#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 0.18 -0.78 1.61 0.15 -1.26 -5.11 113.70 108.50 2dhg s SER 88 Ca 0.00 -0.37 -0.10 0.00 0.70 0.00 0.00 55.95 56.18 2dhg s SER 88 Cb 0.00 0.08 0.20 0.00 -1.71 0.00 0.00 66.02 64.60 2dhg s SER 88 CO 0.00 -0.23 0.67 -0.55 1.20 0.00 0.00 173.24 174.33 2dhg s SER 89 N -1.12 6.24 -0.04 5.45 0.15 -1.26 -4.82 113.70 118.30 2dhg s SER 89 Ca -0.12 -2.83 -0.02 0.00 0.70 0.00 0.00 55.95 53.67 2dhg s SER 89 Cb -0.08 -2.08 0.01 0.00 -1.71 0.00 0.00 66.02 62.16 2dhg s SER 89 CO -0.01 -0.48 0.05 0.61 1.20 0.00 0.00 173.24 174.61 2dhg n GLY 90 N 3.68 -3.39 2.58 9.45 0.00 -1.26 -4.89 105.19 111.37 2dhg n GLY 90 Ca 0.13 0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2dhg n GLY 90 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dhg n SER 91 N 0.32 -0.52 0.01 1.61 2.88 -1.26 -4.90 113.62 111.76 2dhg n SER 91 Ca -0.08 0.86 -0.02 0.00 -1.33 0.00 0.00 58.87 58.29 2dhg n SER 91 Cb 0.12 -0.70 -0.01 0.00 -0.75 0.00 0.00 64.21 62.87 2dhg n SER 91 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dhg n SER 92 N 1.33 0.88 -3.15 -3.46 7.64 -1.26 -5.09 113.62 110.51 2dhg n SER 92 Ca 0.14 0.12 0.06 0.00 1.01 0.00 0.00 58.87 60.20 2dhg n SER 92 Cb 0.13 -0.29 -0.02 0.00 -1.01 0.00 0.00 64.21 63.02 2dhg n SER 92 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dhg s GLY 93 N -4.49 -0.26 -1.07 0.23 0.00 -1.26 -5.08 107.32 95.38 2dhg s GLY 93 Ca -0.05 2.95 -0.23 0.00 0.00 0.00 0.00 44.72 47.39 2dhg s GLY 93 CO 0.07 4.02 1.94 2.56 0.00 0.00 0.00 173.10 181.68 2dhg s PRO 94 N 2.99 2.52 -0.09 2.90 0.04 -1.26 -4.88 135.00 137.22 2dhg s PRO 94 Ca -0.00 -0.83 -0.06 0.00 0.04 0.00 0.00 61.00 60.15 2dhg s PRO 94 Cb -0.07 -5.17 0.04 0.00 0.04 0.00 0.00 34.50 29.34 2dhg s PRO 94 CO -0.10 -3.74 0.23 -1.21 0.04 0.00 0.00 177.00 172.21 2dhg s GLU 95 N 6.67 0.21 -0.25 4.56 2.02 -1.26 -5.12 118.70 125.53 2dhg s GLU 95 Ca 0.69 0.44 -0.01 0.00 0.02 0.00 0.00 54.97 56.10 2dhg s GLU 95 Cb -0.03 -0.05 0.07 0.00 0.10 0.00 0.00 34.13 34.23 2dhg s GLU 95 CO 0.08 -0.12 0.03 0.71 0.02 0.00 0.00 175.26 175.98 2dhg s TYR 96 N 0.87 1.66 0.20 1.61 2.02 -1.26 -5.08 117.35 117.36 2dhg s TYR 96 Ca -0.06 -1.43 0.11 0.00 -0.37 0.00 0.00 57.07 55.32 2dhg s TYR 96 Cb -0.08 -1.44 -0.04 0.00 -0.40 0.00 0.00 41.96 40.00 2dhg s TYR 96 CO -0.05 -0.75 -0.23 -1.12 -1.57 0.00 0.00 175.55 171.83 2dhg s SER 97 N 1.64 3.35 0.05 2.29 0.01 -1.26 -1.02 113.70 118.75 2dhg s SER 97 Ca 0.02 -0.88 0.09 0.00 1.31 0.00 0.00 55.95 56.49 2dhg s SER 97 Cb -0.18 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 65.78 2dhg s SER 97 CO -0.13 0.09 -0.26 -0.76 0.41 0.00 0.00 173.24 172.59 2dhg s LEU 98 N -2.73 2.17 -0.23 2.44 1.43 -0.13 -3.88 118.68 117.74 2dhg s LEU 98 Ca 0.21 -0.59 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 2dhg s LEU 98 Cb -0.07 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 2dhg s LEU 98 CO 0.10 0.25 0.39 0.12 0.23 0.00 0.00 176.35 177.43 2dhg s PHE 99 N -0.81 3.32 0.10 0.29 5.36 -0.74 -1.26 117.98 124.24 2dhg s PHE 99 Ca 0.11 0.53 0.08 0.00 -0.96 0.00 0.00 56.93 56.69 2dhg s PHE 99 Cb -0.10 -2.54 -0.04 0.00 -0.34 0.00 0.00 43.02 40.00 2dhg s PHE 99 CO 0.02 -0.10 -0.15 0.14 -1.46 0.00 0.00 175.22 173.67 2dhg s VAL 100 N 1.63 3.05 0.19 3.12 -7.23 0.19 -1.70 120.40 119.65 2dhg s VAL 100 Ca 0.17 -1.35 0.04 0.00 -1.81 0.00 0.00 61.98 59.03 2dhg s VAL 100 Cb -0.15 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.39 2dhg s VAL 100 CO 0.08 0.15 0.13 0.61 -0.31 0.00 0.00 175.10 175.76 2dhg n GLY 101 N 0.90 3.50 3.84 2.32 0.00 -1.22 -0.24 105.19 114.29 2dhg n GLY 101 Ca -0.15 -1.85 -0.23 0.00 0.00 0.00 0.00 46.02 43.79 2dhg n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dhg n ASP 102 N -2.16 -0.67 -4.39 1.61 9.92 0.11 -3.59 116.55 117.39 2dhg n ASP 102 Ca 0.02 -0.92 -0.45 0.00 -0.53 0.00 0.00 54.79 52.91 2dhg n ASP 102 Cb 0.32 -3.51 -0.07 0.00 -0.64 0.00 0.00 41.12 37.22 2dhg n ASP 102 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2dhg s LEU 103 N -6.83 5.60 0.57 0.64 1.43 -0.41 -4.00 118.68 115.68 2dhg s LEU 103 Ca 0.00 -1.33 -0.18 0.00 -1.03 0.00 0.00 54.13 51.59 2dhg s LEU 103 Cb -0.00 -2.23 -0.09 0.00 0.03 0.00 0.00 46.19 43.90 2dhg s LEU 103 CO 0.85 -0.73 0.52 0.35 0.23 0.00 0.00 176.35 177.57 2dhg n THR 104 N 5.28 2.24 0.98 5.49 -2.24 -1.26 -3.84 114.28 120.92 2dhg n THR 104 Ca -0.12 -0.50 0.06 0.00 -2.27 0.00 0.00 64.05 61.22 2dhg n THR 104 Cb 0.43 -0.68 0.33 0.00 -2.10 0.00 0.00 70.33 68.31 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 -0.06 0.49 -0.00 -0.78 -0.04 -1.26 -1.90 135.00 131.45 2dhg n PRO 105 Ca 0.12 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.68 2dhg n PRO 105 Cb 0.48 -1.35 -0.13 0.00 -0.04 0.00 0.00 33.50 32.46 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 -0.85 0.66 -4.84 3.54 8.00 -1.26 -4.67 116.55 117.13 2dhg n ASP 106 Ca 0.08 -0.64 -0.37 0.00 0.71 0.00 0.00 54.79 54.57 2dhg n ASP 106 Cb 0.04 1.31 -0.06 0.00 -0.02 0.00 0.00 41.12 42.38 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 -3.17 5.24 0.33 2.53 1.01 -0.80 -5.08 120.40 120.46 2dhg s VAL 107 Ca 0.03 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2dhg s VAL 107 Cb 0.15 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2dhg s VAL 107 CO 0.88 0.58 0.03 -0.90 0.00 0.00 0.00 175.10 175.68 2dhg n ASP 108 N 2.07 2.82 -0.19 3.32 5.75 -1.26 -4.86 116.55 124.19 2dhg n ASP 108 Ca -0.16 -2.39 -0.09 0.00 -0.01 0.00 0.00 54.79 52.14 2dhg n ASP 108 Cb 0.53 0.20 0.02 0.00 -1.03 0.00 0.00 41.12 40.84 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 0.74 0.89 -1.09 -1.12 2.03 -1.93 -2.65 116.42 113.29 2dhg h ASP 109 Ca -0.26 -0.27 0.30 0.00 -0.73 0.00 0.00 57.03 56.06 2dhg h ASP 109 Cb 0.81 -0.24 -0.08 0.00 -0.83 0.00 0.00 39.33 38.99 2dhg h ASP 109 CO 0.44 0.94 0.73 1.23 -1.03 0.00 0.00 179.24 181.54 2dhg h GLY 110 N 0.81 0.86 0.05 7.15 0.00 -1.97 -0.28 103.07 109.69 2dhg h GLY 110 Ca 0.17 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 2dhg h GLY 110 CO 0.01 -0.11 -0.27 -0.33 0.00 0.00 0.00 176.54 175.84 2dhg h MET 111 N 0.26 0.02 -0.95 4.80 2.86 -1.91 -3.19 114.93 116.82 2dhg h MET 111 Ca 0.59 -0.03 0.24 0.00 -2.06 0.00 0.00 59.70 58.43 2dhg h MET 111 Cb 1.77 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 33.37 2dhg h MET 111 CO -0.22 1.02 0.64 1.25 1.06 0.00 0.00 176.91 180.66 2dhg h LEU 112 N -0.96 0.34 0.49 1.22 5.85 -0.93 0.34 115.31 121.67 2dhg h LEU 112 Ca -0.07 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 2dhg h LEU 112 Cb 1.10 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2dhg h LEU 112 CO -0.03 0.11 -0.23 0.22 -0.34 0.00 0.00 178.44 178.17 2dhg h TYR 113 N 0.33 -0.61 0.20 1.25 3.20 -1.20 -3.09 116.97 117.06 2dhg h TYR 113 Ca 0.50 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.36 2dhg h TYR 113 Cb 1.39 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.84 2dhg h TYR 113 CO -0.00 -0.38 -0.22 0.93 -1.64 0.00 0.00 178.16 176.85 2dhg h GLU 114 N -1.03 -0.44 -1.58 1.82 5.08 -1.40 0.48 114.58 117.51 2dhg h GLU 114 Ca -0.07 0.03 0.48 0.00 -1.00 0.00 0.00 59.36 58.80 2dhg h GLU 114 Cb 0.50 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.76 2dhg h GLU 114 CO 0.11 -0.29 1.10 0.35 -1.00 0.00 0.00 179.01 179.27 2dhg h PHE 115 N -0.46 0.22 0.00 4.33 3.57 -0.46 0.12 116.94 124.26 2dhg h PHE 115 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2dhg h PHE 115 Cb 0.43 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.12 2dhg h PHE 115 CO -0.16 -0.08 -0.15 1.19 -2.23 0.00 0.00 178.31 176.87 2dhg n PHE 116 N -4.29 0.09 -0.55 0.41 3.72 -0.67 -4.11 117.46 112.08 2dhg n PHE 116 Ca 0.38 0.04 0.42 0.00 -0.05 0.00 0.00 57.45 58.25 2dhg n PHE 116 Cb 1.65 -0.22 0.65 0.00 -0.94 0.00 0.00 39.48 40.61 2dhg n PHE 116 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 2dhg n VAL 117 N -2.82 0.00 0.30 -4.37 3.14 0.16 0.35 118.33 115.09 2dhg n VAL 117 Ca -0.02 1.23 -0.12 0.00 -2.96 0.00 0.00 64.34 62.46 2dhg n VAL 117 Cb 0.08 -2.06 -0.06 0.00 -1.06 0.00 0.00 33.84 30.74 2dhg n VAL 117 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 2dhg h LYS 118 N 0.00 -0.77 -0.13 1.45 1.63 -0.97 -3.13 116.57 114.65 2dhg h LYS 118 Ca 0.74 0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 60.54 2dhg h LYS 118 Cb 3.09 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 34.89 2dhg h LYS 118 CO -0.01 -0.51 -0.19 -0.24 -3.45 0.00 0.00 179.45 175.05 2dhg h VAL 119 N -1.15 1.20 -3.27 2.00 3.04 -0.25 -3.40 116.25 114.42 2dhg h VAL 119 Ca -0.08 -0.92 -0.49 0.00 -1.01 0.00 0.00 66.70 64.19 2dhg h VAL 119 Cb 0.61 1.32 -0.39 0.00 -2.01 0.00 0.00 31.29 30.82 2dhg h VAL 119 CO 0.13 0.28 -0.77 -0.31 -1.01 0.00 0.00 177.57 175.90 2dhg s TYR 120 N -4.60 1.00 -1.87 3.17 2.02 0.32 -4.99 117.35 112.39 2dhg s TYR 120 Ca -0.05 -0.65 0.15 0.00 -0.37 0.00 0.00 57.07 56.16 2dhg s TYR 120 Cb 0.15 -0.99 0.89 0.00 -0.40 0.00 0.00 41.96 41.61 2dhg s TYR 120 CO 0.74 -0.51 1.36 -0.35 -1.57 0.00 0.00 175.55 175.21 2dhg n PRO 121 N 5.06 0.42 0.10 -1.71 -0.04 -1.18 -2.21 135.00 135.44 2dhg n PRO 121 Ca -0.09 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.53 2dhg n PRO 121 Cb 0.48 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.63 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 -2.78 3.54 4.64 -1.93 -3.47 113.55 113.55 2dhg h SER 122 Ca 0.00 -0.10 -0.59 0.00 -0.47 0.00 0.00 61.79 60.62 2dhg h SER 122 Cb 0.03 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.23 2dhg h SER 122 CO 0.00 0.05 0.29 0.00 -0.87 0.00 0.00 176.83 176.30 2dhg n ARG 124 N 0.72 1.15 0.00 0.00 1.74 -0.60 -4.80 116.66 114.88 2dhg n ARG 124 Ca 0.08 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 2dhg n ARG 124 Cb 0.33 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 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 2.24 2.86 3.82 -0.13 0.00 -1.26 -5.01 105.19 107.72 2dhg n GLY 125 Ca -0.28 -0.31 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 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 2.35 -0.12 -0.02 0.00 -1.26 -2.83 107.32 105.44 2dhg s GLY 126 Ca 0.00 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.37 2dhg s GLY 126 CO 0.00 0.12 -0.13 1.25 0.00 0.00 0.00 173.10 174.34 2dhg s LYS 127 N -0.68 2.10 -0.07 2.90 2.47 -0.14 -4.71 119.74 121.62 2dhg s LYS 127 Ca 0.21 -0.50 0.03 0.00 -1.56 0.00 0.00 55.97 54.14 2dhg s LYS 127 Cb -0.15 -1.90 -0.02 0.00 -1.46 0.00 0.00 37.83 34.30 2dhg s LYS 127 CO 0.09 -0.17 -0.13 0.54 0.16 0.00 0.00 175.35 175.85 2dhg s VAL 128 N 1.31 3.15 0.35 4.02 0.11 -1.26 -0.27 120.40 127.81 2dhg s VAL 128 Ca -0.00 -0.68 -0.13 0.00 -2.93 0.00 0.00 61.98 58.24 2dhg s VAL 128 Cb -0.14 -2.26 -0.08 0.00 -1.53 0.00 0.00 36.38 32.38 2dhg s VAL 128 CO -0.06 0.58 0.74 0.68 -3.33 0.00 0.00 175.10 173.71 2dhg s VAL 129 N -0.54 4.74 0.38 2.04 -7.23 -0.89 -4.96 120.40 113.93 2dhg s VAL 129 Ca 0.08 0.78 0.04 0.00 -1.81 0.00 0.00 61.98 61.07 2dhg s VAL 129 Cb -0.12 -3.66 -0.03 0.00 0.56 0.00 0.00 36.38 33.13 2dhg s VAL 129 CO 0.02 -0.33 0.13 -0.76 -0.31 0.00 0.00 175.10 173.84 2dhg s LEU 130 N -3.36 1.96 0.48 1.32 1.43 -1.26 -2.11 118.68 117.15 2dhg s LEU 130 Ca 0.53 -1.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.08 2dhg s LEU 130 Cb -0.10 -0.08 0.01 0.00 0.03 0.00 0.00 46.19 46.05 2dhg s LEU 130 CO 0.24 -0.88 0.43 -0.62 0.23 0.00 0.00 176.35 175.74 2dhg s ASP 131 N -3.55 4.87 0.36 2.29 2.15 -0.68 -4.61 116.67 117.49 2dhg s ASP 131 Ca 0.28 -0.97 0.20 0.00 0.43 0.00 0.00 52.55 52.49 2dhg s ASP 131 Cb 0.04 -0.09 1.30 0.00 -0.30 0.00 0.00 42.92 43.87 2dhg s ASP 131 CO 0.15 -0.90 1.55 0.00 -0.17 0.00 0.00 175.17 175.80 2dhg n GLN 132 N -1.70 -0.06 0.07 4.34 10.64 -1.26 0.23 117.38 129.65 2dhg n GLN 132 Ca 0.03 1.36 -0.09 0.00 -1.83 0.00 0.00 57.00 56.46 2dhg n GLN 132 Cb 0.63 -2.43 0.01 0.00 -0.86 0.00 0.00 30.24 27.60 2dhg n GLN 132 CO 0.00 0.00 0.00 1.79 -1.83 0.00 0.00 177.06 177.02 2dhg h THR 133 N 0.00 1.44 0.00 -0.39 1.35 -2.06 -3.47 112.91 109.78 2dhg h THR 133 Ca 0.82 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 64.30 2dhg h THR 133 Cb 2.17 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 70.89 2dhg h THR 133 CO -0.76 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 175.82 2dhg n GLY 134 N 0.72 1.57 3.78 5.82 0.00 0.63 -5.11 105.19 112.60 2dhg n GLY 134 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 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 5.35 -0.66 1.61 -7.23 -1.26 -4.63 120.40 111.59 2dhg s VAL 135 Ca 0.00 0.40 -0.37 0.00 -1.81 0.00 0.00 61.98 60.20 2dhg s VAL 135 Cb 0.00 -3.54 -0.18 0.00 0.56 0.00 0.00 36.38 33.22 2dhg s VAL 135 CO 0.00 0.48 2.37 -0.24 -0.31 0.00 0.00 175.10 177.40 2dhg n SER 136 N 2.99 0.92 -0.29 4.85 2.88 -1.26 -1.69 113.62 122.02 2dhg n SER 136 Ca -0.15 0.37 0.20 0.00 -1.33 0.00 0.00 58.87 57.96 2dhg n SER 136 Cb 0.53 -1.02 0.50 0.00 -0.75 0.00 0.00 64.21 63.47 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 11.39 0.41 0.00 -1.46 1.57 -1.68 -3.40 116.57 123.40 2dhg h LYS 137 Ca -0.12 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2dhg h LYS 137 Cb 1.35 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2dhg h LYS 137 CO 1.19 0.27 0.00 0.41 -0.57 0.00 0.00 179.45 180.75 2dhg n GLY 138 N -1.49 1.07 3.77 3.86 0.00 -1.25 -4.95 105.19 106.20 2dhg n GLY 138 Ca 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.07 -0.18 0.00 1.61 -0.85 -1.26 0.09 117.35 115.69 2dhg s TYR 139 Ca 0.00 -0.17 0.00 0.00 -0.52 0.00 0.00 57.07 56.38 2dhg s TYR 139 Cb 0.00 0.66 0.00 0.00 0.38 0.00 0.00 41.96 43.00 2dhg s TYR 139 CO 0.00 -0.97 0.00 0.41 -1.52 0.00 0.00 175.55 173.47 2dhg n GLY 140 N -0.45 1.44 3.35 5.49 0.00 0.66 -2.10 105.19 113.59 2dhg n GLY 140 Ca -0.06 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.21 -0.39 0.34 1.61 0.40 0.63 -0.64 117.98 116.73 2dhg s PHE 141 Ca 0.00 0.69 0.06 0.00 -0.60 0.00 0.00 56.93 57.08 2dhg s PHE 141 Cb 0.00 0.21 -0.07 0.00 0.51 0.00 0.00 43.02 43.68 2dhg s PHE 141 CO 0.00 -0.45 0.01 0.14 0.70 0.00 0.00 175.22 175.62 2dhg s VAL 142 N -1.07 1.60 0.20 -0.44 -7.23 -0.39 -0.96 120.40 112.11 2dhg s VAL 142 Ca -0.11 -2.04 0.08 0.00 -1.81 0.00 0.00 61.98 58.10 2dhg s VAL 142 Cb -0.03 -2.77 -0.05 0.00 0.56 0.00 0.00 36.38 34.09 2dhg s VAL 142 CO 0.06 -0.08 -0.15 -0.54 -0.31 0.00 0.00 175.10 174.07 2dhg s LYS 143 N -3.78 1.34 0.06 4.82 3.01 -1.13 -0.96 119.74 123.10 2dhg s LYS 143 Ca 0.34 -1.57 -0.07 0.00 -1.01 0.00 0.00 55.97 53.66 2dhg s LYS 143 Cb 0.08 -1.19 -0.01 0.00 -1.01 0.00 0.00 37.83 35.70 2dhg s LYS 143 CO 0.16 0.21 0.14 -0.06 0.51 0.00 0.00 175.35 176.31 2dhg s PHE 144 N -2.79 0.18 -0.17 3.18 0.08 -0.19 -1.55 117.98 116.72 2dhg s PHE 144 Ca 0.22 -0.54 0.22 0.00 0.12 0.00 0.00 56.93 56.95 2dhg s PHE 144 Cb -0.02 -0.11 -0.21 0.00 -0.57 0.00 0.00 43.02 42.11 2dhg s PHE 144 CO 0.07 -0.46 0.70 0.25 -0.10 0.00 0.00 175.22 175.68 2dhg n THR 145 N 0.34 0.19 -4.17 0.64 -2.24 0.14 -4.20 114.28 104.98 2dhg n THR 145 Ca -0.17 -0.48 -0.33 0.00 -2.27 0.00 0.00 64.05 60.81 2dhg n THR 145 Cb 0.60 -0.04 -0.16 0.00 -2.10 0.00 0.00 70.33 68.63 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 -4.66 3.06 0.19 3.42 2.15 -1.26 -5.01 116.67 114.56 2dhg s ASP 146 Ca -0.04 -0.62 -0.08 0.00 0.43 0.00 0.00 52.55 52.24 2dhg s ASP 146 Cb 0.13 -1.43 0.09 0.00 -0.30 0.00 0.00 42.92 41.40 2dhg s ASP 146 CO 0.87 0.00 1.61 -0.08 -0.17 0.00 0.00 175.17 177.40 2dhg h GLU 147 N 7.89 0.96 -0.86 4.34 4.22 -1.96 -1.98 114.58 127.18 2dhg h GLU 147 Ca -0.43 -0.36 0.19 0.00 0.08 0.00 0.00 59.36 58.83 2dhg h GLU 147 Cb 1.14 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 30.28 2dhg h GLU 147 CO 0.62 1.03 0.57 -0.07 -2.18 0.00 0.00 179.01 178.98 2dhg h LEU 148 N 0.85 0.38 0.14 1.64 3.38 -2.02 -0.92 115.31 118.75 2dhg h LEU 148 Ca 0.13 0.03 -0.32 0.00 0.09 0.00 0.00 57.88 57.81 2dhg h LEU 148 Cb 0.69 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2dhg h LEU 148 CO 0.05 0.16 -1.63 -0.33 0.09 0.00 0.00 178.44 176.79 2dhg h GLU 149 N 0.38 0.29 -0.67 1.13 5.08 -1.94 -3.29 114.58 115.57 2dhg h GLU 149 Ca 0.44 -0.50 0.09 0.00 -1.00 0.00 0.00 59.36 58.39 2dhg h GLU 149 Cb 1.11 0.18 -0.11 0.00 0.50 0.00 0.00 28.75 30.43 2dhg h GLU 149 CO -0.15 1.16 -0.47 0.37 -1.00 0.00 0.00 179.01 178.92 2dhg h GLN 150 N 0.08 -0.18 0.00 2.33 4.15 -0.40 0.59 115.11 121.68 2dhg h GLN 150 Ca -0.28 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.11 2dhg h GLN 150 Cb 2.05 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 29.77 2dhg h GLN 150 CO 0.16 -0.12 -0.19 0.87 -1.93 0.00 0.00 178.83 177.62 2dhg h LYS 151 N -0.19 0.00 -0.92 1.69 1.57 -1.68 -2.63 116.57 114.40 2dhg h LYS 151 Ca 0.18 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.97 2dhg h LYS 151 Cb 0.55 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.81 2dhg h LYS 151 CO -0.75 0.19 0.61 -0.09 -0.57 0.00 0.00 179.45 178.84 2dhg h ARG 152 N 0.00 1.21 -0.16 3.15 2.43 0.08 -2.80 114.38 118.29 2dhg h ARG 152 Ca -0.00 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 2dhg h ARG 152 Cb 0.40 -0.27 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2dhg h ARG 152 CO 0.02 0.80 -0.13 0.00 -1.51 0.00 0.00 179.97 179.15 2dhg h ALA 153 N 1.34 0.23 -0.99 2.80 0.00 -0.92 0.31 119.26 122.04 2dhg h ALA 153 Ca 0.34 -0.31 0.33 0.00 0.00 0.00 0.00 54.91 55.27 2dhg h ALA 153 Cb -0.14 -0.05 -0.16 0.00 0.00 0.00 0.00 17.79 17.44 2dhg h ALA 153 CO -0.07 0.10 0.50 -0.07 0.00 0.00 0.00 179.25 179.71 2dhg h LEU 154 N 0.03 0.37 0.05 0.00 3.38 -1.39 1.78 115.31 119.52 2dhg h LEU 154 Ca 0.03 0.21 -0.33 0.00 0.09 0.00 0.00 57.88 57.88 2dhg h LEU 154 Cb 0.65 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.56 2dhg h LEU 154 CO 0.03 -0.21 -1.84 1.07 0.09 0.00 0.00 178.44 177.58 2dhg n THR 155 N -5.14 1.62 0.32 0.22 5.66 -1.16 -3.21 114.28 112.60 2dhg n THR 155 Ca 0.32 -0.36 -0.13 0.00 -3.05 0.00 0.00 64.05 60.82 2dhg n THR 155 Cb 1.01 -1.84 -0.06 0.00 -1.55 0.00 0.00 70.33 67.88 2dhg n THR 155 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2dhg h GLU 156 N -0.51 -0.83 0.00 1.09 4.39 0.54 -3.03 114.58 116.24 2dhg h GLU 156 Ca -0.45 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.30 2dhg h GLU 156 Cb 1.68 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 30.51 2dhg h GLU 156 CO -0.12 -0.55 0.00 0.00 -1.16 0.00 0.00 179.01 177.18 2dhg n GLN 158 N -0.52 1.67 -3.26 0.00 -0.06 -0.89 -0.82 117.38 113.50 2dhg n GLN 158 Ca 0.01 0.60 -0.23 0.00 -2.00 0.00 0.00 57.00 55.39 2dhg n GLN 158 Cb 0.00 -2.32 0.00 0.00 -4.06 0.00 0.00 30.24 23.87 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 3.15 -0.49 3.67 1.69 0.00 -0.16 -4.84 105.19 108.21 2dhg n GLY 159 Ca 0.18 0.09 -0.44 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.47 1.47 -0.04 4.61 0.00 0.00 -4.25 120.51 118.83 2dhg n ALA 160 Ca -0.04 0.27 -0.14 0.00 0.00 0.00 0.00 53.44 53.53 2dhg n ALA 160 Cb 0.56 -2.58 -0.14 0.00 0.00 0.00 0.00 19.45 17.29 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 5.08 1.61 -0.52 0.00 0.31 -1.26 -1.79 118.33 121.76 2dhg n VAL 161 Ca 0.20 -0.73 0.42 0.00 -0.01 0.00 0.00 64.34 64.22 2dhg n VAL 161 Cb 0.35 -1.22 0.68 0.00 -0.91 0.00 0.00 33.84 32.74 2dhg n VAL 161 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dhg n GLY 162 N 1.84 -0.84 3.58 2.92 0.00 -1.26 -3.88 105.19 107.55 2dhg n GLY 162 Ca -0.29 0.69 -0.41 0.00 0.00 0.00 0.00 46.02 46.01 2dhg n GLY 162 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dhg s LEU 163 N -8.68 4.24 0.44 0.99 2.96 -1.26 -4.89 118.68 112.49 2dhg s LEU 163 Ca -0.06 0.19 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 2dhg s LEU 163 Cb 0.28 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 44.24 2dhg s LEU 163 CO 0.79 -0.52 0.00 0.61 -1.32 0.00 0.00 176.35 175.91 2dhg n GLY 164 N 4.63 -3.99 0.34 7.98 0.00 -1.25 -4.28 105.19 108.62 2dhg n GLY 164 Ca -0.02 -0.89 0.11 0.00 0.00 0.00 0.00 46.02 45.22 2dhg n GLY 164 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2dhg h SER 165 N 0.60 0.00 -2.73 1.61 0.87 -1.90 -3.40 113.55 108.60 2dhg h SER 165 Ca 0.00 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 59.98 2dhg h SER 165 Cb 0.46 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 62.33 2dhg h SER 165 CO 0.00 0.00 -0.61 -0.54 -0.53 0.00 0.00 176.83 175.15 2dhg s LYS 166 N -4.10 2.64 0.38 2.24 1.02 -1.26 -5.06 119.74 115.60 2dhg s LYS 166 Ca -0.02 -1.02 -0.06 0.00 0.02 0.00 0.00 55.97 54.88 2dhg s LYS 166 Cb 0.07 -2.48 0.10 0.00 -0.52 0.00 0.00 37.83 34.99 2dhg s LYS 166 CO 0.21 0.46 0.34 -0.35 -0.92 0.00 0.00 175.35 175.09 2dhg n PRO 167 N -0.31 -1.69 -3.73 -1.68 -0.04 -1.26 -4.68 135.00 121.62 2dhg n PRO 167 Ca -0.09 -0.55 -0.18 0.00 -0.04 0.00 0.00 63.50 62.64 2dhg n PRO 167 Cb 0.55 -0.51 -0.17 0.00 -0.04 0.00 0.00 33.50 33.33 2dhg n PRO 167 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2dhg s VAL 168 N -1.62 -0.05 -0.63 0.52 -7.23 -0.74 -4.30 120.40 106.35 2dhg s VAL 168 Ca 0.22 0.31 -0.21 0.00 -1.81 0.00 0.00 61.98 60.49 2dhg s VAL 168 Cb -0.02 -0.15 0.09 0.00 0.56 0.00 0.00 36.38 36.85 2dhg s VAL 168 CO 0.17 0.15 0.84 -0.60 -0.31 0.00 0.00 175.10 175.34 2dhg s ARG 169 N 1.66 3.08 0.38 4.82 3.52 -1.24 -0.99 118.95 130.18 2dhg s ARG 169 Ca -0.01 -1.08 -0.24 0.00 -0.13 0.00 0.00 55.73 54.26 2dhg s ARG 169 Cb -0.13 -4.25 -0.09 0.00 -1.56 0.00 0.00 34.95 28.92 2dhg s ARG 169 CO -0.03 -1.68 1.03 -0.51 -0.81 0.00 0.00 175.30 173.29 2dhg s LEU 170 N 3.38 4.18 0.36 -0.88 1.43 -1.24 -3.37 118.68 122.54 2dhg s LEU 170 Ca 0.17 1.99 -0.17 0.00 -1.03 0.00 0.00 54.13 55.09 2dhg s LEU 170 Cb -0.21 -4.16 0.06 0.00 0.03 0.00 0.00 46.19 41.91 2dhg s LEU 170 CO 0.08 -0.39 0.81 -0.44 0.23 0.00 0.00 176.35 176.64 2dhg s SER 171 N -1.59 -0.01 -0.44 2.29 0.01 -0.69 -4.92 113.70 108.36 2dhg s SER 171 Ca 0.56 -1.08 -0.10 0.00 1.31 0.00 0.00 55.95 56.64 2dhg s SER 171 Cb -0.21 0.82 0.08 0.00 0.21 0.00 0.00 66.02 66.92 2dhg s SER 171 CO 0.26 -1.61 0.29 -0.69 0.41 0.00 0.00 173.24 171.91 2dhg s VAL 172 N -2.38 4.39 -0.12 3.43 1.01 -1.26 -1.79 120.40 123.68 2dhg s VAL 172 Ca 0.16 -1.40 -0.16 0.00 0.00 0.00 0.00 61.98 60.57 2dhg s VAL 172 Cb -0.05 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2dhg s VAL 172 CO 0.11 -0.56 0.41 0.00 0.00 0.00 0.00 175.10 175.06 2dhg s ALA 173 N 1.45 3.53 -0.02 5.51 0.00 -1.25 -4.93 121.76 126.05 2dhg s ALA 173 Ca 0.04 -0.28 0.04 0.00 0.00 0.00 0.00 51.96 51.76 2dhg s ALA 173 Cb -0.24 -2.54 -0.01 0.00 0.00 0.00 0.00 23.12 20.34 2dhg s ALA 173 CO 0.02 0.08 -0.15 0.42 0.00 0.00 0.00 175.76 176.13 2dhg s ILE 174 N 0.40 1.19 0.60 0.00 1.01 -1.26 -4.67 121.20 118.46 2dhg s ILE 174 Ca 0.23 -0.62 -0.17 0.00 0.00 0.00 0.00 60.65 60.08 2dhg s ILE 174 Cb -0.15 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 2dhg s ILE 174 CO 0.08 0.34 1.12 -2.16 0.00 0.00 0.00 174.94 174.33 2dhg s PRO 175 N -0.21 3.10 -0.53 2.79 0.04 -1.26 -4.84 135.00 134.10 2dhg s PRO 175 Ca 0.03 1.51 -0.41 0.00 0.04 0.00 0.00 61.00 62.17 2dhg s PRO 175 Cb -0.07 -1.98 -0.18 0.00 0.04 0.00 0.00 34.50 32.31 2dhg s PRO 175 CO 0.00 -1.03 2.21 1.17 0.04 0.00 0.00 177.00 179.39 2dhg n LYS 176 N -1.81 0.18 -0.39 4.56 4.81 -1.26 -4.79 118.16 119.46 2dhg n LYS 176 Ca 0.11 0.04 -0.10 0.00 -0.87 0.00 0.00 58.31 57.50 2dhg n LYS 176 Cb 0.51 -1.67 -0.08 0.00 0.02 0.00 0.00 35.03 33.82 2dhg n LYS 176 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dhg h ALA 177 N 9.95 -0.45 -2.97 3.14 0.00 -2.06 -3.45 119.26 123.42 2dhg h ALA 177 Ca -0.12 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2dhg h ALA 177 Cb 1.39 1.30 -0.03 0.00 0.00 0.00 0.00 17.79 20.45 2dhg h ALA 177 CO 1.11 -0.92 0.09 -1.12 0.00 0.00 0.00 179.25 178.41 2dhg s SER 178 N -5.45 0.34 -0.04 0.00 0.01 -1.26 -5.15 113.70 102.16 2dhg s SER 178 Ca -0.12 -1.26 -0.19 0.00 1.31 0.00 0.00 55.95 55.69 2dhg s SER 178 Cb 0.12 0.77 -0.05 0.00 0.21 0.00 0.00 66.02 67.08 2dhg s SER 178 CO 0.63 -1.52 0.54 -0.60 0.41 0.00 0.00 173.24 172.70 2dhg s ARG 179 N -2.67 4.27 -0.13 12.44 3.52 -1.26 -5.07 118.95 130.05 2dhg s ARG 179 Ca 0.21 0.61 -0.02 0.00 -0.13 0.00 0.00 55.73 56.40 2dhg s ARG 179 Cb -0.03 -3.35 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 2dhg s ARG 179 CO 0.15 0.35 -0.05 0.08 -0.81 0.00 0.00 175.30 175.02 2dhg s VAL 180 N -0.08 3.79 0.02 7.11 1.01 -1.26 -5.11 120.40 125.88 2dhg s VAL 180 Ca 0.29 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.88 2dhg s VAL 180 Cb -0.17 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 2dhg s VAL 180 CO 0.15 0.53 -0.06 -1.59 0.00 0.00 0.00 175.10 174.12 2dhg s LYS 181 N -0.00 0.47 -0.58 2.72 -2.85 -1.26 -5.10 119.74 113.14 2dhg s LYS 181 Ca 0.00 -0.47 -0.27 0.00 -1.00 0.00 0.00 55.97 54.24 2dhg s LYS 181 Cb -0.13 -0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 35.27 2dhg s LYS 181 CO 0.03 0.08 1.84 -1.25 0.10 0.00 0.00 175.35 176.15 2dhg s PRO 182 N -0.84 2.73 -0.39 1.78 0.04 -1.26 -4.96 135.00 132.10 2dhg s PRO 182 Ca -0.04 0.69 -0.13 0.00 0.04 0.00 0.00 61.00 61.56 2dhg s PRO 182 Cb -0.06 -4.36 0.01 0.00 0.04 0.00 0.00 34.50 30.14 2dhg s PRO 182 CO 0.00 -2.61 0.26 0.08 0.04 0.00 0.00 177.00 174.77 2dhg s VAL 183 N 8.74 5.08 -0.18 -0.36 1.01 -1.26 -5.07 120.40 128.35 2dhg s VAL 183 Ca 0.68 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2dhg s VAL 183 Cb -0.14 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2dhg s VAL 183 CO 0.22 -0.22 0.05 -0.70 0.00 0.00 0.00 175.10 174.45 2dhg s GLU 184 N 1.66 3.93 -0.12 2.72 2.12 -1.26 -5.08 118.70 122.66 2dhg s GLU 184 Ca 0.04 -0.37 -0.30 0.00 0.36 0.00 0.00 54.97 54.71 2dhg s GLU 184 Cb -0.19 -3.19 0.09 0.00 0.26 0.00 0.00 34.13 31.10 2dhg s GLU 184 CO 0.09 0.25 0.78 -1.54 -0.54 0.00 0.00 175.26 174.29 2dhg s SER 185 N 0.44 -0.60 -0.16 -1.70 1.04 -1.26 -5.18 113.70 106.28 2dhg s SER 185 Ca 0.02 0.77 -0.29 0.00 0.48 0.00 0.00 55.95 56.94 2dhg s SER 185 Cb -0.13 0.65 0.09 0.00 0.10 0.00 0.00 66.02 66.73 2dhg s SER 185 CO 0.01 -0.47 0.83 -0.83 0.98 0.00 0.00 173.24 173.75 2dhg s GLY 186 N -0.85 -0.42 1.07 7.32 0.00 -1.26 -5.17 107.32 108.00 2dhg s GLY 186 Ca -0.06 1.87 -0.14 0.00 0.00 0.00 0.00 44.72 46.38 2dhg s GLY 186 CO 0.06 1.29 1.10 2.56 0.00 0.00 0.00 173.10 178.10 2dhg s PRO 187 N -0.61 -0.12 -0.02 2.90 0.04 -1.26 -5.09 135.00 130.84 2dhg s PRO 187 Ca -0.04 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.03 2dhg s PRO 187 Cb -0.02 -1.69 0.11 0.00 0.04 0.00 0.00 34.50 32.94 2dhg s PRO 187 CO 0.03 -3.06 1.09 -1.54 0.04 0.00 0.00 177.00 173.56 2dhg s SER 188 N -3.57 -0.19 0.06 6.66 1.04 -1.26 -5.19 113.70 111.25 2dhg s SER 188 Ca 0.67 -0.12 -0.27 0.00 0.48 0.00 0.00 55.95 56.71 2dhg s SER 188 Cb -0.16 0.29 0.09 0.00 0.10 0.00 0.00 66.02 66.34 2dhg s SER 188 CO 0.57 -0.50 0.76 -0.55 0.98 0.00 0.00 173.24 174.50 2dhg s SER 189 N -2.63 -0.47 0.00 7.02 0.15 -1.26 -5.38 113.70 111.14 2dhg s SER 189 Ca 0.10 0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.80 2dhg s SER 189 Cb 0.00 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 2dhg s SER 189 CO -0.04 -0.75 0.00 0.61 1.20 0.00 0.00 173.24 174.25