#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jxq n GLY 140 N 0.00 -1.87 0.14 3.03 0.00 -1.26 -4.65 105.19 100.58 1jxq n GLY 140 Ca 0.00 -1.47 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 1jxq n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxq h ALA 141 N -2.00 -0.23 -0.88 4.61 0.00 -2.05 -1.92 119.26 116.79 1jxq h ALA 141 Ca 0.00 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1jxq h ALA 141 Cb 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1jxq h ALA 141 CO 0.00 -0.42 0.57 1.25 0.00 0.00 0.00 179.25 180.65 1jxq h LEU 142 N -0.66 0.85 0.62 0.00 5.85 -1.98 0.66 115.31 120.65 1jxq h LEU 142 Ca -0.02 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1jxq h LEU 142 Cb 0.48 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.34 1jxq h LEU 142 CO 0.04 0.54 -0.30 -0.33 -0.34 0.00 0.00 178.44 178.05 1jxq h GLU 143 N 0.96 -0.80 -0.32 1.25 3.07 -1.89 0.34 114.58 117.20 1jxq h GLU 143 Ca 0.38 0.05 0.09 0.00 -0.50 0.00 0.00 59.36 59.39 1jxq h GLU 143 Cb 0.24 0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1jxq h GLU 143 CO -0.15 -0.49 0.23 1.03 -1.40 0.00 0.00 179.01 178.24 1jxq h SER 144 N -0.96 0.00 0.20 1.42 0.87 -0.96 -0.15 113.55 113.97 1jxq h SER 144 Ca -0.08 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 1jxq h SER 144 Cb 0.67 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1jxq h SER 144 CO 0.14 0.00 -0.10 0.25 -0.53 0.00 0.00 176.83 176.59 1jxq h LEU 145 N 0.00 -0.23 -1.87 2.23 6.46 -0.43 -1.92 115.31 119.55 1jxq h LEU 145 Ca 0.15 -0.29 0.11 0.00 -0.12 0.00 0.00 57.88 57.73 1jxq h LEU 145 Cb 0.62 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.58 1jxq h LEU 145 CO -0.00 0.30 0.34 0.03 -0.62 0.00 0.00 178.44 178.48 1jxq h ARG 146 N -0.89 0.14 0.02 1.25 3.08 0.20 -2.61 114.38 115.58 1jxq h ARG 146 Ca -0.03 -0.01 -0.22 0.00 0.07 0.00 0.00 59.98 59.80 1jxq h ARG 146 Cb 0.51 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 1jxq h ARG 146 CO 0.05 0.09 -0.96 0.78 -1.07 0.00 0.00 179.97 178.86 1jxq h GLY 147 N 0.15 0.27 -7.05 0.04 0.00 -0.96 -3.45 103.07 92.06 1jxq h GLY 147 Ca 0.23 -0.51 -0.56 0.00 0.00 0.00 0.00 47.33 46.48 1jxq h GLY 147 CO -0.03 0.45 1.41 0.21 0.00 0.00 0.00 176.54 178.58 1jxq s ASN 148 N -6.98 5.49 0.49 0.19 3.84 -0.73 -4.84 114.94 112.41 1jxq s ASN 148 Ca -0.03 1.44 0.33 0.00 0.21 0.00 0.00 52.86 54.81 1jxq s ASN 148 Cb 0.09 -2.52 1.66 0.00 -0.55 0.00 0.00 41.25 39.94 1jxq s ASN 148 CO 0.84 -2.00 2.01 0.00 -2.79 0.00 0.00 177.10 175.16 1jxq h ALA 149 N 14.72 1.00 0.00 1.71 0.00 -1.86 0.10 119.26 134.93 1jxq h ALA 149 Ca -0.35 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 1jxq h ALA 149 Cb 1.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1jxq h ALA 149 CO 1.03 0.00 -0.91 -0.44 0.00 0.00 0.00 179.25 178.94 1jxq h ASP 150 N 0.00 0.00 0.00 0.00 3.32 -1.95 -3.35 116.42 114.44 1jxq h ASP 150 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1jxq h ASP 150 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1jxq h ASP 150 CO 0.00 0.53 -0.93 0.18 -1.72 0.00 0.00 179.24 177.29 1jxq n LEU 151 N -3.07 0.59 -3.88 1.55 4.77 -0.58 -4.87 117.00 111.52 1jxq n LEU 151 Ca -0.03 -0.40 -0.11 0.00 -0.03 0.00 0.00 56.01 55.44 1jxq n LEU 151 Cb 0.78 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.75 1jxq n LEU 151 CO 0.42 0.15 -0.27 0.00 -1.33 0.00 0.00 177.39 176.36 1jxq s ALA 152 N -2.60 -0.16 0.01 -1.18 0.00 0.25 -1.29 121.76 116.79 1jxq s ALA 152 Ca 0.04 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.64 1jxq s ALA 152 Cb 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.18 1jxq s ALA 152 CO 0.65 -0.11 1.31 0.71 0.00 0.00 0.00 175.76 178.31 1jxq s TYR 153 N -0.67 3.10 -0.36 0.00 2.02 -0.27 -4.36 117.35 116.80 1jxq s TYR 153 Ca -0.08 1.03 -0.25 0.00 -0.37 0.00 0.00 57.07 57.41 1jxq s TYR 153 Cb -0.05 -3.55 0.01 0.00 -0.40 0.00 0.00 41.96 37.97 1jxq s TYR 153 CO 0.00 -1.90 0.86 0.42 -1.57 0.00 0.00 175.55 173.36 1jxq s ILE 154 N 1.94 4.65 -0.60 2.71 -1.09 -1.26 -4.61 121.20 122.94 1jxq s ILE 154 Ca 0.61 1.08 -0.09 0.00 -2.23 0.00 0.00 60.65 60.01 1jxq s ILE 154 Cb -0.30 -4.28 0.15 0.00 -1.58 0.00 0.00 42.46 36.46 1jxq s ILE 154 CO 0.26 -0.48 0.48 -0.76 -1.23 0.00 0.00 174.94 173.21 1jxq s LEU 155 N 3.30 5.87 -0.03 2.97 1.02 -1.26 -4.86 118.68 125.70 1jxq s LEU 155 Ca 0.35 -2.33 0.08 0.00 0.02 0.00 0.00 54.13 52.25 1jxq s LEU 155 Cb -0.13 -2.03 -0.12 0.00 0.02 0.00 0.00 46.19 43.94 1jxq s LEU 155 CO 0.18 -0.59 0.14 -1.54 0.02 0.00 0.00 176.35 174.55 1jxq n SER 156 N 4.35 3.17 -4.75 2.29 3.41 -1.26 -4.88 113.62 115.94 1jxq n SER 156 Ca 0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.31 1jxq n SER 156 Cb 0.41 1.19 0.11 0.00 -0.26 0.00 0.00 64.21 65.66 1jxq n SER 156 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1jxq s MET 156 N -2.46 1.95 -0.13 4.33 -1.94 -1.26 -5.06 119.30 114.74 1jxq s MET 156 Ca -0.03 1.07 -0.04 0.00 -1.71 0.00 0.00 55.69 54.98 1jxq s MET 156 Cb 0.04 -1.87 0.06 0.00 2.01 0.00 0.00 34.83 35.08 1jxq s MET 156 CO 0.33 -1.83 0.17 -2.00 -0.01 0.00 0.00 175.02 171.68 1jxq s GLU 161 N -4.91 0.08 1.00 2.03 2.56 -1.26 -3.83 118.70 114.38 1jxq s GLU 161 Ca 0.62 0.40 -0.14 0.00 0.00 0.00 0.00 54.97 55.84 1jxq s GLU 161 Cb -0.17 -0.70 0.19 0.00 2.00 0.00 0.00 34.13 35.45 1jxq s GLU 161 CO 0.56 -0.44 1.14 -1.25 -0.56 0.00 0.00 175.26 174.71 1jxq s PRO 162 N 2.29 0.37 0.10 4.30 0.04 -1.26 -5.10 135.00 135.74 1jxq s PRO 162 Ca 0.04 0.19 -0.18 0.00 0.04 0.00 0.00 61.00 61.09 1jxq s PRO 162 Cb -0.13 -1.76 -0.06 0.00 0.04 0.00 0.00 34.50 32.58 1jxq s PRO 162 CO -0.08 -2.70 1.56 0.00 0.04 0.00 0.00 177.00 175.82 1jxq n GLY 163 N -0.41 -1.12 3.87 0.00 0.00 -1.25 -1.28 105.19 105.00 1jxq n GLY 163 Ca -0.03 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 1jxq n GLY 163 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1jxq s HIS 164 N -3.00 3.42 -0.06 1.61 3.76 -1.25 -0.07 115.29 119.70 1jxq s HIS 164 Ca 0.00 0.94 0.00 0.00 -0.15 0.00 0.00 55.06 55.85 1jxq s HIS 164 Cb 0.00 -2.32 0.02 0.00 1.11 0.00 0.00 32.58 31.40 1jxq s HIS 164 CO 0.00 0.20 -0.03 0.00 -0.85 0.00 0.00 174.74 174.05 1jxq s LEU 166 N 1.40 2.28 -0.23 0.00 2.96 -0.05 -1.11 118.68 123.93 1jxq s LEU 166 Ca -0.03 -0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 53.24 1jxq s LEU 166 Cb -0.13 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1jxq s LEU 166 CO -0.03 0.01 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.38 1jxq s ILE 167 N 1.24 3.74 -0.26 6.68 1.01 -0.20 -0.10 121.20 133.30 1jxq s ILE 167 Ca 0.03 -0.37 -0.08 0.00 0.00 0.00 0.00 60.65 60.24 1jxq s ILE 167 Cb -0.14 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 1jxq s ILE 167 CO -0.09 0.40 0.09 -0.63 0.00 0.00 0.00 174.94 174.70 1jxq s ILE 168 N 1.44 4.38 -0.37 2.92 1.01 0.12 -0.48 121.20 130.21 1jxq s ILE 168 Ca 0.05 -0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.50 1jxq s ILE 168 Cb -0.15 -3.09 0.11 0.00 0.01 0.00 0.00 42.46 39.34 1jxq s ILE 168 CO -0.00 0.27 0.09 0.21 0.00 0.00 0.00 174.94 175.51 1jxq s ASN 169 N 1.61 4.58 -0.22 3.58 3.04 -0.43 0.09 114.94 127.19 1jxq s ASN 169 Ca 0.06 -2.25 -0.14 0.00 0.04 0.00 0.00 52.86 50.57 1jxq s ASN 169 Cb -0.16 -1.53 -0.04 0.00 -1.54 0.00 0.00 41.25 37.99 1jxq s ASN 169 CO 0.04 -0.36 0.30 0.20 -3.04 0.00 0.00 177.10 174.25 1jxq s ASN 170 N 0.78 6.29 0.00 -4.21 0.01 -0.26 -1.31 114.94 116.24 1jxq s ASN 170 Ca 0.12 0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.60 1jxq s ASN 170 Cb -0.20 -2.18 0.00 0.00 0.41 0.00 0.00 41.25 39.28 1jxq s ASN 170 CO -0.08 -0.03 0.00 0.52 -1.51 0.00 0.00 177.10 175.99 1jxq n VAL 171 N 4.40 0.00 -3.47 1.60 0.31 -1.26 -4.41 118.33 115.50 1jxq n VAL 171 Ca -0.11 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.79 1jxq n VAL 171 Cb 0.51 -0.49 -0.07 0.00 -0.91 0.00 0.00 33.84 32.89 1jxq n VAL 171 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1jxq s ASN 172 N -3.82 5.89 0.49 4.52 0.01 -1.26 -1.45 114.94 119.33 1jxq s ASN 172 Ca 0.00 -1.94 -0.04 0.00 -0.71 0.00 0.00 52.86 50.17 1jxq s ASN 172 Cb 0.00 -2.08 -0.02 0.00 0.41 0.00 0.00 41.25 39.56 1jxq s ASN 172 CO 0.00 -0.73 0.78 -0.36 -1.51 0.00 0.00 177.10 175.28 1jxq s PHE 173 N 1.34 3.45 0.98 2.20 0.40 -1.26 -4.90 117.98 120.18 1jxq s PHE 173 Ca 0.06 0.67 -0.12 0.00 -0.60 0.00 0.00 56.93 56.94 1jxq s PHE 173 Cb -0.26 -2.37 0.17 0.00 0.51 0.00 0.00 43.02 41.07 1jxq s PHE 173 CO -0.00 -0.38 1.09 0.00 0.70 0.00 0.00 175.22 176.63 1jxq h ARG 175 N -1.84 -0.15 -0.07 0.00 2.43 -1.94 -2.93 114.38 109.90 1jxq h ARG 175 Ca -0.53 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.67 1jxq h ARG 175 Cb 1.31 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.89 1jxq h ARG 175 CO 0.55 0.25 0.26 1.49 -1.51 0.00 0.00 179.97 181.02 1jxq h GLU 175 N -0.58 0.00 0.72 0.20 4.81 -1.97 -2.90 114.58 114.85 1jxq h GLU 175 Ca -0.02 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1jxq h GLU 175 Cb 0.46 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.85 1jxq h GLU 175 CO 0.03 0.00 -0.34 0.77 -0.73 0.00 0.00 179.01 178.73 1jxq h SER 175 N 0.00 -0.81 0.00 1.04 0.02 -1.85 -3.47 113.55 108.48 1jxq h SER 175 Ca 0.03 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1jxq h SER 175 Cb 0.56 0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1jxq h SER 175 CO -0.00 -0.54 0.00 0.61 -1.14 0.00 0.00 176.83 175.76 1jxq n GLY 175 N -1.32 0.74 3.72 -3.77 0.00 -1.10 -5.03 105.19 98.43 1jxq n GLY 175 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1jxq n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jxq s LEU 176 N 0.00 4.42 0.59 0.99 1.43 -1.26 -5.04 118.68 119.81 1jxq s LEU 176 Ca 0.00 1.70 -0.16 0.00 -1.03 0.00 0.00 54.13 54.64 1jxq s LEU 176 Cb 0.00 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 1jxq s LEU 176 CO 0.00 -0.17 1.05 -0.13 0.23 0.00 0.00 176.35 177.33 1jxq s ARG 177 N 0.56 3.38 -0.01 1.70 0.52 -1.26 -4.67 118.95 119.17 1jxq s ARG 177 Ca 0.49 1.18 -0.30 0.00 -0.52 0.00 0.00 55.73 56.58 1jxq s ARG 177 Cb -0.22 -2.04 -0.06 0.00 0.52 0.00 0.00 34.95 33.15 1jxq s ARG 177 CO 0.28 -0.76 1.50 0.99 0.02 0.00 0.00 175.30 177.34 1jxq s THR 178 N -2.47 3.57 -1.26 0.02 2.01 -1.26 -4.72 115.64 111.53 1jxq s THR 178 Ca 0.63 0.90 -0.14 0.00 0.31 0.00 0.00 61.69 63.40 1jxq s THR 178 Cb -0.15 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 1jxq s THR 178 CO 0.36 -0.03 2.31 0.54 -0.69 0.00 0.00 174.62 177.12 1jxq n ARG 179 N 5.91 2.62 -1.68 4.92 1.74 -0.52 -4.94 116.66 124.70 1jxq n ARG 179 Ca 0.15 -2.16 -0.46 0.00 -0.77 0.00 0.00 57.85 54.61 1jxq n ARG 179 Cb 0.43 -2.97 -0.04 0.00 -1.02 0.00 0.00 32.46 28.86 1jxq n ARG 179 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1jxq n THR 180 N 4.83 0.28 0.00 0.55 -1.04 -1.26 -2.39 114.28 115.25 1jxq n THR 180 Ca 0.56 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 1jxq n THR 180 Cb 0.32 -1.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.06 1jxq n THR 180 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1jxq n GLY 181 N 3.93 0.79 0.23 3.41 0.00 -1.24 -4.10 105.19 108.21 1jxq n GLY 181 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 1jxq n GLY 181 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1jxq h SER 182 N 0.00 0.00 -0.52 1.61 0.02 -1.81 -2.56 113.55 110.30 1jxq h SER 182 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1jxq h SER 182 Cb 0.00 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 1jxq h SER 182 CO 0.00 0.18 0.12 0.78 -1.14 0.00 0.00 176.83 176.77 1jxq h ASN 183 N 0.00 0.84 -0.08 3.07 4.21 -1.93 1.02 115.58 122.71 1jxq h ASN 183 Ca -0.00 -0.17 -0.12 0.00 1.21 0.00 0.00 56.30 57.22 1jxq h ASN 183 Cb 0.34 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.31 1jxq h ASN 183 CO 0.02 0.83 -0.34 0.16 -1.29 0.00 0.00 177.43 176.82 1jxq h ILE 184 N 0.85 1.29 0.28 2.81 3.07 -1.87 -1.21 117.51 122.72 1jxq h ILE 184 Ca 0.18 -1.46 -0.01 0.00 1.55 0.00 0.00 64.86 65.12 1jxq h ILE 184 Cb 0.34 1.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.35 1jxq h ILE 184 CO 0.00 0.46 -0.13 0.44 -1.05 0.00 0.00 178.15 177.87 1jxq h ASP 185 N 0.48 -0.32 -0.65 2.16 5.19 -1.26 -1.90 116.42 120.13 1jxq h ASP 185 Ca 0.05 -0.16 0.13 0.00 -0.62 0.00 0.00 57.03 56.44 1jxq h ASP 185 Cb 0.82 0.08 -0.12 0.00 0.18 0.00 0.00 39.33 40.28 1jxq h ASP 185 CO 0.07 -0.01 -0.18 0.00 -3.12 0.00 0.00 179.24 175.99 1jxq h GLU 187 N -0.02 0.83 -0.40 0.00 3.07 -1.20 -0.12 114.58 116.74 1jxq h GLU 187 Ca 0.31 -0.27 0.08 0.00 -0.50 0.00 0.00 59.36 58.98 1jxq h GLU 187 Cb 0.49 -0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 28.25 1jxq h GLU 187 CO -0.67 0.88 -0.06 0.87 -1.40 0.00 0.00 179.01 178.63 1jxq h LYS 188 N 0.69 0.04 -0.53 2.33 1.57 -0.46 0.95 116.57 121.16 1jxq h LYS 188 Ca 0.13 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1jxq h LYS 188 Cb 0.51 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1jxq h LYS 188 CO 0.02 0.03 0.01 -0.07 -0.57 0.00 0.00 179.45 178.88 1jxq h LEU 189 N 0.04 0.91 -0.09 2.94 3.38 -1.17 0.22 115.31 121.53 1jxq h LEU 189 Ca 0.20 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.91 1jxq h LEU 189 Cb 0.29 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 1jxq h LEU 189 CO -0.38 0.98 -0.21 -0.09 0.09 0.00 0.00 178.44 178.83 1jxq h ARG 190 N 0.80 -0.28 0.14 1.13 2.43 -0.06 0.11 114.38 118.65 1jxq h ARG 190 Ca 0.15 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1jxq h ARG 190 Cb 0.51 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1jxq h ARG 190 CO 0.02 -0.19 -0.11 -0.09 -1.51 0.00 0.00 179.97 178.09 1jxq h ARG 191 N -0.29 -0.26 -0.29 0.20 9.65 -0.65 -2.07 114.38 120.67 1jxq h ARG 191 Ca 0.09 0.02 0.07 0.00 -1.10 0.00 0.00 59.98 59.05 1jxq h ARG 191 Cb 0.42 0.06 -0.08 0.00 -1.39 0.00 0.00 29.97 28.98 1jxq h ARG 191 CO -0.26 -0.17 -0.23 -0.09 2.80 0.00 0.00 179.97 182.02 1jxq h ARG 192 N -0.27 -0.20 0.00 0.20 9.65 -0.06 0.44 114.38 124.14 1jxq h ARG 192 Ca -0.00 0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1jxq h ARG 192 Cb 0.24 0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1jxq h ARG 192 CO -0.02 -0.14 -0.02 0.74 2.80 0.00 0.00 179.97 183.34 1jxq h PHE 193 N -0.21 0.00 -0.12 2.20 -1.00 -0.78 -0.72 116.94 116.31 1jxq h PHE 193 Ca 0.15 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.82 1jxq h PHE 193 Cb 0.45 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.01 1jxq h PHE 193 CO -0.41 0.02 -0.36 0.77 -1.61 0.00 0.00 178.31 176.72 1jxq h SER 194 N 0.00 0.52 -0.84 2.17 0.02 -0.42 0.65 113.55 115.65 1jxq h SER 194 Ca -0.00 -0.60 0.11 0.00 -0.84 0.00 0.00 61.79 60.46 1jxq h SER 194 Cb 0.60 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.93 1jxq h SER 194 CO 0.00 1.03 0.55 -1.28 -1.14 0.00 0.00 176.83 176.00 1jxq h SER 195 N 0.04 0.68 -0.35 3.07 0.87 0.88 -0.25 113.55 118.49 1jxq h SER 195 Ca -0.01 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.45 1jxq h SER 195 Cb 0.98 -0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 62.76 1jxq h SER 195 CO 0.08 0.38 0.15 0.18 -0.53 0.00 0.00 176.83 177.09 1jxq n LEU 196 N -4.53 3.93 -1.87 2.23 4.77 -0.38 -3.57 117.00 117.58 1jxq n LEU 196 Ca 0.15 -2.03 -0.16 0.00 -0.03 0.00 0.00 56.01 53.94 1jxq n LEU 196 Cb 0.37 -0.62 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 1jxq n LEU 196 CO 0.31 0.59 -0.21 1.41 -1.33 0.00 0.00 177.39 178.16 1jxq n HIS 197 N 0.01 -0.78 -4.03 -1.77 8.25 -0.10 -4.35 115.22 112.44 1jxq n HIS 197 Ca 0.20 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.41 1jxq n HIS 197 Cb 0.86 -3.34 -0.04 0.00 1.12 0.00 0.00 29.99 28.58 1jxq n HIS 197 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1jxq s PHE 198 N -2.82 3.29 -0.66 4.41 0.40 0.20 0.31 117.98 123.11 1jxq s PHE 198 Ca 0.00 0.01 -0.20 0.00 -0.60 0.00 0.00 56.93 56.14 1jxq s PHE 198 Cb -0.00 -1.55 0.10 0.00 0.51 0.00 0.00 43.02 42.09 1jxq s PHE 198 CO 0.00 0.51 0.82 -1.64 0.70 0.00 0.00 175.22 175.61 1jxq s MET 199 N -3.38 3.14 0.15 0.44 -1.94 0.90 -4.34 119.30 114.27 1jxq s MET 199 Ca 0.33 -1.30 -0.27 0.00 -1.71 0.00 0.00 55.69 52.74 1jxq s MET 199 Cb -0.10 -4.33 -0.07 0.00 2.01 0.00 0.00 34.83 32.33 1jxq s MET 199 CO 0.26 -1.63 0.84 0.08 -0.01 0.00 0.00 175.02 174.56 1jxq s VAL 200 N 2.92 4.39 -0.12 -6.03 1.01 -1.26 -1.35 120.40 119.96 1jxq s VAL 200 Ca 0.17 1.83 -0.02 0.00 0.00 0.00 0.00 61.98 63.95 1jxq s VAL 200 Cb -0.20 -4.20 0.04 0.00 0.00 0.00 0.00 36.38 32.02 1jxq s VAL 200 CO 0.05 0.46 0.02 -0.70 0.00 0.00 0.00 175.10 174.93 1jxq s GLU 201 N -0.79 0.53 -0.17 2.72 2.12 -0.27 -4.95 118.70 117.90 1jxq s GLU 201 Ca 0.39 -0.05 -0.10 0.00 0.36 0.00 0.00 54.97 55.56 1jxq s GLU 201 Cb -0.23 -1.37 -0.05 0.00 0.26 0.00 0.00 34.13 32.74 1jxq s GLU 201 CO 0.27 -0.44 0.18 0.08 -0.54 0.00 0.00 175.26 174.81 1jxq s VAL 202 N 1.97 5.39 -0.13 3.70 1.01 -1.26 -1.04 120.40 130.04 1jxq s VAL 202 Ca 0.03 0.29 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 1jxq s VAL 202 Cb -0.14 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1jxq s VAL 202 CO -0.06 0.47 -0.07 -0.54 0.00 0.00 0.00 175.10 174.90 1jxq s LYS 203 N 0.03 1.48 0.26 2.72 1.02 0.37 -4.96 119.74 120.66 1jxq s LYS 203 Ca 0.12 -0.33 0.04 0.00 0.02 0.00 0.00 55.97 55.82 1jxq s LYS 203 Cb -0.12 -1.72 -0.03 0.00 -0.52 0.00 0.00 37.83 35.44 1jxq s LYS 203 CO 0.01 -0.32 0.39 0.20 -0.92 0.00 0.00 175.35 174.71 1jxq s GLY 204 N 1.69 1.25 -0.16 -3.33 0.00 -1.26 -1.31 107.32 104.20 1jxq s GLY 204 Ca 0.04 -1.20 -0.14 0.00 0.00 0.00 0.00 44.72 43.41 1jxq s GLY 204 CO -0.08 -1.20 0.24 1.22 0.00 0.00 0.00 173.10 173.28 1jxq n ASP 205 N -1.48 -4.04 -4.25 1.64 8.00 -0.42 -4.91 116.55 111.08 1jxq n ASP 205 Ca -0.08 0.07 -0.31 0.00 0.71 0.00 0.00 54.79 55.18 1jxq n ASP 205 Cb 0.57 -1.07 -0.16 0.00 -0.02 0.00 0.00 41.12 40.44 1jxq n ASP 205 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1jxq s LEU 206 N -1.20 2.05 0.72 0.64 1.43 -1.26 -4.92 118.68 116.14 1jxq s LEU 206 Ca 0.14 -0.49 -0.13 0.00 -1.03 0.00 0.00 54.13 52.62 1jxq s LEU 206 Cb -0.01 -1.31 0.03 0.00 0.03 0.00 0.00 46.19 44.93 1jxq s LEU 206 CO 0.32 0.24 1.12 0.42 0.23 0.00 0.00 176.35 178.68 1jxq s THR 207 N -0.17 3.02 0.29 5.49 -4.23 -1.26 0.38 115.64 119.15 1jxq s THR 207 Ca -0.02 0.42 0.02 0.00 -1.18 0.00 0.00 61.69 60.93 1jxq s THR 207 Cb -0.13 -2.90 0.30 0.00 1.34 0.00 0.00 72.50 71.11 1jxq s THR 207 CO 0.03 -0.34 1.66 0.00 -0.54 0.00 0.00 174.62 175.43 1jxq h ALA 208 N -0.50 1.30 -0.54 3.99 0.00 -1.81 0.31 119.26 122.01 1jxq h ALA 208 Ca -0.46 0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1jxq h ALA 208 Cb 1.25 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 1jxq h ALA 208 CO 0.52 -0.43 0.34 -0.22 0.00 0.00 0.00 179.25 179.45 1jxq h LYS 209 N 0.26 0.65 -0.15 0.00 3.64 -1.93 -2.14 116.57 116.90 1jxq h LYS 209 Ca 0.55 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.79 1jxq h LYS 209 Cb 1.09 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1jxq h LYS 209 CO -0.61 0.43 -0.35 0.87 -2.27 0.00 0.00 179.45 177.52 1jxq h LYS 210 N 0.67 0.32 0.66 1.90 1.57 -1.34 -1.86 116.57 118.50 1jxq h LYS 210 Ca 0.21 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1jxq h LYS 210 Cb -0.02 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1jxq h LYS 210 CO -0.07 0.63 -0.50 0.52 -0.57 0.00 0.00 179.45 179.46 1jxq h MET 211 N 0.27 -1.08 -0.83 3.15 2.86 -0.55 0.28 114.93 119.04 1jxq h MET 211 Ca 0.03 0.07 0.15 0.00 -2.06 0.00 0.00 59.70 57.90 1jxq h MET 211 Cb 0.75 0.24 -0.10 0.00 0.06 0.00 0.00 31.60 32.56 1jxq h MET 211 CO 0.06 -0.72 0.40 0.28 1.06 0.00 0.00 176.91 177.99 1jxq h VAL 212 N -1.12 0.68 0.18 -2.22 2.07 -1.32 0.23 116.25 114.75 1jxq h VAL 212 Ca -0.09 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1jxq h VAL 212 Cb 0.93 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1jxq h VAL 212 CO 0.03 0.10 -0.15 -0.07 0.02 0.00 0.00 177.57 177.50 1jxq h LEU 213 N 0.55 -0.39 -0.61 2.57 3.38 -0.64 0.42 115.31 120.59 1jxq h LEU 213 Ca 0.46 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.55 1jxq h LEU 213 Cb 0.70 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.52 1jxq h LEU 213 CO -0.39 -0.23 0.27 0.00 0.09 0.00 0.00 178.44 178.17 1jxq h ALA 214 N 0.45 0.80 -0.65 1.53 0.00 0.90 -0.38 119.26 121.91 1jxq h ALA 214 Ca -0.00 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1jxq h ALA 214 Cb 0.31 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1jxq h ALA 214 CO -0.02 -0.13 0.09 -0.07 0.00 0.00 0.00 179.25 179.12 1jxq h LEU 215 N 0.48 1.05 -1.01 0.00 3.38 -0.56 -1.89 115.31 116.75 1jxq h LEU 215 Ca 0.30 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1jxq h LEU 215 Cb 0.31 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1jxq h LEU 215 CO -0.26 1.05 0.36 -0.07 0.09 0.00 0.00 178.44 179.61 1jxq h LEU 216 N 1.02 0.96 -0.29 1.67 3.38 0.11 -2.33 115.31 119.83 1jxq h LEU 216 Ca 0.20 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1jxq h LEU 216 Cb 0.46 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1jxq h LEU 216 CO 0.02 0.81 -0.15 -0.08 0.09 0.00 0.00 178.44 179.13 1jxq h GLU 217 N 1.06 0.60 -0.44 1.13 4.81 -0.89 -1.15 114.58 119.70 1jxq h GLU 217 Ca 0.26 -0.27 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1jxq h GLU 217 Cb 0.10 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.40 1jxq h GLU 217 CO -0.03 0.84 0.06 1.25 -0.73 0.00 0.00 179.01 180.40 1jxq h LEU 218 N 0.35 -0.04 -0.84 1.64 5.85 -1.01 -0.98 115.31 120.27 1jxq h LEU 218 Ca 0.06 0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.74 1jxq h LEU 218 Cb 0.67 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1jxq h LEU 218 CO 0.04 0.01 -0.54 0.00 -0.34 0.00 0.00 178.44 177.61 1jxq h ALA 219 N 1.35 1.02 0.00 1.25 0.00 -1.39 -2.72 119.26 118.78 1jxq h ALA 219 Ca 0.22 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1jxq h ALA 219 Cb 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1jxq h ALA 219 CO -0.31 0.68 0.00 -2.13 0.00 0.00 0.00 179.25 177.50 1jxq n ARG 220 N -3.90 0.02 -2.10 0.00 0.63 -0.41 -4.70 116.66 106.18 1jxq n ARG 220 Ca -0.02 0.37 -0.28 0.00 -0.92 0.00 0.00 57.85 57.01 1jxq n ARG 220 Cb 0.56 -1.54 0.12 0.00 0.45 0.00 0.00 32.46 32.05 1jxq n ARG 220 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 1jxq s GLN 221 N -3.04 1.51 -0.52 -0.14 -0.21 -0.95 -5.03 119.66 111.27 1jxq s GLN 221 Ca 0.04 -0.37 -0.15 0.00 0.02 0.00 0.00 55.36 54.90 1jxq s GLN 221 Cb 0.06 -2.03 0.12 0.00 1.00 0.00 0.00 33.01 32.15 1jxq s GLN 221 CO 0.17 -1.77 0.46 0.34 -2.12 0.00 0.00 175.29 172.37 1jxq s ASP 222 N -4.70 6.10 -0.19 5.90 3.68 -1.26 -4.85 116.67 121.35 1jxq s ASP 222 Ca 0.66 -1.76 0.09 0.00 2.13 0.00 0.00 52.55 53.67 1jxq s ASP 222 Cb -0.07 -2.17 0.57 0.00 -1.45 0.00 0.00 42.92 39.80 1jxq s ASP 222 CO 0.48 -0.81 1.43 1.41 0.13 0.00 0.00 175.17 177.82 1jxq n HIS 224 N 5.19 1.60 -0.29 -5.34 8.25 -1.26 -4.56 115.22 118.80 1jxq n HIS 224 Ca -0.13 -0.66 0.05 0.00 -0.26 0.00 0.00 57.72 56.72 1jxq n HIS 224 Cb 0.40 -0.45 0.19 0.00 1.12 0.00 0.00 29.99 31.26 1jxq n HIS 224 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1jxq h GLY 225 N 3.96 1.32 -2.90 -1.41 0.00 -1.91 -0.70 103.07 101.43 1jxq h GLY 225 Ca 0.07 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 1jxq h GLY 225 CO 0.42 0.06 0.05 0.00 0.00 0.00 0.00 176.54 177.07 1jxq n ALA 226 N -2.40 3.63 -2.45 3.60 0.00 -1.26 -4.90 120.51 116.73 1jxq n ALA 226 Ca 0.15 -1.45 -0.25 0.00 0.00 0.00 0.00 53.44 51.89 1jxq n ALA 226 Cb 0.34 -1.12 -0.11 0.00 0.00 0.00 0.00 19.45 18.57 1jxq n ALA 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jxq s LEU 227 N -2.02 2.54 -0.00 0.00 1.43 -0.27 -4.75 118.68 115.61 1jxq s LEU 227 Ca 0.39 -0.97 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 1jxq s LEU 227 Cb 0.30 -1.12 -0.10 0.00 0.03 0.00 0.00 46.19 45.30 1jxq s LEU 227 CO 0.11 0.07 0.29 0.47 0.23 0.00 0.00 176.35 177.51 1jxq n ASP 228 N -0.31 1.34 -3.73 2.29 8.00 -0.40 -5.00 116.55 118.74 1jxq n ASP 228 Ca -0.08 -0.45 -0.10 0.00 0.71 0.00 0.00 54.79 54.88 1jxq n ASP 228 Cb 0.59 1.14 -0.04 0.00 -0.02 0.00 0.00 41.12 42.78 1jxq n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jxq s VAL 231 N 1.44 2.89 -0.09 0.00 1.01 -0.51 0.34 120.40 125.48 1jxq s VAL 231 Ca -0.06 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.16 1jxq s VAL 231 Cb -0.12 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.14 1jxq s VAL 231 CO -0.05 0.57 -0.10 -0.69 0.00 0.00 0.00 175.10 174.84 1jxq s VAL 232 N -0.37 1.07 -0.05 2.92 1.01 0.97 -0.88 120.40 125.08 1jxq s VAL 232 Ca 0.04 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.70 1jxq s VAL 232 Cb -0.12 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1jxq s VAL 232 CO 0.02 0.36 -0.22 -0.69 0.00 0.00 0.00 175.10 174.58 1jxq s VAL 233 N 1.28 2.39 -0.10 2.92 1.01 0.85 -0.75 120.40 128.00 1jxq s VAL 233 Ca -0.03 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1jxq s VAL 233 Cb -0.14 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.39 1jxq s VAL 233 CO -0.04 0.57 -0.01 -0.63 0.00 0.00 0.00 175.10 175.00 1jxq s ILE 234 N -0.37 0.56 -0.25 2.22 1.01 -0.78 0.13 121.20 123.72 1jxq s ILE 234 Ca 0.03 -0.10 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 1jxq s ILE 234 Cb -0.12 -0.75 0.00 0.00 0.01 0.00 0.00 42.46 41.60 1jxq s ILE 234 CO 0.02 0.21 -0.00 -0.76 0.00 0.00 0.00 174.94 174.40 1jxq s LEU 235 N 1.89 3.28 0.00 2.97 1.43 0.11 -1.67 118.68 126.69 1jxq s LEU 235 Ca 0.04 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1jxq s LEU 235 Cb -0.13 -1.78 0.00 0.00 0.03 0.00 0.00 46.19 44.31 1jxq s LEU 235 CO -0.06 -0.09 0.00 -0.24 0.23 0.00 0.00 176.35 176.18 1jxq n SER 236 N 4.80 0.00 -4.85 2.29 2.88 -0.94 -1.10 113.62 116.70 1jxq n SER 236 Ca -0.17 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.07 1jxq n SER 236 Cb 0.49 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.00 1jxq n SER 236 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1jxq s HIS 237 N -2.12 3.27 0.22 0.66 3.76 -1.26 -3.88 115.29 115.94 1jxq s HIS 237 Ca 0.00 1.18 -0.11 0.00 -0.15 0.00 0.00 55.06 55.98 1jxq s HIS 237 Cb 0.00 -2.97 0.04 0.00 1.11 0.00 0.00 32.58 30.77 1jxq s HIS 237 CO 0.00 -1.19 0.58 0.41 -0.85 0.00 0.00 174.74 173.69 1jxq n GLY 238 N -2.61 1.16 2.97 -2.22 0.00 -1.25 -1.58 105.19 101.66 1jxq n GLY 238 Ca 0.07 -1.14 0.01 0.00 0.00 0.00 0.00 46.02 44.96 1jxq n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxq s GLN 240 N -2.02 4.13 -0.06 0.00 -0.21 -1.21 0.05 119.66 120.33 1jxq s GLN 240 Ca 0.21 1.46 -0.09 0.00 0.02 0.00 0.00 55.36 56.97 1jxq s GLN 240 Cb -0.01 -2.47 0.02 0.00 1.00 0.00 0.00 33.01 31.55 1jxq s GLN 240 CO 0.01 -0.16 0.22 0.00 -2.12 0.00 0.00 175.29 173.24 1jxq s ALA 240 N -1.73 -0.54 0.20 6.09 0.00 -1.26 -4.74 121.76 119.77 1jxq s ALA 240 Ca 0.59 0.47 -0.31 0.00 0.00 0.00 0.00 51.96 52.71 1jxq s ALA 240 Cb -0.20 -0.24 -0.10 0.00 0.00 0.00 0.00 23.12 22.57 1jxq s ALA 240 CO 0.25 -0.14 1.57 0.45 0.00 0.00 0.00 175.76 177.89 1jxq s SER 240 N -0.31 6.55 0.14 0.00 0.15 -1.26 -4.26 113.70 114.71 1jxq s SER 240 Ca -0.04 2.69 -0.01 0.00 0.70 0.00 0.00 55.95 59.28 1jxq s SER 240 Cb -0.03 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.64 1jxq s SER 240 CO 0.01 -0.83 0.08 -1.38 1.20 0.00 0.00 173.24 172.32 1jxq s HIS 240 N 0.86 0.87 -0.18 3.44 -3.43 -1.26 -5.01 115.29 110.57 1jxq s HIS 240 Ca 0.68 -1.23 0.04 0.00 -0.80 0.00 0.00 55.06 53.75 1jxq s HIS 240 Cb -0.45 -0.47 -0.13 0.00 -1.43 0.00 0.00 32.58 30.11 1jxq s HIS 240 CO 0.35 -0.55 -0.13 1.28 -2.00 0.00 0.00 174.74 173.69 1jxq n LEU 240 N -0.12 2.42 0.00 5.38 4.77 -1.26 -4.89 117.00 123.30 1jxq n LEU 240 Ca -0.05 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1jxq n LEU 240 Cb 0.64 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1jxq n LEU 240 CO 0.31 0.73 -0.25 1.67 -1.33 0.00 0.00 177.39 178.52 1jxq n GLN 240 N -2.95 0.61 -4.06 3.23 -0.06 -1.26 -5.05 117.38 107.84 1jxq n GLN 240 Ca -0.32 0.00 -0.32 0.00 -2.00 0.00 0.00 57.00 54.37 1jxq n GLN 240 Cb 0.88 -0.75 -0.15 0.00 -4.06 0.00 0.00 30.24 26.16 1jxq n GLN 240 CO 0.00 0.00 0.00 -0.06 -0.20 0.00 0.00 177.06 176.80 1jxq s PHE 240 N -1.50 3.01 1.03 3.69 0.40 -1.26 -5.10 117.98 118.25 1jxq s PHE 240 Ca 0.00 -2.06 -0.12 0.00 -0.60 0.00 0.00 56.93 54.15 1jxq s PHE 240 Cb 0.00 -1.87 0.21 0.00 0.51 0.00 0.00 43.02 41.87 1jxq s PHE 240 CO 0.00 -0.84 1.08 -1.25 0.70 0.00 0.00 175.22 174.90 1jxq s PRO 240 N 1.19 0.15 0.24 0.24 0.04 -1.26 -3.94 135.00 131.66 1jxq s PRO 240 Ca -0.05 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.01 1jxq s PRO 240 Cb -0.18 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1jxq s PRO 240 CO -0.07 -3.06 0.00 0.41 0.04 0.00 0.00 177.00 174.32 1jxq n GLY 241 N 0.12 -2.28 3.46 0.56 0.00 -1.26 -4.61 105.19 101.19 1jxq n GLY 241 Ca 0.06 -1.31 -0.09 0.00 0.00 0.00 0.00 46.02 44.68 1jxq n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxq s ALA 242 N -2.60 -0.34 -0.02 4.61 0.00 0.11 -2.44 121.76 121.08 1jxq s ALA 242 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.30 1jxq s ALA 242 Cb 0.00 0.92 -0.00 0.00 0.00 0.00 0.00 23.12 24.04 1jxq s ALA 242 CO 0.00 -0.75 -0.10 0.14 0.00 0.00 0.00 175.76 175.05 1jxq s VAL 243 N -3.95 0.85 0.05 0.00 -7.23 0.17 -1.69 120.40 108.59 1jxq s VAL 243 Ca 0.16 -0.42 -0.26 0.00 -1.81 0.00 0.00 61.98 59.65 1jxq s VAL 243 Cb 0.01 -0.73 -0.05 0.00 0.56 0.00 0.00 36.38 36.16 1jxq s VAL 243 CO 0.02 0.25 0.82 -0.31 -0.31 0.00 0.00 175.10 175.57 1jxq s TYR 244 N -0.01 3.74 0.75 2.82 1.51 -0.62 -0.17 117.35 125.38 1jxq s TYR 244 Ca -0.00 1.55 -0.12 0.00 -1.01 0.00 0.00 57.07 57.49 1jxq s TYR 244 Cb -0.07 -2.89 0.04 0.00 -0.11 0.00 0.00 41.96 38.93 1jxq s TYR 244 CO 0.00 0.23 1.11 0.20 -1.11 0.00 0.00 175.55 175.98 1jxq s GLY 245 N 0.07 1.62 0.54 0.71 0.00 0.15 -4.59 107.32 105.82 1jxq s GLY 245 Ca 0.41 -0.36 0.22 0.00 0.00 0.00 0.00 44.72 44.99 1jxq s GLY 245 CO 0.25 0.05 2.12 0.00 0.00 0.00 0.00 173.10 175.51 1jxq h THR 246 N -0.86 0.80 0.00 0.90 1.03 -0.34 -0.14 112.91 114.29 1jxq h THR 246 Ca -0.46 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.94 1jxq h THR 246 Cb 1.27 0.91 0.00 0.00 -1.07 0.00 0.00 68.15 69.26 1jxq h THR 246 CO 0.63 0.00 0.00 -0.90 -0.01 0.00 0.00 175.52 175.24 1jxq n ASP 247 N -4.31 0.00 0.00 0.00 3.85 -1.26 -1.91 116.55 112.92 1jxq n ASP 247 Ca 0.01 -0.86 0.00 0.00 -0.71 0.00 0.00 54.79 53.23 1jxq n ASP 247 Cb 0.25 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.02 1jxq n ASP 247 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jxq n GLY 248 N 0.39 1.47 3.82 6.12 0.00 -0.07 -4.86 105.19 112.06 1jxq n GLY 248 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1jxq n GLY 248 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxq s PRO 255 N -1.60 3.93 -0.09 0.00 0.04 -1.26 0.31 135.00 136.33 1jxq s PRO 255 Ca 0.36 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.97 1jxq s PRO 255 Cb -0.18 -2.46 0.02 0.00 0.04 0.00 0.00 34.50 31.92 1jxq s PRO 255 CO 0.20 0.16 -0.07 0.08 0.04 0.00 0.00 177.00 177.41 1jxq s VAL 256 N -2.01 0.92 0.26 -0.36 1.01 0.77 -4.91 120.40 116.09 1jxq s VAL 256 Ca 0.53 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1jxq s VAL 256 Cb -0.10 -0.94 -0.09 0.00 0.00 0.00 0.00 36.38 35.25 1jxq s VAL 256 CO 0.20 0.34 1.01 -0.94 0.00 0.00 0.00 175.10 175.70 1jxq s SER 257 N 1.48 7.47 0.27 3.32 1.04 -1.26 0.42 113.70 126.44 1jxq s SER 257 Ca -0.00 2.08 -0.02 0.00 0.48 0.00 0.00 55.95 58.48 1jxq s SER 257 Cb -0.13 -2.62 0.41 0.00 0.10 0.00 0.00 66.02 63.78 1jxq s SER 257 CO -0.05 0.02 1.90 0.58 0.98 0.00 0.00 173.24 176.67 1jxq h VAL 258 N 3.09 1.13 -0.09 5.02 2.07 -1.73 -0.35 116.25 125.39 1jxq h VAL 258 Ca -0.46 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1jxq h VAL 258 Cb 1.20 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1jxq h VAL 258 CO 0.67 0.22 -0.06 -0.08 0.02 0.00 0.00 177.57 178.34 1jxq h GLU 259 N 1.19 0.13 -0.07 1.57 4.81 -1.78 0.09 114.58 120.52 1jxq h GLU 259 Ca 0.40 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.48 1jxq h GLU 259 Cb 0.09 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.45 1jxq h GLU 259 CO -0.14 0.20 -0.48 -0.22 -0.73 0.00 0.00 179.01 177.64 1jxq h LYS 260 N 0.13 0.44 -0.44 1.92 3.64 -1.46 -2.59 116.57 118.21 1jxq h LYS 260 Ca 0.03 -0.39 0.03 0.00 -1.27 0.00 0.00 60.65 59.05 1jxq h LYS 260 Cb 0.19 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1jxq h LYS 260 CO 0.01 1.03 0.24 0.82 -2.27 0.00 0.00 179.45 179.28 1jxq h ILE 261 N -0.02 1.01 -0.45 2.00 2.04 -0.75 -1.48 117.51 119.85 1jxq h ILE 261 Ca -0.04 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1jxq h ILE 261 Cb 1.14 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1jxq h ILE 261 CO 0.10 0.09 0.19 0.58 0.00 0.00 0.00 178.15 179.10 1jxq h VAL 262 N 0.48 1.20 0.00 1.67 2.07 -1.06 -2.66 116.25 117.96 1jxq h VAL 262 Ca 0.18 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1jxq h VAL 262 Cb 0.05 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1jxq h VAL 262 CO -0.11 0.23 -0.10 -1.13 0.02 0.00 0.00 177.57 176.49 1jxq h ASN 263 N 0.59 0.00 -0.08 0.57 -0.73 -1.10 -0.88 115.58 113.95 1jxq h ASN 263 Ca 0.15 0.00 0.02 0.00 1.87 0.00 0.00 56.30 58.34 1jxq h ASN 263 Cb 0.18 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.77 1jxq h ASN 263 CO -0.01 0.10 0.12 0.40 -0.37 0.00 0.00 177.43 177.66 1jxq h ILE 264 N 0.00 0.33 -0.78 2.57 2.04 -0.90 -1.24 117.51 119.53 1jxq h ILE 264 Ca -0.00 0.00 -0.41 0.00 1.00 0.00 0.00 64.86 65.44 1jxq h ILE 264 Cb 0.35 0.90 -0.24 0.00 -0.74 0.00 0.00 36.82 37.09 1jxq h ILE 264 CO 0.01 0.00 0.40 0.49 0.00 0.00 0.00 178.15 179.05 1jxq n PHE 265 N -3.56 2.42 -1.12 1.37 3.72 -0.34 -4.53 117.46 115.43 1jxq n PHE 265 Ca -0.01 -1.83 -0.29 0.00 -0.05 0.00 0.00 57.45 55.27 1jxq n PHE 265 Cb 0.21 -0.81 0.17 0.00 -0.94 0.00 0.00 39.48 38.11 1jxq n PHE 265 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1jxq s ASN 266 N -1.77 2.69 0.42 4.37 2.20 -0.47 -4.72 114.94 117.65 1jxq s ASN 266 Ca 0.53 1.31 0.10 0.00 -0.94 0.00 0.00 52.86 53.86 1jxq s ASN 266 Cb 0.46 -1.98 0.89 0.00 -2.00 0.00 0.00 41.25 38.61 1jxq s ASN 266 CO 0.07 -3.11 2.00 1.23 -2.94 0.00 0.00 177.10 174.34 1jxq h GLY 267 N -1.88 0.32 0.37 0.45 0.00 -1.88 -0.22 103.07 100.23 1jxq h GLY 267 Ca -0.54 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 46.58 1jxq h GLY 267 CO 0.56 0.15 -0.22 -0.84 0.00 0.00 0.00 176.54 176.18 1jxq h THR 268 N 0.30 1.59 -0.40 4.70 2.02 -1.96 -2.38 112.91 116.77 1jxq h THR 268 Ca 0.07 -2.04 -0.07 0.00 0.77 0.00 0.00 66.41 65.13 1jxq h THR 268 Cb 0.18 2.92 -0.02 0.00 -1.74 0.00 0.00 68.15 69.48 1jxq h THR 268 CO 0.00 0.55 -0.06 -1.28 0.37 0.00 0.00 175.52 175.11 1jxq h SER 269 N -0.61 0.65 -2.02 4.18 0.87 -1.84 -3.36 113.55 111.42 1jxq h SER 269 Ca -0.03 -0.16 -0.56 0.00 -1.23 0.00 0.00 61.79 59.80 1jxq h SER 269 Cb 1.03 -0.17 -0.39 0.00 -0.44 0.00 0.00 62.40 62.42 1jxq h SER 269 CO 0.04 0.76 -1.08 0.00 -0.53 0.00 0.00 176.83 176.03 1jxq h PRO 271 N 4.07 0.00 0.00 0.00 0.13 -1.59 -1.52 132.00 133.09 1jxq h PRO 271 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1jxq h PRO 271 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1jxq h PRO 271 CO 0.48 0.00 0.00 1.03 -0.23 0.00 0.00 178.00 179.28 1jxq h SER 272 N 0.00 0.00 -0.26 1.44 0.87 -1.89 -0.92 113.55 112.79 1jxq h SER 272 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1jxq h SER 272 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1jxq h SER 272 CO -0.00 0.00 0.00 0.18 -0.53 0.00 0.00 176.83 176.48 1jxq n LEU 273 N -2.90 2.88 -4.67 2.23 4.77 -0.57 -4.13 117.00 114.61 1jxq n LEU 273 Ca -0.02 -2.18 -0.45 0.00 -0.03 0.00 0.00 56.01 53.33 1jxq n LEU 273 Cb 0.10 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1jxq n LEU 273 CO 0.19 0.68 1.12 0.61 -1.33 0.00 0.00 177.39 178.66 1jxq n GLY 274 N 0.12 0.98 3.84 -0.72 0.00 -0.35 -0.80 105.19 108.27 1jxq n GLY 274 Ca 0.11 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.71 1jxq n GLY 274 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jxq n GLY 275 N 2.83 2.09 3.88 -0.02 0.00 -1.26 -4.98 105.19 107.74 1jxq n GLY 275 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1jxq n GLY 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jxq s LYS 276 N 0.00 3.72 0.04 1.61 1.02 0.02 -4.94 119.74 121.21 1jxq s LYS 276 Ca 0.00 0.11 -0.31 0.00 0.02 0.00 0.00 55.97 55.80 1jxq s LYS 276 Cb 0.00 -2.76 -0.06 0.00 -0.52 0.00 0.00 37.83 34.49 1jxq s LYS 276 CO 0.00 0.40 1.36 -1.25 -0.92 0.00 0.00 175.35 174.94 1jxq s PRO 277 N -2.68 4.32 -0.29 -1.68 0.04 -1.26 -4.74 135.00 128.71 1jxq s PRO 277 Ca 0.44 1.95 -0.06 0.00 0.04 0.00 0.00 61.00 63.37 1jxq s PRO 277 Cb -0.12 -3.44 0.01 0.00 0.04 0.00 0.00 34.50 30.99 1jxq s PRO 277 CO 0.22 -0.48 0.06 0.15 0.04 0.00 0.00 177.00 176.99 1jxq s LYS 278 N 1.79 3.02 -0.14 4.56 1.02 0.91 -1.95 119.74 128.95 1jxq s LYS 278 Ca 0.63 -0.90 -0.05 0.00 0.02 0.00 0.00 55.97 55.68 1jxq s LYS 278 Cb -0.32 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.64 1jxq s LYS 278 CO 0.28 -0.45 0.02 -0.51 -0.92 0.00 0.00 175.35 173.77 1jxq s LEU 279 N 1.46 3.64 -0.13 3.17 1.43 0.15 -1.47 118.68 126.94 1jxq s LEU 279 Ca 0.02 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.19 1jxq s LEU 279 Cb -0.17 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.19 1jxq s LEU 279 CO 0.01 0.25 -0.09 -0.36 0.23 0.00 0.00 176.35 176.39 1jxq s PHE 280 N -0.09 1.69 -0.23 0.29 0.40 0.51 -0.02 117.98 120.53 1jxq s PHE 280 Ca 0.05 -0.90 -0.06 0.00 -0.60 0.00 0.00 56.93 55.42 1jxq s PHE 280 Cb -0.12 -1.34 -0.02 0.00 0.51 0.00 0.00 43.02 42.04 1jxq s PHE 280 CO 0.02 -0.57 0.03 -0.06 0.70 0.00 0.00 175.22 175.34 1jxq s PHE 281 N 1.64 3.06 -0.25 0.36 0.40 0.07 0.24 117.98 123.50 1jxq s PHE 281 Ca 0.05 -0.49 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1jxq s PHE 281 Cb -0.13 -2.16 0.05 0.00 0.51 0.00 0.00 43.02 41.28 1jxq s PHE 281 CO -0.09 -0.33 -0.09 0.42 0.70 0.00 0.00 175.22 175.83 1jxq s ILE 282 N 1.35 2.44 -0.83 0.64 1.01 0.06 -1.87 121.20 124.00 1jxq s ILE 282 Ca 0.05 -1.38 -0.06 0.00 0.00 0.00 0.00 60.65 59.25 1jxq s ILE 282 Cb -0.15 -2.34 0.21 0.00 0.01 0.00 0.00 42.46 40.19 1jxq s ILE 282 CO 0.02 0.07 0.72 -1.58 0.00 0.00 0.00 174.94 174.18 1jxq s GLN 283 N 1.20 3.28 0.13 2.79 2.00 -0.67 -1.41 119.66 126.97 1jxq s GLN 283 Ca -0.05 -2.86 -0.21 0.00 -2.00 0.00 0.00 55.36 50.24 1jxq s GLN 283 Cb -0.18 -4.09 0.06 0.00 0.80 0.00 0.00 33.01 29.60 1jxq s GLN 283 CO -0.05 -1.24 0.54 0.00 -0.50 0.00 0.00 175.29 174.04 1jxq s ALA 284 N -0.61 -1.39 0.28 1.58 0.00 -1.25 -2.21 121.76 118.15 1jxq s ALA 284 Ca 0.23 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.28 1jxq s ALA 284 Cb -0.12 0.73 -0.12 0.00 0.00 0.00 0.00 23.12 23.61 1jxq s ALA 284 CO -0.08 -0.68 1.61 0.00 0.00 0.00 0.00 175.76 176.60 1jxq n GLY 286 N 2.43 -1.19 0.00 0.00 0.00 -0.32 -2.00 105.19 104.12 1jxq n GLY 286 Ca 0.10 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1jxq n GLY 286 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jxq n GLY 287 N 1.48 -1.25 0.08 -0.02 0.00 0.54 -0.29 105.19 105.73 1jxq n GLY 287 Ca 0.06 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 1jxq n GLY 287 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jxq n GLU 288 N -0.01 0.64 -1.87 1.61 -0.58 -1.01 -3.60 120.64 115.82 1jxq n GLU 288 Ca 0.00 0.30 -0.42 0.00 -0.42 0.00 0.00 57.16 56.62 1jxq n GLU 288 Cb 0.00 -1.79 -0.03 0.00 -0.57 0.00 0.00 31.44 29.05 1jxq n GLU 288 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1jxq s GLN 289 N -2.60 4.19 -0.44 3.49 0.74 -1.07 -4.63 119.66 119.34 1jxq s GLN 289 Ca -0.06 2.42 -0.19 0.00 0.05 0.00 0.00 55.36 57.58 1jxq s GLN 289 Cb 0.08 -3.32 0.03 0.00 1.10 0.00 0.00 33.01 30.89 1jxq s GLN 289 CO 0.82 -0.69 0.56 0.15 -0.55 0.00 0.00 175.29 175.58 1jxq s LYS 290 N 1.76 3.19 -0.26 1.67 1.02 -1.26 -1.21 119.74 124.65 1jxq s LYS 290 Ca 0.73 -0.57 -0.29 0.00 0.02 0.00 0.00 55.97 55.86 1jxq s LYS 290 Cb -0.44 -3.97 -0.00 0.00 -0.52 0.00 0.00 37.83 32.90 1jxq s LYS 290 CO 0.32 -0.96 1.25 0.34 -0.92 0.00 0.00 175.35 175.38 1jxq s ASP 291 N 1.98 6.80 0.17 2.83 2.15 -1.26 -4.93 116.67 124.41 1jxq s ASP 291 Ca 0.18 1.34 0.13 0.00 0.43 0.00 0.00 52.55 54.62 1jxq s ASP 291 Cb -0.16 -2.54 -0.07 0.00 -0.30 0.00 0.00 42.92 39.85 1jxq s ASP 291 CO 0.16 -0.94 1.23 0.45 -0.17 0.00 0.00 175.17 175.90 1jxq h HIS 292 N 8.74 0.00 -0.15 -5.34 3.86 -1.90 0.20 115.15 120.55 1jxq h HIS 292 Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1jxq h HIS 292 Cb 1.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.56 1jxq h HIS 292 CO 0.85 0.70 0.00 0.41 0.86 0.00 0.00 177.93 180.74 1jxq n GLY 293 N 1.32 -0.88 3.33 2.45 0.00 -1.26 -4.65 105.19 105.50 1jxq n GLY 293 Ca -0.02 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 1jxq n GLY 293 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1jxq s PHE 294 N 0.00 -0.34 0.34 1.61 -0.12 -1.26 -5.13 117.98 113.07 1jxq s PHE 294 Ca 0.00 0.57 -0.27 0.00 -0.05 0.00 0.00 56.93 57.18 1jxq s PHE 294 Cb 0.00 0.20 -0.09 0.00 -0.63 0.00 0.00 43.02 42.50 1jxq s PHE 294 CO 0.00 -0.46 1.14 -2.00 -0.05 0.00 0.00 175.22 173.85 1jxq s GLU 295 N -1.24 4.37 0.00 1.99 2.12 -1.26 -5.22 118.70 119.47 1jxq s GLU 295 Ca -0.12 1.82 0.00 0.00 0.36 0.00 0.00 54.97 57.03 1jxq s GLU 295 Cb -0.03 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.42 1jxq s GLU 295 CO 0.06 -0.03 0.00 0.28 -0.54 0.00 0.00 175.26 175.03 1jxq n VAL 296 N 0.65 0.00 -1.28 3.70 0.31 -1.26 -5.35 118.33 115.10 1jxq n VAL 296 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1jxq n VAL 296 Cb 0.46 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 1jxq n VAL 296 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1jxq n LEU 321 N 0.00 0.00 -4.57 7.52 4.77 -1.26 -5.39 117.00 118.07 1jxq n LEU 321 Ca 0.00 0.61 -0.24 0.00 -0.03 0.00 0.00 56.01 56.36 1jxq n LEU 321 Cb 0.00 -1.46 -0.07 0.00 -2.33 0.00 0.00 43.42 39.56 1jxq n LEU 321 CO 0.00 0.00 1.35 -2.16 -1.33 0.00 0.00 177.39 175.25 1jxq s PRO 322 N -1.70 2.18 -0.03 3.23 0.04 -1.26 -4.91 135.00 132.54 1jxq s PRO 322 Ca 0.00 -0.59 0.05 0.00 0.04 0.00 0.00 61.00 60.50 1jxq s PRO 322 Cb 0.00 -5.09 -0.01 0.00 0.04 0.00 0.00 34.50 29.44 1jxq s PRO 322 CO 0.00 -4.13 -0.20 -0.08 0.04 0.00 0.00 177.00 172.63 1jxq s THR 323 N 12.24 1.61 0.33 1.26 -1.32 -1.26 -5.12 115.64 123.38 1jxq s THR 323 Ca 0.74 -0.84 -0.29 0.00 -1.21 0.00 0.00 61.69 60.09 1jxq s THR 323 Cb -0.05 -1.36 -0.11 0.00 -1.51 0.00 0.00 72.50 69.48 1jxq s THR 323 CO 0.09 0.46 1.53 -2.84 -2.21 0.00 0.00 174.62 171.65 1jxq s PRO 324 N -0.20 4.13 -0.18 7.08 0.02 -1.26 -4.85 135.00 139.74 1jxq s PRO 324 Ca 0.01 2.56 -0.07 0.00 0.02 0.00 0.00 61.00 63.52 1jxq s PRO 324 Cb -0.10 -3.00 0.08 0.00 0.02 0.00 0.00 34.50 31.49 1jxq s PRO 324 CO 0.01 -0.57 0.39 -1.12 -0.33 0.00 0.00 177.00 175.38 1jxq s SER 325 N 0.19 -0.18 -1.47 2.53 0.01 -1.26 -4.82 113.70 108.69 1jxq s SER 325 Ca 0.58 0.90 -0.07 0.00 1.31 0.00 0.00 55.95 58.67 1jxq s SER 325 Cb -0.47 1.13 0.02 0.00 0.21 0.00 0.00 66.02 66.91 1jxq s SER 325 CO 0.54 -0.23 0.85 0.47 0.41 0.00 0.00 173.24 175.29 1jxq n ASP 326 N 5.20 -6.07 -4.70 2.44 8.00 -0.72 -4.77 116.55 115.92 1jxq n ASP 326 Ca -0.11 -0.42 -0.35 0.00 0.71 0.00 0.00 54.79 54.63 1jxq n ASP 326 Cb 0.50 -4.85 -0.09 0.00 -0.02 0.00 0.00 41.12 36.66 1jxq n ASP 326 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1jxq s ILE 327 N -3.23 4.46 -0.16 0.53 -1.09 -1.22 -0.06 121.20 120.43 1jxq s ILE 327 Ca 0.44 -0.19 -0.04 0.00 -2.23 0.00 0.00 60.65 58.63 1jxq s ILE 327 Cb -0.20 -2.89 0.07 0.00 -1.58 0.00 0.00 42.46 37.87 1jxq s ILE 327 CO 0.54 0.60 0.20 0.12 -1.23 0.00 0.00 174.94 175.18 1jxq s PHE 328 N -0.84 -0.24 -0.36 3.97 5.36 -0.54 -0.16 117.98 125.15 1jxq s PHE 328 Ca 0.13 0.40 -0.03 0.00 -0.96 0.00 0.00 56.93 56.48 1jxq s PHE 328 Cb -0.11 -0.31 0.08 0.00 -0.34 0.00 0.00 43.02 42.34 1jxq s PHE 328 CO 0.02 -0.47 0.12 0.08 -1.46 0.00 0.00 175.22 173.52 1jxq s VAL 329 N 2.32 3.19 -0.27 3.12 1.01 -0.46 -0.36 120.40 128.95 1jxq s VAL 329 Ca 0.05 -1.77 -0.24 0.00 0.00 0.00 0.00 61.98 60.01 1jxq s VAL 329 Cb -0.14 -3.05 -0.00 0.00 0.00 0.00 0.00 36.38 33.19 1jxq s VAL 329 CO -0.10 -0.45 0.83 -0.55 0.00 0.00 0.00 175.10 174.83 1jxq s SER 330 N 1.57 6.78 -0.14 3.32 0.15 0.14 -0.85 113.70 124.66 1jxq s SER 330 Ca 0.03 0.91 -0.12 0.00 0.70 0.00 0.00 55.95 57.47 1jxq s SER 330 Cb -0.21 -2.43 -0.05 0.00 -1.71 0.00 0.00 66.02 61.62 1jxq s SER 330 CO -0.03 -0.58 0.25 -0.31 1.20 0.00 0.00 173.24 173.77 1jxq s TYR 331 N 2.94 3.51 0.23 3.44 2.02 0.35 -0.76 117.35 129.07 1jxq s TYR 331 Ca 0.35 0.58 -0.05 0.00 -0.37 0.00 0.00 57.07 57.58 1jxq s TYR 331 Cb -0.15 -2.23 0.23 0.00 -0.40 0.00 0.00 41.96 39.41 1jxq s TYR 331 CO 0.10 0.39 1.72 0.66 -1.57 0.00 0.00 175.55 176.84 1jxq h SER 332 N 6.13 0.89 -4.74 2.29 4.64 -1.48 -1.57 113.55 119.71 1jxq h SER 332 Ca -0.45 -0.23 -0.24 0.00 -0.47 0.00 0.00 61.79 60.40 1jxq h SER 332 Cb 1.18 -0.24 -0.18 0.00 -0.31 0.00 0.00 62.40 62.85 1jxq h SER 332 CO 0.71 0.94 -0.72 0.28 -0.87 0.00 0.00 176.83 177.17 1jxq s THR 333 N -5.03 0.57 0.37 2.95 -1.32 -1.26 -3.19 115.64 108.73 1jxq s THR 333 Ca -0.10 -1.45 -0.28 0.00 -1.21 0.00 0.00 61.69 58.64 1jxq s THR 333 Cb 0.14 -1.07 -0.11 0.00 -1.51 0.00 0.00 72.50 69.96 1jxq s THR 333 CO 0.83 -0.61 1.50 0.12 -2.21 0.00 0.00 174.62 174.25 1jxq s PHE 334 N -2.40 2.59 0.02 9.09 5.36 -1.04 -4.75 117.98 126.85 1jxq s PHE 334 Ca -0.01 1.13 -0.36 0.00 -0.96 0.00 0.00 56.93 56.73 1jxq s PHE 334 Cb -0.03 -4.03 -0.15 0.00 -0.34 0.00 0.00 43.02 38.46 1jxq s PHE 334 CO -0.02 -3.07 1.53 -2.30 -1.46 0.00 0.00 175.22 169.90 1jxq n PRO 335 N 0.59 1.51 0.00 10.12 -0.02 -1.26 -1.72 135.00 144.22 1jxq n PRO 335 Ca 0.02 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1jxq n PRO 335 Cb 0.39 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1jxq n PRO 335 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jxq n GLY 336 N 3.24 2.78 4.02 -1.23 0.00 0.60 -4.91 105.19 109.69 1jxq n GLY 336 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1jxq n GLY 336 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jxq s PHE 337 N -2.79 1.54 -0.07 1.61 0.08 -0.70 -2.41 117.98 115.25 1jxq s PHE 337 Ca 0.00 -0.56 -0.11 0.00 0.12 0.00 0.00 56.93 56.39 1jxq s PHE 337 Cb 0.00 -2.48 -0.05 0.00 -0.57 0.00 0.00 43.02 39.92 1jxq s PHE 337 CO 0.00 -1.30 0.26 0.08 -0.10 0.00 0.00 175.22 174.16 1jxq s VAL 338 N -2.81 5.29 -0.19 -0.44 1.01 -0.35 0.20 120.40 123.11 1jxq s VAL 338 Ca 0.63 0.50 -0.10 0.00 0.00 0.00 0.00 61.98 63.01 1jxq s VAL 338 Cb -0.06 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1jxq s VAL 338 CO 0.40 0.59 0.14 -0.55 0.00 0.00 0.00 175.10 175.69 1jxq s SER 339 N -0.99 6.24 0.06 3.32 0.15 -1.26 -4.82 113.70 116.39 1jxq s SER 339 Ca 0.19 0.27 -0.09 0.00 0.70 0.00 0.00 55.95 57.01 1jxq s SER 339 Cb -0.14 -2.09 -0.06 0.00 -1.71 0.00 0.00 66.02 62.02 1jxq s SER 339 CO 0.08 0.20 0.37 0.26 1.20 0.00 0.00 173.24 175.35 1jxq s TRP 340 N 0.21 3.58 0.06 3.44 0.52 -1.26 -4.82 118.94 120.68 1jxq s TRP 340 Ca 0.09 0.74 0.01 0.00 0.02 0.00 0.00 56.10 56.96 1jxq s TRP 340 Cb -0.11 -2.12 -0.03 0.00 -1.15 0.00 0.00 33.47 30.05 1jxq s TRP 340 CO -0.01 0.54 -0.05 0.50 0.02 0.00 0.00 176.95 177.95 1jxq s ARG 341 N -1.86 0.61 -0.07 4.98 3.52 -1.26 -2.70 118.95 122.17 1jxq s ARG 341 Ca 0.32 -1.06 0.05 0.00 -0.13 0.00 0.00 55.73 54.91 1jxq s ARG 341 Cb -0.14 -0.03 -0.01 0.00 -1.56 0.00 0.00 34.95 33.22 1jxq s ARG 341 CO 0.18 -0.04 -0.24 0.34 -0.81 0.00 0.00 175.30 174.73 1jxq s ASP 342 N -2.46 2.93 0.55 -2.12 3.68 -0.76 -4.92 116.67 113.57 1jxq s ASP 342 Ca 0.01 -0.50 0.23 0.00 2.13 0.00 0.00 52.55 54.42 1jxq s ASP 342 Cb 0.01 -0.93 1.51 0.00 -1.45 0.00 0.00 42.92 42.05 1jxq s ASP 342 CO -0.05 0.21 2.16 -0.65 0.13 0.00 0.00 175.17 176.97 1jxq h PRO 343 N 6.25 0.00 0.00 4.34 0.11 -1.88 -1.09 132.00 139.73 1jxq h PRO 343 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1jxq h PRO 343 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1jxq h PRO 343 CO 0.47 0.00 -1.05 1.17 -0.21 0.00 0.00 178.00 178.38 1jxq n LYS 344 N -4.21 0.92 0.00 1.05 4.81 -1.26 -3.60 118.16 115.87 1jxq n LYS 344 Ca -0.01 -0.03 0.06 0.00 -0.87 0.00 0.00 58.31 57.46 1jxq n LYS 344 Cb 0.17 -1.05 0.01 0.00 0.02 0.00 0.00 35.03 34.19 1jxq n LYS 344 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1jxq n SER 345 N -1.57 1.59 -0.01 3.14 2.88 -1.21 -5.04 113.62 113.40 1jxq n SER 345 Ca -0.01 -1.30 0.00 0.00 -1.33 0.00 0.00 58.87 56.24 1jxq n SER 345 Cb 0.11 0.35 -0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1jxq n SER 345 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jxq n GLY 346 N 0.94 -1.36 3.75 0.46 0.00 -0.42 -4.81 105.19 103.76 1jxq n GLY 346 Ca 0.06 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 1jxq n GLY 346 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jxq s SER 347 N -2.42 6.82 0.14 1.61 1.04 -1.26 -1.83 113.70 117.81 1jxq s SER 347 Ca 0.00 2.53 -0.28 0.00 0.48 0.00 0.00 55.95 58.68 1jxq s SER 347 Cb 0.00 -2.62 -0.06 0.00 0.10 0.00 0.00 66.02 63.43 1jxq s SER 347 CO 0.00 -0.56 1.48 0.79 0.98 0.00 0.00 173.24 175.93 1jxq n TRP 348 N 2.11 -0.40 -0.11 5.02 8.01 -1.10 -1.68 117.44 129.30 1jxq n TRP 348 Ca 0.05 1.13 -0.13 0.00 -1.31 0.00 0.00 57.50 57.24 1jxq n TRP 348 Cb 0.42 -0.57 -0.08 0.00 -2.01 0.00 0.00 31.31 29.07 1jxq n TRP 348 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.69 175.76 1jxq h TYR 349 N 0.00 -1.52 -0.40 -5.99 3.20 -1.92 0.12 116.97 110.46 1jxq h TYR 349 Ca 0.14 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1jxq h TYR 349 Cb 0.37 0.71 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 1jxq h TYR 349 CO -1.02 -0.49 0.20 0.28 -1.64 0.00 0.00 178.16 175.50 1jxq h VAL 350 N -0.41 1.16 -0.86 1.81 2.07 -1.88 0.27 116.25 118.41 1jxq h VAL 350 Ca 0.09 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.18 1jxq h VAL 350 Cb 0.61 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1jxq h VAL 350 CO -0.56 0.17 0.57 -0.08 0.02 0.00 0.00 177.57 177.69 1jxq h GLU 351 N 0.50 1.11 0.11 1.57 4.81 -0.98 -0.36 114.58 121.34 1jxq h GLU 351 Ca 0.14 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1jxq h GLU 351 Cb 0.09 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1jxq h GLU 351 CO -0.02 0.74 -0.05 1.15 -0.73 0.00 0.00 179.01 180.09 1jxq h THR 352 N 1.14 1.05 -0.34 0.32 2.02 -0.40 -2.33 112.91 114.36 1jxq h THR 352 Ca 0.32 -0.63 0.06 0.00 0.77 0.00 0.00 66.41 66.93 1jxq h THR 352 Cb -0.10 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 67.71 1jxq h THR 352 CO -0.08 0.15 0.03 0.25 0.37 0.00 0.00 175.52 176.24 1jxq h LEU 353 N -0.44 -0.08 -1.25 2.58 6.46 -0.13 0.19 115.31 122.63 1jxq h LEU 353 Ca -0.02 0.07 -0.03 0.00 -0.12 0.00 0.00 57.88 57.78 1jxq h LEU 353 Cb 0.36 0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 1jxq h LEU 353 CO 0.02 -0.01 0.15 -0.78 -0.62 0.00 0.00 178.44 177.21 1jxq h ASP 354 N 0.13 0.61 0.17 1.25 1.82 -1.10 0.33 116.42 119.62 1jxq h ASP 354 Ca 0.17 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.72 1jxq h ASP 354 Cb 0.21 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.07 1jxq h ASP 354 CO -0.26 0.58 -0.08 -0.78 -1.61 0.00 0.00 179.24 177.09 1jxq h ASP 355 N 0.65 -0.20 -0.27 2.28 -0.00 -0.72 -1.70 116.42 116.47 1jxq h ASP 355 Ca 0.15 -0.22 0.02 0.00 -0.00 0.00 0.00 57.03 56.99 1jxq h ASP 355 Cb 0.19 0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 39.55 1jxq h ASP 355 CO -0.01 0.12 0.13 0.40 -0.00 0.00 0.00 179.24 179.88 1jxq h ILE 356 N -0.53 1.00 -0.60 2.25 1.08 -0.18 -1.70 117.51 118.83 1jxq h ILE 356 Ca -0.02 -0.10 0.06 0.00 -0.39 0.00 0.00 64.86 64.41 1jxq h ILE 356 Cb 0.40 0.69 -0.04 0.00 -3.07 0.00 0.00 36.82 34.80 1jxq h ILE 356 CO 0.04 0.05 0.40 -0.26 -0.69 0.00 0.00 178.15 177.69 1jxq h PHE 357 N 0.28 0.60 0.46 1.37 -1.00 -0.39 0.25 116.94 118.52 1jxq h PHE 357 Ca 0.11 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.88 1jxq h PHE 357 Cb 0.03 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.39 1jxq h PHE 357 CO -0.09 0.33 -0.26 1.49 -1.61 0.00 0.00 178.31 178.16 1jxq h GLU 358 N 0.60 -0.64 -0.01 1.51 4.57 -0.43 -1.06 114.58 119.12 1jxq h GLU 358 Ca 0.26 0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.45 1jxq h GLU 358 Cb 0.25 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 1jxq h GLU 358 CO -0.08 -0.43 -0.15 1.96 -1.18 0.00 0.00 179.01 179.13 1jxq h GLN 359 N -0.67 0.02 0.00 1.92 1.08 -0.89 -3.38 115.11 113.19 1jxq h GLN 359 Ca -0.06 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1jxq h GLN 359 Cb 0.53 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1jxq h GLN 359 CO 0.08 0.17 -0.01 0.91 -0.95 0.00 0.00 178.83 179.03 1jxq n TRP 360 N -4.35 0.00 0.16 2.96 7.02 0.84 -4.70 117.44 119.37 1jxq n TRP 360 Ca -0.02 0.00 0.18 0.00 -1.02 0.00 0.00 57.50 56.64 1jxq n TRP 360 Cb 0.22 0.00 0.71 0.00 -2.42 0.00 0.00 31.31 29.82 1jxq n TRP 360 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1jxq h ALA 361 N 0.00 1.92 -0.13 6.99 0.00 -1.33 0.36 119.26 127.07 1jxq h ALA 361 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1jxq h ALA 361 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1jxq h ALA 361 CO 0.00 -0.66 -0.33 1.25 0.00 0.00 0.00 179.25 179.52 1jxq h HIS 362 N 0.00 0.29 0.00 0.00 -0.00 -1.84 -3.36 115.15 110.24 1jxq h HIS 362 Ca 0.14 -0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1jxq h HIS 362 Cb 1.14 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 28.48 1jxq h HIS 362 CO 0.00 0.56 0.00 -1.13 -0.00 0.00 0.00 177.93 177.36 1jxq n SER 363 N -4.10 0.72 -4.05 3.26 3.41 0.11 -5.01 113.62 107.96 1jxq n SER 363 Ca -0.01 -1.32 -0.16 0.00 -0.26 0.00 0.00 58.87 57.12 1jxq n SER 363 Cb 0.42 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 1jxq n SER 363 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1jxq s GLU 364 N -0.32 0.62 0.71 4.33 2.02 0.00 -5.13 118.70 120.92 1jxq s GLU 364 Ca 0.00 -0.59 -0.13 0.00 0.02 0.00 0.00 54.97 54.28 1jxq s GLU 364 Cb 0.00 -0.52 0.02 0.00 0.10 0.00 0.00 34.13 33.73 1jxq s GLU 364 CO 0.00 0.12 1.09 0.16 0.02 0.00 0.00 175.26 176.65 1jxq s ASP 365 N -1.01 4.96 0.17 -0.19 1.47 -1.26 -4.62 116.67 116.19 1jxq s ASP 365 Ca -0.03 1.85 -0.24 0.00 1.18 0.00 0.00 52.55 55.31 1jxq s ASP 365 Cb -0.07 -2.53 0.07 0.00 -0.34 0.00 0.00 42.92 40.05 1jxq s ASP 365 CO 0.00 -1.72 1.57 0.25 0.68 0.00 0.00 175.17 175.95 1jxq h LEU 366 N -0.53 -1.37 -0.14 2.11 5.85 -0.30 -1.32 115.31 119.61 1jxq h LEU 366 Ca -0.45 0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.54 1jxq h LEU 366 Cb 1.23 0.64 -0.03 0.00 0.37 0.00 0.00 40.66 42.87 1jxq h LEU 366 CO 0.54 -0.33 -0.05 -0.61 -0.34 0.00 0.00 178.44 177.65 1jxq h GLN 367 N -0.21 -0.03 -1.01 1.25 5.75 -1.93 -2.40 115.11 116.53 1jxq h GLN 367 Ca 0.20 0.00 0.11 0.00 -0.15 0.00 0.00 58.65 58.81 1jxq h GLN 367 Cb 0.56 0.01 -0.08 0.00 1.07 0.00 0.00 27.48 29.04 1jxq h GLN 367 CO -0.68 -0.02 0.64 0.77 -2.65 0.00 0.00 178.83 176.89 1jxq h SER 368 N -0.03 0.96 -0.28 -0.69 0.02 -1.75 -1.59 113.55 110.19 1jxq h SER 368 Ca 0.07 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1jxq h SER 368 Cb 0.14 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1jxq h SER 368 CO -0.16 0.53 0.16 -0.07 -1.14 0.00 0.00 176.83 176.15 1jxq h LEU 369 N 1.04 0.25 -1.91 5.07 3.38 -0.85 -2.72 115.31 119.57 1jxq h LEU 369 Ca 0.48 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.43 1jxq h LEU 369 Cb 0.41 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1jxq h LEU 369 CO -0.24 0.18 -0.12 -0.07 0.09 0.00 0.00 178.44 178.28 1jxq h LEU 370 N 0.32 0.00 -0.13 1.67 -0.00 -0.83 -1.52 115.31 114.83 1jxq h LEU 370 Ca 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.97 1jxq h LEU 370 Cb 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1jxq h LEU 370 CO -0.06 0.12 0.00 -0.07 -0.00 0.00 0.00 178.44 178.43 1jxq h LEU 371 N 0.00 0.22 -0.13 1.67 3.38 -1.12 0.35 115.31 119.67 1jxq h LEU 371 Ca -0.00 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.71 1jxq h LEU 371 Cb 0.32 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1jxq h LEU 371 CO 0.02 0.47 -0.32 0.03 0.09 0.00 0.00 178.44 178.73 1jxq h ARG 372 N -0.04 -0.38 -0.34 1.13 3.08 -1.28 0.80 114.38 117.35 1jxq h ARG 372 Ca 0.04 0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.19 1jxq h ARG 372 Cb 0.36 0.09 -0.08 0.00 0.08 0.00 0.00 29.97 30.42 1jxq h ARG 372 CO 0.01 -0.25 -0.19 0.28 -1.07 0.00 0.00 179.97 178.75 1jxq h VAL 373 N -0.39 0.46 -0.38 2.04 2.07 -1.05 0.23 116.25 119.23 1jxq h VAL 373 Ca 0.10 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.63 1jxq h VAL 373 Cb 0.54 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1jxq h VAL 373 CO -0.35 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.46 1jxq h ALA 374 N 1.08 0.48 -0.41 1.67 0.00 0.63 -1.86 119.26 120.86 1jxq h ALA 374 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1jxq h ALA 374 Cb 0.40 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1jxq h ALA 374 CO -0.42 -0.11 0.20 -0.97 0.00 0.00 0.00 179.25 177.95 1jxq h ASN 375 N 0.46 0.53 0.43 0.00 -1.24 0.15 -2.01 115.58 113.90 1jxq h ASN 375 Ca 0.15 -0.12 -0.02 0.00 0.71 0.00 0.00 56.30 57.03 1jxq h ASN 375 Cb -0.00 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 38.91 1jxq h ASN 375 CO -0.07 0.49 -0.33 0.00 -1.29 0.00 0.00 177.43 176.24 1jxq h ALA 376 N 1.05 -1.08 -0.95 1.57 0.00 -0.26 -2.94 119.26 116.66 1jxq h ALA 376 Ca 0.14 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.12 1jxq h ALA 376 Cb 0.10 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 1jxq h ALA 376 CO -0.02 -1.08 0.62 0.28 0.00 0.00 0.00 179.25 179.05 1jxq h VAL 377 N -0.73 0.65 0.00 0.00 2.07 -1.37 -2.00 116.25 114.86 1jxq h VAL 377 Ca -0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1jxq h VAL 377 Cb 0.61 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1jxq h VAL 377 CO 0.02 0.08 0.00 -1.54 0.02 0.00 0.00 177.57 176.15 1jxq n SER 378 N -4.56 0.50 -0.85 0.57 3.41 -0.76 -1.17 113.62 110.76 1jxq n SER 378 Ca 0.21 0.71 0.10 0.00 -0.26 0.00 0.00 58.87 59.63 1jxq n SER 378 Cb 0.72 -0.78 0.10 0.00 -0.26 0.00 0.00 64.21 63.99 1jxq n SER 378 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1jxq n VAL 379 N -2.15 0.10 -1.59 -3.33 0.24 -0.75 -4.84 118.33 106.02 1jxq n VAL 379 Ca -0.01 -0.55 -0.30 0.00 -2.04 0.00 0.00 64.34 61.44 1jxq n VAL 379 Cb 0.06 1.33 0.21 0.00 -1.47 0.00 0.00 33.84 33.97 1jxq n VAL 379 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1jxq s LYS 380 N -1.62 -0.13 0.00 7.34 1.02 -0.32 -5.03 119.74 121.00 1jxq s LYS 380 Ca 0.26 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 55.97 1jxq s LYS 380 Cb 0.17 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.74 1jxq s LYS 380 CO 0.26 -2.95 0.00 0.41 -0.92 0.00 0.00 175.35 172.15 1jxq n GLY 381 N -2.63 0.00 0.21 -3.33 0.00 -1.26 -4.59 105.19 93.59 1jxq n GLY 381 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 1jxq n GLY 381 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jxq h ILE 382 N 0.00 1.30 -3.02 -0.61 2.04 -1.97 -3.43 117.51 111.82 1jxq h ILE 382 Ca 0.00 -2.01 -0.61 0.00 1.00 0.00 0.00 64.86 63.25 1jxq h ILE 382 Cb 0.00 2.00 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1jxq h ILE 382 CO 0.00 0.63 -0.31 -0.31 0.00 0.00 0.00 178.15 178.16 1jxq s TYR 383 N -3.73 3.58 0.33 1.37 1.51 -1.26 -4.86 117.35 114.29 1jxq s TYR 383 Ca -0.09 0.69 -0.04 0.00 -1.01 0.00 0.00 57.07 56.62 1jxq s TYR 383 Cb 0.09 -2.08 -0.05 0.00 -0.11 0.00 0.00 41.96 39.81 1jxq s TYR 383 CO 0.89 0.56 0.58 0.15 -1.11 0.00 0.00 175.55 176.62 1jxq s LYS 384 N -1.85 3.59 -0.14 -0.62 -0.14 0.68 -4.88 119.74 116.38 1jxq s LYS 384 Ca 0.31 -0.04 -0.07 0.00 -1.36 0.00 0.00 55.97 54.81 1jxq s LYS 384 Cb -0.14 -2.61 0.06 0.00 -1.68 0.00 0.00 37.83 33.46 1jxq s LYS 384 CO 0.17 0.15 0.33 -1.14 -0.76 0.00 0.00 175.35 174.09 1jxq s GLN 385 N -3.87 0.29 -0.59 1.68 0.74 -1.26 -4.41 119.66 112.24 1jxq s GLN 385 Ca 0.44 0.69 0.04 0.00 0.05 0.00 0.00 55.36 56.57 1jxq s GLN 385 Cb -0.10 -0.05 0.14 0.00 1.10 0.00 0.00 33.01 34.10 1jxq s GLN 385 CO 0.33 -0.18 0.35 1.41 -0.55 0.00 0.00 175.29 176.65 1jxq s MET 386 N 1.49 2.17 0.70 1.67 -2.45 -1.26 -3.99 119.30 117.62 1jxq s MET 386 Ca -0.08 -2.88 -0.16 0.00 -1.25 0.00 0.00 55.69 51.31 1jxq s MET 386 Cb -0.10 -3.37 -0.01 0.00 1.25 0.00 0.00 34.83 32.60 1jxq s MET 386 CO -0.11 -1.17 0.86 -2.30 1.05 0.00 0.00 175.02 173.35 1jxq n PRO 387 N 2.71 0.53 -3.85 4.11 -0.02 -1.19 -2.49 135.00 134.79 1jxq n PRO 387 Ca 0.10 0.23 -0.01 0.00 -2.02 0.00 0.00 63.50 61.80 1jxq n PRO 387 Cb 0.33 -2.12 0.01 0.00 -0.02 0.00 0.00 33.50 31.70 1jxq n PRO 387 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1jxq s GLY 388 N -1.53 -0.09 0.06 -1.23 0.00 -0.59 -4.85 107.32 99.09 1jxq s GLY 388 Ca 0.72 0.01 -0.16 0.00 0.00 0.00 0.00 44.72 45.30 1jxq s GLY 388 CO 0.51 2.60 0.36 0.00 0.00 0.00 0.00 173.10 176.57 1jxq s PHE 390 N -2.83 3.22 -0.48 0.00 0.40 -0.03 -4.94 117.98 113.32 1jxq s PHE 390 Ca -0.03 -1.21 -0.20 0.00 -0.60 0.00 0.00 56.93 54.89 1jxq s PHE 390 Cb 0.00 -3.76 0.04 0.00 0.51 0.00 0.00 43.02 39.81 1jxq s PHE 390 CO -0.05 -1.03 0.64 1.21 0.70 0.00 0.00 175.22 176.69 1jxq s ASN 392 N 3.50 6.27 -0.24 1.36 3.84 -1.26 -1.35 114.94 127.05 1jxq s ASN 392 Ca 0.04 -0.64 0.10 0.00 0.21 0.00 0.00 52.86 52.57 1jxq s ASN 392 Cb -0.29 -2.31 0.46 0.00 -0.55 0.00 0.00 41.25 38.56 1jxq s ASN 392 CO 0.04 -0.85 1.33 0.49 -2.79 0.00 0.00 177.10 175.32 1jxq n PHE 393 N 6.26 0.50 -2.11 0.43 3.72 0.77 -5.02 117.46 122.00 1jxq n PHE 393 Ca -0.04 -1.53 -0.30 0.00 -0.05 0.00 0.00 57.45 55.53 1jxq n PHE 393 Cb 0.47 -0.36 0.01 0.00 -0.94 0.00 0.00 39.48 38.66 1jxq n PHE 393 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1jxq s LEU 394 N -3.23 3.34 -0.01 4.37 1.43 -1.21 -1.75 118.68 121.61 1jxq s LEU 394 Ca 0.41 1.25 0.14 0.00 -1.03 0.00 0.00 54.13 54.90 1jxq s LEU 394 Cb 0.38 -4.26 -0.20 0.00 0.03 0.00 0.00 46.19 42.14 1jxq s LEU 394 CO -0.04 -0.80 0.37 0.54 0.23 0.00 0.00 176.35 176.66 1jxq n ARG 395 N -2.61 0.90 -4.14 1.70 1.74 -1.26 -4.91 116.66 108.08 1jxq n ARG 395 Ca 0.04 -0.10 -0.13 0.00 -0.77 0.00 0.00 57.85 56.89 1jxq n ARG 395 Cb 0.54 -1.29 -0.07 0.00 -1.02 0.00 0.00 32.46 30.62 1jxq n ARG 395 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1jxq s LYS 396 N -2.83 1.52 0.61 5.56 1.02 -1.26 -4.95 119.74 119.41 1jxq s LYS 396 Ca -0.03 -1.62 -0.13 0.00 0.02 0.00 0.00 55.97 54.22 1jxq s LYS 396 Cb 0.09 0.37 -0.03 0.00 -0.52 0.00 0.00 37.83 37.74 1jxq s LYS 396 CO 0.59 -0.58 1.03 0.15 -0.92 0.00 0.00 175.35 175.62 1jxq s LYS 397 N -3.79 3.44 -0.16 1.68 1.02 -0.41 -4.74 119.74 116.77 1jxq s LYS 397 Ca 0.33 0.93 -0.00 0.00 0.02 0.00 0.00 55.97 57.25 1jxq s LYS 397 Cb 0.03 -2.06 0.04 0.00 -0.52 0.00 0.00 37.83 35.32 1jxq s LYS 397 CO 0.15 -0.70 -0.07 -1.17 -0.92 0.00 0.00 175.35 172.64 1jxq s LEU 398 N -4.92 1.60 -0.23 3.17 2.96 -1.26 -1.12 118.68 118.88 1jxq s LEU 398 Ca 0.58 -0.60 -0.04 0.00 -0.22 0.00 0.00 54.13 53.86 1jxq s LEU 398 Cb -0.12 -0.95 -0.00 0.00 0.50 0.00 0.00 46.19 45.61 1jxq s LEU 398 CO 0.46 -0.16 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.95 1jxq s PHE 399 N 1.61 2.99 0.74 5.38 0.08 -1.26 0.54 117.98 128.06 1jxq s PHE 399 Ca 0.02 -0.99 -0.12 0.00 0.12 0.00 0.00 56.93 55.95 1jxq s PHE 399 Cb -0.15 -2.12 0.04 0.00 -0.57 0.00 0.00 43.02 40.22 1jxq s PHE 399 CO -0.08 -0.57 1.10 -0.06 -0.10 0.00 0.00 175.22 175.52 1jxq s PHE 400 N 1.47 2.55 -0.26 0.36 0.08 -1.26 -4.78 117.98 116.14 1jxq s PHE 400 Ca 0.05 1.56 -0.27 0.00 0.12 0.00 0.00 56.93 58.39 1jxq s PHE 400 Cb -0.15 -3.11 0.01 0.00 -0.57 0.00 0.00 43.02 39.20 1jxq s PHE 400 CO -0.03 -1.81 0.97 0.21 -0.10 0.00 0.00 175.22 174.47 1jxq s LYS 401 N -4.58 4.17 -0.10 0.44 2.47 -1.26 -4.95 119.74 115.92 1jxq s LYS 401 Ca 0.64 1.12 -0.05 0.00 -1.56 0.00 0.00 55.97 56.12 1jxq s LYS 401 Cb -0.19 -3.67 -0.04 0.00 -1.46 0.00 0.00 37.83 32.47 1jxq s LYS 401 CO 0.51 -0.67 0.10 0.95 0.16 0.00 0.00 175.35 176.40 1jxq s THR 402 N 3.19 5.17 0.00 3.43 -4.23 -1.26 -4.16 115.64 117.78 1jxq s THR 402 Ca 0.41 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.97 1jxq s THR 402 Cb -0.14 -3.25 0.00 0.00 1.34 0.00 0.00 72.50 70.45 1jxq s THR 402 CO 0.09 0.59 0.00 -1.54 -0.54 0.00 0.00 174.62 173.22