#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 1.90 0.36 2.53 1.01 -1.26 -5.01 120.40 119.93 1maj s VAL 2 Ca 0.00 -0.95 -0.27 0.00 0.00 0.00 0.00 61.98 60.75 1maj s VAL 2 Cb 0.00 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 1maj s VAL 2 CO 0.00 0.53 1.24 -0.69 0.00 0.00 0.00 175.10 176.17 1maj s VAL 3 N 0.14 2.93 -0.24 2.92 1.01 -1.26 -4.81 120.40 121.09 1maj s VAL 3 Ca -0.11 0.87 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 1maj s VAL 3 Cb -0.15 -3.53 0.08 0.00 0.00 0.00 0.00 36.38 32.78 1maj s VAL 3 CO 0.06 0.16 0.05 -0.04 0.00 0.00 0.00 175.10 175.33 1maj s MET 4 N -1.99 0.73 -0.38 2.72 -1.94 -1.26 -2.24 119.30 114.95 1maj s MET 4 Ca 0.52 -0.70 -0.15 0.00 -1.71 0.00 0.00 55.69 53.65 1maj s MET 4 Cb -0.36 -2.05 0.00 0.00 2.01 0.00 0.00 34.83 34.43 1maj s MET 4 CO 0.46 -0.78 0.31 0.99 -0.01 0.00 0.00 175.02 175.99 1maj s THR 5 N 1.75 5.23 0.14 2.05 2.01 -1.05 -4.58 115.64 121.19 1maj s THR 5 Ca 0.03 -0.35 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 1maj s THR 5 Cb -0.17 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.43 1maj s THR 5 CO -0.16 -0.19 0.37 -1.58 -0.69 0.00 0.00 174.62 172.37 1maj s GLN 6 N 1.82 3.61 0.13 4.92 0.74 -1.26 -2.23 119.66 127.39 1maj s GLN 6 Ca 0.08 -0.11 -0.24 0.00 0.05 0.00 0.00 55.36 55.14 1maj s GLN 6 Cb -0.18 -2.86 0.08 0.00 1.10 0.00 0.00 33.01 31.15 1maj s GLN 6 CO 0.11 0.48 0.65 0.95 -0.55 0.00 0.00 175.29 176.92 1maj s THR 7 N -1.65 0.00 1.13 -0.34 -4.23 0.20 -4.62 115.64 106.13 1maj s THR 7 Ca 0.41 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.73 1maj s THR 7 Cb -0.12 -1.00 0.26 0.00 1.34 0.00 0.00 72.50 72.98 1maj s THR 7 CO 0.25 0.00 1.17 -2.16 -0.54 0.00 0.00 174.62 173.33 1maj s PRO 8 N -3.64 -0.67 0.21 3.99 0.04 -1.26 0.24 135.00 133.91 1maj s PRO 8 Ca 0.02 -0.15 0.25 0.00 0.04 0.00 0.00 61.00 61.16 1maj s PRO 8 Cb -0.01 -1.67 0.62 0.00 0.04 0.00 0.00 34.50 33.48 1maj s PRO 8 CO -0.12 -3.33 1.62 -0.07 0.04 0.00 0.00 177.00 175.14 1maj h LEU 9 N -2.30 0.00 -7.49 -3.56 3.38 -1.83 -3.37 115.31 100.14 1maj h LEU 9 Ca -0.45 -0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.26 1maj h LEU 9 Cb 1.28 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.74 1maj h LEU 9 CO 0.36 0.03 -0.54 -0.44 0.09 0.00 0.00 178.44 177.93 1maj s SER 10 N -4.64 -0.16 -0.54 -0.43 0.01 -1.26 -0.67 113.70 106.00 1maj s SER 10 Ca 0.09 0.35 0.06 0.00 1.31 0.00 0.00 55.95 57.76 1maj s SER 10 Cb 0.12 0.30 0.23 0.00 0.21 0.00 0.00 66.02 66.88 1maj s SER 10 CO 0.64 -0.10 0.60 -0.11 0.41 0.00 0.00 173.24 174.68 1maj n LEU 11 N 3.56 2.04 -4.58 2.44 7.94 0.12 -4.87 117.00 123.64 1maj n LEU 11 Ca -0.19 -5.06 -0.41 0.00 -1.11 0.00 0.00 56.01 49.24 1maj n LEU 11 Cb 0.56 -0.11 -0.03 0.00 0.53 0.00 0.00 43.42 44.37 1maj n LEU 11 CO 0.19 2.01 1.59 -2.16 -1.11 0.00 0.00 177.39 177.92 1maj s PRO 12 N -1.69 3.08 0.28 1.96 0.04 -1.26 -4.54 135.00 132.87 1maj s PRO 12 Ca 0.36 1.26 0.02 0.00 0.04 0.00 0.00 61.00 62.68 1maj s PRO 12 Cb 0.13 -4.27 -0.03 0.00 0.04 0.00 0.00 34.50 30.36 1maj s PRO 12 CO -0.08 -2.17 0.26 0.14 0.04 0.00 0.00 177.00 175.20 1maj s VAL 13 N 7.81 0.00 0.28 -0.36 -7.23 -1.25 -4.45 120.40 115.19 1maj s VAL 13 Ca 0.79 -1.91 0.05 0.00 -1.81 0.00 0.00 61.98 59.09 1maj s VAL 13 Cb -0.20 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.21 1maj s VAL 13 CO 0.30 0.00 0.41 -0.94 -0.31 0.00 0.00 175.10 174.56 1maj s SER 14 N -3.26 6.24 -1.01 4.85 1.04 -1.26 0.19 113.70 120.49 1maj s SER 14 Ca 0.38 0.07 -0.23 0.00 0.48 0.00 0.00 55.95 56.65 1maj s SER 14 Cb 0.03 -1.75 -0.00 0.00 0.10 0.00 0.00 66.02 64.40 1maj s SER 14 CO 0.20 -0.18 1.74 -0.76 0.98 0.00 0.00 173.24 175.22 1maj s LEU 15 N -4.07 3.34 0.00 2.42 1.43 -1.26 -2.21 118.68 118.32 1maj s LEU 15 Ca 0.37 -1.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1maj s LEU 15 Cb -0.09 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1maj s LEU 15 CO 0.30 -2.18 0.00 0.61 0.23 0.00 0.00 176.35 175.32 1maj n GLY 16 N 6.63 0.56 3.71 -3.19 0.00 -0.23 -4.80 105.19 107.87 1maj n GLY 16 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 1maj n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1maj s ASP 17 N 0.00 2.67 -0.05 1.61 1.01 -0.94 -4.35 116.67 116.62 1maj s ASP 17 Ca 0.00 1.02 -0.14 0.00 0.71 0.00 0.00 52.55 54.14 1maj s ASP 17 Cb 0.00 -1.59 -0.05 0.00 1.01 0.00 0.00 42.92 42.28 1maj s ASP 17 CO 0.00 -3.08 0.36 -1.10 0.21 0.00 0.00 175.17 171.56 1maj s GLN 18 N -5.14 3.93 0.32 8.23 -0.21 -1.26 -2.86 119.66 122.66 1maj s GLN 18 Ca 0.66 0.29 0.09 0.00 0.02 0.00 0.00 55.36 56.41 1maj s GLN 18 Cb -0.16 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.54 1maj s GLN 18 CO 0.56 0.60 0.09 0.00 -2.12 0.00 0.00 175.29 174.42 1maj s ALA 19 N -0.72 3.37 -0.34 6.09 0.00 0.36 -4.91 121.76 125.60 1maj s ALA 19 Ca 0.22 -1.78 0.04 0.00 0.00 0.00 0.00 51.96 50.44 1maj s ALA 19 Cb -0.15 -0.73 0.19 0.00 0.00 0.00 0.00 23.12 22.43 1maj s ALA 19 CO 0.10 0.11 0.67 -1.54 0.00 0.00 0.00 175.76 175.11 1maj s SER 20 N -3.78 -1.41 0.74 0.00 1.04 -1.25 -0.11 113.70 108.92 1maj s SER 20 Ca 0.35 -0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.45 1maj s SER 20 Cb -0.04 1.84 0.05 0.00 0.10 0.00 0.00 66.02 67.97 1maj s SER 20 CO 0.22 -0.21 1.10 -0.63 0.98 0.00 0.00 173.24 174.70 1maj s ILE 21 N 2.40 2.77 -0.17 -1.02 1.09 -1.11 -4.73 121.20 120.44 1maj s ILE 21 Ca 0.14 0.16 -0.04 0.00 -1.10 0.00 0.00 60.65 59.81 1maj s ILE 21 Cb -0.06 -3.23 0.06 0.00 -1.06 0.00 0.00 42.46 38.17 1maj s ILE 21 CO -0.18 -0.29 0.08 -0.55 -0.10 0.00 0.00 174.94 173.90 1maj s SER 22 N -4.46 2.40 -0.13 3.58 0.15 0.66 -2.51 113.70 113.38 1maj s SER 22 Ca 0.59 -0.62 0.01 0.00 0.70 0.00 0.00 55.95 56.64 1maj s SER 22 Cb -0.11 -0.31 -0.00 0.00 -1.71 0.00 0.00 66.02 63.89 1maj s SER 22 CO 0.49 -0.34 -0.18 0.00 1.20 0.00 0.00 173.24 174.42 1maj s ARG 24 N 0.59 1.76 -0.24 0.00 0.52 -0.95 -0.80 118.95 119.83 1maj s ARG 24 Ca -0.10 -1.21 -0.05 0.00 -0.52 0.00 0.00 55.73 53.84 1maj s ARG 24 Cb -0.16 -2.09 -0.01 0.00 0.52 0.00 0.00 34.95 33.21 1maj s ARG 24 CO 0.03 0.47 0.00 -1.54 0.02 0.00 0.00 175.30 174.29 1maj s SER 25 N -2.20 4.62 0.00 0.23 1.04 0.23 -2.51 113.70 115.11 1maj s SER 25 Ca 0.18 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.25 1maj s SER 25 Cb -0.10 -1.81 0.00 0.00 0.10 0.00 0.00 66.02 64.21 1maj s SER 25 CO 0.10 -0.04 0.44 -1.20 0.98 0.00 0.00 173.24 173.53 1maj n SER 26 N 4.84 1.01 0.00 7.02 7.64 -0.95 -2.73 113.62 130.44 1maj n SER 26 Ca -0.17 -1.52 0.00 0.00 1.01 0.00 0.00 58.87 58.18 1maj n SER 26 Cb 0.51 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1maj n SER 26 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1maj n GLN 27 N 0.20 0.00 -0.99 1.43 7.27 -1.26 -4.86 117.38 119.18 1maj n GLN 27 Ca 0.00 -0.07 0.01 0.00 0.07 0.00 0.00 57.00 57.01 1maj n GLN 27 Cb 0.22 -0.26 -0.01 0.00 2.41 0.00 0.00 30.24 32.60 1maj n GLN 27 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1maj n SER 28 N 0.00 -5.32 -0.91 1.69 3.41 -1.11 -4.80 113.62 106.59 1maj n SER 28 Ca 0.00 1.17 0.01 0.00 -0.26 0.00 0.00 58.87 59.78 1maj n SER 28 Cb 0.32 -2.87 0.20 0.00 -0.26 0.00 0.00 64.21 61.60 1maj n SER 28 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1maj n LEU 29 N -2.32 3.55 -4.56 1.04 4.77 -1.25 -4.97 117.00 113.27 1maj n LEU 29 Ca -0.01 -3.75 -0.41 0.00 -0.03 0.00 0.00 56.01 51.82 1maj n LEU 29 Cb 0.32 -0.59 -0.08 0.00 -2.33 0.00 0.00 43.42 40.74 1maj n LEU 29 CO 0.00 1.25 0.17 -0.69 -1.33 0.00 0.00 177.39 176.79 1maj s VAL 30 N -3.20 5.07 1.33 4.08 1.01 -1.26 -2.41 120.40 125.02 1maj s VAL 30 Ca 0.42 0.27 -0.19 0.00 0.00 0.00 0.00 61.98 62.48 1maj s VAL 30 Cb 0.38 -3.91 0.34 0.00 0.00 0.00 0.00 36.38 33.19 1maj s VAL 30 CO -0.02 -0.16 0.96 -2.28 0.00 0.00 0.00 175.10 173.60 1maj s HIS 31 N 2.27 0.10 -0.86 5.22 2.46 -0.30 -4.57 115.29 119.61 1maj s HIS 31 Ca 0.17 0.78 -0.09 0.00 0.47 0.00 0.00 55.06 56.38 1maj s HIS 31 Cb -0.16 -2.97 -0.28 0.00 -0.13 0.00 0.00 32.58 29.04 1maj s HIS 31 CO 0.13 -4.60 2.02 0.43 -2.47 0.00 0.00 174.74 170.24 1maj n SER 32 N -5.39 -1.27 -4.21 9.88 7.64 -1.26 -1.90 113.62 117.11 1maj n SER 32 Ca 0.09 -0.75 -0.33 0.00 1.01 0.00 0.00 58.87 58.89 1maj n SER 32 Cb 0.58 -0.64 -0.07 0.00 -1.01 0.00 0.00 64.21 63.07 1maj n SER 32 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1maj n ASN 33 N 6.51 -0.05 0.00 6.43 6.94 -1.26 -4.85 115.26 128.98 1maj n ASN 33 Ca 0.57 -1.23 0.00 0.00 -0.02 0.00 0.00 54.58 53.90 1maj n ASN 33 Cb 0.21 -1.52 0.00 0.00 -2.36 0.00 0.00 39.78 36.11 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 -2.43 2.69 3.89 4.83 0.00 -0.80 -5.17 105.19 108.20 1maj n GLY 34 Ca -0.27 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 1maj n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1maj n ASN 35 N 0.00 2.94 -4.48 1.61 4.13 -1.26 -4.82 115.26 113.38 1maj n ASN 35 Ca 0.00 -3.02 -0.33 0.00 1.68 0.00 0.00 54.58 52.91 1maj n ASN 35 Cb 0.00 0.04 -0.13 0.00 -1.54 0.00 0.00 39.78 38.15 1maj n ASN 35 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1maj s THR 36 N -2.83 3.12 -0.07 3.41 2.01 -1.26 -1.15 115.64 118.87 1maj s THR 36 Ca 0.26 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.61 1maj s THR 36 Cb -0.02 -2.24 -0.00 0.00 0.01 0.00 0.00 72.50 70.25 1maj s THR 36 CO 0.16 0.59 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.15 1maj s TYR 37 N -0.64 2.29 -0.20 4.92 2.02 -1.01 -4.66 117.35 120.06 1maj s TYR 37 Ca 0.10 -0.80 -0.21 0.00 -0.37 0.00 0.00 57.07 55.79 1maj s TYR 37 Cb -0.11 -1.53 0.06 0.00 -0.40 0.00 0.00 41.96 39.98 1maj s TYR 37 CO 0.01 -0.29 0.59 -1.17 -1.57 0.00 0.00 175.55 173.12 1maj s LEU 38 N 0.13 -0.25 0.08 -1.29 2.96 -1.26 -3.55 118.68 115.50 1maj s LEU 38 Ca -0.10 1.12 0.08 0.00 -0.22 0.00 0.00 54.13 55.00 1maj s LEU 38 Cb -0.15 2.04 -0.03 0.00 0.50 0.00 0.00 46.19 48.55 1maj s LEU 38 CO 0.05 -0.25 -0.21 0.20 -1.32 0.00 0.00 176.35 174.83 1maj s ASN 39 N 0.13 2.52 0.28 3.68 -0.87 -0.72 -1.85 114.94 118.12 1maj s ASN 39 Ca -0.01 -0.63 0.10 0.00 -1.57 0.00 0.00 52.86 50.75 1maj s ASN 39 Cb -0.04 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.25 40.98 1maj s ASN 39 CO 0.02 0.10 -0.05 0.26 -2.57 0.00 0.00 177.10 174.86 1maj s TRP 40 N -1.02 2.57 0.07 2.20 0.52 0.97 -1.54 118.94 122.71 1maj s TRP 40 Ca 0.07 -0.28 -0.12 0.00 0.02 0.00 0.00 56.10 55.78 1maj s TRP 40 Cb -0.10 -1.19 0.01 0.00 -1.15 0.00 0.00 33.47 31.05 1maj s TRP 40 CO 0.03 0.62 0.28 0.71 0.02 0.00 0.00 176.95 178.61 1maj s TYR 41 N -2.40 -0.04 -0.14 -1.98 2.02 -0.40 -3.45 117.35 110.96 1maj s TYR 41 Ca 0.32 -0.21 -0.04 0.00 -0.37 0.00 0.00 57.07 56.77 1maj s TYR 41 Cb -0.05 0.07 0.06 0.00 -0.40 0.00 0.00 41.96 41.64 1maj s TYR 41 CO 0.19 -0.54 0.13 -1.17 -1.57 0.00 0.00 175.55 172.59 1maj s LEU 42 N -2.38 0.11 -0.13 -1.29 2.96 0.78 -1.42 118.68 117.30 1maj s LEU 42 Ca -0.01 -0.20 -0.24 0.00 -0.22 0.00 0.00 54.13 53.45 1maj s LEU 42 Cb 0.01 0.04 -0.02 0.00 0.50 0.00 0.00 46.19 46.71 1maj s LEU 42 CO -0.07 -0.31 0.76 -1.58 -1.32 0.00 0.00 176.35 173.83 1maj s GLN 43 N 2.22 4.34 0.07 1.98 0.74 0.56 -0.88 119.66 128.68 1maj s GLN 43 Ca 0.04 0.91 -0.00 0.00 0.05 0.00 0.00 55.36 56.36 1maj s GLN 43 Cb -0.14 -3.53 0.01 0.00 1.10 0.00 0.00 33.01 30.45 1maj s GLN 43 CO -0.08 -0.17 0.10 1.17 -0.55 0.00 0.00 175.29 175.75 1maj n LYS 44 N 4.67 0.55 -2.02 1.67 4.81 -1.26 -0.45 118.16 126.13 1maj n LYS 44 Ca 0.02 -0.26 -0.26 0.00 -0.87 0.00 0.00 58.31 56.93 1maj n LYS 44 Cb 0.50 -0.06 -0.06 0.00 0.02 0.00 0.00 35.03 35.43 1maj n LYS 44 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1maj s ALA 45 N -2.80 1.63 -1.21 3.14 0.00 -1.26 -3.68 121.76 117.57 1maj s ALA 45 Ca 0.06 -1.63 -0.00 0.00 0.00 0.00 0.00 51.96 50.40 1maj s ALA 45 Cb -0.00 -4.59 0.00 0.00 0.00 0.00 0.00 23.12 18.53 1maj s ALA 45 CO 0.04 -5.01 0.98 0.41 0.00 0.00 0.00 175.76 172.18 1maj n GLY 46 N 6.59 -0.36 0.00 0.00 0.00 -1.26 -5.00 105.19 105.16 1maj n GLY 46 Ca 0.42 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 -4.15 1.54 -3.38 1.61 7.27 -1.24 -5.14 117.38 113.88 1maj n GLN 47 Ca -0.29 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.45 1maj n GLN 47 Cb 0.67 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 33.26 1maj n GLN 47 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1maj s SER 48 N 1.00 6.71 -0.19 1.69 1.04 -1.26 -4.73 113.70 117.96 1maj s SER 48 Ca 0.00 1.00 -0.29 0.00 0.48 0.00 0.00 55.95 57.15 1maj s SER 48 Cb 0.00 -2.26 -0.05 0.00 0.10 0.00 0.00 66.02 63.81 1maj s SER 48 CO 0.00 -0.00 2.04 -2.16 0.98 0.00 0.00 173.24 174.10 1maj s PRO 49 N -2.46 3.41 0.04 4.02 0.04 -1.26 -4.39 135.00 134.40 1maj s PRO 49 Ca 0.44 1.99 -0.30 0.00 0.04 0.00 0.00 61.00 63.17 1maj s PRO 49 Cb -0.13 -4.27 -0.04 0.00 0.04 0.00 0.00 34.50 30.10 1maj s PRO 49 CO 0.20 -1.78 0.99 0.21 0.04 0.00 0.00 177.00 176.66 1maj s LYS 50 N 5.72 4.60 -0.26 4.56 2.20 -0.06 -4.81 119.74 131.70 1maj s LYS 50 Ca 0.92 1.46 -0.13 0.00 -0.36 0.00 0.00 55.97 57.86 1maj s LYS 50 Cb -0.32 -3.42 -0.05 0.00 -1.51 0.00 0.00 37.83 32.53 1maj s LYS 50 CO 0.35 0.02 0.26 -1.17 -0.36 0.00 0.00 175.35 174.45 1maj s LEU 51 N 0.67 4.06 0.00 5.43 2.96 -1.26 -0.16 118.68 130.38 1maj s LEU 51 Ca 0.51 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 1maj s LEU 51 Cb -0.22 -2.25 0.00 0.00 0.50 0.00 0.00 46.19 44.22 1maj s LEU 51 CO 0.29 -0.07 0.00 0.18 -1.32 0.00 0.00 176.35 175.43 1maj n LEU 52 N 4.91 0.09 -4.74 -0.68 7.99 -1.22 -4.66 117.00 118.69 1maj n LEU 52 Ca -0.12 0.06 -0.35 0.00 -0.01 0.00 0.00 56.01 55.59 1maj n LEU 52 Cb 0.52 -0.40 -0.08 0.00 -0.11 0.00 0.00 43.42 43.34 1maj n LEU 52 CO 0.35 -0.40 -0.21 -0.63 -1.51 0.00 0.00 177.39 174.99 1maj s ILE 53 N -0.81 5.18 -0.12 -0.08 -1.09 -1.26 -0.13 121.20 122.89 1maj s ILE 53 Ca 0.00 0.10 0.17 0.00 -2.23 0.00 0.00 60.65 58.69 1maj s ILE 53 Cb 0.00 -3.32 0.26 0.00 -1.58 0.00 0.00 42.46 37.82 1maj s ILE 53 CO 0.00 0.51 1.13 0.00 -1.23 0.00 0.00 174.94 175.35 1maj n TYR 54 N 3.00 0.00 -2.70 3.97 4.11 -1.26 -0.02 117.16 124.25 1maj n TYR 54 Ca -0.17 -0.89 -0.06 0.00 -0.00 0.00 0.00 57.90 56.78 1maj n TYR 54 Cb 0.53 -0.14 0.08 0.00 -0.00 0.00 0.00 39.34 39.81 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 -1.25 0.48 0.00 -3.48 3.00 -0.77 -4.70 118.16 111.44 1maj n LYS 55 Ca 0.14 -1.22 0.00 0.00 -0.00 0.00 0.00 58.31 57.23 1maj n LYS 55 Cb 0.65 -0.71 0.00 0.00 0.00 0.00 0.00 35.03 34.97 1maj n LYS 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1maj n VAL 56 N 1.11 0.00 -1.11 3.15 0.31 -0.91 -2.93 118.33 117.94 1maj n VAL 56 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 1maj n VAL 56 Cb 0.70 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.63 1maj n VAL 56 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1maj n SER 57 N 1.70 0.14 -3.24 4.52 3.41 -1.25 -2.38 113.62 116.52 1maj n SER 57 Ca 0.00 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 1maj n SER 57 Cb 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1maj n SER 57 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1maj n ASN 58 N -0.05 0.00 -3.59 4.04 6.94 -1.15 -4.42 115.26 117.04 1maj n ASN 58 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 54.58 54.50 1maj n ASN 58 Cb 0.52 0.00 -0.08 0.00 -2.36 0.00 0.00 39.78 37.86 1maj n ASN 58 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1maj s ARG 59 N 0.00 0.38 0.83 -3.83 0.52 -1.26 -4.60 118.95 111.00 1maj s ARG 59 Ca 0.00 1.05 -0.12 0.00 -0.52 0.00 0.00 55.73 56.14 1maj s ARG 59 Cb 0.00 0.34 0.10 0.00 0.52 0.00 0.00 34.95 35.91 1maj s ARG 59 CO 0.00 -0.31 1.17 0.12 0.02 0.00 0.00 175.30 176.30 1maj s PHE 60 N 2.67 1.86 0.29 -0.53 5.36 0.81 -4.84 117.98 123.60 1maj s PHE 60 Ca 0.01 1.70 -0.29 0.00 -0.96 0.00 0.00 56.93 57.38 1maj s PHE 60 Cb -0.13 -3.38 -0.13 0.00 -0.34 0.00 0.00 43.02 39.05 1maj s PHE 60 CO -0.15 -2.67 1.25 -1.13 -1.46 0.00 0.00 175.22 171.07 1maj n SER 61 N -3.60 2.36 0.00 6.13 3.41 -1.26 -1.17 113.62 119.49 1maj n SER 61 Ca 0.12 1.18 0.00 0.00 -0.26 0.00 0.00 58.87 59.91 1maj n SER 61 Cb 0.51 -1.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 1maj n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1maj n GLY 62 N 1.31 2.89 3.65 5.00 0.00 -1.26 -4.99 105.19 111.80 1maj n GLY 62 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.38 3.35 0.49 1.61 1.01 -0.32 -4.94 120.40 120.23 1maj s VAL 63 Ca 0.00 0.41 -0.24 0.00 0.00 0.00 0.00 61.98 62.16 1maj s VAL 63 Cb 0.00 -3.29 -0.07 0.00 0.00 0.00 0.00 36.38 33.02 1maj s VAL 63 CO 0.00 -0.06 1.39 -2.84 0.00 0.00 0.00 175.10 173.59 1maj s PRO 64 N 4.42 3.44 0.40 2.72 0.02 -1.26 -4.85 135.00 139.89 1maj s PRO 64 Ca 0.81 2.31 0.19 0.00 0.02 0.00 0.00 61.00 64.33 1maj s PRO 64 Cb -0.36 -2.47 1.12 0.00 0.02 0.00 0.00 34.50 32.81 1maj s PRO 64 CO 0.34 -0.98 1.77 0.22 -0.33 0.00 0.00 177.00 178.03 1maj h ASP 65 N 1.92 0.43 -0.77 2.53 3.58 -1.99 0.53 116.42 122.66 1maj h ASP 65 Ca -0.51 0.08 0.22 0.00 0.42 0.00 0.00 57.03 57.25 1maj h ASP 65 Cb 1.28 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 42.31 1maj h ASP 65 CO 0.59 0.08 0.73 0.03 -2.88 0.00 0.00 179.24 177.80 1maj h ARG 66 N 0.38 0.00 -6.14 0.28 3.08 -1.94 -3.36 114.38 106.68 1maj h ARG 66 Ca 0.59 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 60.05 1maj h ARG 66 Cb 1.52 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.47 1maj h ARG 66 CO -0.29 0.00 0.68 -0.06 -1.07 0.00 0.00 179.97 179.23 1maj s PHE 67 N -4.67 2.79 -0.21 3.04 0.40 0.18 -0.64 117.98 118.86 1maj s PHE 67 Ca -0.04 0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.49 1maj s PHE 67 Cb 0.17 -4.16 0.07 0.00 0.51 0.00 0.00 43.02 39.61 1maj s PHE 67 CO 0.60 -1.33 0.05 0.45 0.70 0.00 0.00 175.22 175.69 1maj s SER 68 N 2.68 3.06 0.43 1.36 0.15 -0.29 -4.88 113.70 116.21 1maj s SER 68 Ca 0.36 -0.93 0.08 0.00 0.70 0.00 0.00 55.95 56.16 1maj s SER 68 Cb -0.10 -0.61 0.01 0.00 -1.71 0.00 0.00 66.02 63.61 1maj s SER 68 CO 0.23 -0.33 0.56 -0.83 1.20 0.00 0.00 173.24 174.08 1maj s GLY 69 N 1.85 1.96 0.00 9.45 0.00 -1.26 -1.27 107.32 118.05 1maj s GLY 69 Ca 0.01 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1maj s GLY 69 CO -0.11 -1.54 0.00 -1.26 0.00 0.00 0.00 173.10 170.19 1maj n SER 70 N -1.84 0.00 0.00 1.64 2.88 0.28 -3.82 113.62 112.76 1maj n SER 70 Ca 0.08 -0.58 0.00 0.00 -1.33 0.00 0.00 58.87 57.04 1maj n SER 70 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1maj n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1maj n GLY 71 N 0.00 2.43 3.33 0.46 0.00 -1.25 -1.05 105.19 109.11 1maj n GLY 71 Ca 0.00 0.10 -0.46 0.00 0.00 0.00 0.00 46.02 45.66 1maj n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1maj s SER 72 N 0.00 6.19 0.43 1.61 0.01 -0.73 -4.82 113.70 116.39 1maj s SER 72 Ca 0.00 -1.65 0.00 0.00 1.31 0.00 0.00 55.95 55.61 1maj s SER 72 Cb 0.00 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 64.00 1maj s SER 72 CO 0.00 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.36 1maj n GLY 73 N 5.25 1.38 1.78 3.44 0.00 -1.26 -3.97 105.19 111.81 1maj n GLY 73 Ca -0.13 -0.77 0.07 0.00 0.00 0.00 0.00 46.02 45.20 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 2.45 -4.61 2.61 -2.24 -1.26 -3.90 114.28 107.33 1maj n THR 74 Ca 0.00 -1.30 -0.23 0.00 -2.27 0.00 0.00 64.05 60.25 1maj n THR 74 Cb 0.00 -0.18 -0.16 0.00 -2.10 0.00 0.00 70.33 67.89 1maj n THR 74 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1maj s ASP 75 N -0.78 1.66 0.03 3.42 1.11 -1.25 -0.60 116.67 120.25 1maj s ASP 75 Ca 0.52 -0.26 0.00 0.00 0.18 0.00 0.00 52.55 52.99 1maj s ASP 75 Cb 0.38 -0.42 -0.02 0.00 1.07 0.00 0.00 42.92 43.93 1maj s ASP 75 CO 0.18 0.11 -0.04 -0.36 1.18 0.00 0.00 175.17 176.24 1maj s PHE 76 N 0.07 0.37 -0.08 4.23 0.40 0.02 -1.77 117.98 121.21 1maj s PHE 76 Ca -0.02 -0.62 -0.07 0.00 -0.60 0.00 0.00 56.93 55.62 1maj s PHE 76 Cb -0.09 -0.25 0.02 0.00 0.51 0.00 0.00 43.02 43.20 1maj s PHE 76 CO 0.01 -0.20 0.21 0.99 0.70 0.00 0.00 175.22 176.92 1maj s THR 77 N -1.88 -0.00 -0.70 0.64 2.01 -0.22 -1.15 115.64 114.33 1maj s THR 77 Ca -0.11 0.01 -0.10 0.00 0.31 0.00 0.00 61.69 61.80 1maj s THR 77 Cb -0.07 -0.30 0.18 0.00 0.01 0.00 0.00 72.50 72.33 1maj s THR 77 CO -0.02 0.00 0.59 -0.22 -0.69 0.00 0.00 174.62 174.29 1maj s LEU 78 N 0.18 6.09 -0.31 4.42 0.20 -1.05 -0.56 118.68 127.65 1maj s LEU 78 Ca -0.01 -2.62 -0.24 0.00 0.69 0.00 0.00 54.13 51.95 1maj s LEU 78 Cb -0.02 -2.06 0.00 0.00 -0.43 0.00 0.00 46.19 43.68 1maj s LEU 78 CO -0.00 -0.53 0.81 -0.54 -0.29 0.00 0.00 176.35 175.80 1maj s LYS 79 N 0.28 3.96 -0.18 1.98 1.02 -0.40 -2.74 119.74 123.67 1maj s LYS 79 Ca 0.15 0.61 -0.06 0.00 0.02 0.00 0.00 55.97 56.69 1maj s LYS 79 Cb -0.16 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.38 1maj s LYS 79 CO -0.05 -0.71 0.03 0.42 -0.92 0.00 0.00 175.35 174.11 1maj s ILE 80 N 3.03 4.45 -1.56 2.17 1.01 0.84 -1.14 121.20 130.00 1maj s ILE 80 Ca 0.33 -0.16 0.11 0.00 0.00 0.00 0.00 60.65 60.93 1maj s ILE 80 Cb -0.14 -2.99 0.37 0.00 0.01 0.00 0.00 42.46 39.71 1maj s ILE 80 CO 0.13 0.47 1.25 -1.54 0.00 0.00 0.00 174.94 175.24 1maj n SER 81 N 3.61 2.54 -3.18 3.58 3.41 0.19 -0.49 113.62 123.28 1maj n SER 81 Ca -0.17 -2.16 0.05 0.00 -0.26 0.00 0.00 58.87 56.33 1maj n SER 81 Cb 0.52 -0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 1maj n SER 81 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1maj s ARG 82 N -1.62 0.10 -0.04 4.33 1.81 -1.24 -4.71 118.95 117.58 1maj s ARG 82 Ca 0.27 0.21 -0.06 0.00 -1.72 0.00 0.00 55.73 54.43 1maj s ARG 82 Cb 0.16 0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.74 1maj s ARG 82 CO 0.15 -0.09 0.20 0.08 -0.68 0.00 0.00 175.30 174.96 1maj s VAL 83 N 2.69 5.41 0.49 3.52 1.01 -1.14 -4.86 120.40 127.53 1maj s VAL 83 Ca -0.04 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.05 1maj s VAL 83 Cb -0.07 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.79 1maj s VAL 83 CO -0.11 0.44 0.04 -1.61 0.00 0.00 0.00 175.10 173.86 1maj s GLU 84 N -1.56 2.14 0.02 2.72 2.02 -1.26 -1.07 118.70 121.71 1maj s GLU 84 Ca 0.23 -2.36 -0.26 0.00 0.02 0.00 0.00 54.97 52.60 1maj s GLU 84 Cb -0.13 -1.23 -0.17 0.00 0.10 0.00 0.00 34.13 32.71 1maj s GLU 84 CO 0.13 -0.43 1.28 0.00 0.02 0.00 0.00 175.26 176.26 1maj h ALA 85 N 1.45 -0.50 -0.47 5.21 0.00 -1.97 -2.92 119.26 120.06 1maj h ALA 85 Ca -0.41 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.46 1maj h ALA 85 Cb 1.31 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1maj h ALA 85 CO 0.68 -0.63 0.34 0.93 0.00 0.00 0.00 179.25 180.57 1maj h GLU 86 N -0.79 0.00 -0.49 0.00 5.08 -2.02 0.26 114.58 116.63 1maj h GLU 86 Ca -0.05 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1maj h GLU 86 Cb 0.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1maj h GLU 86 CO 0.08 0.00 0.11 0.22 -1.00 0.00 0.00 179.01 178.42 1maj h ASP 87 N 0.00 0.68 -1.95 1.42 1.82 -1.92 -3.44 116.42 113.03 1maj h ASP 87 Ca 0.22 -0.12 -0.65 0.00 -0.39 0.00 0.00 57.03 56.10 1maj h ASP 87 Cb 0.90 -0.18 0.08 0.00 0.68 0.00 0.00 39.33 40.81 1maj h ASP 87 CO -0.00 0.68 0.30 0.18 -1.61 0.00 0.00 179.24 178.79 1maj n LEU 88 N -4.29 1.61 0.00 2.28 4.77 0.08 -4.79 117.00 116.66 1maj n LEU 88 Ca 0.03 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.15 1maj n LEU 88 Cb 0.22 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.08 1maj n LEU 88 CO 0.39 -1.24 0.00 0.61 -1.33 0.00 0.00 177.39 175.82 1maj n GLY 89 N 2.07 -0.57 3.24 -0.72 0.00 0.13 -4.45 105.19 104.89 1maj n GLY 89 Ca 0.15 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 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 -4.00 3.32 0.22 -0.61 1.01 0.40 -0.97 121.20 120.58 1maj s ILE 90 Ca 0.00 -1.08 -0.30 0.00 0.00 0.00 0.00 60.65 59.27 1maj s ILE 90 Cb 0.00 -2.80 -0.08 0.00 0.01 0.00 0.00 42.46 39.59 1maj s ILE 90 CO 0.00 0.01 0.98 -0.31 0.00 0.00 0.00 174.94 175.62 1maj s TYR 91 N 1.36 3.87 0.16 3.97 2.02 0.12 -0.33 117.35 128.52 1maj s TYR 91 Ca -0.01 1.84 0.01 0.00 -0.37 0.00 0.00 57.07 58.54 1maj s TYR 91 Cb -0.18 -3.06 -0.04 0.00 -0.40 0.00 0.00 41.96 38.27 1maj s TYR 91 CO -0.01 0.18 0.01 -0.06 -1.57 0.00 0.00 175.55 174.11 1maj s PHE 92 N -0.92 1.11 0.01 2.71 0.40 -0.51 -1.86 117.98 118.92 1maj s PHE 92 Ca 0.43 -1.05 0.02 0.00 -0.60 0.00 0.00 56.93 55.73 1maj s PHE 92 Cb -0.27 -0.64 -0.01 0.00 0.51 0.00 0.00 43.02 42.62 1maj s PHE 92 CO 0.33 -0.27 -0.06 0.00 0.70 0.00 0.00 175.22 175.92 1maj s SER 94 N -0.54 1.40 0.58 0.00 0.15 -0.59 -1.28 113.70 113.42 1maj s SER 94 Ca -0.01 -0.15 -0.19 0.00 0.70 0.00 0.00 55.95 56.29 1maj s SER 94 Cb -0.04 0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.48 1maj s SER 94 CO -0.00 -0.31 1.20 0.00 1.20 0.00 0.00 173.24 175.33 1maj s GLN 95 N 2.29 3.07 -0.15 5.44 1.03 -1.26 -1.75 119.66 128.32 1maj s GLN 95 Ca 0.05 1.82 0.14 0.00 0.04 0.00 0.00 55.36 57.41 1maj s GLN 95 Cb -0.15 -1.98 0.36 0.00 0.03 0.00 0.00 33.01 31.27 1maj s GLN 95 CO -0.10 -1.13 1.18 -2.37 -2.54 0.00 0.00 175.29 170.33 1maj n THR 96 N -1.47 1.74 0.04 3.63 5.66 -1.23 -4.15 114.28 118.49 1maj n THR 96 Ca 0.13 -2.53 0.04 0.00 -3.05 0.00 0.00 64.05 58.63 1maj n THR 96 Cb 0.49 -0.06 -0.08 0.00 -1.55 0.00 0.00 70.33 69.14 1maj n THR 96 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1maj n THR 97 N -0.96 0.91 -4.71 1.09 -1.04 -1.24 -4.78 114.28 103.55 1maj n THR 97 Ca 0.16 -0.64 -0.24 0.00 -2.04 0.00 0.00 64.05 61.28 1maj n THR 97 Cb 0.73 -0.52 -0.16 0.00 -1.82 0.00 0.00 70.33 68.56 1maj n THR 97 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1maj s HIS 98 N -3.08 1.46 -0.08 -1.42 3.76 -1.26 -4.98 115.29 109.69 1maj s HIS 98 Ca -0.03 -0.38 -0.00 0.00 -0.15 0.00 0.00 55.06 54.50 1maj s HIS 98 Cb 0.09 -0.99 -0.03 0.00 1.11 0.00 0.00 32.58 32.77 1maj s HIS 98 CO 0.82 -0.12 -0.05 0.08 -0.85 0.00 0.00 174.74 174.62 1maj s VAL 99 N -0.02 3.83 0.74 -0.90 1.01 -1.26 -3.05 120.40 120.74 1maj s VAL 99 Ca -0.01 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 1maj s VAL 99 Cb -0.10 -2.59 0.04 0.00 0.00 0.00 0.00 36.38 33.73 1maj s VAL 99 CO 0.01 0.58 1.07 -2.16 0.00 0.00 0.00 175.10 174.61 1maj s PRO 100 N -0.63 2.56 0.28 2.72 0.04 -1.26 -4.91 135.00 133.79 1maj s PRO 100 Ca 0.10 0.93 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1maj s PRO 100 Cb -0.12 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 1maj s PRO 100 CO 0.02 -1.36 1.45 -1.25 0.04 0.00 0.00 177.00 175.90 1maj s PRO 101 N -5.03 4.24 0.07 0.56 0.04 -1.17 -4.87 135.00 128.83 1maj s PRO 101 Ca 0.59 2.36 -0.25 0.00 0.04 0.00 0.00 61.00 63.75 1maj s PRO 101 Cb -0.15 -3.08 -0.16 0.00 0.04 0.00 0.00 34.50 31.15 1maj s PRO 101 CO 0.55 -0.44 1.62 1.79 0.04 0.00 0.00 177.00 180.57 1maj h THR 102 N 3.40 0.96 -5.33 1.26 1.35 -1.80 -3.49 112.91 109.26 1maj h THR 102 Ca -0.47 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1maj h THR 102 Cb 1.22 1.10 -0.06 0.00 -1.73 0.00 0.00 68.15 68.68 1maj h THR 102 CO 0.75 0.05 -1.15 0.33 -0.25 0.00 0.00 175.52 175.25 1maj n PHE 103 N -5.10 -3.35 0.00 4.73 -0.00 -1.26 -5.02 117.46 107.46 1maj n PHE 103 Ca -0.08 1.78 0.00 0.00 -0.00 0.00 0.00 57.45 59.14 1maj n PHE 103 Cb 0.12 -3.30 0.00 0.00 -0.00 0.00 0.00 39.48 36.30 1maj n PHE 103 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1maj n GLY 104 N 1.49 -1.98 0.00 7.13 0.00 -0.41 -4.99 105.19 106.44 1maj n GLY 104 Ca -0.20 1.00 0.00 0.00 0.00 0.00 0.00 46.02 46.82 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 0.60 0.00 -0.02 0.00 -1.18 -4.59 105.19 99.99 1maj n GLY 105 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 5.00 -0.28 3.00 -0.02 0.00 -1.12 -4.21 105.19 107.55 1maj n GLY 106 Ca 0.00 0.22 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.75 0.43 2.61 2.01 -0.78 -3.94 115.64 115.22 1maj s THR 107 Ca 0.00 -0.07 -0.21 0.00 0.31 0.00 0.00 61.69 61.71 1maj s THR 107 Cb 0.00 -0.90 -0.10 0.00 0.01 0.00 0.00 72.50 71.51 1maj s THR 107 CO 0.00 -0.10 0.97 -0.54 -0.69 0.00 0.00 174.62 174.26 1maj s LYS 108 N 2.66 4.19 -0.41 4.92 1.02 0.15 0.15 119.74 132.42 1maj s LYS 108 Ca 0.15 1.19 0.06 0.00 0.02 0.00 0.00 55.97 57.39 1maj s LYS 108 Cb -0.15 -2.24 0.17 0.00 -0.52 0.00 0.00 37.83 35.10 1maj s LYS 108 CO -0.20 -0.07 0.52 -1.17 -0.92 0.00 0.00 175.35 173.52 1maj s LEU 109 N -3.10 -0.79 -0.27 3.17 0.20 -0.14 0.16 118.68 117.91 1maj s LEU 109 Ca 0.62 -1.32 0.09 0.00 0.69 0.00 0.00 54.13 54.21 1maj s LEU 109 Cb -0.12 1.28 0.46 0.00 -0.43 0.00 0.00 46.19 47.38 1maj s LEU 109 CO 0.16 -0.19 1.19 -1.84 -0.29 0.00 0.00 176.35 175.37 1maj n GLU 110 N 4.12 3.13 -0.37 1.98 0.28 -1.26 0.20 120.64 128.72 1maj n GLU 110 Ca 0.13 -3.97 0.05 0.00 -0.16 0.00 0.00 57.16 53.21 1maj n GLU 110 Cb 0.52 -2.10 -0.02 0.00 1.43 0.00 0.00 31.44 31.27 1maj n GLU 110 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 1maj n ILE 111 N -0.73 -0.03 -0.33 3.84 3.06 -1.26 -4.33 119.36 119.58 1maj n ILE 111 Ca 0.37 0.14 0.16 0.00 -2.50 0.00 0.00 62.75 60.92 1maj n ILE 111 Cb 0.92 -0.27 0.36 0.00 0.54 0.00 0.00 39.64 41.19 1maj n ILE 111 CO 0.00 0.00 0.00 0.11 -2.50 0.00 0.00 176.55 174.16 1maj h LYS 112 N -0.36 0.46 0.00 9.51 1.79 -0.48 -3.34 116.57 124.15 1maj h LYS 112 Ca -0.03 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1maj h LYS 112 Cb 0.35 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1maj h LYS 112 CO 0.01 0.31 0.00 -2.13 -1.08 0.00 0.00 179.45 176.56