#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l1g s ARG 69 N 0.00 0.37 0.05 2.12 6.06 -1.10 -4.79 118.95 121.66 3l1g s ARG 69 Ca 0.00 0.19 0.00 0.00 -2.50 0.00 0.00 55.73 53.42 3l1g s ARG 69 Cb 0.00 0.17 -0.03 0.00 0.06 0.00 0.00 34.95 35.15 3l1g s ARG 69 CO 0.00 -0.09 -0.05 -0.51 -2.50 0.00 0.00 175.30 172.15 3l1g s LEU 70 N -0.67 2.38 0.15 -0.88 1.43 -1.26 -3.20 118.68 116.64 3l1g s LEU 70 Ca 0.03 -0.78 -0.00 0.00 -1.03 0.00 0.00 54.13 52.35 3l1g s LEU 70 Cb -0.02 0.06 -0.04 0.00 0.03 0.00 0.00 46.19 46.21 3l1g s LEU 70 CO -0.05 -0.42 0.06 -1.61 0.23 0.00 0.00 176.35 174.56 3l1g s GLU 71 N -2.80 1.02 0.27 1.70 2.02 -0.46 -4.97 118.70 115.48 3l1g s GLU 71 Ca -0.02 -1.50 0.22 0.00 0.02 0.00 0.00 54.97 53.70 3l1g s GLU 71 Cb -0.01 0.12 1.01 0.00 0.10 0.00 0.00 34.13 35.35 3l1g s GLU 71 CO -0.05 -0.25 1.68 0.36 0.02 0.00 0.00 175.26 177.02 3l1g n LYS 72 N -0.16 0.17 0.00 1.61 0.00 -1.26 -3.90 118.16 114.62 3l1g n LYS 72 Ca -0.05 0.49 0.00 0.00 -0.00 0.00 0.00 58.31 58.75 3l1g n LYS 72 Cb 0.64 -1.88 0.00 0.00 -0.00 0.00 0.00 35.03 33.79 3l1g n LYS 72 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 3l1g n ASP 73 N -2.21 1.65 -3.51 -5.58 -0.08 -1.26 -5.02 116.55 100.54 3l1g n ASP 73 Ca 0.01 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.08 3l1g n ASP 73 Cb 0.16 0.25 -0.08 0.00 2.34 0.00 0.00 41.12 43.79 3l1g n ASP 73 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 3l1g s ARG 74 N -1.00 1.80 0.18 -0.67 0.52 -1.25 -1.95 118.95 116.58 3l1g s ARG 74 Ca 0.00 -2.06 -0.02 0.00 -0.52 0.00 0.00 55.73 53.13 3l1g s ARG 74 Cb 0.00 0.13 -0.04 0.00 0.52 0.00 0.00 34.95 35.57 3l1g s ARG 74 CO 0.00 -0.62 0.15 -0.59 0.02 0.00 0.00 175.30 174.26 3l1g s PHE 75 N -3.39 0.97 -0.27 -0.53 -0.12 -1.01 -1.35 117.98 112.28 3l1g s PHE 75 Ca 0.37 -1.25 -0.13 0.00 -0.05 0.00 0.00 56.93 55.87 3l1g s PHE 75 Cb 0.02 -0.45 0.09 0.00 -0.63 0.00 0.00 43.02 42.06 3l1g s PHE 75 CO 0.25 -0.64 0.64 0.45 -0.05 0.00 0.00 175.22 175.86 3l1g s SER 76 N -3.11 -0.93 -0.22 1.98 0.15 -1.19 -3.61 113.70 106.76 3l1g s SER 76 Ca 0.33 1.45 -0.09 0.00 0.70 0.00 0.00 55.95 58.33 3l1g s SER 76 Cb 0.06 1.61 -0.04 0.00 -1.71 0.00 0.00 66.02 65.94 3l1g s SER 76 CO 0.08 -0.23 0.11 -0.69 1.20 0.00 0.00 173.24 173.71 3l1g s VAL 77 N 2.05 4.93 -0.10 4.45 1.01 -0.16 -2.69 120.40 129.89 3l1g s VAL 77 Ca -0.08 0.03 0.04 0.00 0.00 0.00 0.00 61.98 61.96 3l1g s VAL 77 Cb -0.08 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.02 3l1g s VAL 77 CO -0.19 0.38 -0.22 0.20 0.00 0.00 0.00 175.10 175.27 3l1g s ASN 78 N 0.97 3.24 -0.08 3.32 0.02 -1.26 -1.41 114.94 119.75 3l1g s ASN 78 Ca 0.05 -0.51 0.01 0.00 -1.02 0.00 0.00 52.86 51.40 3l1g s ASN 78 Cb -0.14 -1.37 0.02 0.00 0.02 0.00 0.00 41.25 39.78 3l1g s ASN 78 CO 0.03 0.17 -0.10 -0.76 0.02 0.00 0.00 177.10 176.46 3l1g s LEU 79 N 0.27 1.49 -0.16 0.60 1.02 -0.65 -4.97 118.68 116.28 3l1g s LEU 79 Ca -0.16 -0.29 -0.29 0.00 0.02 0.00 0.00 54.13 53.41 3l1g s LEU 79 Cb -0.17 -0.81 -0.01 0.00 0.02 0.00 0.00 46.19 45.22 3l1g s LEU 79 CO 0.08 -0.02 1.13 -0.62 0.02 0.00 0.00 176.35 176.94 3l1g s ASP 80 N 1.00 7.07 -0.32 2.29 2.15 -1.26 -1.14 116.67 126.46 3l1g s ASP 80 Ca -0.08 1.58 0.17 0.00 0.43 0.00 0.00 52.55 54.65 3l1g s ASP 80 Cb -0.15 -2.55 0.46 0.00 -0.30 0.00 0.00 42.92 40.38 3l1g s ASP 80 CO -0.00 -0.64 1.00 1.33 -0.17 0.00 0.00 175.17 176.68 3l1g n VAL 81 N 5.06 0.91 -0.75 1.11 0.24 -0.55 -4.96 118.33 119.39 3l1g n VAL 81 Ca 0.12 -2.90 -0.32 0.00 -2.04 0.00 0.00 64.34 59.19 3l1g n VAL 81 Cb 0.46 0.73 0.14 0.00 -1.47 0.00 0.00 33.84 33.70 3l1g n VAL 81 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 3l1g n LYS 82 N -0.14 -0.48 -1.67 7.34 2.85 -0.92 -2.21 118.16 122.93 3l1g n LYS 82 Ca 0.08 -0.10 -0.15 0.00 -1.05 0.00 0.00 58.31 57.09 3l1g n LYS 82 Cb 0.82 -1.98 -0.05 0.00 -0.65 0.00 0.00 35.03 33.17 3l1g n LYS 82 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3l1g n HIS 83 N -3.85 -0.52 -4.18 5.58 8.25 -1.26 -4.96 115.22 114.27 3l1g n HIS 83 Ca 0.07 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.26 3l1g n HIS 83 Cb 0.54 -2.87 -0.08 0.00 1.12 0.00 0.00 29.99 28.70 3l1g n HIS 83 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 3l1g s PHE 84 N -2.38 2.88 -0.01 4.41 2.19 -0.94 -5.07 117.98 119.06 3l1g s PHE 84 Ca 0.00 -0.11 0.03 0.00 0.33 0.00 0.00 56.93 57.18 3l1g s PHE 84 Cb 0.00 -1.42 -0.01 0.00 -1.31 0.00 0.00 43.02 40.28 3l1g s PHE 84 CO 0.00 0.50 -0.10 -1.54 1.83 0.00 0.00 175.22 175.91 3l1g s SER 85 N -2.79 1.19 0.29 6.13 1.04 -1.26 -4.83 113.70 113.48 3l1g s SER 85 Ca 0.27 -0.18 -0.02 0.00 0.48 0.00 0.00 55.95 56.49 3l1g s SER 85 Cb -0.10 -0.16 0.62 0.00 0.10 0.00 0.00 66.02 66.48 3l1g s SER 85 CO 0.19 0.11 1.53 -2.65 0.98 0.00 0.00 173.24 173.40 3l1g n PRO 86 N 2.91 -0.08 0.07 4.02 -0.02 -1.26 -0.50 135.00 140.14 3l1g n PRO 86 Ca -0.14 1.49 0.21 0.00 -2.02 0.00 0.00 63.50 63.03 3l1g n PRO 86 Cb 0.56 -2.30 0.72 0.00 -0.02 0.00 0.00 33.50 32.46 3l1g n PRO 86 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3l1g h GLU 87 N 0.00 0.00 0.00 -0.52 9.09 -2.02 0.49 114.58 121.62 3l1g h GLU 87 Ca 0.54 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.95 3l1g h GLU 87 Cb 1.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 3l1g h GLU 87 CO -0.95 0.00 -0.32 0.39 0.05 0.00 0.00 179.01 178.18 3l1g n GLU 88 N -3.65 0.04 -4.38 1.06 1.02 0.34 -4.90 120.64 110.17 3l1g n GLU 88 Ca 0.08 0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.98 3l1g n GLU 88 Cb 0.68 -1.53 -0.10 0.00 -0.02 0.00 0.00 31.44 30.48 3l1g n GLU 88 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 3l1g s LEU 89 N -3.17 2.73 -0.23 -4.62 2.34 0.16 -3.46 118.68 112.44 3l1g s LEU 89 Ca 0.12 -0.79 -0.02 0.00 0.06 0.00 0.00 54.13 53.49 3l1g s LEU 89 Cb 0.17 -1.37 0.07 0.00 -0.56 0.00 0.00 46.19 44.50 3l1g s LEU 89 CO 0.64 0.08 0.04 -0.54 -1.06 0.00 0.00 176.35 175.51 3l1g s LYS 90 N -3.06 0.79 0.28 1.48 1.02 -0.42 -4.97 119.74 114.86 3l1g s LYS 90 Ca 0.26 -0.64 0.01 0.00 0.02 0.00 0.00 55.97 55.62 3l1g s LYS 90 Cb -0.07 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 35.07 3l1g s LYS 90 CO 0.14 -0.71 0.46 0.08 -0.92 0.00 0.00 175.35 174.40 3l1g s VAL 91 N 1.75 5.17 -0.23 3.17 1.01 -1.26 -0.98 120.40 129.03 3l1g s VAL 91 Ca 0.01 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 3l1g s VAL 91 Cb -0.17 -3.83 0.16 0.00 0.00 0.00 0.00 36.38 32.54 3l1g s VAL 91 CO -0.12 -0.41 1.18 -0.75 0.00 0.00 0.00 175.10 175.01 3l1g s LYS 92 N -3.99 0.32 -0.20 2.72 2.20 -1.08 -4.95 119.74 114.76 3l1g s LYS 92 Ca 0.38 0.11 0.00 0.00 -0.36 0.00 0.00 55.97 56.10 3l1g s LYS 92 Cb -0.10 0.15 0.05 0.00 -1.51 0.00 0.00 37.83 36.42 3l1g s LYS 92 CO 0.32 -0.09 -0.07 0.08 -0.36 0.00 0.00 175.35 175.23 3l1g s VAL 93 N -0.93 1.43 -0.77 4.02 1.01 -1.26 -0.62 120.40 123.28 3l1g s VAL 93 Ca 0.04 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.10 3l1g s VAL 93 Cb -0.01 -1.59 0.34 0.00 0.00 0.00 0.00 36.38 35.11 3l1g s VAL 93 CO -0.04 0.08 1.41 0.18 0.00 0.00 0.00 175.10 176.73 3l1g n LEU 94 N 4.75 5.93 0.00 3.92 4.32 -0.74 -4.99 117.00 130.19 3l1g n LEU 94 Ca -0.13 -5.46 0.00 0.00 -0.02 0.00 0.00 56.01 50.40 3l1g n LEU 94 Cb 0.46 -0.84 0.00 0.00 -1.62 0.00 0.00 43.42 41.42 3l1g n LEU 94 CO 0.18 2.17 0.00 0.61 -1.22 0.00 0.00 177.39 179.14 3l1g n GLY 95 N -0.22 1.70 0.22 -0.72 0.00 -1.26 -3.45 105.19 101.46 3l1g n GLY 95 Ca 0.40 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.50 3l1g n GLY 95 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3l1g h ASP 96 N 0.00 0.00 -2.18 1.61 1.82 -1.95 -3.45 116.42 112.27 3l1g h ASP 96 Ca 0.00 0.00 -0.53 0.00 -0.39 0.00 0.00 57.03 56.11 3l1g h ASP 96 Cb 0.00 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 39.94 3l1g h ASP 96 CO 0.00 0.21 -0.59 -0.69 -1.61 0.00 0.00 179.24 176.57 3l1g s VAL 97 N -3.58 3.85 -0.33 2.25 1.01 -1.22 -0.87 120.40 121.51 3l1g s VAL 97 Ca 0.01 -1.68 0.02 0.00 0.00 0.00 0.00 61.98 60.33 3l1g s VAL 97 Cb 0.10 -3.09 0.09 0.00 0.00 0.00 0.00 36.38 33.47 3l1g s VAL 97 CO 0.64 -0.35 0.04 -0.63 0.00 0.00 0.00 175.10 174.80 3l1g s ILE 98 N -2.25 2.49 0.67 2.22 -1.09 0.12 -1.79 121.20 121.57 3l1g s ILE 98 Ca 0.32 -2.09 -0.12 0.00 -2.23 0.00 0.00 60.65 56.53 3l1g s ILE 98 Cb -0.07 -2.72 -0.00 0.00 -1.58 0.00 0.00 42.46 38.09 3l1g s ILE 98 CO 0.22 -0.47 1.06 -1.61 -1.23 0.00 0.00 174.94 172.91 3l1g s GLU 99 N 1.01 3.04 -0.30 2.79 2.02 0.21 -1.48 118.70 126.00 3l1g s GLU 99 Ca 0.06 1.03 -0.05 0.00 0.02 0.00 0.00 54.97 56.02 3l1g s GLU 99 Cb -0.20 -2.00 0.17 0.00 0.10 0.00 0.00 34.13 32.20 3l1g s GLU 99 CO -0.06 -1.02 0.68 0.08 0.02 0.00 0.00 175.26 174.96 3l1g s VAL 100 N -2.87 -0.90 -0.03 2.63 1.01 -0.41 -2.65 120.40 117.18 3l1g s VAL 100 Ca 0.60 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.65 3l1g s VAL 100 Cb -0.15 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 3l1g s VAL 100 CO 0.50 0.00 -0.24 -2.28 0.00 0.00 0.00 175.10 173.08 3l1g s HIS 101 N 2.85 2.41 0.17 5.22 5.04 -0.15 -0.38 115.29 130.45 3l1g s HIS 101 Ca 0.10 -0.39 0.06 0.00 -1.54 0.00 0.00 55.06 53.29 3l1g s HIS 101 Cb -0.13 -1.53 -0.05 0.00 0.04 0.00 0.00 32.58 30.91 3l1g s HIS 101 CO -0.19 0.00 -0.12 0.20 -2.34 0.00 0.00 174.74 172.29 3l1g s GLY 102 N -0.62 1.20 -0.30 1.59 0.00 -1.25 -1.30 107.32 106.64 3l1g s GLY 102 Ca 0.10 -1.55 -0.17 0.00 0.00 0.00 0.00 44.72 43.10 3l1g s GLY 102 CO -0.01 -1.65 1.18 1.25 0.00 0.00 0.00 173.10 173.87 3l1g s LYS 103 N -3.70 0.07 -0.03 2.90 2.20 -1.22 -1.34 119.74 118.61 3l1g s LYS 103 Ca 0.19 0.13 0.05 0.00 -0.36 0.00 0.00 55.97 55.98 3l1g s LYS 103 Cb 0.01 0.07 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 3l1g s LYS 103 CO 0.03 -0.08 -0.18 -1.58 -0.36 0.00 0.00 175.35 173.18 3l1g s HIS 104 N 2.98 1.74 -0.48 4.03 2.46 -0.21 -4.86 115.29 120.96 3l1g s HIS 104 Ca -0.07 -0.44 0.08 0.00 0.47 0.00 0.00 55.06 55.10 3l1g s HIS 104 Cb -0.09 -1.15 0.38 0.00 -0.13 0.00 0.00 32.58 31.59 3l1g s HIS 104 CO -0.08 -0.11 0.95 -1.91 -2.47 0.00 0.00 174.74 171.12 3l1g n GLU 105 N 2.92 2.66 0.23 2.88 2.13 -1.26 -2.95 120.64 127.26 3l1g n GLU 105 Ca -0.17 -4.34 0.14 0.00 0.66 0.00 0.00 57.16 53.46 3l1g n GLU 105 Cb 0.53 -2.04 0.77 0.00 0.27 0.00 0.00 31.44 30.97 3l1g n GLU 105 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3l1g h GLU 106 N 2.88 0.00 0.00 5.31 4.81 -1.97 -3.47 114.58 122.13 3l1g h GLU 106 Ca 0.15 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.44 3l1g h GLU 106 Cb 0.77 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 3l1g h GLU 106 CO 0.74 0.00 -0.08 -2.13 -0.73 0.00 0.00 179.01 176.80 3l1g n ARG 107 N -2.52 -0.46 0.00 1.92 3.00 -1.26 -3.81 116.66 113.53 3l1g n ARG 107 Ca -0.02 0.30 0.00 0.00 -0.00 0.00 0.00 57.85 58.14 3l1g n ARG 107 Cb 0.10 -0.56 0.00 0.00 0.00 0.00 0.00 32.46 32.00 3l1g n ARG 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 3l1g n GLN 108 N -1.38 0.00 -0.12 -0.14 3.00 -1.26 -2.71 117.38 114.76 3l1g n GLN 108 Ca 0.00 0.08 0.25 0.00 -0.01 0.00 0.00 57.00 57.32 3l1g n GLN 108 Cb 0.10 -1.51 0.69 0.00 0.00 0.00 0.00 30.24 29.52 3l1g n GLN 108 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 3l1g h ASP 109 N 0.00 0.04 0.14 1.08 5.19 -1.97 -3.29 116.42 117.61 3l1g h ASP 109 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.41 3l1g h ASP 109 Cb 0.03 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.53 3l1g h ASP 109 CO 0.00 0.02 -0.07 -0.33 -3.12 0.00 0.00 179.24 175.74 3l1g h GLU 110 N 0.04 -0.18 0.00 3.56 5.08 -1.77 -3.51 114.58 117.81 3l1g h GLU 110 Ca 0.37 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3l1g h GLU 110 Cb 1.41 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.70 3l1g h GLU 110 CO -0.02 -0.12 0.00 -2.39 -1.00 0.00 0.00 179.01 175.48 3l1g n HIS 111 N -3.89 0.00 -3.42 4.33 1.44 -1.24 -4.96 115.22 107.48 3l1g n HIS 111 Ca -0.02 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.47 3l1g n HIS 111 Cb 0.07 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.19 3l1g n HIS 111 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3l1g n GLY 112 N 0.15 -0.87 3.46 -1.39 0.00 -1.26 -4.78 105.19 100.50 3l1g n GLY 112 Ca 0.00 0.85 -0.37 0.00 0.00 0.00 0.00 46.02 46.50 3l1g n GLY 112 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3l1g n PHE 113 N -1.39 -0.79 -3.78 1.61 3.72 -1.26 -4.98 117.46 110.59 3l1g n PHE 113 Ca -0.12 0.37 -0.25 0.00 -0.05 0.00 0.00 57.45 57.39 3l1g n PHE 113 Cb 0.62 -1.92 -0.17 0.00 -0.94 0.00 0.00 39.48 37.07 3l1g n PHE 113 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3l1g s ILE 114 N -1.87 0.54 -0.85 4.37 1.01 -1.26 -5.03 121.20 118.11 3l1g s ILE 114 Ca 0.66 -0.21 0.01 0.00 0.00 0.00 0.00 60.65 61.11 3l1g s ILE 114 Cb -0.37 -0.81 0.26 0.00 0.01 0.00 0.00 42.46 41.55 3l1g s ILE 114 CO 0.57 0.10 1.00 -0.24 0.00 0.00 0.00 174.94 176.37 3l1g n SER 115 N 5.07 4.77 -4.59 3.58 2.88 -1.26 -4.27 113.62 119.80 3l1g n SER 115 Ca -0.09 -3.36 -0.43 0.00 -1.33 0.00 0.00 58.87 53.66 3l1g n SER 115 Cb 0.49 -0.96 -0.03 0.00 -0.75 0.00 0.00 64.21 62.95 3l1g n SER 115 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 3l1g s ARG 116 N -2.33 3.70 0.15 -1.46 3.52 -1.15 -4.88 118.95 116.49 3l1g s ARG 116 Ca 0.34 0.44 0.05 0.00 -0.13 0.00 0.00 55.73 56.43 3l1g s ARG 116 Cb 0.06 -3.87 -0.04 0.00 -1.56 0.00 0.00 34.95 29.54 3l1g s ARG 116 CO 0.00 -1.16 -0.12 -2.00 -0.81 0.00 0.00 175.30 171.21 3l1g s GLU 117 N 3.84 1.07 0.00 5.12 -6.30 -1.26 -1.04 118.70 120.13 3l1g s GLU 117 Ca 0.41 -1.39 0.00 0.00 -2.50 0.00 0.00 54.97 51.48 3l1g s GLU 117 Cb -0.10 -0.75 0.00 0.00 0.00 0.00 0.00 34.13 33.28 3l1g s GLU 117 CO 0.25 0.12 0.00 1.97 0.02 0.00 0.00 175.26 177.61 3l1g n PHE 118 N 0.02 0.00 0.00 5.30 1.16 -0.45 -4.92 117.46 118.57 3l1g n PHE 118 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.46 3l1g n PHE 118 Cb 0.59 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.46 3l1g n PHE 118 CO 0.00 0.00 0.00 1.58 -1.87 0.00 0.00 176.76 176.47 3l1g n HIS 119 N 0.00 0.00 -3.25 2.97 -0.00 -1.25 -3.85 115.22 109.84 3l1g n HIS 119 Ca 0.00 0.00 -0.31 0.00 0.46 0.00 0.00 57.72 57.87 3l1g n HIS 119 Cb 0.00 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 29.82 3l1g n HIS 119 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 3l1g s ARG 120 N 0.00 3.79 -0.01 1.57 3.00 0.49 -4.91 118.95 122.88 3l1g s ARG 120 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 55.73 56.05 3l1g s ARG 120 Cb 0.00 -2.56 0.02 0.00 0.00 0.00 0.00 34.95 32.40 3l1g s ARG 120 CO 0.00 0.20 0.01 0.15 0.00 0.00 0.00 175.30 175.66 3l1g s LYS 121 N -3.21 -0.00 0.14 3.54 1.02 -1.26 -1.29 119.74 118.69 3l1g s LYS 121 Ca 0.48 0.09 0.09 0.00 0.02 0.00 0.00 55.97 56.65 3l1g s LYS 121 Cb -0.11 -0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.02 3l1g s LYS 121 CO 0.24 -0.09 -0.20 0.71 -0.92 0.00 0.00 175.35 175.10 3l1g s TYR 122 N 0.56 1.86 -0.23 3.18 2.02 -0.55 -4.92 117.35 119.28 3l1g s TYR 122 Ca -0.05 -0.44 -0.14 0.00 -0.37 0.00 0.00 57.07 56.08 3l1g s TYR 122 Cb -0.07 -0.96 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 3l1g s TYR 122 CO -0.02 0.30 0.31 0.50 -1.57 0.00 0.00 175.55 175.07 3l1g s ARG 123 N -2.43 4.11 0.96 -0.62 3.52 -1.26 0.13 118.95 123.36 3l1g s ARG 123 Ca 0.13 0.01 -0.11 0.00 -0.13 0.00 0.00 55.73 55.62 3l1g s ARG 123 Cb -0.08 -3.56 0.17 0.00 -1.56 0.00 0.00 34.95 29.92 3l1g s ARG 123 CO 0.06 -0.05 1.10 0.96 -0.81 0.00 0.00 175.30 176.55 3l1g s ILE 124 N 1.37 2.35 0.20 4.11 -4.36 -0.04 -4.98 121.20 119.85 3l1g s ILE 124 Ca 0.14 0.11 -0.03 0.00 -0.26 0.00 0.00 60.65 60.62 3l1g s ILE 124 Cb -0.15 -2.32 -0.05 0.00 1.25 0.00 0.00 42.46 41.19 3l1g s ILE 124 CO 0.07 -0.15 0.42 -2.16 0.24 0.00 0.00 174.94 173.36 3l1g s PRO 125 N -4.71 3.58 0.23 0.37 0.05 -1.26 -5.01 135.00 128.25 3l1g s PRO 125 Ca 0.66 -0.17 -0.06 0.00 0.05 0.00 0.00 61.00 61.48 3l1g s PRO 125 Cb -0.21 -2.80 0.34 0.00 0.05 0.00 0.00 34.50 31.88 3l1g s PRO 125 CO 0.59 0.38 1.80 0.00 0.05 0.00 0.00 177.00 179.83 3l1g h ALA 126 N 2.23 1.05 -0.13 8.56 0.00 -2.00 -1.72 119.26 127.25 3l1g h ALA 126 Ca -0.47 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3l1g h ALA 126 Cb 1.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3l1g h ALA 126 CO 0.69 0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.59 3l1g n ASP 127 N -4.78 1.94 -4.23 0.00 5.68 -1.26 -4.73 116.55 109.16 3l1g n ASP 127 Ca 0.12 -2.19 -0.34 0.00 -0.50 0.00 0.00 54.79 51.88 3l1g n ASP 127 Cb 0.25 -0.50 -0.15 0.00 -1.14 0.00 0.00 41.12 39.58 3l1g n ASP 127 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3l1g s VAL 128 N -1.42 2.88 0.18 2.12 1.01 -0.65 -1.61 120.40 122.91 3l1g s VAL 128 Ca 0.12 -0.73 -0.31 0.00 0.00 0.00 0.00 61.98 61.06 3l1g s VAL 128 Cb 0.09 -2.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.06 3l1g s VAL 128 CO 0.04 0.41 1.44 -0.62 0.00 0.00 0.00 175.10 176.37 3l1g s ASP 129 N 1.39 6.73 0.60 3.32 -1.08 -1.26 -4.79 116.67 121.58 3l1g s ASP 129 Ca 0.04 2.50 0.30 0.00 -0.52 0.00 0.00 52.55 54.88 3l1g s ASP 129 Cb -0.14 -2.60 1.72 0.00 -1.46 0.00 0.00 42.92 40.44 3l1g s ASP 129 CO -0.06 -0.69 2.13 1.55 0.52 0.00 0.00 175.17 178.61 3l1g h PRO 130 N 6.11 0.00 0.00 4.34 0.13 -1.96 -3.38 132.00 137.24 3l1g h PRO 130 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3l1g h PRO 130 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3l1g h PRO 130 CO 0.84 0.00 0.00 -0.11 -0.23 0.00 0.00 178.00 178.50 3l1g n LEU 131 N -3.72 0.00 -3.07 1.56 -0.00 -1.26 -4.84 117.00 105.67 3l1g n LEU 131 Ca 0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.91 3l1g n LEU 131 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 3l1g n LEU 131 CO 0.26 0.00 -0.11 1.07 -0.00 0.00 0.00 177.39 178.61 3l1g n THR 132 N 0.00 -1.36 -3.56 1.96 5.66 -1.26 -4.93 114.28 110.79 3l1g n THR 132 Ca 0.00 -0.01 -0.28 0.00 -3.05 0.00 0.00 64.05 60.71 3l1g n THR 132 Cb 0.00 -1.21 -0.16 0.00 -1.55 0.00 0.00 70.33 67.42 3l1g n THR 132 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 3l1g s ILE 133 N -2.46 -0.08 -0.43 1.09 1.01 -1.26 -4.31 121.20 114.75 3l1g s ILE 133 Ca 0.00 -0.58 -0.28 0.00 0.00 0.00 0.00 60.65 59.80 3l1g s ILE 133 Cb -0.00 -0.86 -0.01 0.00 0.01 0.00 0.00 42.46 41.61 3l1g s ILE 133 CO 0.38 -0.59 1.65 -0.89 0.00 0.00 0.00 174.94 175.49 3l1g s THR 134 N 2.11 3.61 -0.68 2.92 2.01 -1.04 -4.81 115.64 119.77 3l1g s THR 134 Ca 0.07 0.58 -0.09 0.00 0.31 0.00 0.00 61.69 62.55 3l1g s THR 134 Cb -0.16 -3.96 0.18 0.00 0.01 0.00 0.00 72.50 68.57 3l1g s THR 134 CO -0.28 -0.70 0.56 -0.44 -0.69 0.00 0.00 174.62 173.07 3l1g s SER 135 N 5.63 6.00 0.00 3.53 0.01 -1.26 0.11 113.70 127.72 3l1g s SER 135 Ca 0.69 -2.57 0.00 0.00 1.31 0.00 0.00 55.95 55.38 3l1g s SER 135 Cb -0.17 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.02 3l1g s SER 135 CO 0.30 -0.54 0.00 -1.54 0.41 0.00 0.00 173.24 171.87 3l1g n SER 136 N 4.03 0.01 -3.56 2.44 3.41 -0.34 -4.95 113.62 114.66 3l1g n SER 136 Ca 0.06 -0.49 -0.12 0.00 -0.26 0.00 0.00 58.87 58.07 3l1g n SER 136 Cb 0.42 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 3l1g n SER 136 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3l1g s LEU 137 N 0.00 -0.42 0.40 1.04 2.96 -1.26 -2.35 118.68 119.05 3l1g s LEU 137 Ca 0.00 0.43 0.08 0.00 -0.22 0.00 0.00 54.13 54.41 3l1g s LEU 137 Cb 0.00 2.00 -0.01 0.00 0.50 0.00 0.00 46.19 48.68 3l1g s LEU 137 CO 0.00 -0.41 0.44 -0.94 -1.32 0.00 0.00 176.35 174.11 3l1g s SER 138 N -1.24 5.37 0.42 3.68 1.04 -1.09 -4.98 113.70 116.91 3l1g s SER 138 Ca -0.03 -0.55 0.11 0.00 0.48 0.00 0.00 55.95 55.96 3l1g s SER 138 Cb -0.00 -0.72 0.90 0.00 0.10 0.00 0.00 66.02 66.30 3l1g s SER 138 CO 0.02 -0.63 1.97 0.77 0.98 0.00 0.00 173.24 176.36 3l1g h SER 139 N 0.91 0.16 -0.32 7.02 4.64 -2.02 -3.04 113.55 120.90 3l1g h SER 139 Ca -0.42 -0.03 -0.20 0.00 -0.47 0.00 0.00 61.79 60.68 3l1g h SER 139 Cb 1.27 -0.04 -0.10 0.00 -0.31 0.00 0.00 62.40 63.22 3l1g h SER 139 CO 0.53 0.29 0.25 -0.90 -0.87 0.00 0.00 176.83 176.13 3l1g n ASP 140 N -4.33 4.82 -3.34 4.97 5.75 -1.26 -4.88 116.55 118.28 3l1g n ASP 140 Ca -0.01 -2.70 -0.14 0.00 -0.01 0.00 0.00 54.79 51.93 3l1g n ASP 140 Cb 0.23 -0.87 0.01 0.00 -1.03 0.00 0.00 41.12 39.45 3l1g n ASP 140 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3l1g n GLY 141 N 0.38 -1.12 2.66 6.12 0.00 -1.15 -4.50 105.19 107.59 3l1g n GLY 141 Ca 0.20 0.70 -0.23 0.00 0.00 0.00 0.00 46.02 46.69 3l1g n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3l1g s VAL 142 N -2.77 -0.20 0.02 1.61 1.01 -1.26 -1.48 120.40 117.33 3l1g s VAL 142 Ca 0.08 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 3l1g s VAL 142 Cb -0.01 -0.70 -0.06 0.00 0.00 0.00 0.00 36.38 35.61 3l1g s VAL 142 CO 0.82 -0.33 1.38 -1.48 0.00 0.00 0.00 175.10 175.48 3l1g s LEU 143 N 2.22 4.33 -0.05 3.92 -0.00 -0.29 -2.65 118.68 126.16 3l1g s LEU 143 Ca 0.05 2.12 0.06 0.00 -0.00 0.00 0.00 54.13 56.37 3l1g s LEU 143 Cb -0.16 -3.57 -0.01 0.00 -0.00 0.00 0.00 46.19 42.46 3l1g s LEU 143 CO -0.16 -0.69 -0.23 -0.89 -0.00 0.00 0.00 176.35 174.38 3l1g s THR 144 N 2.12 1.89 -0.12 5.48 2.01 -0.99 -1.63 115.64 124.40 3l1g s THR 144 Ca 0.63 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.64 3l1g s THR 144 Cb -0.32 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.62 3l1g s THR 144 CO 0.27 0.53 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.94 3l1g s VAL 145 N -0.21 1.19 0.34 3.82 1.01 -0.50 -1.20 120.40 124.85 3l1g s VAL 145 Ca -0.01 -0.41 0.09 0.00 0.00 0.00 0.00 61.98 61.66 3l1g s VAL 145 Cb -0.12 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 35.03 3l1g s VAL 145 CO 0.02 0.39 -0.04 0.20 0.00 0.00 0.00 175.10 175.68 3l1g s ASN 146 N 1.51 3.97 -0.29 3.32 -0.87 0.31 -0.98 114.94 121.91 3l1g s ASN 146 Ca 0.02 -1.09 -0.39 0.00 -1.57 0.00 0.00 52.86 49.84 3l1g s ASN 146 Cb -0.13 -0.45 0.16 0.00 -0.02 0.00 0.00 41.25 40.81 3l1g s ASN 146 CO -0.07 -0.22 1.40 -0.83 -2.57 0.00 0.00 177.10 174.81 3l1g s GLY 147 N -3.66 -0.21 0.54 0.66 0.00 -1.24 -2.50 107.32 100.91 3l1g s GLY 147 Ca 0.34 1.89 -0.02 0.00 0.00 0.00 0.00 44.72 46.93 3l1g s GLY 147 CO 0.18 0.62 0.79 -4.14 0.00 0.00 0.00 173.10 170.55 3l1g s PRO 148 N -2.01 2.80 0.13 2.90 0.02 -1.26 -2.40 135.00 135.19 3l1g s PRO 148 Ca 0.12 -0.41 0.09 0.00 0.02 0.00 0.00 61.00 60.82 3l1g s PRO 148 Cb -0.00 -2.42 -0.04 0.00 0.02 0.00 0.00 34.50 32.05 3l1g s PRO 148 CO -0.02 -0.60 -0.21 1.03 -0.33 0.00 0.00 177.00 176.87 3l1g s ARG 149 N -4.79 1.24 -0.08 5.54 0.52 -0.82 -4.17 118.95 116.38 3l1g s ARG 149 Ca 0.53 -1.29 -0.01 0.00 -0.52 0.00 0.00 55.73 54.44 3l1g s ARG 149 Cb -0.10 -1.47 0.03 0.00 0.52 0.00 0.00 34.95 33.92 3l1g s ARG 149 CO 0.41 0.33 -0.01 -1.59 0.02 0.00 0.00 175.30 174.46 3l1g s LYS 150 N -2.27 0.73 0.59 3.54 -2.85 -0.63 -4.98 119.74 113.87 3l1g s LYS 150 Ca 0.11 0.06 0.29 0.00 -1.00 0.00 0.00 55.97 55.43 3l1g s LYS 150 Cb -0.08 -1.06 1.68 0.00 -2.06 0.00 0.00 37.83 36.31 3l1g s LYS 150 CO 0.06 -0.30 2.12 -0.56 0.10 0.00 0.00 175.35 176.76 3l1g h GLN 151 N 8.31 0.00 -2.95 1.78 -0.00 -1.97 -3.44 115.11 116.84 3l1g h GLN 151 Ca -0.21 0.00 0.31 0.00 -0.00 0.00 0.00 58.65 58.76 3l1g h GLN 151 Cb 1.13 0.00 -0.12 0.00 -0.00 0.00 0.00 27.48 28.49 3l1g h GLN 151 CO 0.28 0.00 -0.70 0.28 -0.00 0.00 0.00 178.83 178.69 3l1g n VAL 152 N -3.78 0.00 -3.76 1.86 0.31 -1.26 -4.86 118.33 106.84 3l1g n VAL 152 Ca 0.01 0.33 -0.26 0.00 -0.01 0.00 0.00 64.34 64.41 3l1g n VAL 152 Cb 0.30 -0.74 -0.17 0.00 -0.91 0.00 0.00 33.84 32.32 3l1g n VAL 152 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3l1g s SER 153 N -6.45 2.53 -0.06 4.52 0.15 -1.26 -5.10 113.70 108.03 3l1g s SER 153 Ca 0.00 -0.60 0.03 0.00 0.70 0.00 0.00 55.95 56.08 3l1g s SER 153 Cb 0.00 -0.57 0.01 0.00 -1.71 0.00 0.00 66.02 63.74 3l1g s SER 153 CO 0.00 -0.27 -0.14 -0.83 1.20 0.00 0.00 173.24 173.20 3l1g s GLY 154 N 1.88 0.85 0.21 9.45 0.00 -1.26 -5.11 107.32 113.33 3l1g s GLY 154 Ca 0.01 -0.53 -0.32 0.00 0.00 0.00 0.00 44.72 43.88 3l1g s GLY 154 CO -0.07 -0.08 1.40 -1.05 0.00 0.00 0.00 173.10 173.30 3l1g n PRO 155 N 3.54 1.88 -1.45 2.90 -0.02 -1.26 -4.62 135.00 135.96 3l1g n PRO 155 Ca -0.21 0.67 -0.14 0.00 -2.02 0.00 0.00 63.50 61.80 3l1g n PRO 155 Cb 0.52 -2.32 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 3l1g n PRO 155 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3l1g n GLU 156 N 2.26 0.20 -2.56 -0.52 0.00 -1.26 -4.73 120.64 114.03 3l1g n GLU 156 Ca 0.13 -0.53 -0.41 0.00 0.00 0.00 0.00 57.16 56.35 3l1g n GLU 156 Cb 0.29 -2.32 -0.03 0.00 0.00 0.00 0.00 31.44 29.38 3l1g n GLU 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 3l1g s ARG 157 N 7.55 3.24 -0.16 3.44 3.00 -1.26 -4.93 118.95 129.83 3l1g s ARG 157 Ca 0.91 -0.17 -0.28 0.00 -1.00 0.00 0.00 55.73 55.18 3l1g s ARG 157 Cb -0.36 -4.16 -0.06 0.00 0.00 0.00 0.00 34.95 30.37 3l1g s ARG 157 CO 0.26 -2.08 2.16 -0.08 0.00 0.00 0.00 175.30 175.56 3l1g s THR 158 N 5.61 3.02 0.01 4.11 -1.32 -1.26 -4.93 115.64 120.88 3l1g s THR 158 Ca 0.36 0.02 -0.22 0.00 -1.21 0.00 0.00 61.69 60.64 3l1g s THR 158 Cb -0.08 -3.02 -0.05 0.00 -1.51 0.00 0.00 72.50 67.83 3l1g s THR 158 CO 0.17 -0.01 0.66 -0.63 -2.21 0.00 0.00 174.62 172.60 3l1g s ILE 159 N 7.44 4.84 -0.47 5.08 1.01 -1.26 -5.02 121.20 132.82 3l1g s ILE 159 Ca 0.97 1.40 -0.28 0.00 0.00 0.00 0.00 60.65 62.75 3l1g s ILE 159 Cb -0.35 -4.01 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 3l1g s ILE 159 CO 0.36 0.39 1.71 -2.16 0.00 0.00 0.00 174.94 175.25 3l1g s PRO 160 N -0.11 3.11 0.02 2.79 0.04 -1.26 -5.01 135.00 134.59 3l1g s PRO 160 Ca 0.34 0.93 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 3l1g s PRO 160 Cb -0.19 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.08 3l1g s PRO 160 CO 0.19 -2.14 1.00 0.42 0.04 0.00 0.00 177.00 176.51 3l1g s ILE 161 N 7.34 4.74 -1.38 0.56 1.01 -1.26 -5.35 121.20 126.86 3l1g s ILE 161 Ca 0.69 2.01 0.00 0.00 0.00 0.00 0.00 60.65 63.35 3l1g s ILE 161 Cb -0.16 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.02 3l1g s ILE 161 CO 0.28 0.18 0.35 0.35 0.00 0.00 0.00 174.94 176.09