#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c3h s TYR 112 N 0.00 3.48 -0.25 0.00 5.04 -1.26 -5.02 117.35 119.34 1c3h s TYR 112 Ca 0.00 1.40 -0.08 0.00 -2.44 0.00 0.00 57.07 55.95 1c3h s TYR 112 Cb 0.00 -3.38 -0.03 0.00 0.35 0.00 0.00 41.96 38.89 1c3h s TYR 112 CO 0.00 -1.09 0.09 -1.64 -1.34 0.00 0.00 175.55 171.58 1c3h s MET 113 N 0.45 3.75 -0.53 4.97 -1.94 -1.26 -5.06 119.30 119.69 1c3h s MET 113 Ca 0.55 -0.43 -0.25 0.00 -1.71 0.00 0.00 55.69 53.85 1c3h s MET 113 Cb -0.30 -3.38 0.03 0.00 2.01 0.00 0.00 34.83 33.20 1c3h s MET 113 CO 0.32 -0.13 0.98 0.71 -0.01 0.00 0.00 175.02 176.89 1c3h s TYR 114 N 1.50 2.80 -0.08 -0.03 1.51 -1.26 -5.02 117.35 116.77 1c3h s TYR 114 Ca 0.06 0.19 0.04 0.00 -1.01 0.00 0.00 57.07 56.35 1c3h s TYR 114 Cb -0.15 -4.13 -0.01 0.00 -0.11 0.00 0.00 41.96 37.56 1c3h s TYR 114 CO 0.05 -1.32 -0.20 1.03 -1.11 0.00 0.00 175.55 174.00 1c3h s ARG 115 N 4.08 2.83 -0.29 -0.62 0.52 -1.26 -4.97 118.95 119.24 1c3h s ARG 115 Ca 0.35 -0.80 0.04 0.00 -0.52 0.00 0.00 55.73 54.80 1c3h s ARG 115 Cb -0.11 -2.35 0.20 0.00 0.52 0.00 0.00 34.95 33.21 1c3h s ARG 115 CO 0.23 0.36 0.59 0.45 0.02 0.00 0.00 175.30 176.95 1c3h s SER 116 N -0.07 -1.58 0.10 0.23 0.15 -1.26 -4.95 113.70 106.32 1c3h s SER 116 Ca -0.05 0.35 -0.19 0.00 0.70 0.00 0.00 55.95 56.76 1c3h s SER 116 Cb -0.14 2.07 0.05 0.00 -1.71 0.00 0.00 66.02 66.28 1c3h s SER 116 CO 0.04 -0.29 0.48 0.00 1.20 0.00 0.00 173.24 174.67 1c3h s ALA 117 N 2.84 -1.19 -0.05 5.45 0.00 -1.26 -0.57 121.76 126.98 1c3h s ALA 117 Ca 0.13 0.28 -0.24 0.00 0.00 0.00 0.00 51.96 52.13 1c3h s ALA 117 Cb -0.11 0.61 0.05 0.00 0.00 0.00 0.00 23.12 23.67 1c3h s ALA 117 CO -0.25 -0.61 0.53 -0.59 0.00 0.00 0.00 175.76 174.84 1c3h s PHE 118 N -3.27 -0.48 -0.15 0.00 -0.12 -0.59 -4.35 117.98 109.02 1c3h s PHE 118 Ca -0.01 0.85 -0.04 0.00 -0.05 0.00 0.00 56.93 57.68 1c3h s PHE 118 Cb 0.00 0.27 0.07 0.00 -0.63 0.00 0.00 43.02 42.73 1c3h s PHE 118 CO -0.08 -0.50 0.15 0.45 -0.05 0.00 0.00 175.22 175.18 1c3h s SER 119 N -1.10 1.60 0.12 1.98 0.15 0.16 -1.56 113.70 115.04 1c3h s SER 119 Ca -0.11 -0.23 0.05 0.00 0.70 0.00 0.00 55.95 56.36 1c3h s SER 119 Cb -0.02 0.08 -0.04 0.00 -1.71 0.00 0.00 66.02 64.33 1c3h s SER 119 CO 0.07 -0.31 -0.13 0.68 1.20 0.00 0.00 173.24 174.75 1c3h s VAL 120 N 2.24 1.20 0.16 4.45 -7.23 0.14 -0.23 120.40 121.12 1c3h s VAL 120 Ca 0.04 -1.71 0.07 0.00 -1.81 0.00 0.00 61.98 58.57 1c3h s VAL 120 Cb -0.15 -1.49 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 1c3h s VAL 120 CO -0.09 -0.48 -0.14 -0.83 -0.31 0.00 0.00 175.10 173.25 1c3h s GLY 121 N -2.49 1.26 0.05 2.32 0.00 0.41 -0.67 107.32 108.21 1c3h s GLY 121 Ca 0.08 -1.49 -0.30 0.00 0.00 0.00 0.00 44.72 43.01 1c3h s GLY 121 CO 0.02 -1.57 1.09 -2.27 0.00 0.00 0.00 173.10 170.37 1c3h s LEU 122 N -2.90 4.39 -0.16 0.66 2.96 -0.25 -0.59 118.68 122.79 1c3h s LEU 122 Ca 0.16 1.87 -0.07 0.00 -0.22 0.00 0.00 54.13 55.87 1c3h s LEU 122 Cb -0.03 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 43.01 1c3h s LEU 122 CO 0.05 -0.34 -0.20 -0.62 -1.32 0.00 0.00 176.35 173.92 1c3h n GLU 123 N 3.69 0.35 0.00 1.98 1.02 -1.26 -4.64 120.64 121.78 1c3h n GLU 123 Ca 0.07 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1c3h n GLU 123 Cb 0.48 -1.10 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 1c3h n GLU 123 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1c3h n THR 124 N -3.64 0.00 -3.95 2.62 -2.24 -1.26 -4.73 114.28 101.08 1c3h n THR 124 Ca -0.31 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.30 1c3h n THR 124 Cb 0.73 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.80 1c3h n THR 124 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1c3h s ARG 125 N 0.23 0.33 -0.18 -0.78 1.81 -1.26 -4.66 118.95 114.44 1c3h s ARG 125 Ca 0.00 0.05 -0.29 0.00 -1.72 0.00 0.00 55.73 53.77 1c3h s ARG 125 Cb 0.00 -0.48 -0.05 0.00 -0.45 0.00 0.00 34.95 33.97 1c3h s ARG 125 CO 0.00 -0.11 2.04 0.08 -0.68 0.00 0.00 175.30 176.62 1c3h s VAL 126 N 0.90 3.16 -0.15 3.52 1.01 -1.26 -4.81 120.40 122.77 1c3h s VAL 126 Ca -0.09 0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 1c3h s VAL 126 Cb -0.13 -3.18 -0.07 0.00 0.00 0.00 0.00 36.38 33.00 1c3h s VAL 126 CO -0.01 -0.10 -0.17 1.07 0.00 0.00 0.00 175.10 175.89 1c3h n THR 127 N 7.08 0.82 -3.06 3.92 5.66 -1.26 -4.52 114.28 122.92 1c3h n THR 127 Ca 0.25 -0.24 -0.41 0.00 -3.05 0.00 0.00 64.05 60.60 1c3h n THR 127 Cb 0.44 -1.48 -0.06 0.00 -1.55 0.00 0.00 70.33 67.68 1c3h n THR 127 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1c3h s VAL 128 N -2.28 4.96 0.83 1.08 1.01 -1.26 -4.66 120.40 120.07 1c3h s VAL 128 Ca -0.20 1.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.90 1c3h s VAL 128 Cb 0.07 -3.98 0.09 0.00 0.00 0.00 0.00 36.38 32.56 1c3h s VAL 128 CO 0.28 0.02 1.15 -2.16 0.00 0.00 0.00 175.10 174.39 1c3h s PRO 129 N 2.47 1.83 -0.99 2.72 0.04 -1.26 -4.21 135.00 135.61 1c3h s PRO 129 Ca 0.29 0.27 -0.07 0.00 0.04 0.00 0.00 61.00 61.52 1c3h s PRO 129 Cb -0.16 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.53 1c3h s PRO 129 CO 0.09 -1.71 0.29 0.09 0.04 0.00 0.00 177.00 175.79 1c3h n ASN 130 N -3.43 -2.82 -3.99 6.66 4.13 -0.90 -4.95 115.26 109.96 1c3h n ASN 130 Ca 0.07 -0.16 -0.13 0.00 1.68 0.00 0.00 54.58 56.04 1c3h n ASN 130 Cb 0.59 -2.40 -0.12 0.00 -1.54 0.00 0.00 39.78 36.31 1c3h n ASN 130 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1c3h s VAL 131 N -2.68 0.34 0.02 2.41 -7.23 -1.26 -4.99 120.40 107.01 1c3h s VAL 131 Ca 0.28 -0.70 -0.37 0.00 -1.81 0.00 0.00 61.98 59.38 1c3h s VAL 131 Cb -0.15 -0.39 -0.16 0.00 0.56 0.00 0.00 36.38 36.23 1c3h s VAL 131 CO 0.34 -0.24 1.42 -2.65 -0.31 0.00 0.00 175.10 173.67 1c3h n PRO 132 N 2.05 1.16 -2.54 4.82 -0.02 -1.26 -4.38 135.00 134.84 1c3h n PRO 132 Ca -0.19 0.42 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 1c3h n PRO 132 Cb 0.56 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.94 1c3h n PRO 132 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1c3h s ILE 133 N 1.10 4.45 -0.93 4.25 1.01 0.11 -4.84 121.20 126.35 1c3h s ILE 133 Ca 0.87 1.75 -0.18 0.00 0.00 0.00 0.00 60.65 63.09 1c3h s ILE 133 Cb -0.97 -4.12 0.14 0.00 0.01 0.00 0.00 42.46 37.51 1c3h s ILE 133 CO 0.50 -0.04 1.10 -0.13 0.00 0.00 0.00 174.94 176.38 1c3h s ARG 134 N 2.42 3.62 0.22 2.79 1.81 -1.26 -4.57 118.95 123.98 1c3h s ARG 134 Ca 0.52 -1.88 -0.30 0.00 -1.72 0.00 0.00 55.73 52.36 1c3h s ARG 134 Cb -0.22 -4.87 -0.08 0.00 -0.45 0.00 0.00 34.95 29.33 1c3h s ARG 134 CO 0.18 -1.72 1.13 -0.06 -0.68 0.00 0.00 175.30 174.16 1c3h s PHE 135 N 2.34 3.53 0.00 -0.53 0.40 -1.26 -4.79 117.98 117.66 1c3h s PHE 135 Ca 0.31 1.58 0.00 0.00 -0.60 0.00 0.00 56.93 58.22 1c3h s PHE 135 Cb -0.05 -3.33 0.00 0.00 0.51 0.00 0.00 43.02 40.14 1c3h s PHE 135 CO -0.09 -0.79 0.06 0.25 0.70 0.00 0.00 175.22 175.34 1c3h n THR 136 N 1.97 0.00 -2.75 0.64 -2.24 -0.75 -4.61 114.28 106.54 1c3h n THR 136 Ca 0.02 -0.37 -0.43 0.00 -2.27 0.00 0.00 64.05 61.00 1c3h n THR 136 Cb 0.45 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.69 1c3h n THR 136 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1c3h s LYS 137 N -0.63 3.85 -0.37 -0.78 2.20 0.25 -4.89 119.74 119.38 1c3h s LYS 137 Ca 0.00 0.65 -0.16 0.00 -0.36 0.00 0.00 55.97 56.10 1c3h s LYS 137 Cb 0.00 -3.81 -0.00 0.00 -1.51 0.00 0.00 37.83 32.51 1c3h s LYS 137 CO 0.00 -1.02 0.39 0.42 -0.36 0.00 0.00 175.35 174.78 1c3h s ILE 138 N 3.66 5.14 -0.08 5.43 -1.09 -1.26 0.16 121.20 133.15 1c3h s ILE 138 Ca 0.41 -0.07 0.02 0.00 -2.23 0.00 0.00 60.65 58.78 1c3h s ILE 138 Cb -0.11 -3.89 -0.25 0.00 -1.58 0.00 0.00 42.46 36.63 1c3h s ILE 138 CO 0.20 -0.19 0.50 0.49 -1.23 0.00 0.00 174.94 174.71 1c3h n PHE 139 N 5.45 1.16 -3.64 3.97 3.01 0.67 -4.95 117.46 123.14 1c3h n PHE 139 Ca -0.08 0.31 -0.09 0.00 1.01 0.00 0.00 57.45 58.59 1c3h n PHE 139 Cb 0.49 -1.18 -0.07 0.00 -0.01 0.00 0.00 39.48 38.71 1c3h n PHE 139 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1c3h s TYR 140 N -2.58 -0.70 -0.27 1.38 5.04 -0.68 -4.92 117.35 114.62 1c3h s TYR 140 Ca -0.15 1.59 0.05 0.00 -2.44 0.00 0.00 57.07 56.12 1c3h s TYR 140 Cb 0.07 0.38 0.17 0.00 0.35 0.00 0.00 41.96 42.93 1c3h s TYR 140 CO 0.80 -0.34 1.08 -1.71 -1.34 0.00 0.00 175.55 174.03 1c3h n ASN 141 N 2.98 -1.11 0.27 4.32 5.15 -1.26 0.35 115.26 125.96 1c3h n ASN 141 Ca -0.15 -1.77 0.15 0.00 -0.60 0.00 0.00 54.58 52.20 1c3h n ASN 141 Cb 0.56 0.75 0.87 0.00 -0.53 0.00 0.00 39.78 41.43 1c3h n ASN 141 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 1c3h h GLN 142 N 1.07 0.00 -0.02 1.20 4.15 -1.97 -1.24 115.11 118.29 1c3h h GLN 142 Ca -0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.04 1c3h h GLN 142 Cb 1.21 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.90 1c3h h GLN 142 CO -0.14 0.00 -0.15 1.04 -1.93 0.00 0.00 178.83 177.66 1c3h n GLN 143 N -3.92 1.73 -2.14 1.69 3.00 -1.26 -4.94 117.38 111.53 1c3h n GLN 143 Ca -0.02 -1.31 -0.19 0.00 -0.01 0.00 0.00 57.00 55.47 1c3h n GLN 143 Cb 0.13 -1.47 -0.03 0.00 0.00 0.00 0.00 30.24 28.87 1c3h n GLN 143 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1c3h n ASN 144 N 0.50 -5.39 0.20 1.08 3.02 -0.47 -4.85 115.26 109.35 1c3h n ASN 144 Ca 0.14 0.16 0.14 0.00 -0.03 0.00 0.00 54.58 54.99 1c3h n ASN 144 Cb 0.48 -4.59 0.43 0.00 -0.61 0.00 0.00 39.78 35.49 1c3h n ASN 144 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1c3h h HIS 145 N 0.00 0.00 -2.90 3.10 3.86 -1.87 -3.42 115.15 113.92 1c3h h HIS 145 Ca -0.44 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.10 1c3h h HIS 145 Cb 1.31 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 29.69 1c3h h HIS 145 CO 0.57 0.00 -0.53 -0.47 0.86 0.00 0.00 177.93 178.36 1c3h s TYR 146 N -3.34 3.43 -0.25 2.45 5.04 -1.26 0.24 117.35 123.66 1c3h s TYR 146 Ca 0.06 0.39 -0.02 0.00 -2.44 0.00 0.00 57.07 55.06 1c3h s TYR 146 Cb 0.08 -1.87 0.03 0.00 0.35 0.00 0.00 41.96 40.55 1c3h s TYR 146 CO 0.57 0.64 -0.05 0.34 -1.34 0.00 0.00 175.55 175.70 1c3h s ASP 147 N -1.06 4.39 0.45 4.32 -1.08 0.31 -4.98 116.67 119.03 1c3h s ASP 147 Ca 0.15 -0.93 0.18 0.00 -0.52 0.00 0.00 52.55 51.44 1c3h s ASP 147 Cb -0.12 -1.67 1.07 0.00 -1.46 0.00 0.00 42.92 40.75 1c3h s ASP 147 CO 0.05 -0.14 1.97 1.23 0.52 0.00 0.00 175.17 178.80 1c3h h GLY 148 N 8.01 0.00 1.19 2.66 0.00 -1.88 0.83 103.07 113.88 1c3h h GLY 148 Ca -0.31 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 1c3h h GLY 148 CO 0.57 0.00 -0.06 1.76 0.00 0.00 0.00 176.54 178.81 1c3h h SER 149 N 0.00 0.95 0.00 0.19 0.02 -1.93 -3.28 113.55 109.50 1c3h h SER 149 Ca -0.00 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1c3h h SER 149 Cb 0.41 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1c3h h SER 149 CO 0.03 1.04 -0.86 0.35 -1.14 0.00 0.00 176.83 176.24 1c3h n THR 150 N -4.17 0.00 -1.64 -2.27 -2.24 -1.09 -5.00 114.28 97.87 1c3h n THR 150 Ca 0.02 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.47 1c3h n THR 150 Cb 0.36 0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 69.35 1c3h n THR 150 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c3h n GLY 151 N 1.43 0.67 3.42 3.38 0.00 0.29 -4.78 105.19 109.60 1c3h n GLY 151 Ca 0.01 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 1c3h n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c3h s LYS 152 N -3.48 1.83 -0.16 1.61 1.02 -1.15 -4.53 119.74 114.88 1c3h s LYS 152 Ca 0.00 -1.11 -0.10 0.00 0.02 0.00 0.00 55.97 54.78 1c3h s LYS 152 Cb 0.00 -2.07 -0.05 0.00 -0.52 0.00 0.00 37.83 35.20 1c3h s LYS 152 CO 0.00 0.51 0.17 0.12 -0.92 0.00 0.00 175.35 175.23 1c3h s PHE 153 N -0.95 3.50 -0.21 3.18 5.36 -0.14 -0.53 117.98 128.20 1c3h s PHE 153 Ca 0.14 0.47 -0.02 0.00 -0.96 0.00 0.00 56.93 56.56 1c3h s PHE 153 Cb -0.10 -2.12 0.00 0.00 -0.34 0.00 0.00 43.02 40.46 1c3h s PHE 153 CO 0.05 0.45 -0.09 0.71 -1.46 0.00 0.00 175.22 174.88 1c3h s TYR 154 N -0.17 2.90 -0.08 10.12 1.51 0.14 -1.85 117.35 129.93 1c3h s TYR 154 Ca 0.12 -1.15 -0.30 0.00 -1.01 0.00 0.00 57.07 54.74 1c3h s TYR 154 Cb -0.12 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 1c3h s TYR 154 CO 0.02 -0.62 1.53 0.00 -1.11 0.00 0.00 175.55 175.36 1c3h n ASN 156 N 6.79 1.05 -3.73 0.00 4.13 -1.26 -0.40 115.26 121.83 1c3h n ASN 156 Ca 0.16 -1.02 -0.24 0.00 1.68 0.00 0.00 54.58 55.15 1c3h n ASN 156 Cb 0.43 0.39 -0.17 0.00 -1.54 0.00 0.00 39.78 38.89 1c3h n ASN 156 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1c3h s ILE 157 N -0.93 0.31 0.30 2.41 1.01 -1.26 -4.91 121.20 118.12 1c3h s ILE 157 Ca 0.06 -0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.36 1c3h s ILE 157 Cb 0.05 -0.62 -0.10 0.00 0.01 0.00 0.00 42.46 41.79 1c3h s ILE 157 CO 0.14 0.07 1.36 -2.16 0.00 0.00 0.00 174.94 174.35 1c3h s PRO 158 N 1.98 4.32 0.00 2.79 0.04 -1.26 -4.78 135.00 138.09 1c3h s PRO 158 Ca 0.03 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1c3h s PRO 158 Cb -0.14 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.32 1c3h s PRO 158 CO -0.06 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 177.11 1c3h n GLY 159 N 1.30 -1.37 3.69 0.56 0.00 -0.44 -0.69 105.19 108.26 1c3h n GLY 159 Ca 0.02 -1.20 -0.39 0.00 0.00 0.00 0.00 46.02 44.46 1c3h n GLY 159 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1c3h s LEU 160 N 0.00 4.22 0.10 0.99 0.20 0.96 -0.38 118.68 124.77 1c3h s LEU 160 Ca 0.00 0.83 0.10 0.00 0.69 0.00 0.00 54.13 55.75 1c3h s LEU 160 Cb 0.00 -2.79 -0.04 0.00 -0.43 0.00 0.00 46.19 42.93 1c3h s LEU 160 CO 0.00 -0.12 -0.24 -0.31 -0.29 0.00 0.00 176.35 175.39 1c3h s TYR 161 N 1.18 2.38 -0.11 5.38 1.51 -0.08 0.68 117.35 128.28 1c3h s TYR 161 Ca 0.28 -0.35 -0.00 0.00 -1.01 0.00 0.00 57.07 55.98 1c3h s TYR 161 Cb -0.16 -1.32 -0.02 0.00 -0.11 0.00 0.00 41.96 40.35 1c3h s TYR 161 CO 0.11 0.30 -0.10 -0.47 -1.11 0.00 0.00 175.55 174.27 1c3h s TYR 162 N -1.01 2.86 -0.02 2.71 5.04 -0.16 -0.70 117.35 126.06 1c3h s TYR 162 Ca 0.14 -0.40 0.05 0.00 -2.44 0.00 0.00 57.07 54.43 1c3h s TYR 162 Cb -0.10 -1.82 -0.01 0.00 0.35 0.00 0.00 41.96 40.38 1c3h s TYR 162 CO 0.06 -0.03 -0.19 -0.06 -1.34 0.00 0.00 175.55 173.99 1c3h s PHE 163 N 0.02 1.73 -0.04 4.97 0.40 -0.06 -1.07 117.98 123.93 1c3h s PHE 163 Ca -0.03 -0.38 -0.05 0.00 -0.60 0.00 0.00 56.93 55.87 1c3h s PHE 163 Cb -0.14 -1.13 0.01 0.00 0.51 0.00 0.00 43.02 42.27 1c3h s PHE 163 CO 0.04 -0.07 0.12 0.45 0.70 0.00 0.00 175.22 176.45 1c3h s SER 164 N -0.30 -0.09 0.01 1.36 0.15 0.66 -1.06 113.70 114.44 1c3h s SER 164 Ca 0.04 0.14 -0.04 0.00 0.70 0.00 0.00 55.95 56.79 1c3h s SER 164 Cb -0.09 0.24 -0.01 0.00 -1.71 0.00 0.00 66.02 64.46 1c3h s SER 164 CO 0.00 -0.11 0.06 -0.72 1.20 0.00 0.00 173.24 173.66 1c3h s TYR 165 N -0.26 0.16 -0.06 3.44 -0.85 -0.36 0.59 117.35 120.01 1c3h s TYR 165 Ca -0.03 -0.36 -0.01 0.00 -0.52 0.00 0.00 57.07 56.15 1c3h s TYR 165 Cb -0.03 -0.13 0.03 0.00 0.38 0.00 0.00 41.96 42.22 1c3h s TYR 165 CO 0.00 -0.25 -0.00 -1.01 -1.52 0.00 0.00 175.55 172.77 1c3h s HIS 166 N -1.56 0.57 -0.12 -3.49 3.76 -0.45 -1.41 115.29 112.59 1c3h s HIS 166 Ca -0.14 -0.11 0.02 0.00 -0.15 0.00 0.00 55.06 54.68 1c3h s HIS 166 Cb -0.08 -0.68 -0.00 0.00 1.11 0.00 0.00 32.58 32.93 1c3h s HIS 166 CO -0.00 -0.26 -0.20 0.42 -0.85 0.00 0.00 174.74 173.85 1c3h s ILE 167 N 1.65 2.36 -0.52 0.60 -1.09 0.47 0.01 121.20 124.67 1c3h s ILE 167 Ca -0.00 -0.90 -0.26 0.00 -2.23 0.00 0.00 60.65 57.26 1c3h s ILE 167 Cb -0.13 -1.94 0.03 0.00 -1.58 0.00 0.00 42.46 38.84 1c3h s ILE 167 CO -0.04 0.54 1.00 -0.89 -1.23 0.00 0.00 174.94 174.33 1c3h s THR 168 N 0.47 4.33 -0.18 2.92 2.01 -1.25 -0.36 115.64 123.57 1c3h s THR 168 Ca -0.14 0.62 -0.27 0.00 0.31 0.00 0.00 61.69 62.21 1c3h s THR 168 Cb -0.17 -4.55 -0.01 0.00 0.01 0.00 0.00 72.50 67.79 1c3h s THR 168 CO 0.06 -1.06 0.92 -0.69 -0.69 0.00 0.00 174.62 173.15 1c3h s VAL 169 N 4.12 4.80 -0.03 3.82 1.01 0.64 -1.17 120.40 133.60 1c3h s VAL 169 Ca 0.36 1.81 -0.12 0.00 0.00 0.00 0.00 61.98 64.02 1c3h s VAL 169 Cb -0.10 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.08 1c3h s VAL 169 CO 0.24 -0.05 0.27 -0.47 0.00 0.00 0.00 175.10 175.09 1c3h s TYR 170 N 2.50 -0.16 0.00 5.22 6.04 -0.52 -2.06 117.35 128.37 1c3h s TYR 170 Ca 0.41 0.27 0.00 0.00 0.04 0.00 0.00 57.07 57.80 1c3h s TYR 170 Cb -0.16 0.07 0.00 0.00 -1.04 0.00 0.00 41.96 40.83 1c3h s TYR 170 CO 0.11 -0.33 0.00 -0.12 -1.54 0.00 0.00 175.55 173.67 1c3h n MET 171 N 1.60 0.00 -4.43 4.97 1.56 -1.26 -4.47 117.12 115.08 1c3h n MET 171 Ca -0.20 0.00 -0.25 0.00 -0.27 0.00 0.00 57.70 56.98 1c3h n MET 171 Cb 0.56 0.00 -0.09 0.00 2.15 0.00 0.00 33.22 35.84 1c3h n MET 171 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 1c3h s LYS 172 N 0.00 1.94 1.22 2.12 1.02 -1.26 -4.93 119.74 119.85 1c3h s LYS 172 Ca 0.00 -1.80 -0.16 0.00 0.02 0.00 0.00 55.97 54.02 1c3h s LYS 172 Cb 0.00 -1.84 0.26 0.00 -0.52 0.00 0.00 37.83 35.73 1c3h s LYS 172 CO 0.00 0.18 0.69 -0.25 -0.92 0.00 0.00 175.35 175.05 1c3h n ASP 173 N -0.84 -2.47 -3.80 2.83 10.43 -1.26 -4.21 116.55 117.22 1c3h n ASP 173 Ca -0.05 -0.32 -0.21 0.00 2.57 0.00 0.00 54.79 56.78 1c3h n ASP 173 Cb 0.62 -1.10 -0.17 0.00 1.84 0.00 0.00 41.12 42.31 1c3h n ASP 173 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1c3h s VAL 174 N -2.28 0.38 -0.22 2.53 1.01 0.11 -3.14 120.40 118.79 1c3h s VAL 174 Ca 0.63 0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.65 1c3h s VAL 174 Cb -0.19 -0.50 0.07 0.00 0.00 0.00 0.00 36.38 35.76 1c3h s VAL 174 CO 0.63 0.24 0.08 -0.75 0.00 0.00 0.00 175.10 175.29 1c3h s LYS 175 N 1.61 0.41 0.20 2.72 2.47 -1.26 0.26 119.74 126.15 1c3h s LYS 175 Ca -0.01 -0.45 0.11 0.00 -1.56 0.00 0.00 55.97 54.06 1c3h s LYS 175 Cb -0.13 -1.83 -0.04 0.00 -1.46 0.00 0.00 37.83 34.37 1c3h s LYS 175 CO -0.04 -0.78 -0.21 0.14 0.16 0.00 0.00 175.35 174.62 1c3h s VAL 176 N 1.95 2.22 0.01 4.02 -7.23 -0.81 0.29 120.40 120.85 1c3h s VAL 176 Ca 0.03 -2.08 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 1c3h s VAL 176 Cb -0.17 -2.08 -0.01 0.00 0.56 0.00 0.00 36.38 34.68 1c3h s VAL 176 CO -0.17 -0.24 -0.06 -0.55 -0.31 0.00 0.00 175.10 173.77 1c3h s SER 177 N -2.85 0.69 -0.18 4.85 0.15 0.39 -1.31 113.70 115.43 1c3h s SER 177 Ca 0.21 -0.28 -0.17 0.00 0.70 0.00 0.00 55.95 56.41 1c3h s SER 177 Cb -0.07 -0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.18 1c3h s SER 177 CO 0.10 -0.05 0.44 -0.22 1.20 0.00 0.00 173.24 174.70 1c3h s LEU 178 N -0.72 4.18 -0.02 3.45 2.96 -0.15 -1.75 118.68 126.62 1c3h s LEU 178 Ca -0.03 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.50 1c3h s LEU 178 Cb -0.05 -2.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 1c3h s LEU 178 CO 0.00 -0.08 -0.01 -0.36 -1.32 0.00 0.00 176.35 174.58 1c3h s PHE 179 N 1.23 3.06 -0.06 5.38 0.40 0.79 -0.90 117.98 127.87 1c3h s PHE 179 Ca 0.21 0.08 -0.01 0.00 -0.60 0.00 0.00 56.93 56.62 1c3h s PHE 179 Cb -0.15 -1.68 0.03 0.00 0.51 0.00 0.00 43.02 41.72 1c3h s PHE 179 CO 0.09 0.44 -0.01 0.21 0.70 0.00 0.00 175.22 176.65 1c3h s LYS 180 N -1.39 0.62 -1.24 0.44 2.20 0.10 -1.57 119.74 118.90 1c3h s LYS 180 Ca 0.18 0.07 -0.08 0.00 -0.36 0.00 0.00 55.97 55.77 1c3h s LYS 180 Cb -0.11 -0.89 -0.01 0.00 -1.51 0.00 0.00 37.83 35.30 1c3h s LYS 180 CO 0.08 -0.24 0.69 1.63 -0.36 0.00 0.00 175.35 177.15 1c3h n LYS 181 N 4.83 -3.00 -0.51 4.03 5.02 -0.39 -1.56 118.16 126.59 1c3h n LYS 181 Ca -0.12 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1c3h n LYS 181 Cb 0.50 -4.71 0.00 0.00 -0.02 0.00 0.00 35.03 30.80 1c3h n LYS 181 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1c3h n ASP 182 N -2.92 0.00 -4.58 4.39 8.00 -1.26 -4.95 116.55 115.24 1c3h n ASP 182 Ca -0.21 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 54.96 1c3h n ASP 182 Cb 0.64 -2.12 -0.11 0.00 -0.02 0.00 0.00 41.12 39.51 1c3h n ASP 182 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1c3h s LYS 183 N -0.80 2.70 0.08 -1.24 1.02 -0.60 -5.09 119.74 115.80 1c3h s LYS 183 Ca 0.00 -0.59 -0.30 0.00 0.02 0.00 0.00 55.97 55.10 1c3h s LYS 183 Cb 0.00 -2.56 -0.05 0.00 -0.52 0.00 0.00 37.83 34.70 1c3h s LYS 183 CO 0.00 0.65 1.05 0.00 -0.92 0.00 0.00 175.35 176.13 1c3h s ALA 184 N -0.84 3.28 -0.04 5.17 0.00 -1.26 -0.72 121.76 127.36 1c3h s ALA 184 Ca 0.13 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.77 1c3h s ALA 184 Cb -0.11 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 1c3h s ALA 184 CO 0.02 -0.22 -0.04 1.33 0.00 0.00 0.00 175.76 176.86 1c3h n VAL 185 N 3.28 0.22 -5.13 0.00 0.24 -0.08 -4.94 118.33 111.92 1c3h n VAL 185 Ca 0.05 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.34 61.95 1c3h n VAL 185 Cb 0.48 -0.82 -0.15 0.00 -1.47 0.00 0.00 33.84 31.88 1c3h n VAL 185 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1c3h s LEU 186 N -5.42 2.32 -0.08 1.34 0.20 -1.16 -4.97 118.68 110.91 1c3h s LEU 186 Ca -0.05 -0.38 0.02 0.00 0.69 0.00 0.00 54.13 54.41 1c3h s LEU 186 Cb 0.01 -1.43 0.01 0.00 -0.43 0.00 0.00 46.19 44.35 1c3h s LEU 186 CO 0.08 0.31 -0.15 -0.36 -0.29 0.00 0.00 176.35 175.94 1c3h s PHE 187 N -0.51 1.79 -0.12 5.38 0.40 -1.26 -0.98 117.98 122.68 1c3h s PHE 187 Ca 0.07 -0.72 -0.00 0.00 -0.60 0.00 0.00 56.93 55.67 1c3h s PHE 187 Cb -0.11 -1.28 0.02 0.00 0.51 0.00 0.00 43.02 42.17 1c3h s PHE 187 CO 0.01 -0.35 -0.09 0.99 0.70 0.00 0.00 175.22 176.48 1c3h s THR 188 N 0.67 1.16 -0.12 0.64 2.01 -0.43 -5.02 115.64 114.55 1c3h s THR 188 Ca -0.14 -0.39 0.02 0.00 0.31 0.00 0.00 61.69 61.49 1c3h s THR 188 Cb -0.16 -1.16 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 1c3h s THR 188 CO 0.04 0.38 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.70 1c3h s TYR 189 N 1.65 2.70 -0.11 4.92 5.04 -1.26 -1.93 117.35 128.37 1c3h s TYR 189 Ca 0.05 -0.82 -0.03 0.00 -2.44 0.00 0.00 57.07 53.82 1c3h s TYR 189 Cb -0.13 -1.78 0.05 0.00 0.35 0.00 0.00 41.96 40.44 1c3h s TYR 189 CO -0.09 -0.30 0.07 0.34 -1.34 0.00 0.00 175.55 174.23 1c3h s ASP 190 N 0.34 1.78 0.32 4.32 -1.08 0.14 -5.01 116.67 117.48 1c3h s ASP 190 Ca -0.15 -0.28 -0.24 0.00 -0.52 0.00 0.00 52.55 51.35 1c3h s ASP 190 Cb -0.17 -0.21 -0.10 0.00 -1.46 0.00 0.00 42.92 40.99 1c3h s ASP 190 CO 0.07 -0.30 0.91 -1.10 0.52 0.00 0.00 175.17 175.27 1c3h s GLN 191 N 2.14 4.50 -0.03 4.34 -0.21 -1.26 0.06 119.66 129.19 1c3h s GLN 191 Ca 0.03 1.23 -0.02 0.00 0.02 0.00 0.00 55.36 56.62 1c3h s GLN 191 Cb -0.14 -2.76 -0.04 0.00 1.00 0.00 0.00 33.01 31.07 1c3h s GLN 191 CO -0.06 0.27 0.09 -0.47 -2.12 0.00 0.00 175.29 173.01 1c3h s TYR 192 N -1.65 3.36 -0.04 0.91 5.04 -1.26 -4.91 117.35 118.80 1c3h s TYR 192 Ca 0.50 0.28 0.03 0.00 -2.44 0.00 0.00 57.07 55.44 1c3h s TYR 192 Cb -0.17 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.35 1c3h s TYR 192 CO 0.22 0.58 -0.14 -0.65 -1.34 0.00 0.00 175.55 174.23 1c3h s GLN 193 N -1.53 1.48 -0.07 4.97 -1.52 -1.26 -4.80 119.66 116.92 1c3h s GLN 193 Ca 0.21 -0.48 -0.33 0.00 -1.95 0.00 0.00 55.36 52.80 1c3h s GLN 193 Cb -0.12 -1.30 -0.16 0.00 -0.22 0.00 0.00 33.01 31.21 1c3h s GLN 193 CO 0.11 0.18 0.94 0.39 -0.25 0.00 0.00 175.29 176.66 1c3h n GLU 194 N 3.25 0.00 -2.15 2.91 -0.58 -1.26 0.11 120.64 122.91 1c3h n GLU 194 Ca -0.19 0.00 -0.20 0.00 -0.42 0.00 0.00 57.16 56.36 1c3h n GLU 194 Cb 0.53 -1.21 -0.03 0.00 -0.57 0.00 0.00 31.44 30.16 1c3h n GLU 194 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1c3h n LYS 195 N 1.57 -1.52 -3.27 3.49 5.02 -1.26 -4.94 118.16 117.25 1c3h n LYS 195 Ca 0.18 1.02 -0.25 0.00 -2.02 0.00 0.00 58.31 57.24 1c3h n LYS 195 Cb 0.04 -5.55 -0.08 0.00 -0.02 0.00 0.00 35.03 29.42 1c3h n LYS 195 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1c3h n ASN 196 N -1.61 0.09 -4.74 4.39 5.15 0.12 -5.10 115.26 113.56 1c3h n ASN 196 Ca -0.22 -2.62 -0.42 0.00 -0.60 0.00 0.00 54.58 50.72 1c3h n ASN 196 Cb 0.67 -0.61 -0.01 0.00 -0.53 0.00 0.00 39.78 39.29 1c3h n ASN 196 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1c3h n VAL 197 N 1.84 1.19 -4.62 3.44 0.31 -1.26 -4.18 118.33 115.05 1c3h n VAL 197 Ca 0.24 -0.30 -0.28 0.00 -0.01 0.00 0.00 64.34 63.99 1c3h n VAL 197 Cb 0.51 -1.87 -0.10 0.00 -0.91 0.00 0.00 33.84 31.47 1c3h n VAL 197 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1c3h s ASP 198 N 0.34 3.65 -0.12 4.52 1.01 -0.88 -4.97 116.67 120.22 1c3h s ASP 198 Ca 0.63 -1.44 0.01 0.00 0.71 0.00 0.00 52.55 52.45 1c3h s ASP 198 Cb -0.52 -0.12 0.02 0.00 1.01 0.00 0.00 42.92 43.31 1c3h s ASP 198 CO 0.51 -0.58 -0.13 -1.10 0.21 0.00 0.00 175.17 174.09 1c3h s GLN 199 N -3.77 2.03 0.04 8.23 -1.52 -1.26 -0.26 119.66 123.15 1c3h s GLN 199 Ca 0.29 -0.47 0.08 0.00 -1.95 0.00 0.00 55.36 53.31 1c3h s GLN 199 Cb 0.08 -1.87 -0.03 0.00 -0.22 0.00 0.00 33.01 30.97 1c3h s GLN 199 CO 0.14 -0.18 -0.22 0.00 -0.25 0.00 0.00 175.29 174.78 1c3h s ALA 200 N 1.37 2.44 0.18 6.09 0.00 0.51 -4.95 121.76 127.40 1c3h s ALA 200 Ca 0.01 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 50.64 1c3h s ALA 200 Cb -0.13 -0.63 0.00 0.00 0.00 0.00 0.00 23.12 22.35 1c3h s ALA 200 CO -0.07 0.55 0.36 -1.54 0.00 0.00 0.00 175.76 175.07 1c3h s SER 201 N -1.29 -0.05 0.14 0.00 1.04 -1.26 0.18 113.70 112.46 1c3h s SER 201 Ca 0.13 -0.79 -0.21 0.00 0.48 0.00 0.00 55.95 55.56 1c3h s SER 201 Cb -0.10 0.49 0.06 0.00 0.10 0.00 0.00 66.02 66.56 1c3h s SER 201 CO 0.03 -0.96 0.55 -0.83 0.98 0.00 0.00 173.24 173.01 1c3h s GLY 202 N -2.95 -0.52 -0.08 7.32 0.00 -0.50 -4.99 107.32 105.60 1c3h s GLY 202 Ca 0.16 0.39 -0.30 0.00 0.00 0.00 0.00 44.72 44.97 1c3h s GLY 202 CO 0.01 0.08 0.69 -1.35 0.00 0.00 0.00 173.10 172.52 1c3h s SER 203 N -2.67 -0.67 0.00 1.64 1.04 -1.26 -1.22 113.70 110.57 1c3h s SER 203 Ca 0.01 0.81 -0.28 0.00 0.48 0.00 0.00 55.95 56.97 1c3h s SER 203 Cb -0.00 0.66 0.08 0.00 0.10 0.00 0.00 66.02 66.86 1c3h s SER 203 CO -0.11 -0.56 0.72 0.54 0.98 0.00 0.00 173.24 174.81 1c3h s VAL 204 N -0.99 0.00 -0.16 5.02 0.11 -0.22 -4.98 120.40 119.17 1c3h s VAL 204 Ca -0.10 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.88 1c3h s VAL 204 Cb -0.01 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1c3h s VAL 204 CO 0.09 0.00 0.10 -0.76 -3.33 0.00 0.00 175.10 171.20 1c3h s LEU 205 N -1.80 4.06 -0.03 2.54 1.43 -1.26 -0.88 118.68 122.75 1c3h s LEU 205 Ca -0.04 0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1c3h s LEU 205 Cb -0.00 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.22 1c3h s LEU 205 CO -0.00 0.25 -0.01 -0.76 0.23 0.00 0.00 176.35 176.06 1c3h s LEU 206 N -0.09 1.30 0.08 1.79 1.43 0.12 -4.96 118.68 118.35 1c3h s LEU 206 Ca 0.08 -0.04 -0.28 0.00 -1.03 0.00 0.00 54.13 52.86 1c3h s LEU 206 Cb -0.12 -0.24 -0.06 0.00 0.03 0.00 0.00 46.19 45.80 1c3h s LEU 206 CO 0.01 -0.08 0.89 -2.28 0.23 0.00 0.00 176.35 175.12 1c3h s HIS 207 N 0.86 3.78 0.12 0.29 5.65 -1.26 -0.90 115.29 123.82 1c3h s HIS 207 Ca -0.09 1.67 0.07 0.00 0.25 0.00 0.00 55.06 56.96 1c3h s HIS 207 Cb -0.12 -2.97 -0.04 0.00 -1.18 0.00 0.00 32.58 28.27 1c3h s HIS 207 CO -0.01 0.22 -0.17 -0.51 -0.65 0.00 0.00 174.74 173.62 1c3h s LEU 208 N 0.02 2.37 0.23 8.88 1.43 0.49 -4.96 118.68 127.15 1c3h s LEU 208 Ca 0.44 -0.77 0.09 0.00 -1.03 0.00 0.00 54.13 52.86 1c3h s LEU 208 Cb -0.22 -0.71 -0.04 0.00 0.03 0.00 0.00 46.19 45.24 1c3h s LEU 208 CO 0.27 -0.05 -0.01 -1.61 0.23 0.00 0.00 176.35 175.18 1c3h s GLU 209 N -2.39 2.29 0.19 1.70 0.41 -1.26 -1.32 118.70 118.32 1c3h s GLU 209 Ca 0.09 -1.32 -0.33 0.00 -0.41 0.00 0.00 54.97 53.00 1c3h s GLU 209 Cb -0.07 -2.21 -0.14 0.00 -1.78 0.00 0.00 34.13 29.93 1c3h s GLU 209 CO 0.04 0.40 1.49 0.28 -0.49 0.00 0.00 175.26 176.98 1c3h n VAL 210 N -0.59 0.38 0.00 2.63 0.31 -1.26 -1.23 118.33 118.57 1c3h n VAL 210 Ca -0.08 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1c3h n VAL 210 Cb 0.58 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 1c3h n VAL 210 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1c3h n GLY 211 N 2.84 3.26 3.75 2.92 0.00 0.46 -5.00 105.19 113.43 1c3h n GLY 211 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1c3h n GLY 211 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1c3h s ASP 212 N -1.07 6.50 0.00 1.61 1.11 -0.37 -4.70 116.67 119.75 1c3h s ASP 212 Ca 0.00 2.82 0.02 0.00 0.18 0.00 0.00 52.55 55.57 1c3h s ASP 212 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.33 1c3h s ASP 212 CO 0.00 -0.82 -0.02 -1.10 1.18 0.00 0.00 175.17 174.41 1c3h s GLN 213 N -0.43 2.70 -0.00 8.23 -0.21 -1.26 -1.30 119.66 127.39 1c3h s GLN 213 Ca 0.62 -0.65 0.01 0.00 0.02 0.00 0.00 55.36 55.35 1c3h s GLN 213 Cb -0.45 -2.61 -0.00 0.00 1.00 0.00 0.00 33.01 30.95 1c3h s GLN 213 CO 0.46 0.61 -0.03 0.08 -2.12 0.00 0.00 175.29 174.29 1c3h s VAL 214 N -1.06 0.22 0.23 1.09 1.01 -0.77 -1.26 120.40 119.86 1c3h s VAL 214 Ca 0.19 -0.13 -0.22 0.00 0.00 0.00 0.00 61.98 61.82 1c3h s VAL 214 Cb -0.11 -0.20 0.04 0.00 0.00 0.00 0.00 36.38 36.11 1c3h s VAL 214 CO 0.10 0.06 0.77 -1.66 0.00 0.00 0.00 175.10 174.37 1c3h s TRP 215 N -0.07 -0.21 -0.03 5.22 -2.14 -0.61 -0.97 118.94 120.13 1c3h s TRP 215 Ca 0.01 -0.18 0.02 0.00 2.66 0.00 0.00 56.10 58.61 1c3h s TRP 215 Cb -0.01 0.67 -0.03 0.00 -3.10 0.00 0.00 33.47 31.00 1c3h s TRP 215 CO -0.00 -1.09 -0.07 -1.17 -2.66 0.00 0.00 176.95 171.96 1c3h s LEU 216 N -2.90 3.16 -0.06 -4.66 0.20 -1.26 -0.15 118.68 113.01 1c3h s LEU 216 Ca 0.10 -0.10 -0.18 0.00 0.69 0.00 0.00 54.13 54.64 1c3h s LEU 216 Cb -0.04 -1.76 0.04 0.00 -0.43 0.00 0.00 46.19 44.00 1c3h s LEU 216 CO 0.04 0.32 0.42 0.00 -0.29 0.00 0.00 176.35 176.83 1c3h s GLN 217 N -1.16 0.71 0.34 1.98 -2.07 -0.72 0.09 119.66 118.84 1c3h s GLN 217 Ca 0.15 0.11 -0.28 0.00 -1.82 0.00 0.00 55.36 53.52 1c3h s GLN 217 Cb -0.11 0.33 -0.10 0.00 -1.09 0.00 0.00 33.01 32.04 1c3h s GLN 217 CO 0.05 -0.18 1.22 0.14 -1.32 0.00 0.00 175.29 175.20 1c3h s VAL 218 N -0.90 3.00 0.00 3.63 -7.23 -1.26 -0.46 120.40 117.18 1c3h s VAL 218 Ca -0.10 0.96 0.00 0.00 -1.81 0.00 0.00 61.98 61.03 1c3h s VAL 218 Cb -0.04 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.31 1c3h s VAL 218 CO 0.05 0.19 0.00 0.00 -0.31 0.00 0.00 175.10 175.03 1c3h n TYR 219 N 0.67 0.00 -2.77 2.82 9.36 0.15 -2.12 117.16 125.27 1c3h n TYR 219 Ca 0.01 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 61.02 1c3h n TYR 219 Cb 0.44 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.14 1c3h n TYR 219 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1c3h n GLY 220 N 2.62 4.32 3.31 2.98 0.00 -1.25 -4.71 105.19 112.47 1c3h n GLY 220 Ca 0.00 -2.19 -0.46 0.00 0.00 0.00 0.00 46.02 43.37 1c3h n GLY 220 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1c3h s ASP 221 N -3.21 6.27 -0.44 1.61 2.15 -1.26 -4.59 116.67 117.20 1c3h s ASP 221 Ca 0.41 -1.94 0.00 0.00 0.43 0.00 0.00 52.55 51.46 1c3h s ASP 221 Cb 0.38 -2.21 0.00 0.00 -0.30 0.00 0.00 42.92 40.79 1c3h s ASP 221 CO -0.10 -0.81 0.00 0.61 -0.17 0.00 0.00 175.17 174.70 1c3h n GLY 222 N 5.04 0.40 1.85 2.66 0.00 -1.26 -1.01 105.19 112.87 1c3h n GLY 222 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.85 1c3h n GLY 222 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c3h n ASP 223 N 0.58 -2.42 -3.64 1.61 9.92 -1.26 -4.76 116.55 116.58 1c3h n ASP 223 Ca -0.04 0.17 -0.02 0.00 -0.53 0.00 0.00 54.79 54.37 1c3h n ASP 223 Cb 0.14 -2.25 -0.05 0.00 -0.64 0.00 0.00 41.12 38.32 1c3h n ASP 223 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1c3h s HIS 224 N -1.47 -1.23 0.32 1.24 3.76 -0.18 -4.91 115.29 112.81 1c3h s HIS 224 Ca 0.00 2.21 -0.11 0.00 -0.15 0.00 0.00 55.06 57.01 1c3h s HIS 224 Cb 0.00 0.74 -0.07 0.00 1.11 0.00 0.00 32.58 34.36 1c3h s HIS 224 CO 0.00 -0.61 0.68 -0.80 -0.85 0.00 0.00 174.74 173.16 1c3h s ASN 225 N 2.54 6.62 -0.27 1.40 -0.87 -1.25 -4.80 114.94 118.31 1c3h s ASN 225 Ca -0.07 1.08 0.09 0.00 -1.57 0.00 0.00 52.86 52.39 1c3h s ASN 225 Cb -0.10 -2.29 0.46 0.00 -0.02 0.00 0.00 41.25 39.29 1c3h s ASN 225 CO -0.19 -0.23 1.19 0.61 -2.57 0.00 0.00 177.10 175.91 1c3h n GLY 226 N -0.66 5.90 3.76 0.66 0.00 -1.19 -4.80 105.19 108.86 1c3h n GLY 226 Ca 0.02 -2.37 -0.39 0.00 0.00 0.00 0.00 46.02 43.28 1c3h n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c3h s LEU 227 N -3.53 4.55 0.11 0.99 1.43 -1.26 -1.44 118.68 119.53 1c3h s LEU 227 Ca 0.48 2.02 0.06 0.00 -1.03 0.00 0.00 54.13 55.65 1c3h s LEU 227 Cb 0.40 -3.71 -0.03 0.00 0.03 0.00 0.00 46.19 42.87 1c3h s LEU 227 CO 0.02 0.01 -0.15 -0.47 0.23 0.00 0.00 176.35 175.99 1c3h s TYR 228 N -1.27 1.42 -0.15 0.29 5.04 -0.32 -4.51 117.35 117.85 1c3h s TYR 228 Ca 0.44 -0.50 -0.30 0.00 -2.44 0.00 0.00 57.07 54.27 1c3h s TYR 228 Cb -0.26 -0.76 0.13 0.00 0.35 0.00 0.00 41.96 41.42 1c3h s TYR 228 CO 0.33 0.13 1.03 0.00 -1.34 0.00 0.00 175.55 175.71 1c3h s ALA 229 N -1.72 -1.95 0.00 3.97 0.00 -1.26 -4.06 121.76 116.75 1c3h s ALA 229 Ca 0.05 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1c3h s ALA 229 Cb -0.07 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.47 1c3h s ALA 229 CO 0.03 -0.38 0.00 -0.40 0.00 0.00 0.00 175.76 175.01 1c3h n ASP 230 N 0.50 0.00 0.29 0.00 5.68 -0.29 -4.92 116.55 117.80 1c3h n ASP 230 Ca -0.08 -0.04 0.15 0.00 -0.50 0.00 0.00 54.79 54.32 1c3h n ASP 230 Cb 0.59 0.00 0.88 0.00 -1.14 0.00 0.00 41.12 41.45 1c3h n ASP 230 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1c3h h ASN 231 N 0.00 0.00 -0.15 -1.12 4.21 -1.97 -3.11 115.58 113.44 1c3h h ASN 231 Ca 0.00 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.33 1c3h h ASN 231 Cb 0.00 0.00 -0.30 0.00 -1.12 0.00 0.00 38.32 36.90 1c3h h ASN 231 CO 0.00 0.02 -0.91 1.33 -1.29 0.00 0.00 177.43 176.58 1c3h n VAL 232 N -3.81 0.98 -3.69 2.81 0.24 -1.26 -5.03 118.33 108.57 1c3h n VAL 232 Ca -0.03 -2.18 -0.11 0.00 -2.04 0.00 0.00 64.34 59.98 1c3h n VAL 232 Cb 0.11 0.58 -0.10 0.00 -1.47 0.00 0.00 33.84 32.96 1c3h n VAL 232 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1c3h s ASN 233 N -2.78 -0.58 0.12 -1.34 0.01 -1.18 -5.15 114.94 104.05 1c3h s ASN 233 Ca 0.35 1.02 0.08 0.00 -0.71 0.00 0.00 52.86 53.60 1c3h s ASN 233 Cb 0.37 0.95 -0.04 0.00 0.41 0.00 0.00 41.25 42.95 1c3h s ASN 233 CO -0.10 -0.19 -0.18 -1.81 -1.51 0.00 0.00 177.10 173.30 1c3h s ASP 234 N 1.01 2.38 -0.12 -1.22 1.01 -1.26 -1.14 116.67 117.33 1c3h s ASP 234 Ca -0.06 -0.74 -0.02 0.00 0.71 0.00 0.00 52.55 52.44 1c3h s ASP 234 Cb -0.06 -0.12 0.04 0.00 1.01 0.00 0.00 42.92 43.79 1c3h s ASP 234 CO -0.09 -0.01 0.02 -0.44 0.21 0.00 0.00 175.17 174.86 1c3h s SER 235 N -2.14 2.08 0.27 0.27 0.01 -1.26 -3.90 113.70 109.03 1c3h s SER 235 Ca 0.08 -0.37 0.10 0.00 1.31 0.00 0.00 55.95 57.08 1c3h s SER 235 Cb -0.08 -0.49 -0.05 0.00 0.21 0.00 0.00 66.02 65.61 1c3h s SER 235 CO 0.04 -0.24 -0.17 0.42 0.41 0.00 0.00 173.24 173.70 1c3h s THR 236 N 1.94 2.24 -0.05 1.44 -4.23 0.10 -1.09 115.64 115.99 1c3h s THR 236 Ca 0.03 -2.33 -0.01 0.00 -1.18 0.00 0.00 61.69 58.20 1c3h s THR 236 Cb -0.14 -2.28 0.03 0.00 1.34 0.00 0.00 72.50 71.44 1c3h s THR 236 CO -0.06 -0.42 0.02 0.12 -0.54 0.00 0.00 174.62 173.74 1c3h s PHE 237 N -2.65 0.34 0.07 3.99 5.36 0.16 -1.35 117.98 123.89 1c3h s PHE 237 Ca 0.28 0.04 0.03 0.00 -0.96 0.00 0.00 56.93 56.33 1c3h s PHE 237 Cb -0.03 -0.57 -0.03 0.00 -0.34 0.00 0.00 43.02 42.05 1c3h s PHE 237 CO 0.13 -0.22 -0.10 0.99 -1.46 0.00 0.00 175.22 174.56 1c3h s THR 238 N 1.80 0.77 -0.09 0.12 2.01 0.20 -0.68 115.64 119.76 1c3h s THR 238 Ca 0.01 -1.34 -0.30 0.00 0.31 0.00 0.00 61.69 60.37 1c3h s THR 238 Cb -0.12 -0.98 0.08 0.00 0.01 0.00 0.00 72.50 71.48 1c3h s THR 238 CO -0.03 -0.43 0.72 -0.83 -0.69 0.00 0.00 174.62 173.35 1c3h s GLY 239 N -1.95 -0.54 -0.05 4.40 0.00 -0.60 -0.25 107.32 108.33 1c3h s GLY 239 Ca -0.03 1.50 -0.24 0.00 0.00 0.00 0.00 44.72 45.95 1c3h s GLY 239 CO 0.00 1.08 0.53 -0.11 0.00 0.00 0.00 173.10 174.61 1c3h s PHE 240 N -0.95 -0.48 -0.02 1.90 -0.12 -0.24 -1.54 117.98 116.54 1c3h s PHE 240 Ca -0.08 0.85 -0.30 0.00 -0.05 0.00 0.00 56.93 57.35 1c3h s PHE 240 Cb -0.01 0.28 -0.05 0.00 -0.63 0.00 0.00 43.02 42.61 1c3h s PHE 240 CO 0.08 -0.50 1.28 -1.17 -0.05 0.00 0.00 175.22 174.86 1c3h s LEU 241 N -1.10 4.31 -0.11 -1.99 2.96 0.26 -0.99 118.68 122.02 1c3h s LEU 241 Ca -0.11 1.96 -0.08 0.00 -0.22 0.00 0.00 54.13 55.69 1c3h s LEU 241 Cb -0.02 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.08 1c3h s LEU 241 CO 0.07 -0.62 -0.15 -0.11 -1.32 0.00 0.00 176.35 174.22 1c3h n LEU 242 N 5.08 1.32 -4.03 -0.68 0.00 0.21 -4.82 117.00 114.08 1c3h n LEU 242 Ca 0.12 0.47 -0.29 0.00 0.00 0.00 0.00 56.01 56.31 1c3h n LEU 242 Cb 0.45 -0.75 -0.17 0.00 0.00 0.00 0.00 43.42 42.95 1c3h n LEU 242 CO 0.57 -0.45 -0.49 -0.31 0.00 0.00 0.00 177.39 176.70 1c3h s TYR 243 N -1.99 2.03 0.52 1.96 2.02 -1.13 -4.98 117.35 115.78 1c3h s TYR 243 Ca -0.13 -1.04 -0.16 0.00 -0.37 0.00 0.00 57.07 55.37 1c3h s TYR 243 Cb 0.02 -1.49 -0.08 0.00 -0.40 0.00 0.00 41.96 40.01 1c3h s TYR 243 CO 0.19 -0.56 0.98 -3.38 -1.57 0.00 0.00 175.55 171.21 1c3h s HIS 244 N 1.25 3.47 0.33 2.71 -3.43 -1.26 -0.03 115.29 118.33 1c3h s HIS 244 Ca -0.01 1.45 -0.27 0.00 -0.80 0.00 0.00 55.06 55.43 1c3h s HIS 244 Cb -0.14 -2.78 -0.09 0.00 -1.43 0.00 0.00 32.58 28.14 1c3h s HIS 244 CO -0.06 -0.39 1.03 -0.51 -2.00 0.00 0.00 174.74 172.82 1c3h s ASP 245 N -3.15 7.11 -0.84 7.38 1.01 0.14 -4.86 116.67 123.45 1c3h s ASP 245 Ca 0.58 2.06 0.01 0.00 0.71 0.00 0.00 52.55 55.91 1c3h s ASP 245 Cb -0.10 -2.60 0.22 0.00 1.01 0.00 0.00 42.92 41.45 1c3h s ASP 245 CO 0.33 -0.24 0.78 0.35 0.21 0.00 0.00 175.17 176.60 1c3h n THR 246 N 0.59 2.83 1.51 -1.27 -2.24 -1.26 -4.97 114.28 109.46 1c3h n THR 246 Ca 0.02 -5.14 0.12 0.00 -2.27 0.00 0.00 64.05 56.78 1c3h n THR 246 Cb 0.48 -2.28 0.72 0.00 -2.10 0.00 0.00 70.33 67.14 1c3h n THR 246 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09