#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 -1.53 0.37 3.03 0.00 -1.26 -4.66 105.19 101.14 1jxq n GLY 140 Ca 0.00 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.91 -1.00 4.61 0.00 -2.05 -1.34 119.26 116.57 1jxq h ALA 141 Ca 0.00 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.93 1jxq h ALA 141 Cb 0.00 0.35 -0.10 0.00 0.00 0.00 0.00 17.79 18.03 1jxq h ALA 141 CO 0.00 -0.85 0.62 1.25 0.00 0.00 0.00 179.25 180.27 1jxq h LEU 142 N -1.21 0.63 0.22 0.00 5.85 -1.98 0.17 115.31 118.99 1jxq h LEU 142 Ca -0.09 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1jxq h LEU 142 Cb 0.68 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1jxq h LEU 142 CO 0.15 0.18 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.00 1jxq h GLU 143 N 0.59 -0.28 0.00 1.25 3.07 -1.89 0.30 114.58 117.62 1jxq h GLU 143 Ca 0.58 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.45 1jxq h GLU 143 Cb 1.14 0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1jxq h GLU 143 CO -0.35 -0.04 -0.05 1.03 -1.40 0.00 0.00 179.01 178.20 1jxq h SER 144 N -0.50 0.00 0.21 1.42 0.87 -0.01 -1.14 113.55 114.40 1jxq h SER 144 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1jxq h SER 144 Cb 0.38 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1jxq h SER 144 CO 0.05 0.05 -0.10 0.25 -0.53 0.00 0.00 176.83 176.54 1jxq h LEU 145 N 0.00 -0.24 -1.52 2.23 6.46 -0.34 -2.61 115.31 119.29 1jxq h LEU 145 Ca -0.00 -0.18 0.22 0.00 -0.12 0.00 0.00 57.88 57.79 1jxq h LEU 145 Cb 0.09 0.06 -0.07 0.00 -0.73 0.00 0.00 40.66 40.02 1jxq h LEU 145 CO 0.01 0.28 0.61 0.03 -0.62 0.00 0.00 178.44 178.75 1jxq h ARG 146 N -1.00 0.37 0.00 1.25 3.08 -0.16 -1.71 114.38 116.21 1jxq h ARG 146 Ca -0.03 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1jxq h ARG 146 Cb 0.41 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1jxq h ARG 146 CO 0.05 0.24 -0.02 0.78 -1.07 0.00 0.00 179.97 179.95 1jxq h GLY 147 N 0.38 0.00 -7.07 0.04 0.00 -1.22 -3.45 103.07 91.75 1jxq h GLY 147 Ca 0.48 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 47.27 1jxq h GLY 147 CO -0.18 0.00 1.15 0.21 0.00 0.00 0.00 176.54 177.72 1jxq s ASN 148 N -6.22 6.01 0.51 0.19 3.84 -0.64 -4.85 114.94 113.78 1jxq s ASN 148 Ca 0.07 0.49 0.33 0.00 0.21 0.00 0.00 52.86 53.97 1jxq s ASN 148 Cb 0.05 -2.54 1.82 0.00 -0.55 0.00 0.00 41.25 40.03 1jxq s ASN 148 CO 0.67 -1.76 2.02 0.00 -2.79 0.00 0.00 177.10 175.24 1jxq h ALA 149 N 11.75 1.02 0.00 1.71 0.00 -1.86 0.28 119.26 132.17 1jxq h ALA 149 Ca -0.28 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 1jxq h ALA 149 Cb 1.11 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1jxq h ALA 149 CO 1.15 -0.02 -1.08 -0.44 0.00 0.00 0.00 179.25 178.86 1jxq h ASP 150 N 0.00 0.00 0.00 0.00 3.32 -1.95 -3.37 116.42 114.42 1jxq h ASP 150 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1jxq h ASP 150 Cb 0.06 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1jxq h ASP 150 CO 0.00 0.49 -1.81 0.18 -1.72 0.00 0.00 179.24 176.38 1jxq n LEU 151 N -2.97 0.00 -4.02 1.55 4.77 -0.15 -4.87 117.00 111.30 1jxq n LEU 151 Ca -0.05 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.75 1jxq n LEU 151 Cb 0.78 0.02 -0.14 0.00 -2.33 0.00 0.00 43.42 41.75 1jxq n LEU 151 CO 0.42 0.02 -0.43 0.00 -1.33 0.00 0.00 177.39 176.07 1jxq s ALA 152 N -3.16 0.73 -0.03 -1.18 0.00 0.81 -0.38 121.76 118.56 1jxq s ALA 152 Ca -0.06 -0.41 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1jxq s ALA 152 Cb 0.11 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 1jxq s ALA 152 CO 0.72 0.17 1.53 0.71 0.00 0.00 0.00 175.76 178.90 1jxq s TYR 153 N -0.27 2.41 -0.35 0.00 2.02 -0.18 -4.31 117.35 116.67 1jxq s TYR 153 Ca 0.03 0.49 -0.28 0.00 -0.37 0.00 0.00 57.07 56.94 1jxq s TYR 153 Cb -0.04 -3.80 0.02 0.00 -0.40 0.00 0.00 41.96 37.74 1jxq s TYR 153 CO -0.00 -3.19 1.03 0.42 -1.57 0.00 0.00 175.55 172.23 1jxq s ILE 154 N 3.27 4.51 -0.64 2.71 -1.09 -1.26 -4.61 121.20 124.10 1jxq s ILE 154 Ca 0.68 1.52 -0.11 0.00 -2.23 0.00 0.00 60.65 60.51 1jxq s ILE 154 Cb -0.32 -4.40 0.16 0.00 -1.58 0.00 0.00 42.46 36.32 1jxq s ILE 154 CO 0.27 -0.53 0.54 -0.76 -1.23 0.00 0.00 174.94 173.23 1jxq s LEU 155 N 3.65 6.10 -0.00 2.97 1.02 -1.26 -4.85 118.68 126.30 1jxq s LEU 155 Ca 0.43 -2.32 0.07 0.00 0.02 0.00 0.00 54.13 52.33 1jxq s LEU 155 Cb -0.12 -2.10 -0.10 0.00 0.02 0.00 0.00 46.19 43.90 1jxq s LEU 155 CO 0.18 -0.63 0.23 -1.54 0.02 0.00 0.00 176.35 174.61 1jxq n SER 156 N 4.41 1.79 -4.85 2.29 3.41 -1.26 -4.90 113.62 114.52 1jxq n SER 156 Ca 0.01 -0.34 -0.31 0.00 -0.26 0.00 0.00 58.87 57.97 1jxq n SER 156 Cb 0.42 1.16 0.02 0.00 -0.26 0.00 0.00 64.21 65.56 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 -2.08 3.36 -0.11 4.33 -1.94 -1.26 -5.07 119.30 116.53 1jxq s MET 156 Ca 0.00 0.83 -0.04 0.00 -1.71 0.00 0.00 55.69 54.78 1jxq s MET 156 Cb 0.05 -2.05 0.05 0.00 2.01 0.00 0.00 34.83 34.89 1jxq s MET 156 CO 0.30 -0.76 0.09 -2.00 -0.01 0.00 0.00 175.02 172.64 1jxq s GLU 161 N -5.10 0.01 1.08 2.03 2.56 -1.26 -3.79 118.70 114.23 1jxq s GLU 161 Ca 0.56 0.18 -0.16 0.00 0.00 0.00 0.00 54.97 55.55 1jxq s GLU 161 Cb -0.12 -1.13 0.23 0.00 2.00 0.00 0.00 34.13 35.11 1jxq s GLU 161 CO 0.54 -0.50 1.14 -1.25 -0.56 0.00 0.00 175.26 174.63 1jxq s PRO 162 N 2.18 -0.25 0.11 4.30 0.04 -1.26 -5.09 135.00 135.02 1jxq s PRO 162 Ca 0.04 0.06 -0.14 0.00 0.04 0.00 0.00 61.00 60.99 1jxq s PRO 162 Cb -0.14 -1.70 -0.05 0.00 0.04 0.00 0.00 34.50 32.65 1jxq s PRO 162 CO -0.06 -3.09 1.50 0.00 0.04 0.00 0.00 177.00 175.38 1jxq n GLY 163 N -0.10 -1.15 3.87 0.00 0.00 -1.26 -0.96 105.19 105.60 1jxq n GLY 163 Ca -0.02 -1.12 -0.32 0.00 0.00 0.00 0.00 46.02 44.56 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 3.41 -0.06 1.61 3.76 -1.25 -0.24 115.29 119.51 1jxq s HIS 164 Ca 0.00 1.00 -0.00 0.00 -0.15 0.00 0.00 55.06 55.91 1jxq s HIS 164 Cb 0.00 -2.36 0.02 0.00 1.11 0.00 0.00 32.58 31.35 1jxq s HIS 164 CO 0.00 0.18 -0.03 0.00 -0.85 0.00 0.00 174.74 174.04 1jxq s LEU 166 N 1.42 2.20 -0.23 0.00 2.96 -0.09 -1.29 118.68 123.65 1jxq s LEU 166 Ca -0.03 -0.58 -0.03 0.00 -0.22 0.00 0.00 54.13 53.27 1jxq s LEU 166 Cb -0.13 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.08 1jxq s LEU 166 CO -0.03 0.07 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.38 1jxq s ILE 167 N 0.90 3.10 -0.26 6.68 1.01 -0.27 0.17 121.20 132.53 1jxq s ILE 167 Ca -0.05 -0.69 -0.09 0.00 0.00 0.00 0.00 60.65 59.82 1jxq s ILE 167 Cb -0.15 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 1jxq s ILE 167 CO -0.03 0.37 0.12 -0.63 0.00 0.00 0.00 174.94 174.76 1jxq s ILE 168 N 1.42 4.66 -0.43 2.92 1.01 0.30 -0.76 121.20 130.33 1jxq s ILE 168 Ca 0.04 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 60.65 1jxq s ILE 168 Cb -0.15 -3.21 0.12 0.00 0.01 0.00 0.00 42.46 39.23 1jxq s ILE 168 CO -0.05 0.29 0.16 0.21 0.00 0.00 0.00 174.94 175.55 1jxq s ASN 169 N 1.66 4.45 -0.20 3.58 3.04 -0.67 0.36 114.94 127.16 1jxq s ASN 169 Ca 0.06 -2.56 -0.17 0.00 0.04 0.00 0.00 52.86 50.24 1jxq s ASN 169 Cb -0.16 -1.56 -0.04 0.00 -1.54 0.00 0.00 41.25 37.96 1jxq s ASN 169 CO 0.06 -0.31 0.45 0.20 -3.04 0.00 0.00 177.10 174.47 1jxq s ASN 170 N 0.35 6.49 0.00 -4.21 0.01 -0.26 -1.64 114.94 115.68 1jxq s ASN 170 Ca 0.14 0.59 0.00 0.00 -0.71 0.00 0.00 52.86 52.88 1jxq s ASN 170 Cb -0.22 -2.26 0.00 0.00 0.41 0.00 0.00 41.25 39.18 1jxq s ASN 170 CO -0.05 -0.13 0.00 0.52 -1.51 0.00 0.00 177.10 175.94 1jxq n VAL 171 N 4.45 0.00 -3.56 1.60 0.31 -1.26 -4.42 118.33 115.45 1jxq n VAL 171 Ca -0.07 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.86 1jxq n VAL 171 Cb 0.51 -0.55 -0.09 0.00 -0.91 0.00 0.00 33.84 32.80 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 -3.63 5.70 0.44 4.52 0.01 -1.26 -1.15 114.94 119.57 1jxq s ASN 172 Ca 0.00 -1.80 -0.03 0.00 -0.71 0.00 0.00 52.86 50.31 1jxq s ASN 172 Cb 0.00 -2.01 -0.04 0.00 0.41 0.00 0.00 41.25 39.61 1jxq s ASN 172 CO 0.00 -0.66 0.71 -0.36 -1.51 0.00 0.00 177.10 175.28 1jxq s PHE 173 N 1.38 3.54 1.11 2.20 0.40 -1.26 -4.90 117.98 120.46 1jxq s PHE 173 Ca 0.05 0.67 -0.14 0.00 -0.60 0.00 0.00 56.93 56.91 1jxq s PHE 173 Cb -0.25 -2.18 0.25 0.00 0.51 0.00 0.00 43.02 41.35 1jxq s PHE 173 CO 0.00 -0.15 1.06 0.00 0.70 0.00 0.00 175.22 176.83 1jxq h ARG 175 N -2.35 0.30 -0.22 0.00 2.43 -1.93 -3.18 114.38 109.42 1jxq h ARG 175 Ca -0.57 -0.29 0.06 0.00 -0.81 0.00 0.00 59.98 58.37 1jxq h ARG 175 Cb 1.33 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.95 1jxq h ARG 175 CO 0.52 0.98 0.22 1.49 -1.51 0.00 0.00 179.97 181.67 1jxq h GLU 175 N -0.27 0.00 0.57 0.20 4.81 -1.96 -3.07 114.58 114.86 1jxq h GLU 175 Ca -0.04 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1jxq h GLU 175 Cb 1.10 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1jxq h GLU 175 CO 0.08 0.00 -0.48 0.77 -0.73 0.00 0.00 179.01 178.65 1jxq h SER 175 N 0.00 -1.29 0.00 1.04 0.02 -1.88 -3.47 113.55 107.98 1jxq h SER 175 Ca 0.10 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1jxq h SER 175 Cb 0.54 0.41 0.00 0.00 0.14 0.00 0.00 62.40 63.49 1jxq h SER 175 CO -0.00 -0.67 0.00 0.61 -1.14 0.00 0.00 176.83 175.63 1jxq n GLY 175 N -1.56 0.36 3.75 -3.77 0.00 -1.16 -5.04 105.19 97.78 1jxq n GLY 175 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 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 4.56 0.58 0.99 1.43 -1.26 -5.04 118.68 119.94 1jxq s LEU 176 Ca 0.00 2.20 -0.09 0.00 -1.03 0.00 0.00 54.13 55.21 1jxq s LEU 176 Cb 0.00 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 1jxq s LEU 176 CO 0.00 -0.11 0.95 -0.13 0.23 0.00 0.00 176.35 177.29 1jxq s ARG 177 N -1.26 3.52 0.04 1.70 0.52 -1.26 -4.73 118.95 117.48 1jxq s ARG 177 Ca 0.45 0.52 -0.31 0.00 -0.52 0.00 0.00 55.73 55.87 1jxq s ARG 177 Cb -0.31 -2.18 -0.06 0.00 0.52 0.00 0.00 34.95 32.92 1jxq s ARG 177 CO 0.39 -0.48 1.38 0.99 0.02 0.00 0.00 175.30 177.61 1jxq s THR 178 N -3.04 3.61 -1.54 0.02 2.01 -1.26 -4.68 115.64 110.76 1jxq s THR 178 Ca 0.53 1.07 -0.12 0.00 0.31 0.00 0.00 61.69 63.47 1jxq s THR 178 Cb -0.11 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 1jxq s THR 178 CO 0.50 0.03 2.60 0.54 -0.69 0.00 0.00 174.62 177.60 1jxq n ARG 179 N 4.82 3.33 -1.68 4.92 1.74 -0.30 -4.94 116.66 124.55 1jxq n ARG 179 Ca 0.12 -2.43 -0.47 0.00 -0.77 0.00 0.00 57.85 54.31 1jxq n ARG 179 Cb 0.43 -3.03 -0.04 0.00 -1.02 0.00 0.00 32.46 28.81 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 4.25 0.36 0.00 0.55 -1.04 -1.26 -2.16 114.28 114.98 1jxq n THR 180 Ca 0.66 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.60 1jxq n THR 180 Cb 0.31 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.02 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 4.04 1.31 0.30 3.41 0.00 -1.24 -4.05 105.19 108.96 1jxq n GLY 181 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 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 0.53 -0.38 1.61 0.02 -1.77 -2.36 113.55 111.20 1jxq h SER 182 Ca 0.00 -0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1jxq h SER 182 Cb 0.00 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1jxq h SER 182 CO 0.00 0.48 0.22 0.78 -1.14 0.00 0.00 176.83 177.17 1jxq h ASN 183 N 0.59 0.48 0.61 3.07 4.21 -1.93 1.04 115.58 123.64 1jxq h ASN 183 Ca 0.14 -0.03 -0.15 0.00 1.21 0.00 0.00 56.30 57.48 1jxq h ASN 183 Cb 0.12 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 1jxq h ASN 183 CO -0.01 0.39 -0.67 0.16 -1.29 0.00 0.00 177.43 176.00 1jxq h ILE 184 N 0.55 1.47 -0.10 2.81 3.07 -1.85 -1.81 117.51 121.65 1jxq h ILE 184 Ca 0.14 -2.27 -0.05 0.00 1.55 0.00 0.00 64.86 64.24 1jxq h ILE 184 Cb 0.02 2.22 -0.00 0.00 -0.27 0.00 0.00 36.82 38.78 1jxq h ILE 184 CO -0.02 0.65 -0.12 0.44 -1.05 0.00 0.00 178.15 178.05 1jxq h ASP 185 N 0.04 0.27 -0.33 2.16 5.19 -0.98 -2.50 116.42 120.26 1jxq h ASP 185 Ca -0.01 -0.51 0.07 0.00 -0.62 0.00 0.00 57.03 55.97 1jxq h ASP 185 Cb 1.20 -0.08 -0.08 0.00 0.18 0.00 0.00 39.33 40.55 1jxq h ASP 185 CO 0.09 0.73 -0.21 0.00 -3.12 0.00 0.00 179.24 176.72 1jxq h GLU 187 N -0.17 0.71 -0.37 0.00 4.39 -1.38 -0.09 114.58 117.67 1jxq h GLU 187 Ca 0.17 -0.32 0.06 0.00 0.34 0.00 0.00 59.36 59.61 1jxq h GLU 187 Cb 0.43 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.02 1jxq h GLU 187 CO -0.44 0.92 0.06 0.87 -1.16 0.00 0.00 179.01 179.26 1jxq h LYS 188 N 0.61 0.17 -0.41 2.33 1.57 -0.97 0.14 116.57 120.01 1jxq h LYS 188 Ca 0.07 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 1jxq h LYS 188 Cb 0.81 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1jxq h LYS 188 CO 0.07 0.11 -0.13 -0.07 -0.57 0.00 0.00 179.45 178.87 1jxq h LEU 189 N 0.18 0.82 -0.15 2.94 3.38 -1.18 0.35 115.31 121.65 1jxq h LEU 189 Ca 0.18 -0.37 0.05 0.00 0.09 0.00 0.00 57.88 57.82 1jxq h LEU 189 Cb 0.21 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 1jxq h LEU 189 CO -0.24 1.01 -0.23 -0.09 0.09 0.00 0.00 178.44 178.97 1jxq h ARG 190 N 0.62 -0.27 -0.74 1.13 2.43 -0.40 0.15 114.38 117.30 1jxq h ARG 190 Ca 0.10 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1jxq h ARG 190 Cb 0.66 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.24 1jxq h ARG 190 CO 0.05 -0.18 0.29 0.00 -1.51 0.00 0.00 179.97 178.61 1jxq h ARG 191 N -0.29 1.11 0.42 0.20 3.08 -0.56 -2.13 114.38 116.22 1jxq h ARG 191 Ca 0.11 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1jxq h ARG 191 Cb 0.45 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1jxq h ARG 191 CO -0.32 0.90 -0.20 -0.09 -1.07 0.00 0.00 179.97 179.19 1jxq h ARG 192 N 1.08 -0.55 0.00 0.04 9.65 0.76 -0.83 114.38 124.54 1jxq h ARG 192 Ca 0.25 0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.15 1jxq h ARG 192 Cb 0.21 0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.92 1jxq h ARG 192 CO -0.02 -0.32 -0.06 0.74 2.80 0.00 0.00 179.97 183.11 1jxq h PHE 193 N -0.65 0.00 -0.26 2.20 -1.00 -0.73 -0.73 116.94 115.77 1jxq h PHE 193 Ca -0.06 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.56 1jxq h PHE 193 Cb 0.48 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.04 1jxq h PHE 193 CO -0.03 0.06 -0.49 0.77 -1.61 0.00 0.00 178.31 177.02 1jxq h SER 194 N 0.00 0.87 -0.75 2.17 0.02 -1.19 -0.68 113.55 113.99 1jxq h SER 194 Ca -0.00 -0.54 0.02 0.00 -0.84 0.00 0.00 61.79 60.43 1jxq h SER 194 Cb 0.48 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 1jxq h SER 194 CO 0.01 1.25 0.49 -1.28 -1.14 0.00 0.00 176.83 176.16 1jxq h SER 195 N 0.53 0.81 -0.31 3.07 0.87 0.23 -1.74 113.55 117.02 1jxq h SER 195 Ca 0.01 -0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 1jxq h SER 195 Cb 1.10 -0.19 -0.07 0.00 -0.44 0.00 0.00 62.40 62.80 1jxq h SER 195 CO 0.11 0.57 0.14 0.18 -0.53 0.00 0.00 176.83 177.30 1jxq n LEU 196 N -4.44 3.71 -2.22 2.23 4.77 -0.48 -3.89 117.00 116.68 1jxq n LEU 196 Ca 0.09 -1.91 -0.19 0.00 -0.03 0.00 0.00 56.01 53.97 1jxq n LEU 196 Cb 0.09 -0.60 -0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1jxq n LEU 196 CO 0.35 0.57 -0.20 1.41 -1.33 0.00 0.00 177.39 178.19 1jxq n HIS 197 N 0.04 -1.02 -3.98 -1.77 8.25 -0.65 -4.35 115.22 111.73 1jxq n HIS 197 Ca 0.17 0.07 -0.22 0.00 -0.26 0.00 0.00 57.72 57.49 1jxq n HIS 197 Cb 0.80 -3.73 -0.02 0.00 1.12 0.00 0.00 29.99 28.15 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 -2.96 3.42 -0.57 4.41 0.40 -0.29 0.65 117.98 123.04 1jxq s PHE 198 Ca 0.04 -0.01 -0.18 0.00 -0.60 0.00 0.00 56.93 56.17 1jxq s PHE 198 Cb -0.02 -1.56 0.10 0.00 0.51 0.00 0.00 43.02 42.05 1jxq s PHE 198 CO 0.05 0.45 0.66 -1.64 0.70 0.00 0.00 175.22 175.44 1jxq s MET 199 N -3.89 3.04 0.07 0.44 -1.94 0.66 -4.45 119.30 113.23 1jxq s MET 199 Ca 0.34 -1.36 -0.23 0.00 -1.71 0.00 0.00 55.69 52.73 1jxq s MET 199 Cb -0.09 -4.26 -0.06 0.00 2.01 0.00 0.00 34.83 32.43 1jxq s MET 199 CO 0.29 -1.47 0.70 0.08 -0.01 0.00 0.00 175.02 174.61 1jxq s VAL 200 N 2.47 4.67 -0.09 -6.03 1.01 -1.26 -0.96 120.40 120.21 1jxq s VAL 200 Ca 0.10 1.51 -0.02 0.00 0.00 0.00 0.00 61.98 63.57 1jxq s VAL 200 Cb -0.25 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.11 1jxq s VAL 200 CO 0.06 0.45 0.01 -0.70 0.00 0.00 0.00 175.10 174.92 1jxq s GLU 201 N -0.56 0.59 -0.16 2.72 2.12 -0.41 -4.96 118.70 118.03 1jxq s GLU 201 Ca 0.35 0.06 -0.07 0.00 0.36 0.00 0.00 54.97 55.66 1jxq s GLU 201 Cb -0.21 -1.09 -0.04 0.00 0.26 0.00 0.00 34.13 33.05 1jxq s GLU 201 CO 0.22 -0.35 0.07 0.08 -0.54 0.00 0.00 175.26 174.75 1jxq s VAL 202 N 1.97 4.90 -0.14 3.70 1.01 -1.26 -1.11 120.40 129.47 1jxq s VAL 202 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 1jxq s VAL 202 Cb -0.13 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 33.10 1jxq s VAL 202 CO -0.06 0.50 -0.06 -0.54 0.00 0.00 0.00 175.10 174.95 1jxq s LYS 203 N 0.03 1.40 0.23 2.72 1.02 0.06 -4.97 119.74 120.23 1jxq s LYS 203 Ca 0.06 -0.38 0.05 0.00 0.02 0.00 0.00 55.97 55.73 1jxq s LYS 203 Cb -0.12 -1.79 -0.03 0.00 -0.52 0.00 0.00 37.83 35.37 1jxq s LYS 203 CO 0.01 -0.37 0.31 0.20 -0.92 0.00 0.00 175.35 174.58 1jxq s GLY 204 N 1.69 1.31 -0.41 -3.33 0.00 -1.26 -1.67 107.32 103.65 1jxq s GLY 204 Ca 0.03 -1.26 -0.34 0.00 0.00 0.00 0.00 44.72 43.15 1jxq s GLY 204 CO -0.08 -1.28 0.59 1.22 0.00 0.00 0.00 173.10 173.55 1jxq n ASP 205 N -1.26 -4.79 -4.34 1.64 8.00 -0.65 -4.91 116.55 110.24 1jxq n ASP 205 Ca -0.09 -0.17 -0.32 0.00 0.71 0.00 0.00 54.79 54.92 1jxq n ASP 205 Cb 0.57 -1.40 -0.15 0.00 -0.02 0.00 0.00 41.12 40.12 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 -2.23 2.29 0.76 0.64 1.43 -1.26 -4.92 118.68 115.39 1jxq s LEU 206 Ca 0.33 -0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 1jxq s LEU 206 Cb -0.03 -1.43 0.05 0.00 0.03 0.00 0.00 46.19 44.80 1jxq s LEU 206 CO 0.77 0.28 1.11 0.42 0.23 0.00 0.00 176.35 179.16 1jxq s THR 207 N -0.34 3.04 0.24 5.49 -4.23 -1.26 0.33 115.64 118.91 1jxq s THR 207 Ca 0.02 0.39 -0.07 0.00 -1.18 0.00 0.00 61.69 60.85 1jxq s THR 207 Cb -0.12 -2.83 0.25 0.00 1.34 0.00 0.00 72.50 71.14 1jxq s THR 207 CO 0.02 -0.39 1.66 0.00 -0.54 0.00 0.00 174.62 175.37 1jxq h ALA 208 N -0.85 0.82 -0.75 3.99 0.00 -1.82 0.49 119.26 121.15 1jxq h ALA 208 Ca -0.45 0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.73 1jxq h ALA 208 Cb 1.25 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 19.31 1jxq h ALA 208 CO 0.51 -0.40 0.44 -0.22 0.00 0.00 0.00 179.25 179.58 1jxq h LYS 209 N 0.16 0.77 -0.01 0.00 3.64 -1.93 -1.41 116.57 117.79 1jxq h LYS 209 Ca 0.40 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.64 1jxq h LYS 209 Cb 0.70 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1jxq h LYS 209 CO -0.59 0.51 -0.45 0.87 -2.27 0.00 0.00 179.45 177.52 1jxq h LYS 210 N 0.79 0.02 0.84 1.90 1.57 -1.29 -2.03 116.57 118.37 1jxq h LYS 210 Ca 0.33 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 59.06 1jxq h LYS 210 Cb 0.20 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.51 1jxq h LYS 210 CO -0.18 0.47 -0.40 0.52 -0.57 0.00 0.00 179.45 179.28 1jxq h MET 211 N 0.01 -1.09 -0.86 3.15 2.86 -0.17 0.10 114.93 118.94 1jxq h MET 211 Ca -0.00 0.07 0.18 0.00 -2.06 0.00 0.00 59.70 57.89 1jxq h MET 211 Cb 0.81 0.25 -0.11 0.00 0.06 0.00 0.00 31.60 32.61 1jxq h MET 211 CO 0.06 -0.72 0.41 0.28 1.06 0.00 0.00 176.91 178.00 1jxq h VAL 212 N -1.17 0.61 -0.24 -2.22 2.07 -1.35 0.56 116.25 114.51 1jxq h VAL 212 Ca -0.12 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1jxq h VAL 212 Cb 0.87 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1jxq h VAL 212 CO 0.19 0.09 0.15 -0.07 0.02 0.00 0.00 177.57 177.96 1jxq h LEU 213 N 0.51 0.29 -0.56 2.57 3.38 -0.85 0.38 115.31 121.04 1jxq h LEU 213 Ca 0.50 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.42 1jxq h LEU 213 Cb 0.82 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1jxq h LEU 213 CO -0.44 0.23 0.27 0.00 0.09 0.00 0.00 178.44 178.59 1jxq h ALA 214 N 1.07 0.72 -0.53 1.53 0.00 0.74 -1.21 119.26 121.58 1jxq h ALA 214 Ca 0.09 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1jxq h ALA 214 Cb -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1jxq h ALA 214 CO -0.02 0.27 0.04 -0.07 0.00 0.00 0.00 179.25 179.47 1jxq h LEU 215 N 0.75 0.83 -0.59 0.00 3.38 -0.58 -1.83 115.31 117.26 1jxq h LEU 215 Ca 0.19 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1jxq h LEU 215 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1jxq h LEU 215 CO -0.03 0.87 0.11 -0.07 0.09 0.00 0.00 178.44 179.42 1jxq h LEU 216 N 0.81 0.93 -0.59 1.67 3.38 0.23 -2.21 115.31 119.54 1jxq h LEU 216 Ca 0.16 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1jxq h LEU 216 Cb 0.43 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1jxq h LEU 216 CO 0.02 0.94 -0.00 -0.08 0.09 0.00 0.00 178.44 179.41 1jxq h GLU 217 N 0.88 1.03 -0.04 1.13 4.81 -1.06 0.60 114.58 121.92 1jxq h GLU 217 Ca 0.18 -0.33 0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1jxq h GLU 217 Cb 0.40 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1jxq h GLU 217 CO 0.01 1.02 -0.01 1.25 -0.73 0.00 0.00 179.01 180.55 1jxq h LEU 218 N 0.93 -0.03 -1.17 1.64 5.85 -1.16 -2.21 115.31 119.15 1jxq h LEU 218 Ca 0.17 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1jxq h LEU 218 Cb 0.55 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1jxq h LEU 218 CO 0.03 -0.01 -0.27 0.00 -0.34 0.00 0.00 178.44 177.85 1jxq h ALA 219 N 1.04 1.31 0.00 1.25 0.00 -1.26 -1.98 119.26 119.62 1jxq h ALA 219 Ca 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1jxq h ALA 219 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1jxq h ALA 219 CO -0.04 0.47 0.00 -2.13 0.00 0.00 0.00 179.25 177.55 1jxq n ARG 220 N -4.15 0.10 -2.27 0.00 0.63 0.19 -4.70 116.66 106.46 1jxq n ARG 220 Ca -0.01 0.24 -0.26 0.00 -0.92 0.00 0.00 57.85 56.90 1jxq n ARG 220 Cb 0.37 -1.50 0.10 0.00 0.45 0.00 0.00 32.46 31.88 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 -2.70 1.81 -0.51 -0.14 -0.21 -0.74 -5.04 119.66 112.13 1jxq s GLN 221 Ca 0.08 -0.52 -0.16 0.00 0.02 0.00 0.00 55.36 54.78 1jxq s GLN 221 Cb 0.06 -2.17 0.11 0.00 1.00 0.00 0.00 33.01 32.01 1jxq s GLN 221 CO 0.15 -1.47 0.46 0.34 -2.12 0.00 0.00 175.29 172.66 1jxq s ASP 222 N -4.63 6.17 -0.20 5.90 3.68 -1.26 -4.85 116.67 121.47 1jxq s ASP 222 Ca 0.64 -1.60 0.10 0.00 2.13 0.00 0.00 52.55 53.81 1jxq s ASP 222 Cb -0.08 -2.20 0.62 0.00 -1.45 0.00 0.00 42.92 39.81 1jxq s ASP 222 CO 0.46 -0.77 1.49 1.41 0.13 0.00 0.00 175.17 177.89 1jxq n HIS 224 N 5.23 1.71 -0.37 -5.34 8.25 -1.26 -4.58 115.22 118.87 1jxq n HIS 224 Ca -0.13 -0.69 0.02 0.00 -0.26 0.00 0.00 57.72 56.66 1jxq n HIS 224 Cb 0.41 -0.47 0.17 0.00 1.12 0.00 0.00 29.99 31.22 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 3.91 1.50 -2.99 -1.41 0.00 -1.91 -1.87 103.07 100.30 1jxq h GLY 225 Ca 0.07 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1jxq h GLY 225 CO 0.44 0.34 0.02 0.00 0.00 0.00 0.00 176.54 177.34 1jxq n ALA 226 N -2.36 3.62 -2.49 3.60 0.00 -1.26 -4.91 120.51 116.71 1jxq n ALA 226 Ca 0.15 -1.50 -0.24 0.00 0.00 0.00 0.00 53.44 51.85 1jxq n ALA 226 Cb 0.17 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.42 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 -2.14 2.65 -0.00 0.00 1.43 -0.70 -4.75 118.68 115.16 1jxq s LEU 227 Ca 0.42 -1.01 0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1jxq s LEU 227 Cb 0.32 -1.14 -0.09 0.00 0.03 0.00 0.00 46.19 45.31 1jxq s LEU 227 CO 0.12 0.02 0.28 0.47 0.23 0.00 0.00 176.35 177.47 1jxq n ASP 228 N -0.65 1.04 -3.71 2.29 8.00 -0.13 -5.01 116.55 118.37 1jxq n ASP 228 Ca -0.05 -0.51 -0.09 0.00 0.71 0.00 0.00 54.79 54.84 1jxq n ASP 228 Cb 0.60 1.08 -0.03 0.00 -0.02 0.00 0.00 41.12 42.75 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 1.16 2.60 -0.08 0.00 1.01 -0.62 0.44 120.40 124.91 1jxq s VAL 231 Ca -0.09 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1jxq s VAL 231 Cb -0.12 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1jxq s VAL 231 CO -0.05 0.57 -0.08 -0.69 0.00 0.00 0.00 175.10 174.85 1jxq s VAL 232 N -0.32 0.91 -0.02 2.92 1.01 0.25 -0.92 120.40 124.24 1jxq s VAL 232 Ca 0.02 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.78 1jxq s VAL 232 Cb -0.13 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1jxq s VAL 232 CO 0.02 0.32 -0.24 -0.69 0.00 0.00 0.00 175.10 174.52 1jxq s VAL 233 N 1.15 2.22 -0.08 2.92 1.01 0.13 -0.73 120.40 127.02 1jxq s VAL 233 Ca -0.06 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1jxq s VAL 233 Cb -0.14 -1.79 0.03 0.00 0.00 0.00 0.00 36.38 34.47 1jxq s VAL 233 CO -0.02 0.56 -0.02 -0.63 0.00 0.00 0.00 175.10 175.00 1jxq s ILE 234 N -0.65 0.51 -0.24 2.22 1.01 -0.82 -0.53 121.20 122.69 1jxq s ILE 234 Ca 0.10 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.74 1jxq s ILE 234 Cb -0.10 -0.63 0.01 0.00 0.01 0.00 0.00 42.46 41.75 1jxq s ILE 234 CO -0.00 0.28 -0.02 -0.76 0.00 0.00 0.00 174.94 174.43 1jxq s LEU 235 N 1.80 3.18 0.00 2.97 1.43 0.16 -1.70 118.68 126.51 1jxq s LEU 235 Ca 0.03 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1jxq s LEU 235 Cb -0.13 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.35 1jxq s LEU 235 CO -0.05 -0.09 0.00 -0.24 0.23 0.00 0.00 176.35 176.20 1jxq n SER 236 N 4.77 0.00 -4.85 2.29 2.88 -0.89 -1.10 113.62 116.71 1jxq n SER 236 Ca -0.17 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.05 1jxq n SER 236 Cb 0.49 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.93 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 -2.29 3.50 0.12 0.66 3.76 -1.26 -3.93 115.29 115.84 1jxq s HIS 237 Ca 0.00 1.42 -0.03 0.00 -0.15 0.00 0.00 55.06 56.31 1jxq s HIS 237 Cb 0.00 -2.77 0.01 0.00 1.11 0.00 0.00 32.58 30.93 1jxq s HIS 237 CO 0.00 -0.44 0.21 0.41 -0.85 0.00 0.00 174.74 174.06 1jxq n GLY 238 N -1.86 2.26 3.74 -2.22 0.00 -1.25 -1.29 105.19 104.57 1jxq n GLY 238 Ca 0.06 -1.28 0.02 0.00 0.00 0.00 0.00 46.02 44.82 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 4.35 -0.00 0.00 -0.21 -1.19 0.26 119.66 120.85 1jxq s GLN 240 Ca 0.27 1.57 -0.01 0.00 0.02 0.00 0.00 55.36 57.21 1jxq s GLN 240 Cb -0.01 -2.76 -0.00 0.00 1.00 0.00 0.00 33.01 31.24 1jxq s GLN 240 CO 0.00 0.01 0.03 0.00 -2.12 0.00 0.00 175.29 173.21 1jxq s ALA 240 N -1.51 -0.05 0.08 6.09 0.00 -1.26 -4.71 121.76 120.40 1jxq s ALA 240 Ca 0.53 -0.12 -0.31 0.00 0.00 0.00 0.00 51.96 52.06 1jxq s ALA 240 Cb -0.24 0.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.81 1jxq s ALA 240 CO 0.31 -0.08 1.55 0.45 0.00 0.00 0.00 175.76 177.99 1jxq s SER 240 N -0.54 6.68 0.19 0.00 0.15 -1.26 -4.19 113.70 114.73 1jxq s SER 240 Ca -0.06 2.41 0.01 0.00 0.70 0.00 0.00 55.95 59.01 1jxq s SER 240 Cb -0.04 -2.57 -0.05 0.00 -1.71 0.00 0.00 66.02 61.66 1jxq s SER 240 CO -0.00 -0.81 0.04 -1.38 1.20 0.00 0.00 173.24 172.28 1jxq s HIS 240 N 2.13 1.24 -0.24 3.44 -3.43 -1.26 -5.02 115.29 112.15 1jxq s HIS 240 Ca 0.70 -1.10 -0.05 0.00 -0.80 0.00 0.00 55.06 53.81 1jxq s HIS 240 Cb -0.38 -0.70 -0.13 0.00 -1.43 0.00 0.00 32.58 29.94 1jxq s HIS 240 CO 0.31 -0.30 -0.26 1.28 -2.00 0.00 0.00 174.74 173.77 1jxq n LEU 240 N -0.27 2.37 0.00 5.38 4.77 -1.26 -4.89 117.00 123.09 1jxq n LEU 240 Ca -0.05 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1jxq n LEU 240 Cb 0.64 -0.76 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1jxq n LEU 240 CO 0.34 0.70 -0.42 1.67 -1.33 0.00 0.00 177.39 178.35 1jxq n GLN 240 N -3.62 0.16 -4.07 3.23 -0.06 -1.26 -5.04 117.38 106.73 1jxq n GLN 240 Ca -0.44 0.00 -0.32 0.00 -2.00 0.00 0.00 57.00 54.23 1jxq n GLN 240 Cb 0.89 -0.92 -0.15 0.00 -4.06 0.00 0.00 30.24 26.00 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 -1.84 3.17 0.97 3.69 0.40 -1.26 -5.10 117.98 118.01 1jxq s PHE 240 Ca 0.00 -2.14 -0.11 0.00 -0.60 0.00 0.00 56.93 54.08 1jxq s PHE 240 Cb 0.00 -1.94 0.18 0.00 0.51 0.00 0.00 43.02 41.77 1jxq s PHE 240 CO 0.00 -0.86 1.12 -1.25 0.70 0.00 0.00 175.22 174.93 1jxq s PRO 240 N 1.15 0.56 0.22 0.24 0.04 -1.26 -3.94 135.00 132.02 1jxq s PRO 240 Ca -0.06 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1jxq s PRO 240 Cb -0.18 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1jxq s PRO 240 CO -0.06 -2.89 0.00 0.41 0.04 0.00 0.00 177.00 174.50 1jxq n GLY 241 N 0.32 -2.16 3.35 0.56 0.00 -1.26 -4.60 105.19 101.39 1jxq n GLY 241 Ca 0.10 -1.31 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.43 -0.34 -0.03 4.61 0.00 0.14 -2.18 121.76 121.53 1jxq s ALA 242 Ca 0.00 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 51.41 1jxq s ALA 242 Cb 0.00 0.77 -0.01 0.00 0.00 0.00 0.00 23.12 23.88 1jxq s ALA 242 CO 0.00 -0.65 -0.18 0.14 0.00 0.00 0.00 175.76 175.07 1jxq s VAL 243 N -3.91 1.46 0.06 0.00 -7.23 0.24 -1.39 120.40 109.63 1jxq s VAL 243 Ca 0.12 -0.76 -0.28 0.00 -1.81 0.00 0.00 61.98 59.25 1jxq s VAL 243 Cb 0.03 -1.23 -0.05 0.00 0.56 0.00 0.00 36.38 35.68 1jxq s VAL 243 CO -0.04 0.42 0.87 -0.31 -0.31 0.00 0.00 175.10 175.73 1jxq s TYR 244 N -0.18 3.75 0.85 2.82 1.51 -0.41 -0.41 117.35 125.27 1jxq s TYR 244 Ca 0.01 1.62 -0.12 0.00 -1.01 0.00 0.00 57.07 57.57 1jxq s TYR 244 Cb -0.10 -2.96 0.10 0.00 -0.11 0.00 0.00 41.96 38.90 1jxq s TYR 244 CO 0.01 0.19 1.15 0.20 -1.11 0.00 0.00 175.55 175.99 1jxq s GLY 245 N 0.17 1.59 0.57 0.71 0.00 0.22 -4.63 107.32 105.95 1jxq s GLY 245 Ca 0.44 -0.52 0.30 0.00 0.00 0.00 0.00 44.72 44.94 1jxq s GLY 245 CO 0.26 -0.01 2.17 0.00 0.00 0.00 0.00 173.10 175.52 1jxq h THR 246 N -1.25 0.47 0.00 0.90 1.03 -0.38 -0.57 112.91 113.11 1jxq h THR 246 Ca -0.48 -0.27 0.00 0.00 -0.01 0.00 0.00 66.41 65.65 1jxq h THR 246 Cb 1.32 1.18 0.00 0.00 -1.07 0.00 0.00 68.15 69.58 1jxq h THR 246 CO 0.63 0.06 0.00 -0.90 -0.01 0.00 0.00 175.52 175.30 1jxq n ASP 247 N -3.64 0.00 0.00 0.00 3.85 -1.26 -1.83 116.55 113.67 1jxq n ASP 247 Ca -0.02 -1.16 0.00 0.00 -0.71 0.00 0.00 54.79 52.90 1jxq n ASP 247 Cb 0.16 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.93 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 0.76 1.14 3.82 6.12 0.00 -0.22 -4.85 105.19 111.97 1jxq n GLY 248 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.39 4.08 -0.09 0.00 0.04 -1.26 0.72 135.00 137.09 1jxq s PRO 255 Ca 0.32 0.73 0.00 0.00 0.04 0.00 0.00 61.00 62.09 1jxq s PRO 255 Cb -0.18 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 31.80 1jxq s PRO 255 CO 0.19 0.23 -0.08 0.08 0.04 0.00 0.00 177.00 177.47 1jxq s VAL 256 N -1.83 0.95 0.34 -0.36 1.01 0.45 -4.91 120.40 116.04 1jxq s VAL 256 Ca 0.50 -0.28 -0.26 0.00 0.00 0.00 0.00 61.98 61.94 1jxq s VAL 256 Cb -0.12 -0.95 -0.09 0.00 0.00 0.00 0.00 36.38 35.21 1jxq s VAL 256 CO 0.19 0.34 1.03 -0.94 0.00 0.00 0.00 175.10 175.72 1jxq s SER 257 N 1.40 7.10 0.25 3.32 1.04 -1.26 0.82 113.70 126.37 1jxq s SER 257 Ca -0.01 2.05 -0.06 0.00 0.48 0.00 0.00 55.95 58.41 1jxq s SER 257 Cb -0.13 -2.60 0.27 0.00 0.10 0.00 0.00 66.02 63.66 1jxq s SER 257 CO -0.04 -0.25 1.89 0.58 0.98 0.00 0.00 173.24 176.40 1jxq h VAL 258 N 2.61 1.25 -0.42 5.02 2.07 -1.69 -1.80 116.25 123.29 1jxq h VAL 258 Ca -0.47 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1jxq h VAL 258 Cb 1.21 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1jxq h VAL 258 CO 0.65 0.27 0.22 -0.08 0.02 0.00 0.00 177.57 178.65 1jxq h GLU 259 N 1.25 0.57 -0.23 1.57 4.81 -1.78 0.24 114.58 121.01 1jxq h GLU 259 Ca 0.32 -0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 59.30 1jxq h GLU 259 Cb -0.03 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.23 1jxq h GLU 259 CO -0.06 0.42 -0.64 -0.22 -0.73 0.00 0.00 179.01 177.78 1jxq h LYS 260 N 0.58 0.84 -0.21 1.92 3.64 -1.73 -2.15 116.57 119.45 1jxq h LYS 260 Ca 0.15 -0.60 -0.01 0.00 -1.27 0.00 0.00 60.65 58.92 1jxq h LYS 260 Cb 0.02 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1jxq h LYS 260 CO -0.02 1.22 0.10 0.82 -2.27 0.00 0.00 179.45 179.30 1jxq h ILE 261 N 0.60 1.13 -0.46 2.00 2.04 -0.52 -1.60 117.51 120.71 1jxq h ILE 261 Ca -0.02 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1jxq h ILE 261 Cb 1.27 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1jxq h ILE 261 CO 0.14 0.13 0.25 0.58 0.00 0.00 0.00 178.15 179.24 1jxq h VAL 262 N 0.21 1.17 0.00 1.67 2.07 -0.59 -2.61 116.25 118.16 1jxq h VAL 262 Ca 0.07 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1jxq h VAL 262 Cb 0.11 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1jxq h VAL 262 CO -0.01 0.18 -0.10 -1.13 0.02 0.00 0.00 177.57 176.52 1jxq h ASN 263 N 0.60 0.00 -0.33 0.57 -0.73 -1.21 -1.24 115.58 113.25 1jxq h ASN 263 Ca 0.16 0.00 0.09 0.00 1.87 0.00 0.00 56.30 58.42 1jxq h ASN 263 Cb 0.06 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 1jxq h ASN 263 CO -0.03 0.10 0.25 0.40 -0.37 0.00 0.00 177.43 177.79 1jxq h ILE 264 N 0.00 0.75 -0.89 2.57 2.04 -0.89 -1.35 117.51 119.74 1jxq h ILE 264 Ca -0.00 0.00 -0.47 0.00 1.00 0.00 0.00 64.86 65.39 1jxq h ILE 264 Cb 0.25 0.82 -0.28 0.00 -0.74 0.00 0.00 36.82 36.88 1jxq h ILE 264 CO 0.01 0.00 0.59 0.49 0.00 0.00 0.00 178.15 179.25 1jxq n PHE 265 N -4.31 2.76 -1.18 1.37 3.72 -0.47 -4.50 117.46 114.86 1jxq n PHE 265 Ca 0.05 -1.73 -0.30 0.00 -0.05 0.00 0.00 57.45 55.42 1jxq n PHE 265 Cb 0.42 -0.89 0.15 0.00 -0.94 0.00 0.00 39.48 38.22 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 -1.06 3.27 0.50 4.37 2.20 -0.51 -4.71 114.94 118.99 1jxq s ASN 266 Ca 0.51 1.45 0.16 0.00 -0.94 0.00 0.00 52.86 54.04 1jxq s ASN 266 Cb 0.43 -2.13 1.21 0.00 -2.00 0.00 0.00 41.25 38.77 1jxq s ASN 266 CO 0.10 -2.76 2.11 1.23 -2.94 0.00 0.00 177.10 174.83 1jxq h GLY 267 N -1.63 0.11 0.02 0.45 0.00 -1.89 0.13 103.07 100.26 1jxq h GLY 267 Ca -0.50 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1jxq h GLY 267 CO 0.55 0.04 -0.00 -0.84 0.00 0.00 0.00 176.54 176.28 1jxq h THR 268 N 0.10 1.75 -0.10 4.70 2.02 -1.96 -2.25 112.91 117.17 1jxq h THR 268 Ca 0.07 -2.28 -0.04 0.00 0.77 0.00 0.00 66.41 64.92 1jxq h THR 268 Cb 0.14 3.29 -0.01 0.00 -1.74 0.00 0.00 68.15 69.84 1jxq h THR 268 CO -0.01 0.59 -0.14 -1.28 0.37 0.00 0.00 175.52 175.05 1jxq h SER 269 N -0.98 0.15 -1.74 4.18 0.87 -1.81 -3.35 113.55 110.86 1jxq h SER 269 Ca -0.00 -0.03 -0.51 0.00 -1.23 0.00 0.00 61.79 60.02 1jxq h SER 269 Cb 0.96 -0.04 -0.36 0.00 -0.44 0.00 0.00 62.40 62.53 1jxq h SER 269 CO 0.00 0.31 -1.04 0.00 -0.53 0.00 0.00 176.83 175.57 1jxq h PRO 271 N 3.86 0.00 0.00 0.00 0.13 -1.54 -1.28 132.00 133.17 1jxq h PRO 271 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1jxq h PRO 271 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1jxq h PRO 271 CO 0.44 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.66 1jxq n SER 272 N -3.02 0.49 -0.13 1.44 2.88 -1.26 -1.69 113.62 112.32 1jxq n SER 272 Ca -0.02 0.65 0.04 0.00 -1.33 0.00 0.00 58.87 58.21 1jxq n SER 272 Cb 0.31 -0.74 0.07 0.00 -0.75 0.00 0.00 64.21 63.09 1jxq n SER 272 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1jxq n LEU 273 N -2.08 2.29 -4.69 2.46 4.77 -0.48 -4.02 117.00 115.25 1jxq n LEU 273 Ca 0.01 -2.33 -0.44 0.00 -0.03 0.00 0.00 56.01 53.22 1jxq n LEU 273 Cb 0.15 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1jxq n LEU 273 CO 0.14 0.59 1.41 0.61 -1.33 0.00 0.00 177.39 178.81 1jxq n GLY 274 N -0.63 1.51 3.11 -0.72 0.00 -0.68 -1.17 105.19 106.61 1jxq n GLY 274 Ca 0.06 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.80 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 4.05 2.29 3.92 -0.02 0.00 -1.26 -5.01 105.19 109.16 1jxq n GLY 275 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.02 3.46 0.05 1.61 1.02 -0.31 -4.97 119.74 120.58 1jxq s LYS 276 Ca 0.00 -0.42 -0.31 0.00 0.02 0.00 0.00 55.97 55.27 1jxq s LYS 276 Cb 0.00 -3.01 -0.06 0.00 -0.52 0.00 0.00 37.83 34.24 1jxq s LYS 276 CO 0.00 0.58 1.34 -1.25 -0.92 0.00 0.00 175.35 175.11 1jxq s PRO 277 N -2.60 4.33 -0.28 -1.68 0.04 -1.26 -4.74 135.00 128.81 1jxq s PRO 277 Ca 0.36 1.95 -0.03 0.00 0.04 0.00 0.00 61.00 63.31 1jxq s PRO 277 Cb -0.13 -3.40 0.03 0.00 0.04 0.00 0.00 34.50 31.04 1jxq s PRO 277 CO 0.28 -0.45 0.00 0.15 0.04 0.00 0.00 177.00 177.02 1jxq s LYS 278 N 1.61 2.79 -0.08 4.56 1.02 0.60 -1.76 119.74 128.48 1jxq s LYS 278 Ca 0.63 -1.03 -0.04 0.00 0.02 0.00 0.00 55.97 55.55 1jxq s LYS 278 Cb -0.33 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 33.79 1jxq s LYS 278 CO 0.28 -0.48 0.09 -0.51 -0.92 0.00 0.00 175.35 173.81 1jxq s LEU 279 N 1.36 4.05 -0.10 3.17 1.43 0.17 -1.60 118.68 127.15 1jxq s LEU 279 Ca -0.01 0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 1jxq s LEU 279 Cb -0.18 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.01 1jxq s LEU 279 CO -0.01 0.37 -0.04 -0.36 0.23 0.00 0.00 176.35 176.53 1jxq s PHE 280 N -1.03 1.14 -0.22 0.29 0.40 0.47 -0.58 117.98 118.44 1jxq s PHE 280 Ca 0.17 -0.52 -0.06 0.00 -0.60 0.00 0.00 56.93 55.91 1jxq s PHE 280 Cb -0.12 -1.05 -0.03 0.00 0.51 0.00 0.00 43.02 42.34 1jxq s PHE 280 CO 0.06 -0.44 0.03 -0.06 0.70 0.00 0.00 175.22 175.51 1jxq s PHE 281 N 1.82 3.07 -0.24 0.36 0.40 0.09 0.13 117.98 123.61 1jxq s PHE 281 Ca 0.05 -0.44 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 1jxq s PHE 281 Cb -0.13 -2.15 0.05 0.00 0.51 0.00 0.00 43.02 41.30 1jxq s PHE 281 CO -0.07 -0.28 -0.13 0.42 0.70 0.00 0.00 175.22 175.86 1jxq s ILE 282 N 1.26 2.20 -0.78 0.64 1.01 -0.03 -1.94 121.20 123.56 1jxq s ILE 282 Ca 0.04 -1.44 -0.06 0.00 0.00 0.00 0.00 60.65 59.19 1jxq s ILE 282 Cb -0.15 -2.20 0.20 0.00 0.01 0.00 0.00 42.46 40.32 1jxq s ILE 282 CO 0.02 0.12 0.66 -1.58 0.00 0.00 0.00 174.94 174.16 1jxq s GLN 283 N 1.16 3.16 0.04 2.79 2.00 -0.69 -1.64 119.66 126.48 1jxq s GLN 283 Ca -0.05 -2.72 -0.25 0.00 -2.00 0.00 0.00 55.36 50.33 1jxq s GLN 283 Cb -0.18 -4.05 0.06 0.00 0.80 0.00 0.00 33.01 29.64 1jxq s GLN 283 CO -0.07 -1.23 0.59 0.00 -0.50 0.00 0.00 175.29 174.08 1jxq s ALA 284 N -0.37 -1.54 0.24 1.58 0.00 -1.25 -2.10 121.76 118.32 1jxq s ALA 284 Ca 0.21 0.81 -0.31 0.00 0.00 0.00 0.00 51.96 52.66 1jxq s ALA 284 Cb -0.14 0.37 -0.13 0.00 0.00 0.00 0.00 23.12 23.22 1jxq s ALA 284 CO -0.07 -0.52 1.42 0.00 0.00 0.00 0.00 175.76 176.59 1jxq n GLY 286 N 2.17 -1.34 0.00 0.00 0.00 0.28 -1.97 105.19 104.34 1jxq n GLY 286 Ca 0.11 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.43 -1.23 0.10 -0.02 0.00 0.31 -0.87 105.19 104.91 1jxq n GLY 287 Ca 0.05 -0.82 0.04 0.00 0.00 0.00 0.00 46.02 45.28 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 0.00 0.62 -2.15 1.61 -0.58 -1.11 -3.51 120.64 115.52 1jxq n GLU 288 Ca 0.00 0.16 -0.42 0.00 -0.42 0.00 0.00 57.16 56.48 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 -3.08 4.28 -0.44 3.49 0.74 -1.07 -4.68 119.66 118.90 1jxq s GLN 289 Ca -0.03 2.07 -0.20 0.00 0.05 0.00 0.00 55.36 57.26 1jxq s GLN 289 Cb 0.09 -3.44 0.03 0.00 1.10 0.00 0.00 33.01 30.79 1jxq s GLN 289 CO 0.81 -0.55 0.60 0.15 -0.55 0.00 0.00 175.29 175.76 1jxq s LYS 290 N 1.91 3.23 -0.24 1.67 1.02 -1.26 -1.17 119.74 124.89 1jxq s LYS 290 Ca 0.66 -0.50 -0.29 0.00 0.02 0.00 0.00 55.97 55.86 1jxq s LYS 290 Cb -0.35 -3.97 -0.00 0.00 -0.52 0.00 0.00 37.83 32.99 1jxq s LYS 290 CO 0.29 -1.01 1.23 0.34 -0.92 0.00 0.00 175.35 175.28 1jxq s ASP 291 N 2.04 6.85 0.17 2.83 2.15 -1.26 -4.93 116.67 124.52 1jxq s ASP 291 Ca 0.20 1.39 0.15 0.00 0.43 0.00 0.00 52.55 54.71 1jxq s ASP 291 Cb -0.15 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.88 1jxq s ASP 291 CO 0.17 -0.89 1.17 0.45 -0.17 0.00 0.00 175.17 175.90 1jxq h HIS 292 N 8.53 0.00 -0.11 -5.34 3.86 -1.89 0.37 115.15 120.57 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 0.83 0.61 0.00 0.41 0.86 0.00 0.00 177.93 180.64 1jxq n GLY 293 N 1.31 -0.42 3.36 2.45 0.00 -1.26 -4.68 105.19 105.96 1jxq n GLY 293 Ca -0.03 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.38 0.40 1.61 -0.12 -1.26 -5.14 117.98 113.09 1jxq s PHE 294 Ca 0.00 0.58 -0.24 0.00 -0.05 0.00 0.00 56.93 57.22 1jxq s PHE 294 Cb 0.00 0.24 -0.09 0.00 -0.63 0.00 0.00 43.02 42.54 1jxq s PHE 294 CO 0.00 -0.51 1.08 -2.00 -0.05 0.00 0.00 175.22 173.74 1jxq s GLU 295 N -1.50 4.14 0.00 1.99 2.12 -1.26 -5.22 118.70 118.97 1jxq s GLU 295 Ca -0.11 1.59 0.00 0.00 0.36 0.00 0.00 54.97 56.81 1jxq s GLU 295 Cb -0.03 -2.58 0.00 0.00 0.26 0.00 0.00 34.13 31.78 1jxq s GLU 295 CO 0.05 -0.18 0.00 0.28 -0.54 0.00 0.00 175.26 174.87 1jxq n VAL 296 N -0.02 0.00 -1.32 3.70 0.31 -1.26 -5.35 118.33 114.39 1jxq n VAL 296 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1jxq n VAL 296 Cb 0.49 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 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 0.70 -0.24 0.00 -0.03 0.00 0.00 56.01 56.44 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 1.36 -2.16 -1.33 0.00 0.00 177.39 175.26 1jxq s PRO 322 N -1.54 2.17 -0.02 3.23 0.04 -1.26 -4.91 135.00 132.71 1jxq s PRO 322 Ca 0.00 -0.66 0.06 0.00 0.04 0.00 0.00 61.00 60.44 1jxq s PRO 322 Cb 0.00 -5.11 -0.01 0.00 0.04 0.00 0.00 34.50 29.42 1jxq s PRO 322 CO 0.00 -4.18 -0.22 -0.08 0.04 0.00 0.00 177.00 172.56 1jxq s THR 323 N 12.31 1.74 0.32 1.26 -1.32 -1.26 -5.11 115.64 123.57 1jxq s THR 323 Ca 0.74 -0.93 -0.29 0.00 -1.21 0.00 0.00 61.69 60.00 1jxq s THR 323 Cb -0.04 -1.45 -0.11 0.00 -1.51 0.00 0.00 72.50 69.39 1jxq s THR 323 CO 0.10 0.49 1.47 -2.84 -2.21 0.00 0.00 174.62 171.64 1jxq s PRO 324 N -0.41 4.19 -0.18 7.08 0.02 -1.26 -4.85 135.00 139.59 1jxq s PRO 324 Ca 0.06 2.45 -0.07 0.00 0.02 0.00 0.00 61.00 63.46 1jxq s PRO 324 Cb -0.09 -3.03 0.08 0.00 0.02 0.00 0.00 34.50 31.48 1jxq s PRO 324 CO 0.00 -0.48 0.38 -1.12 -0.33 0.00 0.00 177.00 175.46 1jxq s SER 325 N 0.08 -0.14 -1.49 2.53 0.01 -1.26 -4.82 113.70 108.61 1jxq s SER 325 Ca 0.56 0.89 -0.04 0.00 1.31 0.00 0.00 55.95 58.68 1jxq s SER 325 Cb -0.45 1.15 0.00 0.00 0.21 0.00 0.00 66.02 66.93 1jxq s SER 325 CO 0.53 -0.23 0.49 0.47 0.41 0.00 0.00 173.24 174.91 1jxq n ASP 326 N 5.27 -5.83 -4.74 2.44 8.00 -0.73 -4.80 116.55 116.17 1jxq n ASP 326 Ca -0.09 -0.23 -0.35 0.00 0.71 0.00 0.00 54.79 54.82 1jxq n ASP 326 Cb 0.50 -4.68 -0.08 0.00 -0.02 0.00 0.00 41.12 36.84 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 -3.12 4.91 -0.10 0.53 -1.09 -1.23 -0.29 121.20 120.81 1jxq s ILE 327 Ca 0.24 -0.01 -0.03 0.00 -2.23 0.00 0.00 60.65 58.62 1jxq s ILE 327 Cb -0.11 -3.15 0.05 0.00 -1.58 0.00 0.00 42.46 37.67 1jxq s ILE 327 CO 0.30 0.56 0.08 0.12 -1.23 0.00 0.00 174.94 174.77 1jxq s PHE 328 N -0.48 0.11 -0.35 3.97 5.36 -0.63 -0.44 117.98 125.51 1jxq s PHE 328 Ca 0.10 0.00 -0.02 0.00 -0.96 0.00 0.00 56.93 56.05 1jxq s PHE 328 Cb -0.12 -0.57 0.08 0.00 -0.34 0.00 0.00 43.02 42.07 1jxq s PHE 328 CO 0.02 -0.35 0.10 0.08 -1.46 0.00 0.00 175.22 173.61 1jxq s VAL 329 N 2.16 3.15 -0.24 3.12 1.01 -0.37 -0.40 120.40 128.84 1jxq s VAL 329 Ca 0.04 -1.69 -0.24 0.00 0.00 0.00 0.00 61.98 60.08 1jxq s VAL 329 Cb -0.14 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1jxq s VAL 329 CO -0.06 -0.38 0.82 -0.55 0.00 0.00 0.00 175.10 174.93 1jxq s SER 330 N 1.49 6.83 -0.13 3.32 0.15 0.12 -1.02 113.70 124.46 1jxq s SER 330 Ca 0.02 1.03 -0.09 0.00 0.70 0.00 0.00 55.95 57.60 1jxq s SER 330 Cb -0.21 -2.43 -0.04 0.00 -1.71 0.00 0.00 66.02 61.62 1jxq s SER 330 CO -0.02 -0.50 0.18 -0.31 1.20 0.00 0.00 173.24 173.79 1jxq s TYR 331 N 2.76 3.55 0.19 3.44 2.02 0.34 -0.85 117.35 128.80 1jxq s TYR 331 Ca 0.35 0.53 -0.06 0.00 -0.37 0.00 0.00 57.07 57.52 1jxq s TYR 331 Cb -0.15 -2.07 0.10 0.00 -0.40 0.00 0.00 41.96 39.43 1jxq s TYR 331 CO 0.08 0.56 1.55 0.66 -1.57 0.00 0.00 175.55 176.83 1jxq h SER 332 N 5.57 0.82 -4.66 2.29 4.64 -1.56 -1.84 113.55 118.81 1jxq h SER 332 Ca -0.50 -0.35 -0.23 0.00 -0.47 0.00 0.00 61.79 60.24 1jxq h SER 332 Cb 1.20 -0.23 -0.16 0.00 -0.31 0.00 0.00 62.40 62.90 1jxq h SER 332 CO 0.65 1.08 -0.71 0.28 -0.87 0.00 0.00 176.83 177.27 1jxq s THR 333 N -4.40 0.65 0.32 2.95 -1.32 -1.26 -3.15 115.64 109.42 1jxq s THR 333 Ca -0.09 -1.72 -0.29 0.00 -1.21 0.00 0.00 61.69 58.38 1jxq s THR 333 Cb 0.12 -1.41 -0.11 0.00 -1.51 0.00 0.00 72.50 69.60 1jxq s THR 333 CO 0.85 -0.75 1.42 0.12 -2.21 0.00 0.00 174.62 174.05 1jxq s PHE 334 N -3.06 2.88 -0.01 9.09 5.36 -1.02 -4.75 117.98 126.46 1jxq s PHE 334 Ca 0.06 1.19 -0.36 0.00 -0.96 0.00 0.00 56.93 56.86 1jxq s PHE 334 Cb 0.01 -3.85 -0.15 0.00 -0.34 0.00 0.00 43.02 38.69 1jxq s PHE 334 CO -0.04 -2.54 1.57 -2.30 -1.46 0.00 0.00 175.22 170.45 1jxq n PRO 335 N 1.18 1.54 0.00 10.12 -0.02 -1.26 -1.51 135.00 145.04 1jxq n PRO 335 Ca 0.03 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1jxq n PRO 335 Cb 0.40 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 3.40 3.19 4.00 -1.23 0.00 -0.05 -4.91 105.19 109.59 1jxq n GLY 336 Ca 0.21 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.78 2.60 0.08 1.61 0.08 -0.57 -2.61 117.98 116.39 1jxq s PHE 337 Ca 0.00 -0.46 -0.19 0.00 0.12 0.00 0.00 56.93 56.40 1jxq s PHE 337 Cb 0.00 -2.33 -0.07 0.00 -0.57 0.00 0.00 43.02 40.05 1jxq s PHE 337 CO 0.00 -0.49 0.57 0.08 -0.10 0.00 0.00 175.22 175.28 1jxq s VAL 338 N -2.41 4.73 -0.19 -0.44 1.01 -0.31 0.11 120.40 122.90 1jxq s VAL 338 Ca 0.55 1.22 -0.09 0.00 0.00 0.00 0.00 61.98 63.67 1jxq s VAL 338 Cb -0.09 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1jxq s VAL 338 CO 0.33 0.55 0.10 -0.55 0.00 0.00 0.00 175.10 175.53 1jxq s SER 339 N -1.12 5.93 0.06 3.32 0.15 -1.26 -4.83 113.70 115.95 1jxq s SER 339 Ca 0.29 0.17 -0.10 0.00 0.70 0.00 0.00 55.95 57.01 1jxq s SER 339 Cb -0.19 -2.02 -0.06 0.00 -1.71 0.00 0.00 66.02 62.04 1jxq s SER 339 CO 0.19 0.19 0.39 0.26 1.20 0.00 0.00 173.24 175.47 1jxq s TRP 340 N 0.29 3.60 0.10 3.44 0.52 -1.26 -4.80 118.94 120.83 1jxq s TRP 340 Ca 0.06 0.80 0.02 0.00 0.02 0.00 0.00 56.10 57.01 1jxq s TRP 340 Cb -0.12 -2.17 -0.04 0.00 -1.15 0.00 0.00 33.47 30.00 1jxq s TRP 340 CO -0.01 0.55 -0.07 0.50 0.02 0.00 0.00 176.95 177.94 1jxq s ARG 341 N -1.77 0.84 -0.06 4.98 3.52 -1.26 -2.70 118.95 122.50 1jxq s ARG 341 Ca 0.31 -1.30 0.04 0.00 -0.13 0.00 0.00 55.73 54.65 1jxq s ARG 341 Cb -0.14 -0.27 0.00 0.00 -1.56 0.00 0.00 34.95 32.98 1jxq s ARG 341 CO 0.17 0.00 -0.17 0.34 -0.81 0.00 0.00 175.30 174.83 1jxq s ASP 342 N -2.93 2.24 0.58 -2.12 3.68 -0.73 -4.93 116.67 112.46 1jxq s ASP 342 Ca 0.11 -0.38 0.28 0.00 2.13 0.00 0.00 52.55 54.69 1jxq s ASP 342 Cb 0.04 -0.80 1.72 0.00 -1.45 0.00 0.00 42.92 42.42 1jxq s ASP 342 CO -0.04 0.13 2.20 -0.65 0.13 0.00 0.00 175.17 176.94 1jxq h PRO 343 N 6.51 0.00 0.00 4.34 0.11 -1.87 -0.71 132.00 140.38 1jxq h PRO 343 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 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 0.48 0.00 0.00 1.17 -0.21 0.00 0.00 178.00 179.44 1jxq n LYS 344 N -3.91 0.05 0.00 1.05 4.81 -1.26 -3.61 118.16 115.28 1jxq n LYS 344 Ca -0.02 -0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.10 1jxq n LYS 344 Cb 0.16 -0.81 0.00 0.00 0.02 0.00 0.00 35.03 34.40 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 -0.10 0.39 0.00 3.14 2.88 -1.20 -5.08 113.62 113.64 1jxq n SER 345 Ca 0.00 -0.41 0.00 0.00 -1.33 0.00 0.00 58.87 57.13 1jxq n SER 345 Cb 0.05 0.90 0.00 0.00 -0.75 0.00 0.00 64.21 64.41 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 1.01 -2.81 3.75 0.46 0.00 -0.28 -4.81 105.19 102.51 1jxq n GLY 346 Ca 0.00 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.67 6.97 0.19 1.61 1.04 -1.26 -1.78 113.70 118.79 1jxq s SER 347 Ca 0.00 2.41 -0.24 0.00 0.48 0.00 0.00 55.95 58.60 1jxq s SER 347 Cb 0.00 -2.62 0.07 0.00 0.10 0.00 0.00 66.02 63.57 1jxq s SER 347 CO 0.00 -0.43 1.56 -0.50 0.98 0.00 0.00 173.24 174.85 1jxq h TRP 348 N 4.64 -1.36 -0.19 5.02 6.55 -1.86 -1.47 115.95 127.28 1jxq h TRP 348 Ca -0.46 0.10 0.05 0.00 0.95 0.00 0.00 58.89 59.54 1jxq h TRP 348 Cb 1.22 0.71 -0.07 0.00 -0.86 0.00 0.00 29.16 30.16 1jxq h TRP 348 CO 0.60 -0.41 -0.27 -0.92 -1.05 0.00 0.00 178.44 176.39 1jxq h TYR 349 N -0.11 -0.74 -0.18 0.49 3.20 -1.92 -0.24 116.97 117.48 1jxq h TYR 349 Ca 0.23 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 62.10 1jxq h TYR 349 Cb 0.54 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1jxq h TYR 349 CO -0.83 -0.35 -0.01 0.28 -1.64 0.00 0.00 178.16 175.61 1jxq h VAL 350 N -0.31 1.26 -1.00 1.81 2.07 -1.84 0.19 116.25 118.43 1jxq h VAL 350 Ca 0.12 -0.89 0.07 0.00 0.82 0.00 0.00 66.70 66.82 1jxq h VAL 350 Cb 0.49 1.49 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 1jxq h VAL 350 CO -0.37 0.27 0.65 -0.08 0.02 0.00 0.00 177.57 178.06 1jxq h GLU 351 N 0.06 1.13 -0.09 1.57 4.81 -1.17 -0.05 114.58 120.85 1jxq h GLU 351 Ca 0.05 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1jxq h GLU 351 Cb 0.40 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 1jxq h GLU 351 CO 0.01 0.75 -0.06 1.15 -0.73 0.00 0.00 179.01 180.13 1jxq h THR 352 N 1.17 1.34 -0.25 0.32 2.02 -0.84 -2.28 112.91 114.38 1jxq h THR 352 Ca 0.43 -1.15 0.02 0.00 0.77 0.00 0.00 66.41 66.48 1jxq h THR 352 Cb 0.17 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1jxq h THR 352 CO -0.17 0.32 0.12 0.25 0.37 0.00 0.00 175.52 176.41 1jxq h LEU 353 N -0.20 0.17 -0.57 2.58 6.46 -0.07 0.67 115.31 124.36 1jxq h LEU 353 Ca 0.02 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.78 1jxq h LEU 353 Cb 0.54 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.43 1jxq h LEU 353 CO 0.02 0.13 0.32 -0.78 -0.62 0.00 0.00 178.44 177.51 1jxq h ASP 354 N 0.26 0.70 0.12 1.25 1.82 -1.08 0.32 116.42 119.81 1jxq h ASP 354 Ca 0.10 -0.08 0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1jxq h ASP 354 Cb 0.04 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.85 1jxq h ASP 354 CO -0.08 0.58 -0.16 -0.78 -1.61 0.00 0.00 179.24 177.20 1jxq h ASP 355 N 0.76 -0.42 -0.10 2.28 -0.00 -1.01 -0.25 116.42 117.67 1jxq h ASP 355 Ca 0.20 0.05 0.00 0.00 -0.00 0.00 0.00 57.03 57.28 1jxq h ASP 355 Cb 0.03 0.16 -0.00 0.00 -0.00 0.00 0.00 39.33 39.51 1jxq h ASP 355 CO -0.03 -0.23 0.06 0.40 -0.00 0.00 0.00 179.24 179.44 1jxq h ILE 356 N -0.32 1.04 -0.28 2.25 1.08 -0.53 -1.88 117.51 118.87 1jxq h ILE 356 Ca 0.02 -0.10 0.06 0.00 -0.39 0.00 0.00 64.86 64.44 1jxq h ILE 356 Cb 0.32 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 34.99 1jxq h ILE 356 CO -0.07 0.04 0.19 -0.26 -0.69 0.00 0.00 178.15 177.37 1jxq h PHE 357 N 0.12 0.10 0.58 1.37 -1.00 -0.28 0.15 116.94 117.98 1jxq h PHE 357 Ca 0.04 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.79 1jxq h PHE 357 Cb 0.01 -0.03 0.01 0.00 3.61 0.00 0.00 35.95 39.54 1jxq h PHE 357 CO -0.06 0.06 -0.28 1.49 -1.61 0.00 0.00 178.31 177.90 1jxq h GLU 358 N 0.10 -0.75 -0.16 1.51 4.57 -0.28 -2.15 114.58 117.42 1jxq h GLU 358 Ca 0.13 0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.33 1jxq h GLU 358 Cb 0.38 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1jxq h GLU 358 CO -0.01 -0.50 -0.04 1.96 -1.18 0.00 0.00 179.01 179.24 1jxq h GLN 359 N -0.85 0.23 0.00 1.92 1.08 -0.85 -3.39 115.11 113.24 1jxq h GLN 359 Ca -0.08 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 1jxq h GLN 359 Cb 0.60 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1jxq h GLN 359 CO 0.13 0.29 -0.75 0.91 -0.95 0.00 0.00 178.83 178.46 1jxq n TRP 360 N -4.36 0.00 -0.48 2.96 7.02 0.46 -4.75 117.44 118.29 1jxq n TRP 360 Ca -0.01 0.00 0.42 0.00 -1.02 0.00 0.00 57.50 56.90 1jxq n TRP 360 Cb 0.19 0.00 0.72 0.00 -2.42 0.00 0.00 31.31 29.80 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 3.44 0.00 6.99 0.00 -1.53 0.62 119.26 128.78 1jxq h ALA 361 Ca 0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1jxq h ALA 361 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1jxq h ALA 361 CO 0.00 -2.01 -0.35 1.12 0.00 0.00 0.00 179.25 178.01 1jxq h HIS 362 N 0.00 0.00 0.00 0.00 2.07 -1.85 -3.34 115.15 112.03 1jxq h HIS 362 Ca 0.73 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.25 1jxq h HIS 362 Cb 3.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 33.14 1jxq h HIS 362 CO 0.00 0.35 0.00 -1.13 -3.07 0.00 0.00 177.93 174.08 1jxq n SER 363 N -3.53 0.98 -4.04 3.10 3.41 0.20 -5.01 113.62 108.72 1jxq n SER 363 Ca -0.00 -1.31 -0.15 0.00 -0.26 0.00 0.00 58.87 57.15 1jxq n SER 363 Cb 0.49 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.31 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 -0.31 0.54 0.63 4.33 2.02 -0.41 -5.13 118.70 120.37 1jxq s GLU 364 Ca 0.00 -0.59 -0.15 0.00 0.02 0.00 0.00 54.97 54.25 1jxq s GLU 364 Cb 0.00 -0.40 -0.02 0.00 0.10 0.00 0.00 34.13 33.82 1jxq s GLU 364 CO 0.00 0.09 1.08 0.16 0.02 0.00 0.00 175.26 176.60 1jxq s ASP 365 N -1.11 5.47 0.26 -0.19 1.47 -1.26 -4.59 116.67 116.72 1jxq s ASP 365 Ca -0.05 1.85 -0.11 0.00 1.18 0.00 0.00 52.55 55.42 1jxq s ASP 365 Cb -0.07 -2.53 0.37 0.00 -0.34 0.00 0.00 42.92 40.34 1jxq s ASP 365 CO 0.00 -1.38 1.57 0.25 0.68 0.00 0.00 175.17 176.29 1jxq h LEU 366 N 0.12 -1.01 -0.17 2.11 5.85 -0.15 -1.58 115.31 120.46 1jxq h LEU 366 Ca -0.46 0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1jxq h LEU 366 Cb 1.23 0.62 -0.01 0.00 0.37 0.00 0.00 40.66 42.87 1jxq h LEU 366 CO 0.56 -0.31 0.06 1.56 -0.34 0.00 0.00 178.44 179.97 1jxq h GLN 367 N -0.01 0.27 -0.74 1.25 4.20 -1.93 -2.46 115.11 115.70 1jxq h GLN 367 Ca 0.42 -0.06 0.11 0.00 0.06 0.00 0.00 58.65 59.18 1jxq h GLN 367 Cb 0.66 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.33 1jxq h GLN 367 CO -0.96 0.38 0.36 0.77 -0.67 0.00 0.00 178.83 178.70 1jxq h SER 368 N 0.11 0.44 -0.29 1.46 0.02 -1.69 -1.02 113.55 112.57 1jxq h SER 368 Ca 0.06 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.13 1jxq h SER 368 Cb 0.22 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1jxq h SER 368 CO -0.00 0.23 -0.02 -0.07 -1.14 0.00 0.00 176.83 175.83 1jxq h LEU 369 N 0.58 -0.16 -2.00 5.07 3.38 -1.15 -2.33 115.31 118.70 1jxq h LEU 369 Ca 0.37 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.40 1jxq h LEU 369 Cb 0.44 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1jxq h LEU 369 CO -0.30 -0.05 -0.07 -0.07 0.09 0.00 0.00 178.44 178.04 1jxq h LEU 370 N 0.06 0.00 -0.19 1.67 -0.00 -0.73 -1.38 115.31 114.74 1jxq h LEU 370 Ca 0.14 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.94 1jxq h LEU 370 Cb 0.20 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.85 1jxq h LEU 370 CO -0.26 0.07 -0.20 -0.07 -0.00 0.00 0.00 178.44 177.98 1jxq h LEU 371 N 0.00 0.50 -0.41 1.67 3.38 -0.84 0.14 115.31 119.75 1jxq h LEU 371 Ca -0.00 -0.48 0.07 0.00 0.09 0.00 0.00 57.88 57.56 1jxq h LEU 371 Cb 0.33 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 1jxq h LEU 371 CO 0.01 0.88 0.03 0.03 0.09 0.00 0.00 178.44 179.48 1jxq h ARG 372 N 0.13 0.14 -0.25 1.13 3.08 -1.16 0.74 114.38 118.19 1jxq h ARG 372 Ca 0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1jxq h ARG 372 Cb 0.74 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1jxq h ARG 372 CO 0.05 0.09 0.16 0.28 -1.07 0.00 0.00 179.97 179.48 1jxq h VAL 373 N 0.14 1.07 -0.74 2.04 2.07 -1.04 0.13 116.25 119.92 1jxq h VAL 373 Ca 0.20 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.51 1jxq h VAL 373 Cb 0.27 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1jxq h VAL 373 CO -0.31 0.07 0.24 0.00 0.02 0.00 0.00 177.57 177.59 1jxq h ALA 374 N 1.08 1.01 -0.08 1.67 0.00 -0.10 -1.24 119.26 121.60 1jxq h ALA 374 Ca 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1jxq h ALA 374 Cb -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1jxq h ALA 374 CO -0.02 0.66 0.00 -0.97 0.00 0.00 0.00 179.25 178.93 1jxq h ASN 375 N 1.11 0.13 0.28 0.00 -1.24 0.89 -2.06 115.58 114.68 1jxq h ASN 375 Ca 0.24 -0.29 0.00 0.00 0.71 0.00 0.00 56.30 56.96 1jxq h ASN 375 Cb 0.30 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 39.29 1jxq h ASN 375 CO -0.01 0.39 -0.31 0.00 -1.29 0.00 0.00 177.43 176.21 1jxq h ALA 376 N 0.74 -0.63 -0.35 1.57 0.00 -0.56 -2.77 119.26 117.27 1jxq h ALA 376 Ca 0.02 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1jxq h ALA 376 Cb 0.32 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1jxq h ALA 376 CO 0.00 -0.89 0.23 0.28 0.00 0.00 0.00 179.25 178.87 1jxq h VAL 377 N -0.63 1.05 0.00 0.00 2.07 -1.27 -2.86 116.25 114.62 1jxq h VAL 377 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1jxq h VAL 377 Cb 0.58 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1jxq h VAL 377 CO -0.08 0.08 0.00 0.77 0.02 0.00 0.00 177.57 178.35 1jxq h SER 378 N 0.42 0.00 0.02 0.57 4.64 -1.06 -1.82 113.55 116.31 1jxq h SER 378 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1jxq h SER 378 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1jxq h SER 378 CO -0.03 0.00 -0.18 1.33 -0.87 0.00 0.00 176.83 177.07 1jxq n VAL 379 N -3.05 0.00 -1.32 0.95 0.24 -1.08 -4.80 118.33 109.27 1jxq n VAL 379 Ca -0.02 -0.32 -0.30 0.00 -2.04 0.00 0.00 64.34 61.65 1jxq n VAL 379 Cb 0.11 1.07 0.22 0.00 -1.47 0.00 0.00 33.84 33.77 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 -2.22 -0.67 0.00 7.34 1.02 -0.69 -5.01 119.74 119.51 1jxq s LYS 380 Ca 0.26 -0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.10 1jxq s LYS 380 Cb 0.19 -1.67 0.00 0.00 -0.52 0.00 0.00 37.83 35.84 1jxq s LYS 380 CO 0.42 -3.33 0.00 0.41 -0.92 0.00 0.00 175.35 171.93 1jxq n GLY 381 N -1.75 0.00 0.14 -3.33 0.00 -1.26 -4.63 105.19 94.37 1jxq n GLY 381 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 1.09 -3.29 -0.61 2.04 -1.96 -3.44 117.51 111.33 1jxq h ILE 382 Ca 0.00 -2.55 -0.56 0.00 1.00 0.00 0.00 64.86 62.74 1jxq h ILE 382 Cb 0.00 2.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.91 1jxq h ILE 382 CO 0.00 0.82 -0.06 -0.31 0.00 0.00 0.00 178.15 178.60 1jxq s TYR 383 N -2.56 3.69 0.16 1.37 1.51 -1.26 -4.82 117.35 115.44 1jxq s TYR 383 Ca -0.14 1.16 -0.03 0.00 -1.01 0.00 0.00 57.07 57.05 1jxq s TYR 383 Cb 0.05 -2.43 -0.05 0.00 -0.11 0.00 0.00 41.96 39.41 1jxq s TYR 383 CO 0.87 0.49 0.37 0.15 -1.11 0.00 0.00 175.55 176.32 1jxq s LYS 384 N -1.59 3.56 -0.02 -0.62 -0.14 0.13 -4.91 119.74 116.15 1jxq s LYS 384 Ca 0.34 -0.22 -0.00 0.00 -1.36 0.00 0.00 55.97 54.73 1jxq s LYS 384 Cb -0.17 -2.86 0.03 0.00 -1.68 0.00 0.00 37.83 33.15 1jxq s LYS 384 CO 0.19 0.45 0.04 -1.14 -0.76 0.00 0.00 175.35 174.13 1jxq s GLN 385 N -2.92 -0.03 -0.56 1.68 0.74 -1.26 -4.39 119.66 112.92 1jxq s GLN 385 Ca 0.40 0.20 0.04 0.00 0.05 0.00 0.00 55.36 56.05 1jxq s GLN 385 Cb -0.12 -0.24 0.14 0.00 1.10 0.00 0.00 33.01 33.89 1jxq s GLN 385 CO 0.27 -0.17 0.31 1.41 -0.55 0.00 0.00 175.29 176.56 1jxq s MET 386 N 1.07 2.06 0.72 1.67 -2.45 -1.26 -3.94 119.30 117.18 1jxq s MET 386 Ca -0.09 -2.76 -0.16 0.00 -1.25 0.00 0.00 55.69 51.43 1jxq s MET 386 Cb -0.13 -3.32 0.02 0.00 1.25 0.00 0.00 34.83 32.65 1jxq s MET 386 CO -0.03 -1.15 1.07 -2.30 1.05 0.00 0.00 175.02 173.66 1jxq n PRO 387 N 2.88 0.56 -3.80 4.11 -0.02 -1.19 -2.44 135.00 135.09 1jxq n PRO 387 Ca 0.08 0.25 0.02 0.00 -2.02 0.00 0.00 63.50 61.83 1jxq n PRO 387 Cb 0.33 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 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 -1.68 -0.25 0.09 -1.23 0.00 -0.69 -4.83 107.32 98.74 1jxq s GLY 388 Ca 0.75 0.32 -0.10 0.00 0.00 0.00 0.00 44.72 45.70 1jxq s GLY 388 CO 0.49 2.75 0.22 0.00 0.00 0.00 0.00 173.10 176.56 1jxq s PHE 390 N -3.76 3.27 -0.41 0.00 0.40 -0.18 -4.95 117.98 112.34 1jxq s PHE 390 Ca 0.04 -1.09 -0.17 0.00 -0.60 0.00 0.00 56.93 55.12 1jxq s PHE 390 Cb 0.04 -3.17 0.02 0.00 0.51 0.00 0.00 43.02 40.42 1jxq s PHE 390 CO -0.11 -0.82 0.41 1.21 0.70 0.00 0.00 175.22 176.61 1jxq s ASN 392 N 2.57 6.18 -0.21 1.36 3.84 -1.26 -1.23 114.94 126.18 1jxq s ASN 392 Ca 0.04 -0.66 0.12 0.00 0.21 0.00 0.00 52.86 52.57 1jxq s ASN 392 Cb -0.24 -2.21 0.42 0.00 -0.55 0.00 0.00 41.25 38.66 1jxq s ASN 392 CO 0.05 -0.53 1.27 0.49 -2.79 0.00 0.00 177.10 175.59 1jxq n PHE 393 N 5.51 0.27 -1.89 0.43 3.72 0.41 -5.03 117.46 120.88 1jxq n PHE 393 Ca -0.08 -1.41 -0.31 0.00 -0.05 0.00 0.00 57.45 55.61 1jxq n PHE 393 Cb 0.48 -0.29 0.01 0.00 -0.94 0.00 0.00 39.48 38.74 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 -3.16 3.20 -0.01 4.37 1.43 -1.22 -1.77 118.68 121.52 1jxq s LEU 394 Ca 0.38 1.37 0.13 0.00 -1.03 0.00 0.00 54.13 54.98 1jxq s LEU 394 Cb 0.36 -4.39 -0.18 0.00 0.03 0.00 0.00 46.19 42.01 1jxq s LEU 394 CO -0.03 -0.92 0.35 0.54 0.23 0.00 0.00 176.35 176.52 1jxq n ARG 395 N -2.77 1.11 -4.14 1.70 1.74 -1.26 -4.91 116.66 108.14 1jxq n ARG 395 Ca 0.06 -0.08 -0.14 0.00 -0.77 0.00 0.00 57.85 56.92 1jxq n ARG 395 Cb 0.54 -1.24 -0.07 0.00 -1.02 0.00 0.00 32.46 30.67 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 -2.68 1.58 0.52 5.56 1.02 -1.26 -4.95 119.74 119.53 1jxq s LYS 396 Ca -0.02 -1.66 -0.17 0.00 0.02 0.00 0.00 55.97 54.14 1jxq s LYS 396 Cb 0.08 0.37 -0.08 0.00 -0.52 0.00 0.00 37.83 37.69 1jxq s LYS 396 CO 0.52 -0.61 0.99 0.15 -0.92 0.00 0.00 175.35 175.49 1jxq s LYS 397 N -3.67 3.89 -0.17 1.68 1.02 0.49 -4.76 119.74 118.22 1jxq s LYS 397 Ca 0.33 1.01 0.01 0.00 0.02 0.00 0.00 55.97 57.34 1jxq s LYS 397 Cb 0.02 -2.13 0.03 0.00 -0.52 0.00 0.00 37.83 35.24 1jxq s LYS 397 CO 0.17 -0.32 -0.14 -1.17 -0.92 0.00 0.00 175.35 172.97 1jxq s LEU 398 N -4.05 2.00 -0.20 3.17 2.96 -1.26 -1.01 118.68 120.30 1jxq s LEU 398 Ca 0.60 -0.67 -0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1jxq s LEU 398 Cb -0.11 -1.26 -0.01 0.00 0.50 0.00 0.00 46.19 45.32 1jxq s LEU 398 CO 0.30 -0.08 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.84 1jxq s PHE 399 N 1.41 2.94 0.56 5.38 0.08 -1.26 0.67 117.98 127.76 1jxq s PHE 399 Ca 0.03 -0.84 -0.17 0.00 0.12 0.00 0.00 56.93 56.06 1jxq s PHE 399 Cb -0.14 -2.05 -0.05 0.00 -0.57 0.00 0.00 43.02 40.21 1jxq s PHE 399 CO -0.10 -0.45 1.06 -0.06 -0.10 0.00 0.00 175.22 175.57 1jxq s PHE 400 N 1.19 2.94 -0.29 0.36 0.08 -1.26 -4.78 117.98 116.22 1jxq s PHE 400 Ca 0.02 1.53 -0.29 0.00 0.12 0.00 0.00 56.93 58.32 1jxq s PHE 400 Cb -0.14 -3.06 0.00 0.00 -0.57 0.00 0.00 43.02 39.25 1jxq s PHE 400 CO -0.02 -1.10 1.24 0.21 -0.10 0.00 0.00 175.22 175.45 1jxq s LYS 401 N -3.76 3.99 0.15 0.44 2.47 -1.26 -4.89 119.74 116.88 1jxq s LYS 401 Ca 0.66 1.25 0.03 0.00 -1.56 0.00 0.00 55.97 56.35 1jxq s LYS 401 Cb -0.17 -3.83 -0.04 0.00 -1.46 0.00 0.00 37.83 32.34 1jxq s LYS 401 CO 0.31 -1.01 0.27 0.95 0.16 0.00 0.00 175.35 176.03 1jxq s THR 402 N 4.08 5.22 0.00 3.43 -4.23 -1.26 -4.07 115.64 118.80 1jxq s THR 402 Ca 0.53 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 1jxq s THR 402 Cb -0.16 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 69.99 1jxq s THR 402 CO 0.20 -0.10 0.00 -1.54 -0.54 0.00 0.00 174.62 172.64