#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhg s SER 88 N 0.00 5.95 -0.14 1.61 0.01 -1.26 -4.90 113.70 114.97 2dhg s SER 88 Ca 0.00 -2.38 -0.10 0.00 1.31 0.00 0.00 55.95 54.78 2dhg s SER 88 Cb 0.00 -2.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.15 2dhg s SER 88 CO 0.00 -0.59 -0.19 -1.20 0.41 0.00 0.00 173.24 171.67 2dhg n SER 89 N 4.29 1.75 0.00 2.44 7.64 -1.26 -5.08 113.62 123.40 2dhg n SER 89 Ca 0.02 0.59 0.00 0.00 1.01 0.00 0.00 58.87 60.49 2dhg n SER 89 Cb 0.42 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 2dhg n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dhg n GLY 90 N 1.60 5.57 3.12 0.23 0.00 -1.26 -5.16 105.19 109.29 2dhg n GLY 90 Ca -0.08 -0.96 -0.26 0.00 0.00 0.00 0.00 46.02 44.72 2dhg n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dhg s SER 91 N 1.00 2.11 -0.23 1.61 1.04 -1.26 -5.02 113.70 112.95 2dhg s SER 91 Ca 0.00 -0.35 0.04 0.00 0.48 0.00 0.00 55.95 56.12 2dhg s SER 91 Cb 0.00 -0.67 -0.17 0.00 0.10 0.00 0.00 66.02 65.28 2dhg s SER 91 CO 0.00 0.13 -0.17 -0.24 0.98 0.00 0.00 173.24 173.94 2dhg n SER 92 N 3.27 1.81 -3.07 7.02 2.88 -1.26 -4.95 113.62 119.32 2dhg n SER 92 Ca -0.19 -0.11 0.03 0.00 -1.33 0.00 0.00 58.87 57.27 2dhg n SER 92 Cb 0.53 -0.16 -0.00 0.00 -0.75 0.00 0.00 64.21 63.83 2dhg n SER 92 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dhg s GLY 93 N -6.19 -1.24 -0.58 0.46 0.00 -1.26 -5.11 107.32 93.40 2dhg s GLY 93 Ca -0.29 1.23 -0.27 0.00 0.00 0.00 0.00 44.72 45.40 2dhg s GLY 93 CO 0.60 3.96 1.84 2.56 0.00 0.00 0.00 173.10 182.06 2dhg s PRO 94 N 2.44 2.72 -0.30 2.90 0.04 -1.26 -4.89 135.00 136.64 2dhg s PRO 94 Ca 0.18 0.70 -0.13 0.00 0.04 0.00 0.00 61.00 61.78 2dhg s PRO 94 Cb -0.03 -4.36 0.16 0.00 0.04 0.00 0.00 34.50 30.31 2dhg s PRO 94 CO -0.18 -2.62 0.93 -1.21 0.04 0.00 0.00 177.00 173.96 2dhg s GLU 95 N 6.86 0.33 -0.65 4.56 2.02 -1.26 -5.11 118.70 125.45 2dhg s GLU 95 Ca 0.68 0.78 -0.00 0.00 0.02 0.00 0.00 54.97 56.45 2dhg s GLU 95 Cb -0.14 0.46 0.16 0.00 0.10 0.00 0.00 34.13 34.72 2dhg s GLU 95 CO 0.22 -0.17 0.45 0.71 0.02 0.00 0.00 175.26 176.50 2dhg s TYR 96 N 2.61 3.43 0.19 1.61 2.02 -1.26 -4.69 117.35 121.25 2dhg s TYR 96 Ca -0.01 -2.95 0.05 0.00 -0.37 0.00 0.00 57.07 53.80 2dhg s TYR 96 Cb -0.08 -3.06 -0.04 0.00 -0.40 0.00 0.00 41.96 38.38 2dhg s TYR 96 CO -0.17 -0.77 0.17 -1.12 -1.57 0.00 0.00 175.55 172.09 2dhg s SER 97 N 0.07 5.60 0.02 2.29 0.01 -1.26 -2.06 113.70 118.37 2dhg s SER 97 Ca 0.19 -0.14 0.08 0.00 1.31 0.00 0.00 55.95 57.40 2dhg s SER 97 Cb -0.18 -1.48 -0.02 0.00 0.21 0.00 0.00 66.02 64.55 2dhg s SER 97 CO -0.05 0.04 -0.23 -0.76 0.41 0.00 0.00 173.24 172.64 2dhg s LEU 98 N -3.33 2.12 -0.17 2.44 1.43 -0.90 -3.91 118.68 116.36 2dhg s LEU 98 Ca 0.32 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.74 2dhg s LEU 98 Cb -0.10 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.93 2dhg s LEU 98 CO 0.24 0.24 0.44 0.12 0.23 0.00 0.00 176.35 177.62 2dhg s PHE 99 N -0.71 3.42 0.11 0.29 5.36 -0.37 -1.48 117.98 124.59 2dhg s PHE 99 Ca 0.09 0.73 0.10 0.00 -0.96 0.00 0.00 56.93 56.90 2dhg s PHE 99 Cb -0.09 -2.55 -0.04 0.00 -0.34 0.00 0.00 43.02 40.00 2dhg s PHE 99 CO 0.01 0.04 -0.25 0.14 -1.46 0.00 0.00 175.22 173.70 2dhg s VAL 100 N 1.11 2.36 0.30 3.12 -7.23 -0.26 -1.59 120.40 118.21 2dhg s VAL 100 Ca 0.22 -1.61 0.05 0.00 -1.81 0.00 0.00 61.98 58.82 2dhg s VAL 100 Cb -0.15 -2.03 -0.03 0.00 0.56 0.00 0.00 36.38 34.73 2dhg s VAL 100 CO 0.09 0.16 0.22 -0.83 -0.31 0.00 0.00 175.10 174.42 2dhg s GLY 101 N -1.88 2.11 -1.25 2.32 0.00 -1.17 -0.63 107.32 106.83 2dhg s GLY 101 Ca 0.14 -1.88 -0.01 0.00 0.00 0.00 0.00 44.72 42.97 2dhg s GLY 101 CO 0.06 -1.50 0.83 1.22 0.00 0.00 0.00 173.10 173.71 2dhg n ASP 102 N -1.15 -1.87 -4.33 1.64 8.00 0.54 -3.40 116.55 115.98 2dhg n ASP 102 Ca 0.04 -0.74 -0.46 0.00 0.71 0.00 0.00 54.79 54.35 2dhg n ASP 102 Cb 0.64 -4.53 -0.05 0.00 -0.02 0.00 0.00 41.12 37.16 2dhg n ASP 102 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2dhg s LEU 103 N -6.48 5.95 0.50 0.64 1.43 0.62 -4.40 118.68 116.95 2dhg s LEU 103 Ca 0.03 -1.67 -0.19 0.00 -1.03 0.00 0.00 54.13 51.28 2dhg s LEU 103 Cb -0.01 -2.24 -0.13 0.00 0.03 0.00 0.00 46.19 43.84 2dhg s LEU 103 CO 0.78 -0.91 0.11 0.35 0.23 0.00 0.00 176.35 176.90 2dhg n THR 104 N 5.33 0.76 0.97 5.49 -2.24 -1.26 -3.77 114.28 119.55 2dhg n THR 104 Ca -0.13 -0.50 0.05 0.00 -2.27 0.00 0.00 64.05 61.21 2dhg n THR 104 Cb 0.41 -0.21 0.32 0.00 -2.10 0.00 0.00 70.33 68.75 2dhg n THR 104 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2dhg n PRO 105 N 1.03 0.49 -0.38 -0.78 -0.04 -1.26 -2.07 135.00 131.98 2dhg n PRO 105 Ca 0.09 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.65 2dhg n PRO 105 Cb 0.46 -1.34 0.28 0.00 -0.04 0.00 0.00 33.50 32.85 2dhg n PRO 105 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dhg n ASP 106 N -0.84 3.87 -4.08 3.54 8.00 -1.26 -4.67 116.55 121.11 2dhg n ASP 106 Ca 0.08 -2.19 -0.24 0.00 0.71 0.00 0.00 54.79 53.15 2dhg n ASP 106 Cb 0.04 -0.44 -0.16 0.00 -0.02 0.00 0.00 41.12 40.54 2dhg n ASP 106 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dhg s VAL 107 N -1.35 1.18 0.31 2.53 1.01 -0.88 -4.99 120.40 118.21 2dhg s VAL 107 Ca 0.42 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2dhg s VAL 107 Cb 0.24 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.59 2dhg s VAL 107 CO 0.24 0.35 0.01 -0.90 0.00 0.00 0.00 175.10 174.80 2dhg n ASP 108 N 3.26 2.77 -0.22 3.32 5.75 -1.26 -4.83 116.55 125.34 2dhg n ASP 108 Ca -0.19 -2.39 0.05 0.00 -0.01 0.00 0.00 54.79 52.26 2dhg n ASP 108 Cb 0.53 0.25 0.31 0.00 -1.03 0.00 0.00 41.12 41.18 2dhg n ASP 108 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 2dhg h ASP 109 N 0.78 0.75 -0.95 -1.12 3.04 -1.91 -2.13 116.42 114.88 2dhg h ASP 109 Ca -0.26 0.00 0.26 0.00 -3.24 0.00 0.00 57.03 53.79 2dhg h ASP 109 Cb 0.79 -0.16 -0.14 0.00 -1.04 0.00 0.00 39.33 38.79 2dhg h ASP 109 CO 0.43 0.49 0.47 1.23 -2.04 0.00 0.00 179.24 179.82 2dhg h GLY 110 N 0.86 1.77 0.53 7.15 0.00 -1.96 -0.29 103.07 111.13 2dhg h GLY 110 Ca 0.33 -0.20 -0.22 0.00 0.00 0.00 0.00 47.33 47.23 2dhg h GLY 110 CO -0.11 -0.35 -1.11 -0.33 0.00 0.00 0.00 176.54 174.64 2dhg h MET 111 N 0.38 0.23 -0.23 4.80 2.86 -1.80 -3.21 114.93 117.96 2dhg h MET 111 Ca 0.64 -0.40 0.07 0.00 -2.06 0.00 0.00 59.70 57.95 2dhg h MET 111 Cb 1.31 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 33.11 2dhg h MET 111 CO -0.57 1.19 0.46 1.25 1.06 0.00 0.00 176.91 180.31 2dhg h LEU 112 N -0.42 0.00 0.00 1.22 5.85 -0.77 0.44 115.31 121.63 2dhg h LEU 112 Ca -0.23 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2dhg h LEU 112 Cb 1.64 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.67 2dhg h LEU 112 CO 0.07 0.00 -0.10 0.22 -0.34 0.00 0.00 178.44 178.29 2dhg h TYR 113 N 0.00 0.00 -0.18 1.25 3.20 -1.18 -3.27 116.97 116.79 2dhg h TYR 113 Ca 0.11 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.03 2dhg h TYR 113 Cb 1.04 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.30 2dhg h TYR 113 CO 0.00 0.00 0.18 0.93 -1.64 0.00 0.00 178.16 177.63 2dhg h GLU 114 N -0.53 0.00 -0.28 1.82 5.08 -1.46 0.33 114.58 119.54 2dhg h GLU 114 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2dhg h GLU 114 Cb 0.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2dhg h GLU 114 CO 0.00 0.00 -0.20 0.35 -1.00 0.00 0.00 179.01 178.16 2dhg h PHE 115 N 0.00 0.57 0.00 4.33 3.57 -0.29 -2.74 116.94 122.38 2dhg h PHE 115 Ca 0.09 -0.11 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 2dhg h PHE 115 Cb 0.44 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 2dhg h PHE 115 CO 0.00 0.68 -1.03 1.19 -2.23 0.00 0.00 178.31 176.92 2dhg n PHE 116 N -4.15 0.46 -0.44 0.41 3.72 -0.07 -4.11 117.46 113.27 2dhg n PHE 116 Ca 0.00 0.20 0.41 0.00 -0.05 0.00 0.00 57.45 58.01 2dhg n PHE 116 Cb 0.38 -0.73 0.72 0.00 -0.94 0.00 0.00 39.48 38.91 2dhg n PHE 116 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 2dhg h VAL 117 N -1.00 0.14 0.54 -4.37 3.04 -0.52 0.31 116.25 114.39 2dhg h VAL 117 Ca -0.12 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.54 2dhg h VAL 117 Cb 0.92 0.16 0.01 0.00 -2.01 0.00 0.00 31.29 30.37 2dhg h VAL 117 CO -0.07 0.00 -0.26 0.50 -1.01 0.00 0.00 177.57 176.72 2dhg h LYS 118 N 0.00 -0.70 0.00 4.17 1.63 -1.67 -3.12 116.57 116.87 2dhg h LYS 118 Ca 0.69 0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 60.49 2dhg h LYS 118 Cb 3.00 0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 34.79 2dhg h LYS 118 CO -0.01 -0.45 -0.23 -0.24 -3.45 0.00 0.00 179.45 175.07 2dhg h VAL 119 N -1.18 1.04 -3.20 2.00 3.04 -1.00 -3.40 116.25 113.56 2dhg h VAL 119 Ca -0.07 -0.83 -0.44 0.00 -1.01 0.00 0.00 66.70 64.35 2dhg h VAL 119 Cb 0.58 1.46 -0.40 0.00 -2.01 0.00 0.00 31.29 30.92 2dhg h VAL 119 CO 0.12 0.23 -0.75 -0.31 -1.01 0.00 0.00 177.57 175.85 2dhg s TYR 120 N -4.38 0.40 -1.98 3.17 2.02 0.82 -5.00 117.35 112.40 2dhg s TYR 120 Ca -0.03 -0.24 0.15 0.00 -0.37 0.00 0.00 57.07 56.59 2dhg s TYR 120 Cb 0.15 -0.72 0.92 0.00 -0.40 0.00 0.00 41.96 41.91 2dhg s TYR 120 CO 0.68 -0.41 1.34 -0.35 -1.57 0.00 0.00 175.55 175.24 2dhg n PRO 121 N 5.22 0.47 0.09 -1.71 -0.04 -1.18 -2.16 135.00 135.70 2dhg n PRO 121 Ca -0.06 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.52 2dhg n PRO 121 Cb 0.49 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.53 2dhg n PRO 121 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dhg h SER 122 N 0.00 0.00 -2.16 3.54 4.64 -1.92 -3.48 113.55 114.17 2dhg h SER 122 Ca 0.00 -0.10 -0.62 0.00 -0.47 0.00 0.00 61.79 60.60 2dhg h SER 122 Cb 0.00 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.20 2dhg h SER 122 CO 0.00 0.05 0.03 0.00 -0.87 0.00 0.00 176.83 176.04 2dhg n ARG 124 N 0.88 0.72 0.00 0.00 1.74 0.64 -4.79 116.66 115.85 2dhg n ARG 124 Ca 0.12 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2dhg n ARG 124 Cb 0.30 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 2dhg n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dhg n GLY 125 N 2.05 3.21 3.78 -0.13 0.00 -1.25 -4.98 105.19 107.87 2dhg n GLY 125 Ca -0.38 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 2dhg n GLY 125 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dhg s GLY 126 N 0.00 2.16 -0.09 -0.02 0.00 -1.26 -2.54 107.32 105.57 2dhg s GLY 126 Ca 0.00 -0.57 0.03 0.00 0.00 0.00 0.00 44.72 44.18 2dhg s GLY 126 CO 0.00 0.07 -0.17 1.25 0.00 0.00 0.00 173.10 174.25 2dhg s LYS 127 N -0.14 2.30 -0.06 2.90 2.47 -0.11 -4.63 119.74 122.47 2dhg s LYS 127 Ca 0.14 -0.61 0.03 0.00 -1.56 0.00 0.00 55.97 53.96 2dhg s LYS 127 Cb -0.12 -1.84 -0.02 0.00 -1.46 0.00 0.00 37.83 34.39 2dhg s LYS 127 CO 0.03 0.06 -0.15 0.54 0.16 0.00 0.00 175.35 175.99 2dhg s VAL 128 N 0.62 3.01 0.23 4.02 0.11 -1.26 -0.67 120.40 126.46 2dhg s VAL 128 Ca -0.14 -0.73 -0.23 0.00 -2.93 0.00 0.00 61.98 57.95 2dhg s VAL 128 Cb -0.16 -2.19 -0.09 0.00 -1.53 0.00 0.00 36.38 32.41 2dhg s VAL 128 CO 0.04 0.58 0.80 0.68 -3.33 0.00 0.00 175.10 173.87 2dhg s VAL 129 N -0.52 4.42 0.40 2.04 -7.23 -0.97 -4.90 120.40 113.63 2dhg s VAL 129 Ca 0.07 1.54 0.05 0.00 -1.81 0.00 0.00 61.98 61.83 2dhg s VAL 129 Cb -0.12 -3.98 -0.06 0.00 0.56 0.00 0.00 36.38 32.78 2dhg s VAL 129 CO 0.01 0.28 0.03 -0.76 -0.31 0.00 0.00 175.10 174.35 2dhg s LEU 130 N -1.77 2.56 0.00 1.32 1.43 -1.26 -2.11 118.68 118.85 2dhg s LEU 130 Ca 0.43 -1.43 0.07 0.00 -1.03 0.00 0.00 54.13 52.17 2dhg s LEU 130 Cb -0.19 -0.69 0.07 0.00 0.03 0.00 0.00 46.19 45.41 2dhg s LEU 130 CO 0.23 -0.58 0.59 -0.67 0.23 0.00 0.00 176.35 176.15 2dhg n ASP 131 N -0.96 2.52 -0.34 2.29 2.03 -0.64 -4.74 116.55 116.71 2dhg n ASP 131 Ca -0.06 -2.77 0.23 0.00 0.52 0.00 0.00 54.79 52.70 2dhg n ASP 131 Cb 0.67 -0.21 0.46 0.00 -0.72 0.00 0.00 41.12 41.32 2dhg n ASP 131 CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 2dhg h GLN 132 N 0.00 0.37 -0.02 -0.67 3.07 -2.02 0.62 115.11 116.46 2dhg h GLN 132 Ca -0.32 -0.02 -0.19 0.00 0.09 0.00 0.00 58.65 58.21 2dhg h GLN 132 Cb 1.29 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 28.76 2dhg h GLN 132 CO 0.49 0.24 -0.82 1.79 0.09 0.00 0.00 178.83 180.62 2dhg h THR 133 N 0.38 1.44 0.00 1.86 1.35 -2.06 -3.47 112.91 112.41 2dhg h THR 133 Ca 0.72 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.18 2dhg h THR 133 Cb 1.59 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 2dhg h THR 133 CO -0.57 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 2dhg n GLY 134 N 0.73 1.64 3.88 5.82 0.00 0.22 -5.12 105.19 112.36 2dhg n GLY 134 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2dhg n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dhg s VAL 135 N -2.00 5.36 -0.39 1.61 -7.23 -1.26 -4.68 120.40 111.81 2dhg s VAL 135 Ca 0.00 -0.04 -0.31 0.00 -1.81 0.00 0.00 61.98 59.82 2dhg s VAL 135 Cb 0.00 -3.42 -0.09 0.00 0.56 0.00 0.00 36.38 33.42 2dhg s VAL 135 CO 0.00 0.45 2.29 -0.24 -0.31 0.00 0.00 175.10 177.29 2dhg n SER 136 N 1.41 2.35 -0.11 4.85 2.88 -1.26 -1.62 113.62 122.13 2dhg n SER 136 Ca -0.15 0.14 0.25 0.00 -1.33 0.00 0.00 58.87 57.79 2dhg n SER 136 Cb 0.54 -1.39 0.71 0.00 -0.75 0.00 0.00 64.21 63.32 2dhg n SER 136 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2dhg h LYS 137 N 14.62 0.00 0.00 -1.46 1.57 -1.72 -3.40 116.57 126.18 2dhg h LYS 137 Ca -0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2dhg h LYS 137 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 2dhg h LYS 137 CO 1.06 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.35 2dhg n GLY 138 N -1.68 1.70 3.73 3.86 0.00 -1.25 -4.92 105.19 106.63 2dhg n GLY 138 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 2dhg n GLY 138 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dhg s TYR 139 N -1.75 -0.22 0.00 1.61 -0.85 -1.26 0.20 117.35 115.09 2dhg s TYR 139 Ca 0.00 -0.11 0.00 0.00 -0.52 0.00 0.00 57.07 56.44 2dhg s TYR 139 Cb 0.00 0.64 0.00 0.00 0.38 0.00 0.00 41.96 42.98 2dhg s TYR 139 CO 0.00 -0.93 0.00 0.41 -1.52 0.00 0.00 175.55 173.51 2dhg n GLY 140 N -0.43 1.73 3.34 5.49 0.00 0.20 -2.30 105.19 113.22 2dhg n GLY 140 Ca -0.07 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.15 2dhg n GLY 140 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dhg s PHE 141 N -2.43 -0.34 0.45 1.61 0.40 0.16 -1.10 117.98 116.72 2dhg s PHE 141 Ca 0.00 0.49 0.03 0.00 -0.60 0.00 0.00 56.93 56.85 2dhg s PHE 141 Cb 0.00 0.22 -0.03 0.00 0.51 0.00 0.00 43.02 43.72 2dhg s PHE 141 CO 0.00 -0.51 0.05 0.14 0.70 0.00 0.00 175.22 175.60 2dhg s VAL 142 N -1.66 1.08 0.08 -0.44 -7.23 -0.55 -0.94 120.40 110.74 2dhg s VAL 142 Ca -0.10 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.08 2dhg s VAL 142 Cb -0.02 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.49 2dhg s VAL 142 CO 0.04 0.00 -0.06 -0.54 -0.31 0.00 0.00 175.10 174.23 2dhg s LYS 143 N -3.80 0.73 0.18 4.82 1.02 -1.05 -2.12 119.74 119.51 2dhg s LYS 143 Ca 0.18 -1.20 -0.07 0.00 0.02 0.00 0.00 55.97 54.90 2dhg s LYS 143 Cb 0.04 -0.12 -0.02 0.00 -0.52 0.00 0.00 37.83 37.20 2dhg s LYS 143 CO 0.10 -0.03 0.24 -0.06 -0.92 0.00 0.00 175.35 174.69 2dhg s PHE 144 N -3.29 0.63 -0.09 3.18 0.08 -0.88 -0.26 117.98 117.36 2dhg s PHE 144 Ca 0.07 -0.97 0.14 0.00 0.12 0.00 0.00 56.93 56.29 2dhg s PHE 144 Cb 0.03 -0.19 -0.21 0.00 -0.57 0.00 0.00 43.02 42.08 2dhg s PHE 144 CO -0.05 -0.71 0.19 0.25 -0.10 0.00 0.00 175.22 174.79 2dhg n THR 145 N -0.23 0.55 -4.06 0.64 -2.24 0.17 -4.33 114.28 104.77 2dhg n THR 145 Ca -0.04 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 60.91 2dhg n THR 145 Cb 0.64 -0.27 -0.15 0.00 -2.10 0.00 0.00 70.33 68.45 2dhg n THR 145 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dhg s ASP 146 N -4.36 4.34 0.23 3.42 2.15 -1.26 -5.00 116.67 116.19 2dhg s ASP 146 Ca -0.07 -1.30 -0.07 0.00 0.43 0.00 0.00 52.55 51.54 2dhg s ASP 146 Cb 0.07 -1.56 0.37 0.00 -0.30 0.00 0.00 42.92 41.51 2dhg s ASP 146 CO 0.63 -0.17 1.71 -0.08 -0.17 0.00 0.00 175.17 177.09 2dhg h GLU 147 N 7.81 0.32 -0.98 4.34 4.22 -1.95 -0.62 114.58 127.73 2dhg h GLU 147 Ca -0.22 -0.02 0.34 0.00 0.08 0.00 0.00 59.36 59.53 2dhg h GLU 147 Cb 1.05 -0.07 -0.17 0.00 0.50 0.00 0.00 28.75 30.06 2dhg h GLU 147 CO 0.49 0.21 0.38 -0.07 -2.18 0.00 0.00 179.01 177.84 2dhg h LEU 148 N 0.33 0.13 0.02 1.64 3.38 -2.02 0.45 115.31 119.25 2dhg h LEU 148 Ca 0.36 0.24 -0.23 0.00 0.09 0.00 0.00 57.88 58.35 2dhg h LEU 148 Cb 0.55 0.29 0.02 0.00 0.09 0.00 0.00 40.66 41.61 2dhg h LEU 148 CO -0.41 -0.31 -0.89 -0.33 0.09 0.00 0.00 178.44 176.59 2dhg h GLU 149 N 0.11 0.57 -0.92 1.13 4.39 -1.56 -3.13 114.58 115.17 2dhg h GLU 149 Ca 0.72 -0.64 0.11 0.00 0.34 0.00 0.00 59.36 59.89 2dhg h GLU 149 Cb 1.71 0.19 -0.13 0.00 -0.10 0.00 0.00 28.75 30.42 2dhg h GLU 149 CO -0.75 1.25 -0.51 0.37 -1.16 0.00 0.00 179.01 178.21 2dhg h GLN 150 N 0.17 -0.04 0.14 2.33 4.15 0.38 -0.21 115.11 122.02 2dhg h GLN 150 Ca -0.12 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.30 2dhg h GLN 150 Cb 1.57 0.01 0.00 0.00 0.21 0.00 0.00 27.48 29.28 2dhg h GLN 150 CO 0.17 -0.03 -0.07 0.87 -1.93 0.00 0.00 178.83 177.85 2dhg h LYS 151 N -0.04 -0.18 -0.99 1.69 1.79 -1.59 -2.77 116.57 114.47 2dhg h LYS 151 Ca 0.22 0.01 0.36 0.00 -2.18 0.00 0.00 60.65 59.06 2dhg h LYS 151 Cb 0.50 0.04 -0.17 0.00 -1.58 0.00 0.00 32.23 31.02 2dhg h LYS 151 CO -0.91 -0.01 0.48 0.00 -1.08 0.00 0.00 179.45 177.92 2dhg h ARG 152 N -0.31 0.11 -0.09 3.15 3.08 -1.05 0.42 114.38 119.69 2dhg h ARG 152 Ca -0.02 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2dhg h ARG 152 Cb 0.25 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 2dhg h ARG 152 CO 0.03 0.07 -0.03 0.00 -1.07 0.00 0.00 179.97 178.97 2dhg h ALA 153 N 1.94 0.13 -0.97 0.04 0.00 -0.85 0.30 119.26 119.85 2dhg h ALA 153 Ca 0.77 -0.23 0.32 0.00 0.00 0.00 0.00 54.91 55.77 2dhg h ALA 153 Cb 1.90 -0.03 -0.16 0.00 0.00 0.00 0.00 17.79 19.49 2dhg h ALA 153 CO -0.73 -0.13 0.37 -0.07 0.00 0.00 0.00 179.25 178.69 2dhg h LEU 154 N -0.17 0.13 0.03 0.00 3.38 0.08 1.34 115.31 120.09 2dhg h LEU 154 Ca 0.02 0.23 -0.24 0.00 0.09 0.00 0.00 57.88 57.98 2dhg h LEU 154 Cb 0.46 0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2dhg h LEU 154 CO 0.01 -0.28 -1.31 0.00 0.09 0.00 0.00 178.44 176.95 2dhg h THR 155 N 0.13 0.93 0.47 0.22 1.03 -1.43 -3.02 112.91 111.25 2dhg h THR 155 Ca 0.70 -2.23 -0.02 0.00 -0.01 0.00 0.00 66.41 64.85 2dhg h THR 155 Cb 1.62 2.36 0.00 0.00 -1.07 0.00 0.00 68.15 71.06 2dhg h THR 155 CO -0.73 0.44 -0.23 -0.33 -0.01 0.00 0.00 175.52 174.66 2dhg h GLU 156 N -0.80 -0.61 0.00 0.00 4.39 0.55 -2.90 114.58 115.21 2dhg h GLU 156 Ca -0.34 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.40 2dhg h GLU 156 Cb 1.43 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.22 2dhg h GLU 156 CO -0.14 -0.41 0.00 0.00 -1.16 0.00 0.00 179.01 177.30 2dhg n GLN 158 N -1.40 0.00 -4.21 0.00 -0.06 -0.88 0.46 117.38 111.28 2dhg n GLN 158 Ca 0.04 0.00 -0.35 0.00 -2.00 0.00 0.00 57.00 54.69 2dhg n GLN 158 Cb 0.12 -1.03 -0.03 0.00 -4.06 0.00 0.00 30.24 25.24 2dhg n GLN 158 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2dhg n GLY 159 N 1.39 -0.42 3.64 1.69 0.00 -0.47 -4.79 105.19 106.23 2dhg n GLY 159 Ca 0.15 0.14 -0.45 0.00 0.00 0.00 0.00 46.02 45.86 2dhg n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dhg n ALA 160 N -4.38 1.31 -0.04 4.61 0.00 0.17 -4.27 120.51 117.91 2dhg n ALA 160 Ca 0.03 0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.47 2dhg n ALA 160 Cb 0.51 -2.65 -0.14 0.00 0.00 0.00 0.00 19.45 17.17 2dhg n ALA 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dhg n VAL 161 N 5.93 1.60 -0.42 0.00 0.31 -1.26 -1.27 118.33 123.23 2dhg n VAL 161 Ca 0.24 -0.75 0.34 0.00 -0.01 0.00 0.00 64.34 64.17 2dhg n VAL 161 Cb 0.36 -1.15 0.62 0.00 -0.91 0.00 0.00 33.84 32.76 2dhg n VAL 161 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2dhg h GLY 162 N 2.84 1.36 -6.63 2.92 0.00 -1.88 -3.35 103.07 98.33 2dhg h GLY 162 Ca -0.40 -0.13 -0.61 0.00 0.00 0.00 0.00 47.33 46.19 2dhg h GLY 162 CO 0.06 -0.39 0.34 -2.27 0.00 0.00 0.00 176.54 174.27 2dhg s LEU 163 N -9.57 4.15 0.29 3.11 2.96 -1.26 -4.89 118.68 113.46 2dhg s LEU 163 Ca -0.08 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.19 2dhg s LEU 163 Cb 0.29 -2.99 0.00 0.00 0.50 0.00 0.00 46.19 44.00 2dhg s LEU 163 CO 0.82 -0.69 0.00 0.61 -1.32 0.00 0.00 176.35 175.77 2dhg n GLY 164 N 4.51 -2.91 0.00 7.98 0.00 -1.26 -4.24 105.19 109.28 2dhg n GLY 164 Ca 0.02 -1.26 0.05 0.00 0.00 0.00 0.00 46.02 44.83 2dhg n GLY 164 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dhg n SER 165 N -3.14 0.00 -4.26 1.61 3.41 -1.26 -4.66 113.62 105.31 2dhg n SER 165 Ca -0.04 -0.02 -0.19 0.00 -0.26 0.00 0.00 58.87 58.36 2dhg n SER 165 Cb 0.33 -0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 63.97 2dhg n SER 165 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2dhg s LYS 166 N -2.38 1.08 1.05 4.33 1.02 -1.26 -5.08 119.74 118.50 2dhg s LYS 166 Ca 0.12 -1.28 -0.14 0.00 0.02 0.00 0.00 55.97 54.69 2dhg s LYS 166 Cb 0.07 -1.00 0.22 0.00 -0.52 0.00 0.00 37.83 36.60 2dhg s LYS 166 CO 0.15 0.20 1.10 -1.25 -0.92 0.00 0.00 175.35 174.62 2dhg s PRO 167 N -2.70 -0.02 -0.08 -1.68 0.04 -1.26 -4.68 135.00 124.62 2dhg s PRO 167 Ca 0.10 0.37 0.01 0.00 0.04 0.00 0.00 61.00 61.52 2dhg s PRO 167 Cb -0.05 -1.70 0.02 0.00 0.04 0.00 0.00 34.50 32.81 2dhg s PRO 167 CO 0.04 -3.00 -0.11 0.14 0.04 0.00 0.00 177.00 174.11 2dhg s VAL 168 N -2.97 1.10 -0.40 -0.36 -7.23 -0.39 -4.44 120.40 105.70 2dhg s VAL 168 Ca 0.67 -0.41 -0.23 0.00 -1.81 0.00 0.00 61.98 60.19 2dhg s VAL 168 Cb -0.17 -1.05 0.02 0.00 0.56 0.00 0.00 36.38 35.74 2dhg s VAL 168 CO 0.57 0.36 0.78 -0.60 -0.31 0.00 0.00 175.10 175.90 2dhg s ARG 169 N 1.05 3.61 0.25 4.82 3.52 -1.22 -1.37 118.95 129.60 2dhg s ARG 169 Ca -0.07 0.13 -0.18 0.00 -0.13 0.00 0.00 55.73 55.47 2dhg s ARG 169 Cb -0.15 -3.86 -0.08 0.00 -1.56 0.00 0.00 34.95 29.30 2dhg s ARG 169 CO -0.01 -0.96 0.72 -0.51 -0.81 0.00 0.00 175.30 173.73 2dhg s LEU 170 N 3.16 4.26 0.26 -0.88 1.43 -1.25 -3.07 118.68 122.60 2dhg s LEU 170 Ca 0.30 1.36 -0.19 0.00 -1.03 0.00 0.00 54.13 54.58 2dhg s LEU 170 Cb -0.13 -3.71 0.02 0.00 0.03 0.00 0.00 46.19 42.40 2dhg s LEU 170 CO 0.19 -0.03 0.64 -0.44 0.23 0.00 0.00 176.35 176.94 2dhg s SER 171 N -1.83 -0.23 -0.56 2.29 0.01 -0.62 -4.93 113.70 107.83 2dhg s SER 171 Ca 0.46 -0.65 -0.19 0.00 1.31 0.00 0.00 55.95 56.88 2dhg s SER 171 Cb -0.15 0.67 0.08 0.00 0.21 0.00 0.00 66.02 66.84 2dhg s SER 171 CO 0.20 -1.25 0.67 -0.69 0.41 0.00 0.00 173.24 172.58 2dhg s VAL 172 N -3.93 4.84 -0.31 3.43 1.01 -1.26 -1.23 120.40 122.94 2dhg s VAL 172 Ca 0.13 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.19 2dhg s VAL 172 Cb -0.04 -4.41 -0.02 0.00 0.00 0.00 0.00 36.38 31.91 2dhg s VAL 172 CO 0.06 -0.99 0.40 0.00 0.00 0.00 0.00 175.10 174.56 2dhg s ALA 173 N 2.68 3.53 0.21 5.51 0.00 -1.25 -4.93 121.76 127.49 2dhg s ALA 173 Ca 0.13 -0.97 -0.32 0.00 0.00 0.00 0.00 51.96 50.80 2dhg s ALA 173 Cb -0.22 -2.81 -0.14 0.00 0.00 0.00 0.00 23.12 19.96 2dhg s ALA 173 CO 0.09 -0.90 1.43 -0.89 0.00 0.00 0.00 175.76 175.50 2dhg n ILE 174 N 5.22 0.64 -0.11 0.00 5.41 -1.26 -4.61 119.36 124.65 2dhg n ILE 174 Ca -0.08 -0.16 -0.13 0.00 1.00 0.00 0.00 62.75 63.38 2dhg n ILE 174 Cb 0.50 -1.42 -0.03 0.00 -0.71 0.00 0.00 39.64 37.98 2dhg n ILE 174 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2dhg h PRO 175 N 4.64 0.82 -2.88 0.38 0.13 -1.94 -3.45 132.00 129.69 2dhg h PRO 175 Ca -0.45 -0.43 -0.16 0.00 -0.87 0.00 0.00 66.00 64.09 2dhg h PRO 175 Cb 1.28 0.02 -0.28 0.00 0.13 0.00 0.00 31.00 32.15 2dhg h PRO 175 CO 0.79 1.07 -0.39 0.15 -0.23 0.00 0.00 178.00 179.39 2dhg s LYS 176 N -4.38 0.30 -0.22 0.86 -0.14 -1.26 -5.04 119.74 109.86 2dhg s LYS 176 Ca -0.12 0.60 0.17 0.00 -1.36 0.00 0.00 55.97 55.26 2dhg s LYS 176 Cb 0.10 -0.02 0.47 0.00 -1.68 0.00 0.00 37.83 36.69 2dhg s LYS 176 CO 0.85 -0.14 1.16 0.00 -0.76 0.00 0.00 175.35 176.47 2dhg n ALA 177 N 3.96 3.49 -4.36 5.17 0.00 -1.26 -4.97 120.51 122.54 2dhg n ALA 177 Ca -0.22 -3.10 -0.36 0.00 0.00 0.00 0.00 53.44 49.75 2dhg n ALA 177 Cb 0.55 -0.60 -0.07 0.00 0.00 0.00 0.00 19.45 19.33 2dhg n ALA 177 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dhg n SER 178 N -0.53 -1.03 -4.36 0.00 2.88 -1.26 -4.86 113.62 104.45 2dhg n SER 178 Ca 0.21 -1.19 -0.45 0.00 -1.33 0.00 0.00 58.87 56.10 2dhg n SER 178 Cb 0.90 -1.94 -0.05 0.00 -0.75 0.00 0.00 64.21 62.37 2dhg n SER 178 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2dhg s ARG 179 N -7.17 3.03 -0.02 -1.46 6.06 -1.26 -5.02 118.95 113.11 2dhg s ARG 179 Ca 0.47 -1.38 0.01 0.00 -2.50 0.00 0.00 55.73 52.32 2dhg s ARG 179 Cb -0.27 -4.26 0.02 0.00 0.06 0.00 0.00 34.95 30.50 2dhg s ARG 179 CO 0.99 -1.46 -0.01 0.54 -2.50 0.00 0.00 175.30 172.86 2dhg s VAL 180 N 2.40 0.24 -0.76 7.11 0.11 -1.26 -5.09 120.40 123.15 2dhg s VAL 180 Ca 0.09 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.18 2dhg s VAL 180 Cb -0.25 -0.30 0.20 0.00 -1.53 0.00 0.00 36.38 34.50 2dhg s VAL 180 CO 0.06 0.14 0.65 2.29 -3.33 0.00 0.00 175.10 174.91 2dhg n LYS 181 N 3.86 2.27 -2.07 1.54 2.85 -1.26 -5.02 118.16 120.34 2dhg n LYS 181 Ca -0.24 -4.53 -0.28 0.00 -1.05 0.00 0.00 58.31 52.21 2dhg n LYS 181 Cb 0.52 -2.33 -0.06 0.00 -0.65 0.00 0.00 35.03 32.52 2dhg n LYS 181 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2dhg s PRO 182 N -1.68 2.49 -0.03 -1.58 0.04 -1.26 -4.87 135.00 128.11 2dhg s PRO 182 Ca 0.28 -1.17 -0.00 0.00 0.04 0.00 0.00 61.00 60.15 2dhg s PRO 182 Cb -0.01 -5.24 0.03 0.00 0.04 0.00 0.00 34.50 29.31 2dhg s PRO 182 CO -0.12 -3.99 0.02 0.08 0.04 0.00 0.00 177.00 173.02 2dhg s VAL 183 N 11.04 0.10 0.23 -0.36 1.01 -1.26 -5.15 120.40 126.02 2dhg s VAL 183 Ca 0.68 0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.67 2dhg s VAL 183 Cb -0.01 -0.23 -0.08 0.00 0.00 0.00 0.00 36.38 36.06 2dhg s VAL 183 CO 0.13 0.15 0.67 -0.70 0.00 0.00 0.00 175.10 175.35 2dhg s GLU 184 N 1.28 4.07 0.23 2.72 2.56 -1.26 -5.09 118.70 123.21 2dhg s GLU 184 Ca -0.06 0.66 0.01 0.00 0.00 0.00 0.00 54.97 55.58 2dhg s GLU 184 Cb -0.13 -2.74 -0.05 0.00 2.00 0.00 0.00 34.13 33.21 2dhg s GLU 184 CO -0.02 0.34 0.06 -1.12 -0.56 0.00 0.00 175.26 173.96 2dhg s SER 185 N -1.92 1.19 0.02 -1.70 0.01 -1.26 -5.17 113.70 104.87 2dhg s SER 185 Ca 0.45 -1.31 0.02 0.00 1.31 0.00 0.00 55.95 56.42 2dhg s SER 185 Cb -0.14 0.15 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 2dhg s SER 185 CO 0.20 -0.68 -0.06 -0.83 0.41 0.00 0.00 173.24 172.28 2dhg s GLY 186 N -3.26 0.36 0.62 3.44 0.00 -1.26 -5.15 107.32 102.06 2dhg s GLY 186 Ca 0.33 -0.47 -0.17 0.00 0.00 0.00 0.00 44.72 44.42 2dhg s GLY 186 CO 0.10 -0.48 1.12 2.56 0.00 0.00 0.00 173.10 176.41 2dhg s PRO 187 N -0.81 3.00 0.06 2.90 0.04 -1.26 -5.07 135.00 133.88 2dhg s PRO 187 Ca -0.04 1.48 -0.07 0.00 0.04 0.00 0.00 61.00 62.41 2dhg s PRO 187 Cb -0.06 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.51 2dhg s PRO 187 CO 0.00 -1.10 0.14 -1.54 0.04 0.00 0.00 177.00 174.54 2dhg s SER 188 N -2.27 0.16 0.18 6.66 1.04 -1.26 -5.17 113.70 113.05 2dhg s SER 188 Ca 0.69 -0.62 0.04 0.00 0.48 0.00 0.00 55.95 56.54 2dhg s SER 188 Cb -0.22 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 2dhg s SER 188 CO 0.36 -0.64 0.24 -0.44 0.98 0.00 0.00 173.24 173.74 2dhg s SER 189 N -2.59 5.96 0.00 7.02 0.01 -1.26 -5.37 113.70 117.47 2dhg s SER 189 Ca 0.02 -0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.27 2dhg s SER 189 Cb 0.03 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.58 2dhg s SER 189 CO -0.08 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.20