46 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1maj n GLN 47 N -1.97 0.83 0.03 1.61 7.27 -0.16 -4.80 117.38 120.18 1maj n GLN 47 Ca -0.04 -0.81 -0.11 0.00 0.07 0.00 0.00 57.00 56.11 1maj n GLN 47 Cb 0.25 -0.85 -0.05 0.00 2.41 0.00 0.00 30.24 32.00 1maj n GLN 47 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 1maj h SER 48 N 0.00 -0.29 0.00 1.69 0.02 -1.64 -1.49 113.55 111.85 1maj h SER 48 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1maj h SER 48 Cb 0.42 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1maj h SER 48 CO 0.00 -0.14 0.00 -0.81 -1.14 0.00 0.00 176.83 174.74 1maj n PRO 49 N -5.23 0.57 -3.98 3.45 -0.04 -1.26 -4.61 135.00 123.90 1maj n PRO 49 Ca -0.05 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.06 1maj n PRO 49 Cb 0.15 -1.28 -0.11 0.00 -0.04 0.00 0.00 33.50 32.22 1maj n PRO 49 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1maj s LYS 50 N -1.02 3.84 0.08 0.54 2.20 -0.56 -5.09 119.74 119.73 1maj s LYS 50 Ca 0.00 -0.40 0.03 0.00 -0.36 0.00 0.00 55.97 55.24 1maj s LYS 50 Cb 0.00 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 1maj s LYS 50 CO 0.00 0.12 0.07 -1.17 -0.36 0.00 0.00 175.35 174.01 1maj s LEU 51 N 0.77 3.75 0.00 5.43 2.96 -1.26 -4.06 118.68 126.28 1maj s LEU 51 Ca 0.03 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 1maj s LEU 51 Cb -0.14 -2.42 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1maj s LEU 51 CO 0.02 0.18 0.00 0.18 -1.32 0.00 0.00 176.35 175.41 1maj n LEU 52 N 0.53 0.00 -4.71 -0.68 4.77 -1.22 -4.71 117.00 110.97 1maj n LEU 52 Ca -0.09 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.54 1maj n LEU 52 Cb 0.52 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.52 1maj n LEU 52 CO 0.43 0.00 -0.28 -0.63 -1.33 0.00 0.00 177.39 175.58 1maj s ILE 53 N 0.00 4.55 -0.08 -0.08 -1.09 -1.26 -2.10 121.20 121.14 1maj s ILE 53 Ca 0.00 -0.15 0.18 0.00 -2.23 0.00 0.00 60.65 58.45 1maj s ILE 53 Cb 0.00 -2.94 0.38 0.00 -1.58 0.00 0.00 42.46 38.32 1maj s ILE 53 CO 0.00 0.59 1.17 0.00 -1.23 0.00 0.00 174.94 175.47 1maj n TYR 54 N 2.29 0.00 -2.66 3.97 4.11 -1.05 0.26 117.16 124.08 1maj n TYR 54 Ca -0.19 -0.83 -0.04 0.00 -0.00 0.00 0.00 57.90 56.85 1maj n TYR 54 Cb 0.54 -0.18 0.09 0.00 -0.00 0.00 0.00 39.34 39.79 1maj n TYR 54 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 1maj n LYS 55 N -0.20 0.05 -0.29 -3.48 0.00 -0.50 -4.61 118.16 109.13 1maj n LYS 55 Ca 0.10 -0.58 0.00 0.00 0.00 0.00 0.00 58.31 57.84 1maj n LYS 55 Cb 0.93 -0.08 0.00 0.00 0.00 0.00 0.00 35.03 35.87 1maj n LYS 55 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1maj n VAL 56 N 1.33 0.00 -1.55 3.15 0.24 -1.25 -3.66 118.33 116.59 1maj n VAL 56 Ca -0.01 0.00 -0.00 0.00 -2.04 0.00 0.00 64.34 62.29 1maj n VAL 56 Cb 0.72 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.10 1maj n VAL 56 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1maj n SER 57 N 1.27 -2.15 -3.15 -1.34 2.88 0.24 -4.84 113.62 106.54 1maj n SER 57 Ca 0.00 -0.01 0.05 0.00 -1.33 0.00 0.00 58.87 57.58 1maj n SER 57 Cb 0.00 -0.79 -0.01 0.00 -0.75 0.00 0.00 64.21 62.65 1maj n SER 57 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1maj s ASN 58 N -2.70 -0.61 0.33 -3.46 2.47 -1.24 -5.02 114.94 104.71 1maj s ASN 58 Ca 0.01 0.33 -0.09 0.00 0.42 0.00 0.00 52.86 53.54 1maj s ASN 58 Cb -0.00 1.49 -0.06 0.00 -1.45 0.00 0.00 41.25 41.23 1maj s ASN 58 CO 0.02 -0.11 0.65 -0.13 -3.72 0.00 0.00 177.10 173.81 1maj s ARG 59 N 2.94 3.74 0.55 0.43 0.52 -1.26 -2.52 118.95 123.35 1maj s ARG 59 Ca 0.05 0.28 -0.08 0.00 -0.52 0.00 0.00 55.73 55.46 1maj s ARG 59 Cb -0.10 -2.53 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 1maj s ARG 59 CO -0.14 0.13 0.91 0.12 0.02 0.00 0.00 175.30 176.33 1maj s PHE 60 N -2.15 3.58 0.38 -0.53 5.36 -0.89 -4.92 117.98 118.81 1maj s PHE 60 Ca 0.48 1.03 0.21 0.00 -0.96 0.00 0.00 56.93 57.69 1maj s PHE 60 Cb -0.11 -2.52 1.26 0.00 -0.34 0.00 0.00 43.02 41.31 1maj s PHE 60 CO 0.28 -0.51 1.64 1.03 -1.46 0.00 0.00 175.22 176.20 1maj h SER 61 N -0.06 0.38 -1.97 6.13 0.87 -1.95 0.80 113.55 117.75 1maj h SER 61 Ca -0.45 0.19 -0.76 0.00 -1.23 0.00 0.00 61.79 59.53 1maj h SER 61 Cb 1.20 0.16 -0.26 0.00 -0.44 0.00 0.00 62.40 63.06 1maj h SER 61 CO 0.62 -0.21 1.04 0.61 -0.53 0.00 0.00 176.83 178.36 1maj n GLY 62 N -1.36 5.56 2.95 5.77 0.00 -1.26 -4.89 105.19 111.96 1maj n GLY 62 Ca 0.35 -2.45 -0.14 0.00 0.00 0.00 0.00 46.02 43.77 1maj n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maj s VAL 63 N -4.62 -0.38 0.34 1.61 1.01 0.27 -4.93 120.40 113.71 1maj s VAL 63 Ca 0.50 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 62.44 1maj s VAL 63 Cb 0.38 -0.44 -0.11 0.00 0.00 0.00 0.00 36.38 36.20 1maj s VAL 63 CO -0.33 0.09 1.53 -2.84 0.00 0.00 0.00 175.10 173.55 1maj s PRO 64 N 2.39 4.11 0.62 2.72 0.02 -1.26 -4.68 135.00 138.92 1maj s PRO 64 Ca 0.02 2.58 0.28 0.00 0.02 0.00 0.00 61.00 63.91 1maj s PRO 64 Cb -0.12 -2.99 1.48 0.00 0.02 0.00 0.00 34.50 32.89 1maj s PRO 64 CO -0.08 -0.58 1.87 -0.44 -0.33 0.00 0.00 177.00 177.44 1maj h ASP 65 N 3.73 0.00 0.00 2.53 5.19 -2.00 -1.46 116.42 124.41 1maj h ASP 65 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1maj h ASP 65 Cb 1.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.74 1maj h ASP 65 CO 0.70 0.00 0.00 -2.11 -3.12 0.00 0.00 179.24 174.71 1maj n ARG 66 N -3.40 0.38 -3.90 3.56 1.85 -1.26 -4.46 116.66 109.43 1maj n ARG 66 Ca 0.05 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.56 1maj n ARG 66 Cb 0.59 -1.05 -0.13 0.00 -1.05 0.00 0.00 32.46 30.82 1maj n ARG 66 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1maj s PHE 67 N -1.73 3.48 -0.24 2.89 0.08 -0.55 -0.70 117.98 121.20 1maj s PHE 67 Ca 0.00 -2.34 -0.07 0.00 0.12 0.00 0.00 56.93 54.64 1maj s PHE 67 Cb 0.00 -2.64 -0.03 0.00 -0.57 0.00 0.00 43.02 39.77 1maj s PHE 67 CO 0.00 -0.90 0.07 -1.12 -0.10 0.00 0.00 175.22 173.17 1maj s SER 68 N 1.36 5.21 -0.28 1.36 0.01 0.13 -4.78 113.70 116.71 1maj s SER 68 Ca 0.02 -0.17 -0.01 0.00 1.31 0.00 0.00 55.95 57.11 1maj s SER 68 Cb -0.21 -1.93 0.09 0.00 0.21 0.00 0.00 66.02 64.18 1maj s SER 68 CO -0.04 -0.01 0.07 -0.83 0.41 0.00 0.00 173.24 172.84 1maj s GLY 69 N 1.49 1.08 0.31 3.44 0.00 -1.26 0.10 107.32 112.48 1maj s GLY 69 Ca 0.06 -1.52 -0.09 0.00 0.00 0.00 0.00 44.72 43.17 1maj s GLY 69 CO 0.04 1.48 0.53 -0.45 0.00 0.00 0.00 173.10 174.70 1maj s SER 70 N 1.60 0.38 0.00 1.64 0.15 -1.10 0.83 113.70 117.20 1maj s SER 70 Ca 0.06 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.49 1maj s SER 70 Cb -0.17 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1maj s SER 70 CO -0.20 -1.31 0.00 0.61 1.20 0.00 0.00 173.24 173.55 1maj n GLY 71 N -0.49 1.77 3.95 9.45 0.00 -1.26 -1.32 105.19 117.28 1maj n GLY 71 Ca -0.02 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1maj n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1maj s SER 72 N 0.00 6.26 0.33 1.61 1.04 -0.42 -4.81 113.70 117.71 1maj s SER 72 Ca 0.00 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.82 1maj s SER 72 Cb 0.00 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.15 1maj s SER 72 CO 0.00 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.53 1maj n GLY 73 N -1.76 0.88 0.09 7.32 0.00 -1.26 -0.28 105.19 110.18 1maj n GLY 73 Ca -0.05 0.74 0.04 0.00 0.00 0.00 0.00 46.02 46.75 1maj n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1maj n THR 74 N 0.00 1.15 -4.52 2.61 -2.24 -1.26 -4.14 114.28 105.87 1maj n THR 74 Ca 0.00 -1.31 -0.33 0.00 -2.27 0.00 0.00 64.05 60.14 1maj n THR 74 Cb 0.00 0.24 -0.15 0.00 -2.10 0.00 0.00 70.33 68.32 1maj n THR 74 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1maj s ASP 75 N -1.69 3.74 0.18 3.42 -4.77 0.61 -0.68 116.67 117.47 1maj s ASP 75 Ca 0.13 -0.45 -0.02 0.00 -3.30 0.00 0.00 52.55 48.92 1maj s ASP 75 Cb 0.12 -1.58 -0.04 0.00 -1.09 0.00 0.00 42.92 40.33 1maj s ASP 75 CO 0.01 0.09 0.13 -0.36 0.70 0.00 0.00 175.17 175.74 1maj s PHE 76 N 0.80 0.98 0.07 2.11 0.40 -0.92 -1.30 117.98 120.12 1maj s PHE 76 Ca -0.05 -1.27 -0.26 0.00 -0.60 0.00 0.00 56.93 54.75 1maj s PHE 76 Cb -0.15 -0.47 0.07 0.00 0.51 0.00 0.00 43.02 42.98 1maj s PHE 76 CO 0.00 -0.62 0.64 0.99 0.70 0.00 0.00 175.22 176.93 1maj s THR 77 N -4.10 0.00 -0.40 0.64 2.01 -0.44 -0.76 115.64 112.59 1maj s THR 77 Ca 0.32 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.28 1maj s THR 77 Cb 0.07 -1.00 0.10 0.00 0.01 0.00 0.00 72.50 71.67 1maj s THR 77 CO 0.08 0.00 0.18 -0.22 -0.69 0.00 0.00 174.62 173.97 1maj s LEU 78 N -2.11 5.06 -0.17 4.42 0.20 0.12 -2.71 118.68 123.48 1maj s LEU 78 Ca -0.04 -1.86 -0.20 0.00 0.69 0.00 0.00 54.13 52.72 1maj s LEU 78 Cb -0.01 -1.83 -0.03 0.00 -0.43 0.00 0.00 46.19 43.89 1maj s LEU 78 CO -0.04 -0.51 0.59 -0.75 -0.29 0.00 0.00 176.35 175.36 1maj s LYS 79 N 1.19 4.25 -0.14 1.98 2.20 0.12 -2.32 119.74 127.01 1maj s LYS 79 Ca 0.06 0.58 -0.02 0.00 -0.36 0.00 0.00 55.97 56.22 1maj s LYS 79 Cb -0.22 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.53 1maj s LYS 79 CO -0.03 -0.14 -0.07 0.42 -0.36 0.00 0.00 175.35 175.18 1maj s ILE 80 N 1.57 3.63 -0.43 5.43 1.01 -0.48 -0.69 121.20 131.23 1maj s ILE 80 Ca 0.28 -0.46 0.23 0.00 0.00 0.00 0.00 60.65 60.71 1maj s ILE 80 Cb -0.16 -2.57 0.19 0.00 0.01 0.00 0.00 42.46 39.94 1maj s ILE 80 CO 0.11 0.51 1.42 0.28 0.00 0.00 0.00 174.94 177.25 1maj h SER 81 N 6.65 0.00 -1.96 3.58 0.02 -1.18 -1.92 113.55 118.73 1maj h SER 81 Ca -0.30 -0.03 -0.35 0.00 -0.84 0.00 0.00 61.79 60.28 1maj h SER 81 Cb 1.20 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.43 1maj h SER 81 CO 0.60 0.01 -0.67 -0.13 -1.14 0.00 0.00 176.83 175.51 1maj s ARG 82 N -3.24 0.57 -0.23 3.45 1.81 -1.21 -4.60 118.95 115.49 1maj s ARG 82 Ca 0.05 -0.66 -0.29 0.00 -1.72 0.00 0.00 55.73 53.11 1maj s ARG 82 Cb 0.08 -0.68 -0.00 0.00 -0.45 0.00 0.00 34.95 33.90 1maj s ARG 82 CO 0.71 -1.15 1.24 0.08 -0.68 0.00 0.00 175.30 175.49 1maj s VAL 83 N 1.68 4.29 0.52 3.52 1.01 -1.01 -4.84 120.40 125.57 1maj s VAL 83 Ca 0.15 1.52 0.02 0.00 0.00 0.00 0.00 61.98 63.67 1maj s VAL 83 Cb -0.15 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.13 1maj s VAL 83 CO -0.11 -0.29 0.13 -0.62 0.00 0.00 0.00 175.10 174.21 1maj n GLU 84 N 6.85 0.75 0.25 2.72 4.71 -1.26 0.20 120.64 134.85 1maj n GLU 84 Ca 0.14 -3.59 0.18 0.00 -0.01 0.00 0.00 57.16 53.88 1maj n GLU 84 Cb 0.46 0.78 0.87 0.00 -1.01 0.00 0.00 31.44 32.54 1maj n GLU 84 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1maj h ALA 85 N 1.07 1.58 0.00 0.62 0.00 -1.94 0.21 119.26 120.79 1maj h ALA 85 Ca -0.40 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1maj h ALA 85 Cb 1.26 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1maj h ALA 85 CO 0.65 -0.32 -0.17 0.93 0.00 0.00 0.00 179.25 180.33 1maj h GLU 86 N 0.00 0.00 0.00 0.00 5.08 -1.98 -2.73 114.58 114.95 1maj h GLU 86 Ca 0.06 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 1maj h GLU 86 Cb 0.57 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1maj h GLU 86 CO -0.00 0.17 -0.83 -0.44 -1.00 0.00 0.00 179.01 176.90 1maj h ASP 87 N 0.00 0.00 -2.76 1.42 3.32 -0.96 -3.46 116.42 113.98 1maj h ASP 87 Ca -0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.45 1maj h ASP 87 Cb 0.57 0.00 0.12 0.00 0.22 0.00 0.00 39.33 40.24 1maj h ASP 87 CO 0.02 0.83 0.10 0.18 -1.72 0.00 0.00 179.24 178.65 1maj n LEU 88 N -3.50 2.03 0.00 1.55 4.77 -1.03 -4.64 117.00 116.18 1maj n LEU 88 Ca -0.00 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 57.06 1maj n LEU 88 Cb 0.81 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1maj n LEU 88 CO 0.45 -1.58 0.00 0.61 -1.33 0.00 0.00 177.39 175.54 1maj n GLY 89 N 1.25 0.21 3.16 -0.72 0.00 0.15 -4.82 105.19 104.43 1maj n GLY 89 Ca 0.10 -1.59 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 1maj n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1maj s ILE 90 N -1.66 1.58 -0.09 -0.61 1.09 -0.99 0.07 121.20 120.58 1maj s ILE 90 Ca 0.00 -0.80 -0.05 0.00 -1.10 0.00 0.00 60.65 58.70 1maj s ILE 90 Cb 0.00 -1.35 -0.04 0.00 -1.06 0.00 0.00 42.46 40.01 1maj s ILE 90 CO 0.00 0.45 0.12 -0.31 -0.10 0.00 0.00 174.94 175.10 1maj s TYR 91 N 0.01 3.52 0.37 3.97 1.51 0.17 0.25 117.35 127.14 1maj s TYR 91 Ca -0.04 0.44 0.04 0.00 -1.01 0.00 0.00 57.07 56.50 1maj s TYR 91 Cb -0.12 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.80 1maj s TYR 91 CO 0.03 0.68 0.11 -0.06 -1.11 0.00 0.00 175.55 175.20 1maj s PHE 92 N -1.06 1.80 -0.11 2.71 0.40 -0.21 -0.85 117.98 120.67 1maj s PHE 92 Ca 0.17 -1.21 -0.24 0.00 -0.60 0.00 0.00 56.93 55.05 1maj s PHE 92 Cb -0.12 -1.15 0.06 0.00 0.51 0.00 0.00 43.02 42.32 1maj s PHE 92 CO 0.06 -0.24 0.58 0.00 0.70 0.00 0.00 175.22 176.31 1maj n SER 94 N 1.64 0.00 -3.66 0.00 3.41 -0.02 -3.09 113.62 111.91 1maj n SER 94 Ca -0.18 -0.43 -0.15 0.00 -0.26 0.00 0.00 58.87 57.85 1maj n SER 94 Cb 0.56 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.43 1maj n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1maj s GLN 95 N -0.30 0.77 0.00 4.33 0.00 -1.20 -0.18 119.66 123.07 1maj s GLN 95 Ca 0.00 0.38 0.14 0.00 -0.00 0.00 0.00 55.36 55.88 1maj s GLN 95 Cb 0.00 0.36 -0.04 0.00 0.00 0.00 0.00 33.01 33.34 1maj s GLN 95 CO 0.00 -0.18 0.74 2.41 0.00 0.00 0.00 175.29 178.26 1maj n THR 96 N 1.86 0.00 0.20 3.63 -1.04 -1.26 -3.99 114.28 113.67 1maj n THR 96 Ca -0.17 -0.32 0.06 0.00 -2.04 0.00 0.00 64.05 61.58 1maj n THR 96 Cb 0.56 1.13 0.40 0.00 -1.82 0.00 0.00 70.33 70.60 1maj n THR 96 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1maj h THR 97 N 1.23 0.96 -2.97 12.58 2.02 -1.93 -3.43 112.91 121.36 1maj h THR 97 Ca 0.00 -1.33 -0.65 0.00 0.77 0.00 0.00 66.41 65.20 1maj h THR 97 Cb 0.45 1.78 -0.08 0.00 -1.74 0.00 0.00 68.15 68.56 1maj h THR 97 CO 0.00 0.34 -0.54 -1.00 0.37 0.00 0.00 175.52 174.69 1maj s HIS 98 N -3.85 3.40 -0.05 3.16 4.02 -1.26 -4.96 115.29 115.74 1maj s HIS 98 Ca -0.01 0.28 0.01 0.00 1.02 0.00 0.00 55.06 56.36 1maj s HIS 98 Cb 0.12 -1.78 0.02 0.00 -1.02 0.00 0.00 32.58 29.92 1maj s HIS 98 CO 0.68 0.59 -0.07 0.08 1.02 0.00 0.00 174.74 177.05 1maj s VAL 99 N -1.23 0.73 0.53 -0.90 1.01 -1.26 -2.00 120.40 117.28 1maj s VAL 99 Ca 0.24 -0.23 -0.21 0.00 0.00 0.00 0.00 61.98 61.78 1maj s VAL 99 Cb -0.12 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.49 1maj s VAL 99 CO 0.15 0.27 1.19 -2.16 0.00 0.00 0.00 175.10 174.55 1maj s PRO 100 N 0.86 3.33 0.05 2.72 0.04 -1.26 -5.08 135.00 135.66 1maj s PRO 100 Ca -0.12 1.80 -0.30 0.00 0.04 0.00 0.00 61.00 62.42 1maj s PRO 100 Cb -0.15 -2.13 -0.08 0.00 0.04 0.00 0.00 34.50 32.18 1maj s PRO 100 CO 0.01 -0.91 1.67 -1.25 0.04 0.00 0.00 177.00 176.56 1maj s PRO 101 N -3.08 4.19 -0.17 0.56 0.04 -0.85 -4.90 135.00 130.80 1maj s PRO 101 Ca 0.71 2.32 -0.20 0.00 0.04 0.00 0.00 61.00 63.87 1maj s PRO 101 Cb -0.29 -3.70 -0.03 0.00 0.04 0.00 0.00 34.50 30.51 1maj s PRO 101 CO 0.34 -0.77 0.60 0.95 0.04 0.00 0.00 177.00 178.16 1maj s THR 102 N 3.01 5.06 -0.04 1.26 -4.23 -1.26 -4.95 115.64 114.49 1maj s THR 102 Ca 0.75 1.16 0.05 0.00 -1.18 0.00 0.00 61.69 62.47 1maj s THR 102 Cb -0.39 -3.93 -0.01 0.00 1.34 0.00 0.00 72.50 69.52 1maj s THR 102 CO 0.32 0.17 -0.17 0.12 -0.54 0.00 0.00 174.62 174.52 1maj s PHE 103 N 1.53 1.69 0.00 3.99 2.19 -1.26 -3.27 117.98 122.85 1maj s PHE 103 Ca 0.29 -0.45 0.00 0.00 0.33 0.00 0.00 56.93 57.10 1maj s PHE 103 Cb -0.16 -1.13 0.00 0.00 -1.31 0.00 0.00 43.02 40.42 1maj s PHE 103 CO 0.11 -0.13 0.00 0.41 1.83 0.00 0.00 175.22 177.44 1maj n GLY 104 N 3.02 1.10 0.00 13.12 0.00 -1.18 -5.05 105.19 116.21 1maj n GLY 104 Ca -0.17 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1maj n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 105 N 0.00 -0.85 0.00 -0.02 0.00 -1.26 -2.44 105.19 100.61 1maj n GLY 105 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1maj n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 106 N -0.16 -1.51 3.60 -0.02 0.00 -1.13 -4.92 105.19 101.04 1maj n GLY 106 Ca 0.00 0.54 -0.43 0.00 0.00 0.00 0.00 46.02 46.13 1maj n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1maj s THR 107 N 0.00 4.24 -0.47 2.61 2.01 -0.03 -4.80 115.64 119.20 1maj s THR 107 Ca 0.00 1.17 -0.27 0.00 0.31 0.00 0.00 61.69 62.90 1maj s THR 107 Cb 0.00 -4.58 -0.04 0.00 0.01 0.00 0.00 72.50 67.89 1maj s THR 107 CO 0.00 -0.99 2.08 -0.54 -0.69 0.00 0.00 174.62 174.49 1maj s LYS 108 N 4.36 2.64 -1.03 4.92 1.02 0.86 -0.66 119.74 131.85 1maj s LYS 108 Ca 0.47 1.21 -0.11 0.00 0.02 0.00 0.00 55.97 57.55 1maj s LYS 108 Cb -0.07 -4.42 0.24 0.00 -0.52 0.00 0.00 37.83 33.06 1maj s LYS 108 CO 0.31 -2.68 1.05 -1.17 -0.92 0.00 0.00 175.35 171.93 1maj s LEU 109 N 9.66 6.28 0.07 3.17 2.96 0.11 -0.40 118.68 140.53 1maj s LEU 109 Ca 0.84 -3.20 0.04 0.00 -0.22 0.00 0.00 54.13 51.59 1maj s LEU 109 Cb -0.18 -2.24 -0.04 0.00 0.50 0.00 0.00 46.19 44.23 1maj s LEU 109 CO 0.27 -0.45 0.02 -1.61 -1.32 0.00 0.00 176.35 173.26 1maj s GLU 110 N -0.37 2.69 1.10 1.98 2.02 -1.24 -0.68 118.70 124.20 1maj s GLU 110 Ca 0.28 -0.75 -0.18 0.00 0.02 0.00 0.00 54.97 54.35 1maj s GLU 110 Cb -0.09 -2.62 0.10 0.00 0.10 0.00 0.00 34.13 31.62 1maj s GLU 110 CO -0.08 0.57 0.10 1.51 0.02 0.00 0.00 175.26 177.38 1maj n ILE 111 N 0.71 0.00 0.02 -1.63 3.06 -1.26 -2.46 119.36 117.79 1maj n ILE 111 Ca -0.11 -0.29 -0.12 0.00 -2.50 0.00 0.00 62.75 59.74 1maj n ILE 111 Cb 0.52 -0.62 -0.05 0.00 0.54 0.00 0.00 39.64 40.03 1maj n ILE 111 CO 0.00 0.00 0.00 0.50 -2.50 0.00 0.00 176.55 174.55 1maj h LYS 112 N -2.01 -0.46 0.00 9.51 3.64 0.15 -3.35 116.57 124.05 1maj h LYS 112 Ca -0.52 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1maj h LYS 112 Cb 1.35 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 1maj h LYS 112 CO 0.38 -0.31 0.00 2.89 -2.27 0.00 0.00 179.45 180.14