#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jxq n ALA 149 N 0.00 -0.49 -2.12 -2.53 0.00 -1.26 -0.99 120.51 113.11 1jxq n ALA 149 Ca 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.56 1jxq n ALA 149 Cb 0.00 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 17.35 1jxq n ALA 149 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1jxq n ASP 150 N -1.69 -3.78 0.01 0.00 2.03 -1.26 -4.90 116.55 106.95 1jxq n ASP 150 Ca -0.22 0.02 0.11 0.00 0.52 0.00 0.00 54.79 55.22 1jxq n ASP 150 Cb 0.68 -2.93 0.05 0.00 -0.72 0.00 0.00 41.12 38.20 1jxq n ASP 150 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1jxq n LEU 151 N -1.61 0.68 -3.86 -2.67 4.77 -0.17 -4.85 117.00 109.30 1jxq n LEU 151 Ca -0.13 -0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 55.57 1jxq n LEU 151 Cb 0.58 -0.12 -0.11 0.00 -2.33 0.00 0.00 43.42 41.44 1jxq n LEU 151 CO 0.16 0.13 -0.20 0.00 -1.33 0.00 0.00 177.39 176.15 1jxq s ALA 152 N -3.08 -0.29 0.31 -1.18 0.00 -1.26 -1.42 121.76 114.84 1jxq s ALA 152 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.75 1jxq s ALA 152 Cb 0.16 -0.00 -0.10 0.00 0.00 0.00 0.00 23.12 23.18 1jxq s ALA 152 CO 0.79 -0.16 1.21 0.71 0.00 0.00 0.00 175.76 178.32 1jxq s TYR 153 N -0.90 3.29 -0.30 0.00 1.51 -0.37 -4.78 117.35 115.79 1jxq s TYR 153 Ca -0.10 1.54 -0.24 0.00 -1.01 0.00 0.00 57.07 57.26 1jxq s TYR 153 Cb -0.06 -3.50 0.00 0.00 -0.11 0.00 0.00 41.96 38.29 1jxq s TYR 153 CO 0.01 -1.27 0.82 0.42 -1.11 0.00 0.00 175.55 174.42 1jxq s ILE 154 N -1.14 4.77 -0.77 2.71 -1.09 -1.26 -4.70 121.20 119.72 1jxq s ILE 154 Ca 0.47 1.26 0.03 0.00 -2.23 0.00 0.00 60.65 60.18 1jxq s ILE 154 Cb -0.36 -4.17 0.25 0.00 -1.58 0.00 0.00 42.46 36.59 1jxq s ILE 154 CO 0.47 -0.26 0.86 0.18 -1.23 0.00 0.00 174.94 174.96 1jxq n LEU 155 N 6.25 4.24 -0.08 2.97 4.32 -1.26 -4.85 117.00 128.59 1jxq n LEU 155 Ca 0.05 -5.33 -0.21 0.00 -0.02 0.00 0.00 56.01 50.49 1jxq n LEU 155 Cb 0.48 -0.86 -0.12 0.00 -1.62 0.00 0.00 43.42 41.30 1jxq n LEU 155 CO 0.51 1.88 -0.48 0.77 -1.22 0.00 0.00 177.39 178.84 1jxq h SER 156 N 4.83 0.09 -2.62 -1.43 4.64 -1.97 -3.46 113.55 113.63 1jxq h SER 156 Ca 0.19 -0.64 -0.58 0.00 -0.47 0.00 0.00 61.79 60.30 1jxq h SER 156 Cb 0.69 -0.03 0.19 0.00 -0.31 0.00 0.00 62.40 62.93 1jxq h SER 156 CO 0.92 1.52 -0.84 0.80 -0.87 0.00 0.00 176.83 178.36 1jxq n MET 156 N -4.27 0.19 -3.59 4.77 0.00 -1.26 -4.99 117.12 107.97 1jxq n MET 156 Ca -0.30 0.09 -0.23 0.00 -0.00 0.00 0.00 57.70 57.25 1jxq n MET 156 Cb 0.74 -1.43 -0.16 0.00 0.00 0.00 0.00 33.22 32.37 1jxq n MET 156 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1jxq s GLU 161 N -1.99 0.08 0.85 2.12 2.56 -1.26 -3.68 118.70 117.38 1jxq s GLU 161 Ca 0.60 0.04 -0.10 0.00 0.00 0.00 0.00 54.97 55.51 1jxq s GLU 161 Cb -0.39 -1.53 0.11 0.00 2.00 0.00 0.00 34.13 34.31 1jxq s GLU 161 CO 0.63 -0.63 1.12 -1.25 -0.56 0.00 0.00 175.26 174.57 1jxq s PRO 162 N 2.19 1.56 0.23 4.30 0.04 -1.26 -5.10 135.00 136.96 1jxq s PRO 162 Ca 0.03 1.38 -0.00 0.00 0.04 0.00 0.00 61.00 62.45 1jxq s PRO 162 Cb -0.16 -1.80 0.24 0.00 0.04 0.00 0.00 34.50 32.82 1jxq s PRO 162 CO -0.09 -2.20 1.59 0.00 0.04 0.00 0.00 177.00 176.34 1jxq n GLY 163 N 0.02 -1.29 3.89 0.00 0.00 -1.25 -1.11 105.19 105.44 1jxq n GLY 163 Ca -0.02 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.66 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 3.56 -0.05 1.61 3.76 -1.21 -0.83 115.29 119.14 1jxq s HIS 164 Ca 0.00 0.50 -0.01 0.00 -0.15 0.00 0.00 55.06 55.40 1jxq s HIS 164 Cb 0.00 -1.94 0.03 0.00 1.11 0.00 0.00 32.58 31.78 1jxq s HIS 164 CO 0.00 0.62 0.01 0.00 -0.85 0.00 0.00 174.74 174.52 1jxq s LEU 166 N 1.65 3.03 -0.28 0.00 2.96 0.70 -0.85 118.68 125.90 1jxq s LEU 166 Ca -0.01 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1jxq s LEU 166 Cb -0.13 -1.70 0.05 0.00 0.50 0.00 0.00 46.19 44.92 1jxq s LEU 166 CO -0.03 0.20 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.50 1jxq s ILE 167 N 0.18 2.52 -0.35 6.68 1.01 -0.35 0.29 121.20 131.18 1jxq s ILE 167 Ca -0.04 -1.52 -0.21 0.00 0.00 0.00 0.00 60.65 58.88 1jxq s ILE 167 Cb -0.14 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.87 1jxq s ILE 167 CO 0.04 -0.05 0.66 -0.63 0.00 0.00 0.00 174.94 174.95 1jxq s ILE 168 N 1.17 4.87 -0.40 2.92 -1.09 0.27 -1.55 121.20 127.39 1jxq s ILE 168 Ca -0.07 0.66 -0.03 0.00 -2.23 0.00 0.00 60.65 58.98 1jxq s ILE 168 Cb -0.20 -4.09 0.11 0.00 -1.58 0.00 0.00 42.46 36.70 1jxq s ILE 168 CO -0.03 -0.32 0.20 0.21 -1.23 0.00 0.00 174.94 173.77 1jxq s ASN 169 N 1.78 5.25 -0.28 3.58 2.47 -0.40 -0.11 114.94 127.23 1jxq s ASN 169 Ca 0.26 -1.99 -0.15 0.00 0.42 0.00 0.00 52.86 51.40 1jxq s ASN 169 Cb -0.14 -1.83 -0.04 0.00 -1.45 0.00 0.00 41.25 37.79 1jxq s ASN 169 CO 0.15 -0.53 0.36 0.20 -3.72 0.00 0.00 177.10 173.55 1jxq s ASN 170 N 1.81 6.22 -0.01 -4.21 -0.87 -0.03 -1.28 114.94 116.59 1jxq s ASN 170 Ca 0.08 0.21 -0.00 0.00 -1.57 0.00 0.00 52.86 51.58 1jxq s ASN 170 Cb -0.23 -2.20 -0.00 0.00 -0.02 0.00 0.00 41.25 38.80 1jxq s ASN 170 CO -0.04 -0.19 -0.01 0.52 -2.57 0.00 0.00 177.10 174.82 1jxq n VAL 171 N 5.13 0.04 -3.77 1.60 0.31 -1.26 -4.47 118.33 115.92 1jxq n VAL 171 Ca -0.09 -0.01 -0.36 0.00 -0.01 0.00 0.00 64.34 63.86 1jxq n VAL 171 Cb 0.51 -0.85 -0.13 0.00 -0.91 0.00 0.00 33.84 32.46 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 -4.40 5.05 0.10 4.52 0.01 -1.26 -0.38 114.94 118.58 1jxq s ASN 172 Ca -0.01 -0.30 0.06 0.00 -0.71 0.00 0.00 52.86 51.90 1jxq s ASN 172 Cb 0.00 -1.90 -0.04 0.00 0.41 0.00 0.00 41.25 39.72 1jxq s ASN 172 CO 0.02 -0.06 -0.04 -0.36 -1.51 0.00 0.00 177.10 175.15 1jxq s PHE 173 N 1.59 2.90 0.88 2.20 0.40 -1.26 -4.77 117.98 119.91 1jxq s PHE 173 Ca 0.06 -0.08 -0.11 0.00 -0.60 0.00 0.00 56.93 56.21 1jxq s PHE 173 Cb -0.15 -1.49 0.12 0.00 0.51 0.00 0.00 43.02 42.01 1jxq s PHE 173 CO 0.03 0.46 1.11 0.00 0.70 0.00 0.00 175.22 177.52 1jxq h ARG 175 N -1.63 0.90 -0.94 0.00 -0.00 -1.94 -3.16 114.38 107.61 1jxq h ARG 175 Ca -0.45 -0.33 0.21 0.00 -0.00 0.00 0.00 59.98 59.42 1jxq h ARG 175 Cb 1.26 -0.06 -0.07 0.00 -0.00 0.00 0.00 29.97 31.10 1jxq h ARG 175 CO 0.47 0.97 0.62 0.93 -0.00 0.00 0.00 179.97 182.96 1jxq h GLU 175 N 0.75 0.41 -0.03 0.08 5.08 -1.95 -1.79 114.58 117.12 1jxq h GLU 175 Ca 0.13 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.26 1jxq h GLU 175 Cb 0.62 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1jxq h GLU 175 CO 0.04 0.27 -0.84 0.66 -1.00 0.00 0.00 179.01 178.14 1jxq h SER 175 N 0.42 0.45 -0.03 1.42 4.64 -1.84 -3.47 113.55 115.13 1jxq h SER 175 Ca 0.50 -0.33 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 1jxq h SER 175 Cb 1.23 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1jxq h SER 175 CO -0.20 1.10 -0.01 0.61 -0.87 0.00 0.00 176.83 177.46 1jxq n GLY 175 N 0.77 0.47 3.66 -0.77 0.00 -0.67 -5.00 105.19 103.66 1jxq n GLY 175 Ca -0.05 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.14 4.15 0.74 0.99 1.43 -1.26 -5.03 118.68 119.56 1jxq s LEU 176 Ca 0.00 1.15 -0.15 0.00 -1.03 0.00 0.00 54.13 54.10 1jxq s LEU 176 Cb 0.00 -3.24 0.04 0.00 0.03 0.00 0.00 46.19 43.03 1jxq s LEU 176 CO 0.00 -0.44 1.23 -0.13 0.23 0.00 0.00 176.35 177.24 1jxq s ARG 177 N 2.38 2.03 0.30 1.70 0.52 -1.26 -4.48 118.95 120.14 1jxq s ARG 177 Ca 0.38 1.84 -0.29 0.00 -0.52 0.00 0.00 55.73 57.14 1jxq s ARG 177 Cb -0.16 -1.81 -0.10 0.00 0.52 0.00 0.00 34.95 33.39 1jxq s ARG 177 CO 0.11 -1.94 1.40 0.99 0.02 0.00 0.00 175.30 175.88 1jxq s THR 178 N -1.89 2.59 -1.12 0.02 2.01 -1.26 -4.74 115.64 111.24 1jxq s THR 178 Ca 0.76 0.54 -0.04 0.00 0.31 0.00 0.00 61.69 63.26 1jxq s THR 178 Cb -0.31 -3.34 0.27 0.00 0.01 0.00 0.00 72.50 69.12 1jxq s THR 178 CO 0.46 0.11 1.74 0.54 -0.69 0.00 0.00 174.62 176.78 1jxq n ARG 179 N 1.49 4.65 -2.15 4.92 1.74 0.49 -5.00 116.66 122.80 1jxq n ARG 179 Ca 0.03 -4.31 -0.41 0.00 -0.77 0.00 0.00 57.85 52.39 1jxq n ARG 179 Cb 0.41 -2.58 -0.03 0.00 -1.02 0.00 0.00 32.46 29.24 1jxq n ARG 179 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1jxq s THR 180 N -2.58 2.92 0.00 0.55 -4.23 -1.26 -2.40 115.64 108.64 1jxq s THR 180 Ca 0.37 0.83 0.00 0.00 -1.18 0.00 0.00 61.69 61.71 1jxq s THR 180 Cb 0.11 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.42 1jxq s THR 180 CO 0.00 0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.85 1jxq n GLY 181 N 1.67 2.66 0.21 3.99 0.00 -1.26 -4.52 105.19 107.95 1jxq n GLY 181 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1jxq n GLY 181 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1jxq h SER 182 N 0.00 0.00 -0.30 1.61 0.87 -1.84 -2.43 113.55 111.46 1jxq h SER 182 Ca 0.00 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.47 1jxq h SER 182 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1jxq h SER 182 CO 0.00 0.28 -0.12 0.78 -0.53 0.00 0.00 176.83 177.24 1jxq h ASN 183 N 0.00 0.72 -0.22 6.23 2.35 -1.91 0.23 115.58 122.97 1jxq h ASN 183 Ca -0.00 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 1jxq h ASN 183 Cb 0.65 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1jxq h ASN 183 CO 0.04 0.86 0.14 0.40 -1.65 0.00 0.00 177.43 177.22 1jxq h ILE 184 N 0.66 1.06 -0.23 2.81 1.08 -1.83 -0.53 117.51 120.52 1jxq h ILE 184 Ca 0.11 -0.10 0.04 0.00 -0.39 0.00 0.00 64.86 64.52 1jxq h ILE 184 Cb 0.58 0.73 -0.04 0.00 -3.07 0.00 0.00 36.82 35.03 1jxq h ILE 184 CO 0.04 0.05 -0.00 0.44 -0.69 0.00 0.00 178.15 177.99 1jxq h ASP 185 N 0.30 -0.09 -0.53 1.72 3.45 -1.18 -1.72 116.42 118.36 1jxq h ASP 185 Ca 0.08 0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.61 1jxq h ASP 185 Cb -0.03 0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 38.80 1jxq h ASP 185 CO -0.02 -0.02 0.33 0.00 -1.57 0.00 0.00 179.24 177.97 1jxq h GLU 187 N 0.67 1.13 -0.36 0.00 4.57 -0.79 0.14 114.58 119.94 1jxq h GLU 187 Ca 0.21 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1jxq h GLU 187 Cb -0.02 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 1jxq h GLU 187 CO -0.07 0.98 0.19 0.87 -1.18 0.00 0.00 179.01 179.80 1jxq h LYS 188 N 1.08 0.51 -0.34 1.92 1.57 -0.92 -1.55 116.57 118.83 1jxq h LYS 188 Ca 0.23 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.82 1jxq h LYS 188 Cb 0.35 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1jxq h LYS 188 CO -0.00 0.43 -0.28 -0.07 -0.57 0.00 0.00 179.45 178.96 1jxq h LEU 189 N 0.45 0.83 -0.25 2.94 3.38 -1.04 -0.47 115.31 121.15 1jxq h LEU 189 Ca 0.12 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.66 1jxq h LEU 189 Cb 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1jxq h LEU 189 CO -0.02 1.11 0.14 -0.09 0.09 0.00 0.00 178.44 179.67 1jxq h ARG 190 N 0.57 0.28 -0.81 1.13 2.43 -0.67 0.52 114.38 117.83 1jxq h ARG 190 Ca 0.06 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1jxq h ARG 190 Cb 0.85 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.30 1jxq h ARG 190 CO 0.07 0.19 0.45 -0.09 -1.51 0.00 0.00 179.97 179.08 1jxq h ARG 191 N 0.29 1.11 0.61 0.20 9.65 -1.25 -2.50 114.38 122.49 1jxq h ARG 191 Ca 0.10 -0.12 -0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1jxq h ARG 191 Cb 0.00 -0.22 0.01 0.00 -1.39 0.00 0.00 29.97 28.36 1jxq h ARG 191 CO -0.05 0.81 -0.29 -0.09 2.80 0.00 0.00 179.97 183.15 1jxq h ARG 192 N 1.12 -0.78 0.00 0.20 9.65 -0.34 -2.75 114.38 121.47 1jxq h ARG 192 Ca 0.29 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.22 1jxq h ARG 192 Cb 0.01 0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.77 1jxq h ARG 192 CO -0.05 -0.52 0.00 1.19 2.80 0.00 0.00 179.97 183.39 1jxq n PHE 193 N -5.01 0.49 -0.02 2.20 3.01 0.10 -0.77 117.46 117.47 1jxq n PHE 193 Ca -0.10 0.22 -0.16 0.00 1.01 0.00 0.00 57.45 58.42 1jxq n PHE 193 Cb 0.32 -0.86 -0.10 0.00 -0.01 0.00 0.00 39.48 38.83 1jxq n PHE 193 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1jxq h SER 194 N 0.00 0.42 -0.17 4.37 0.87 -1.39 -1.85 113.55 115.79 1jxq h SER 194 Ca 0.00 -0.71 0.02 0.00 -1.23 0.00 0.00 61.79 59.87 1jxq h SER 194 Cb 0.14 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1jxq h SER 194 CO 0.00 1.07 0.11 0.28 -0.53 0.00 0.00 176.83 177.76 1jxq h SER 195 N -0.20 0.13 -0.07 6.23 0.02 -0.65 0.19 113.55 119.21 1jxq h SER 195 Ca -0.04 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1jxq h SER 195 Cb 1.10 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 63.60 1jxq h SER 195 CO 0.08 0.09 0.00 0.18 -1.14 0.00 0.00 176.83 176.05 1jxq n LEU 196 N -4.51 1.58 -3.47 5.07 4.77 -0.84 -4.56 117.00 115.03 1jxq n LEU 196 Ca 0.00 -0.80 -0.23 0.00 -0.03 0.00 0.00 56.01 54.95 1jxq n LEU 196 Cb 0.13 -0.52 0.07 0.00 -2.33 0.00 0.00 43.42 40.78 1jxq n LEU 196 CO 0.35 0.30 0.22 1.41 -1.33 0.00 0.00 177.39 178.34 1jxq n HIS 197 N 0.08 -2.75 -4.18 -1.77 8.25 0.68 -4.49 115.22 111.03 1jxq n HIS 197 Ca 0.03 0.96 -0.24 0.00 -0.26 0.00 0.00 57.72 58.21 1jxq n HIS 197 Cb 0.37 -4.90 -0.06 0.00 1.12 0.00 0.00 29.99 26.51 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 -3.30 2.94 -0.92 4.41 0.40 -0.71 -0.46 117.98 120.35 1jxq s PHE 198 Ca 0.55 -0.14 -0.15 0.00 -0.60 0.00 0.00 56.93 56.59 1jxq s PHE 198 Cb -0.24 -1.35 0.19 0.00 0.51 0.00 0.00 43.02 42.13 1jxq s PHE 198 CO 0.68 0.55 0.98 -1.64 0.70 0.00 0.00 175.22 176.49 1jxq s MET 199 N -3.53 3.69 0.10 0.44 -1.94 -0.01 -4.55 119.30 113.51 1jxq s MET 199 Ca 0.31 -2.28 -0.30 0.00 -1.71 0.00 0.00 55.69 51.71 1jxq s MET 199 Cb -0.08 -4.67 -0.06 0.00 2.01 0.00 0.00 34.83 32.03 1jxq s MET 199 CO 0.22 -1.50 1.08 0.08 -0.01 0.00 0.00 175.02 174.89 1jxq s VAL 200 N 1.08 4.22 -0.11 -6.03 1.01 -1.26 -2.60 120.40 116.70 1jxq s VAL 200 Ca 0.26 1.74 0.00 0.00 0.00 0.00 0.00 61.98 63.98 1jxq s VAL 200 Cb -0.08 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.22 1jxq s VAL 200 CO -0.08 0.22 -0.09 -0.70 0.00 0.00 0.00 175.10 174.44 1jxq s GLU 201 N 0.36 1.69 0.12 2.72 2.12 -0.03 -4.98 118.70 120.70 1jxq s GLU 201 Ca 0.52 -0.33 -0.01 0.00 0.36 0.00 0.00 54.97 55.51 1jxq s GLU 201 Cb -0.27 -1.66 -0.04 0.00 0.26 0.00 0.00 34.13 32.42 1jxq s GLU 201 CO 0.31 -0.23 0.29 0.08 -0.54 0.00 0.00 175.26 175.18 1jxq s VAL 202 N 1.55 5.29 -0.18 3.70 1.01 -1.26 -1.22 120.40 129.29 1jxq s VAL 202 Ca 0.03 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 1jxq s VAL 202 Cb -0.13 -3.66 0.09 0.00 0.00 0.00 0.00 36.38 32.68 1jxq s VAL 202 CO -0.07 0.03 0.32 -0.54 0.00 0.00 0.00 175.10 174.83 1jxq s LYS 203 N -2.80 0.24 0.23 2.72 1.02 -0.59 -4.93 119.74 115.63 1jxq s LYS 203 Ca 0.37 0.70 -0.02 0.00 0.02 0.00 0.00 55.97 57.04 1jxq s LYS 203 Cb -0.12 -0.20 -0.05 0.00 -0.52 0.00 0.00 37.83 36.94 1jxq s LYS 203 CO 0.27 -0.40 0.44 0.20 -0.92 0.00 0.00 175.35 174.94 1jxq s GLY 204 N 2.48 1.81 -0.54 -3.33 0.00 -1.26 -1.28 107.32 105.20 1jxq s GLY 204 Ca 0.04 -0.74 -0.26 0.00 0.00 0.00 0.00 44.72 43.75 1jxq s GLY 204 CO -0.12 -0.68 0.62 1.22 0.00 0.00 0.00 173.10 174.14 1jxq n ASP 205 N -0.75 -4.99 -4.73 1.64 8.00 -0.40 -4.94 116.55 110.39 1jxq n ASP 205 Ca -0.04 -0.40 -0.30 0.00 0.71 0.00 0.00 54.79 54.75 1jxq n ASP 205 Cb 0.54 -1.51 -0.07 0.00 -0.02 0.00 0.00 41.12 40.05 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 -3.11 3.62 0.47 0.64 1.02 -1.26 -4.89 118.68 115.17 1jxq s LEU 206 Ca 0.26 -0.09 -0.07 0.00 0.02 0.00 0.00 54.13 54.24 1jxq s LEU 206 Cb -0.03 -2.31 -0.04 0.00 0.02 0.00 0.00 46.19 43.83 1jxq s LEU 206 CO 0.84 0.18 0.80 -0.89 0.02 0.00 0.00 176.35 177.30 1jxq s THR 207 N -1.33 4.87 0.18 5.49 2.01 -1.26 -0.04 115.64 125.55 1jxq s THR 207 Ca 0.27 0.35 -0.15 0.00 0.31 0.00 0.00 61.69 62.47 1jxq s THR 207 Cb -0.12 -3.84 0.11 0.00 0.01 0.00 0.00 72.50 68.66 1jxq s THR 207 CO 0.20 -0.80 1.68 0.00 -0.69 0.00 0.00 174.62 175.01 1jxq h ALA 208 N 0.42 0.39 -0.00 7.40 0.00 -1.87 1.40 119.26 126.99 1jxq h ALA 208 Ca -0.47 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1jxq h ALA 208 Cb 1.20 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1jxq h ALA 208 CO 0.62 -0.41 0.00 -0.22 0.00 0.00 0.00 179.25 179.25 1jxq h LYS 209 N 0.08 0.01 -0.33 0.00 3.64 -1.93 -1.55 116.57 116.48 1jxq h LYS 209 Ca 0.22 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.54 1jxq h LYS 209 Cb 0.33 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1jxq h LYS 209 CO -0.40 0.02 -0.05 0.87 -2.27 0.00 0.00 179.45 177.62 1jxq h LYS 210 N -0.01 0.53 -0.17 1.90 1.57 -1.53 -1.88 116.57 116.98 1jxq h LYS 210 Ca 0.00 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1jxq h LYS 210 Cb 0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1jxq h LYS 210 CO -0.00 0.60 0.09 0.52 -0.57 0.00 0.00 179.45 180.09 1jxq h MET 211 N 0.50 0.23 -0.87 3.15 2.86 0.21 -1.03 114.93 119.98 1jxq h MET 211 Ca 0.10 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1jxq h MET 211 Cb 0.41 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 1jxq h MET 211 CO 0.02 0.23 0.57 0.28 1.06 0.00 0.00 176.91 179.07 1jxq h VAL 212 N 0.17 1.19 -0.57 -2.22 2.07 -1.06 -0.81 116.25 115.03 1jxq h VAL 212 Ca 0.06 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1jxq h VAL 212 Cb 0.06 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 1jxq h VAL 212 CO -0.01 0.21 0.18 -0.07 0.02 0.00 0.00 177.57 177.90 1jxq h LEU 213 N 1.14 0.82 -0.77 2.57 -0.00 -0.98 0.11 115.31 118.21 1jxq h LEU 213 Ca 0.33 -0.20 -0.03 0.00 -0.00 0.00 0.00 57.88 57.98 1jxq h LEU 213 Cb -0.07 -0.21 -0.04 0.00 -0.00 0.00 0.00 40.66 40.34 1jxq h LEU 213 CO -0.09 0.80 0.38 0.00 -0.00 0.00 0.00 178.44 179.53 1jxq h ALA 214 N 1.05 0.99 0.05 1.53 0.00 -0.79 0.27 119.26 122.37 1jxq h ALA 214 Ca 0.18 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1jxq h ALA 214 Cb 0.27 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1jxq h ALA 214 CO -0.01 0.55 -0.03 -0.07 0.00 0.00 0.00 179.25 179.70 1jxq h LEU 215 N 1.09 -0.06 -1.00 0.00 3.38 -0.77 -1.44 115.31 116.51 1jxq h LEU 215 Ca 0.27 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.10 1jxq h LEU 215 Cb 0.11 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1jxq h LEU 215 CO -0.03 0.16 0.65 -0.07 0.09 0.00 0.00 178.44 179.23 1jxq h LEU 216 N -0.28 1.06 -1.86 1.67 3.38 -0.73 0.86 115.31 119.40 1jxq h LEU 216 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1jxq h LEU 216 Cb 0.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1jxq h LEU 216 CO 0.01 0.69 0.09 -0.08 0.09 0.00 0.00 178.44 179.24 1jxq h GLU 217 N 1.21 0.18 -0.06 1.13 4.57 -0.11 -0.34 114.58 121.16 1jxq h GLU 217 Ca 0.42 -0.01 -0.22 0.00 -1.18 0.00 0.00 59.36 58.37 1jxq h GLU 217 Cb 0.10 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1jxq h GLU 217 CO -0.15 0.12 -0.82 1.25 -1.18 0.00 0.00 179.01 178.23 1jxq h LEU 218 N 0.19 0.82 -1.13 1.64 5.85 0.23 -3.22 115.31 119.68 1jxq h LEU 218 Ca 0.05 -0.70 -0.08 0.00 0.84 0.00 0.00 57.88 58.00 1jxq h LEU 218 Cb -0.02 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1jxq h LEU 218 CO -0.01 1.40 -0.36 0.00 -0.34 0.00 0.00 178.44 179.13 1jxq h ALA 219 N 0.44 1.12 0.00 1.25 0.00 -0.60 -2.23 119.26 119.24 1jxq h ALA 219 Ca -0.09 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1jxq h ALA 219 Cb 1.48 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1jxq h ALA 219 CO 0.16 0.45 0.00 0.54 0.00 0.00 0.00 179.25 180.41 1jxq n ARG 220 N -3.70 0.07 -1.32 0.00 1.74 -0.20 -4.77 116.66 108.48 1jxq n ARG 220 Ca -0.01 0.20 -0.29 0.00 -0.77 0.00 0.00 57.85 56.98 1jxq n ARG 220 Cb 0.46 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.55 1jxq n ARG 220 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1jxq s GLN 221 N -2.87 0.90 -0.52 5.56 2.00 -0.84 -5.00 119.66 118.89 1jxq s GLN 221 Ca 0.10 0.50 -0.06 0.00 -2.00 0.00 0.00 55.36 53.90 1jxq s GLN 221 Cb 0.10 -1.79 0.13 0.00 0.80 0.00 0.00 33.01 32.26 1jxq s GLN 221 CO 0.28 -2.41 0.36 0.34 -0.50 0.00 0.00 175.29 173.36 1jxq s ASP 222 N -3.66 5.53 0.00 6.67 2.15 -1.26 -4.86 116.67 121.23 1jxq s ASP 222 Ca 0.64 -2.25 0.18 0.00 0.43 0.00 0.00 52.55 51.55 1jxq s ASP 222 Cb -0.17 -1.93 0.89 0.00 -0.30 0.00 0.00 42.92 41.41 1jxq s ASP 222 CO 0.56 -0.56 1.59 1.41 -0.17 0.00 0.00 175.17 178.01 1jxq n HIS 224 N 4.38 0.08 -0.22 -5.34 8.25 -1.26 -4.56 115.22 116.55 1jxq n HIS 224 Ca -0.01 -0.04 -0.06 0.00 -0.26 0.00 0.00 57.72 57.36 1jxq n HIS 224 Cb 0.41 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.46 1jxq n HIS 224 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jxq n GLY 225 N 0.89 -1.49 0.62 -1.41 0.00 -1.26 0.12 105.19 102.66 1jxq n GLY 225 Ca 0.14 0.65 0.07 0.00 0.00 0.00 0.00 46.02 46.88 1jxq n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jxq n ALA 226 N -3.51 2.47 -2.93 4.61 0.00 -1.26 -4.89 120.51 115.00 1jxq n ALA 226 Ca 0.01 -0.59 -0.24 0.00 0.00 0.00 0.00 53.44 52.63 1jxq n ALA 226 Cb 0.14 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.17 4.30 -0.03 0.00 1.43 0.32 -4.80 118.68 118.73 1jxq s LEU 227 Ca 0.26 0.16 0.20 0.00 -1.03 0.00 0.00 54.13 53.72 1jxq s LEU 227 Cb 0.14 -2.93 -0.31 0.00 0.03 0.00 0.00 46.19 43.12 1jxq s LEU 227 CO 0.19 -0.03 0.43 0.47 0.23 0.00 0.00 176.35 177.64 1jxq n ASP 228 N -1.03 0.47 -3.60 2.29 8.00 -0.27 -4.99 116.55 117.43 1jxq n ASP 228 Ca -0.08 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.31 1jxq n ASP 228 Cb 0.55 1.89 -0.05 0.00 -0.02 0.00 0.00 41.12 43.50 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 -0.78 0.37 -0.04 0.00 1.01 -0.19 -1.19 120.40 119.59 1jxq s VAL 231 Ca 0.05 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.90 1jxq s VAL 231 Cb -0.08 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.96 1jxq s VAL 231 CO 0.01 0.13 -0.07 -0.69 0.00 0.00 0.00 175.10 174.49 1jxq s VAL 232 N 0.25 0.72 -0.03 2.92 1.01 -0.44 -0.21 120.40 124.61 1jxq s VAL 232 Ca -0.03 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1jxq s VAL 232 Cb -0.06 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.63 1jxq s VAL 232 CO -0.00 0.26 -0.13 -0.69 0.00 0.00 0.00 175.10 174.53 1jxq s VAL 233 N 0.70 1.11 -0.06 2.92 1.01 0.15 -0.51 120.40 125.72 1jxq s VAL 233 Ca -0.11 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1jxq s VAL 233 Cb -0.14 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1jxq s VAL 233 CO 0.01 0.33 -0.08 -0.63 0.00 0.00 0.00 175.10 174.73 1jxq s ILE 234 N 0.11 0.81 -0.18 2.22 1.01 -0.61 0.96 121.20 125.52 1jxq s ILE 234 Ca -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 60.65 60.34 1jxq s ILE 234 Cb -0.10 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.59 1jxq s ILE 234 CO 0.01 0.29 -0.14 -0.76 0.00 0.00 0.00 174.94 174.34 1jxq s LEU 235 N 0.89 2.47 0.00 2.97 1.43 0.84 -2.15 118.68 125.13 1jxq s LEU 235 Ca -0.11 -0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.36 1jxq s LEU 235 Cb -0.15 -1.58 0.04 0.00 0.03 0.00 0.00 46.19 44.53 1jxq s LEU 235 CO 0.01 0.02 0.50 -0.24 0.23 0.00 0.00 176.35 176.88 1jxq n SER 236 N 4.47 -0.46 -4.78 2.29 2.88 -1.14 -0.85 113.62 116.04 1jxq n SER 236 Ca -0.20 -1.09 -0.38 0.00 -1.33 0.00 0.00 58.87 55.88 1jxq n SER 236 Cb 0.51 0.72 -0.06 0.00 -0.75 0.00 0.00 64.21 64.62 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 -2.63 3.70 0.21 0.66 3.76 -1.26 -1.08 115.29 118.64 1jxq s HIS 237 Ca 0.12 1.79 -0.11 0.00 -0.15 0.00 0.00 55.06 56.71 1jxq s HIS 237 Cb -0.00 -2.96 -0.07 0.00 1.11 0.00 0.00 32.58 30.65 1jxq s HIS 237 CO -0.00 0.16 0.56 0.20 -0.85 0.00 0.00 174.74 174.80 1jxq s GLY 238 N -1.52 2.34 -0.15 -2.22 0.00 0.24 -0.04 107.32 105.97 1jxq s GLY 238 Ca 0.49 -0.21 -0.03 0.00 0.00 0.00 0.00 44.72 44.97 1jxq s GLY 238 CO 0.26 -0.03 -0.06 0.00 0.00 0.00 0.00 173.10 173.27 1jxq n GLN 240 N 3.63 2.38 -2.09 0.00 6.02 -1.26 -3.76 117.38 122.31 1jxq n GLN 240 Ca -0.18 -3.00 -0.34 0.00 -0.01 0.00 0.00 57.00 53.47 1jxq n GLN 240 Cb 0.52 -2.18 0.02 0.00 1.02 0.00 0.00 30.24 29.63 1jxq n GLN 240 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jxq s ALA 240 N -3.38 2.62 0.31 -1.58 0.00 -1.26 -5.03 121.76 113.44 1jxq s ALA 240 Ca 0.58 0.73 -0.09 0.00 0.00 0.00 0.00 51.96 53.18 1jxq s ALA 240 Cb 0.47 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 20.18 1jxq s ALA 240 CO 0.06 -0.94 0.63 -1.54 0.00 0.00 0.00 175.76 173.96 1jxq s SER 240 N -2.05 6.56 0.36 0.00 1.04 -1.26 -4.66 113.70 113.70 1jxq s SER 240 Ca 0.71 0.95 0.04 0.00 0.48 0.00 0.00 55.95 58.13 1jxq s SER 240 Cb -0.23 -2.24 -0.03 0.00 0.10 0.00 0.00 66.02 63.62 1jxq s SER 240 CO 0.32 -0.21 0.17 -1.00 0.98 0.00 0.00 173.24 173.50 1jxq s HIS 240 N -2.07 1.73 -0.19 5.02 3.76 -1.26 -5.08 115.29 117.21 1jxq s HIS 240 Ca 0.48 -1.40 -0.15 0.00 -0.15 0.00 0.00 55.06 53.84 1jxq s HIS 240 Cb -0.11 -0.98 -0.10 0.00 1.11 0.00 0.00 32.58 32.51 1jxq s HIS 240 CO 0.26 -0.49 -0.08 1.28 -0.85 0.00 0.00 174.74 174.86 1jxq n LEU 240 N -0.76 1.86 -0.07 0.89 4.32 -1.26 -4.83 117.00 117.15 1jxq n LEU 240 Ca -0.01 0.49 -0.05 0.00 -0.02 0.00 0.00 56.01 56.42 1jxq n LEU 240 Cb 0.64 -0.88 -0.02 0.00 -1.62 0.00 0.00 43.42 41.54 1jxq n LEU 240 CO 0.34 -0.07 -0.32 -0.61 -1.22 0.00 0.00 177.39 175.52 1jxq h GLN 240 N -1.00 0.00 -6.27 3.23 4.15 -2.00 -3.49 115.11 109.73 1jxq h GLN 240 Ca -0.20 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.62 1jxq h GLN 240 Cb 0.97 0.00 -0.24 0.00 0.21 0.00 0.00 27.48 28.43 1jxq h GLN 240 CO -0.12 0.05 -0.84 -0.06 -1.93 0.00 0.00 178.83 175.92 1jxq s PHE 240 N -2.18 1.90 0.57 3.99 2.99 -1.26 -5.08 117.98 118.90 1jxq s PHE 240 Ca -0.14 -0.40 -0.07 0.00 0.00 0.00 0.00 56.93 56.32 1jxq s PHE 240 Cb 0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 43.02 41.95 1jxq s PHE 240 CO 0.22 0.18 0.90 -1.25 -0.00 0.00 0.00 175.22 175.27 1jxq s PRO 240 N -1.62 3.23 0.00 0.24 0.04 -1.26 -4.47 135.00 131.16 1jxq s PRO 240 Ca 0.08 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.36 1jxq s PRO 240 Cb -0.10 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1jxq s PRO 240 CO 0.03 -0.55 0.00 0.41 0.04 0.00 0.00 177.00 176.93 1jxq n GLY 241 N -2.55 1.74 3.47 0.56 0.00 -1.26 -4.48 105.19 102.67 1jxq n GLY 241 Ca 0.04 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.37 -1.67 -0.00 4.61 0.00 -1.25 0.24 121.76 122.32 1jxq s ALA 242 Ca 0.00 0.92 0.02 0.00 0.00 0.00 0.00 51.96 52.89 1jxq s ALA 242 Cb 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.53 1jxq s ALA 242 CO 0.00 -0.55 -0.05 0.14 0.00 0.00 0.00 175.76 175.29 1jxq s VAL 243 N -2.39 0.41 0.16 0.00 -7.23 -0.91 -1.92 120.40 108.52 1jxq s VAL 243 Ca -0.05 -0.29 -0.30 0.00 -1.81 0.00 0.00 61.98 59.53 1jxq s VAL 243 Cb -0.00 -0.36 -0.07 0.00 0.56 0.00 0.00 36.38 36.50 1jxq s VAL 243 CO -0.01 0.07 0.96 -0.31 -0.31 0.00 0.00 175.10 175.51 1jxq s TYR 244 N -0.22 3.85 0.77 2.82 4.12 0.94 -2.18 117.35 127.45 1jxq s TYR 244 Ca 0.01 1.83 -0.08 0.00 0.02 0.00 0.00 57.07 58.85 1jxq s TYR 244 Cb -0.03 -3.05 0.10 0.00 -1.52 0.00 0.00 41.96 37.47 1jxq s TYR 244 CO -0.00 0.23 1.08 0.20 0.02 0.00 0.00 175.55 177.08 1jxq s GLY 245 N -0.40 1.72 0.51 0.71 0.00 -0.41 -4.45 107.32 105.00 1jxq s GLY 245 Ca 0.45 -1.13 0.24 0.00 0.00 0.00 0.00 44.72 44.28 1jxq s GLY 245 CO 0.31 -0.61 2.08 -0.91 0.00 0.00 0.00 173.10 173.97 1jxq h THR 246 N -0.82 0.73 0.00 0.90 1.35 -0.75 -2.04 112.91 112.28 1jxq h THR 246 Ca -0.43 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 1jxq h THR 246 Cb 1.29 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 1jxq h THR 246 CO 0.52 0.11 0.00 -0.90 -0.25 0.00 0.00 175.52 175.00 1jxq n ASP 247 N -3.89 0.00 0.00 5.36 5.75 -1.26 -2.29 116.55 120.22 1jxq n ASP 247 Ca -0.02 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.75 1jxq n ASP 247 Cb 0.21 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1jxq n ASP 247 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jxq n GLY 248 N 0.78 0.67 3.85 6.12 0.00 -0.77 -4.76 105.19 111.09 1jxq n GLY 248 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.32 3.04 -0.21 0.00 0.04 -1.26 -1.29 135.00 134.01 1jxq s PRO 255 Ca 0.25 0.22 -0.04 0.00 0.04 0.00 0.00 61.00 61.46 1jxq s PRO 255 Cb -0.15 -2.20 0.07 0.00 0.04 0.00 0.00 34.50 32.26 1jxq s PRO 255 CO 0.13 -0.72 0.10 0.08 0.04 0.00 0.00 177.00 176.63 1jxq s VAL 256 N -3.08 -0.02 0.59 -0.36 1.01 -0.93 -4.90 120.40 112.72 1jxq s VAL 256 Ca 0.54 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 61.96 1jxq s VAL 256 Cb -0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1jxq s VAL 256 CO 0.48 -0.40 1.18 -0.94 0.00 0.00 0.00 175.10 175.42 1jxq s SER 257 N 2.10 5.28 0.39 3.32 1.04 -1.26 -2.14 113.70 122.43 1jxq s SER 257 Ca 0.04 2.31 0.08 0.00 0.48 0.00 0.00 55.95 58.85 1jxq s SER 257 Cb -0.16 -2.59 0.78 0.00 0.10 0.00 0.00 66.02 64.15 1jxq s SER 257 CO -0.17 -1.52 1.96 0.58 0.98 0.00 0.00 173.24 175.07 1jxq h VAL 258 N 0.87 1.15 -0.21 5.02 2.07 -0.44 -1.96 116.25 122.75 1jxq h VAL 258 Ca -0.50 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 1jxq h VAL 258 Cb 1.28 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1jxq h VAL 258 CO 0.55 0.20 -0.02 1.05 0.02 0.00 0.00 177.57 179.37 1jxq h GLU 259 N 0.39 0.31 -0.13 1.57 4.11 -1.78 0.25 114.58 119.30 1jxq h GLU 259 Ca 0.09 -0.05 -0.15 0.00 0.07 0.00 0.00 59.36 59.32 1jxq h GLU 259 Cb 0.22 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.42 1jxq h GLU 259 CO 0.00 0.35 -0.49 -0.22 0.07 0.00 0.00 179.01 178.73 1jxq h LYS 260 N 0.30 0.57 -0.09 1.06 3.64 -1.73 -2.97 116.57 117.35 1jxq h LYS 260 Ca 0.07 -0.43 0.01 0.00 -1.27 0.00 0.00 60.65 59.03 1jxq h LYS 260 Cb 0.24 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1jxq h LYS 260 CO 0.01 1.05 0.03 0.82 -2.27 0.00 0.00 179.45 179.09 1jxq h ILE 261 N 0.20 0.98 -0.16 2.00 2.04 -1.11 -2.19 117.51 119.26 1jxq h ILE 261 Ca -0.02 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 65.85 1jxq h ILE 261 Cb 1.12 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 1jxq h ILE 261 CO 0.10 0.01 -0.08 0.58 0.00 0.00 0.00 178.15 178.77 1jxq h VAL 262 N 0.07 0.75 0.00 1.67 2.07 -1.03 -2.77 116.25 117.01 1jxq h VAL 262 Ca 0.04 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 1jxq h VAL 262 Cb 0.02 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1jxq h VAL 262 CO -0.04 0.00 -0.19 0.78 0.02 0.00 0.00 177.57 178.13 1jxq h ASN 263 N -0.06 0.00 0.00 0.57 2.35 -1.36 -1.33 115.58 115.75 1jxq h ASN 263 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1jxq h ASN 263 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1jxq h ASN 263 CO -0.20 0.19 0.06 0.40 -1.65 0.00 0.00 177.43 176.24 1jxq h ILE 264 N 0.00 0.00 -0.27 2.81 2.04 -1.09 -1.61 117.51 119.39 1jxq h ILE 264 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1jxq h ILE 264 Cb 0.35 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1jxq h ILE 264 CO 0.03 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.67 1jxq n PHE 265 N -2.72 0.50 -1.39 1.37 3.72 -0.51 -4.47 117.46 113.96 1jxq n PHE 265 Ca -0.02 -0.61 -0.30 0.00 -0.05 0.00 0.00 57.45 56.47 1jxq n PHE 265 Cb 0.12 -0.10 0.23 0.00 -0.94 0.00 0.00 39.48 38.79 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 -1.29 1.42 0.32 4.37 2.20 -0.61 -4.65 114.94 116.70 1jxq s ASN 266 Ca 0.25 0.39 0.01 0.00 -0.94 0.00 0.00 52.86 52.57 1jxq s ASN 266 Cb 0.16 -0.47 0.56 0.00 -2.00 0.00 0.00 41.25 39.51 1jxq s ASN 266 CO 0.12 -3.79 1.95 1.23 -2.94 0.00 0.00 177.10 173.67 1jxq h GLY 267 N -2.36 1.13 0.75 0.45 0.00 -1.57 0.87 103.07 102.34 1jxq h GLY 267 Ca -0.43 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 46.38 1jxq h GLY 267 CO 0.30 0.33 -0.49 -0.84 0.00 0.00 0.00 176.54 175.84 1jxq h THR 268 N 0.98 1.42 0.00 4.70 2.02 -1.93 -2.45 112.91 117.66 1jxq h THR 268 Ca 0.32 -1.94 -0.08 0.00 0.77 0.00 0.00 66.41 65.48 1jxq h THR 268 Cb 0.06 2.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 1jxq h THR 268 CO -0.10 0.56 -0.39 0.28 0.37 0.00 0.00 175.52 176.25 1jxq h SER 269 N -0.10 0.00 -1.76 4.18 0.02 -1.82 -3.38 113.55 110.70 1jxq h SER 269 Ca -0.05 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.39 1jxq h SER 269 Cb 1.18 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 63.36 1jxq h SER 269 CO 0.10 0.39 -1.05 0.00 -1.14 0.00 0.00 176.83 175.13 1jxq h PRO 271 N 3.85 0.00 -0.90 0.00 0.13 -1.62 -1.73 132.00 131.73 1jxq h PRO 271 Ca 0.05 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.33 1jxq h PRO 271 Cb 0.91 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.97 1jxq h PRO 271 CO 0.45 0.00 0.58 1.03 -0.23 0.00 0.00 178.00 179.83 1jxq h SER 272 N 0.00 0.66 -0.61 1.44 0.87 -1.89 -1.12 113.55 112.90 1jxq h SER 272 Ca 0.23 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1jxq h SER 272 Cb 1.00 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1jxq h SER 272 CO -0.00 0.33 0.00 0.18 -0.53 0.00 0.00 176.83 176.80 1jxq n LEU 273 N -4.57 3.33 -4.63 2.23 4.77 -0.65 -4.03 117.00 113.45 1jxq n LEU 273 Ca 0.18 -1.67 -0.49 0.00 -0.03 0.00 0.00 56.01 54.01 1jxq n LEU 273 Cb 0.48 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 1jxq n LEU 273 CO 0.29 0.81 1.06 0.61 -1.33 0.00 0.00 177.39 178.84 1jxq n GLY 274 N 1.45 0.84 3.13 -0.72 0.00 -0.43 -0.68 105.19 108.78 1jxq n GLY 274 Ca 0.21 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.90 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 3.01 2.85 3.92 -0.02 0.00 -1.26 -5.00 105.19 108.69 1jxq n GLY 275 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 3.49 -0.05 1.61 1.02 0.14 -5.02 119.74 120.94 1jxq s LYS 276 Ca 0.00 -0.38 -0.30 0.00 0.02 0.00 0.00 55.97 55.31 1jxq s LYS 276 Cb 0.00 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 1jxq s LYS 276 CO 0.00 0.55 1.30 -1.25 -0.92 0.00 0.00 175.35 175.03 1jxq s PRO 277 N -2.73 4.31 -0.36 -1.68 0.04 -1.25 -4.81 135.00 128.51 1jxq s PRO 277 Ca 0.37 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 63.10 1jxq s PRO 277 Cb -0.12 -3.60 0.02 0.00 0.04 0.00 0.00 34.50 30.84 1jxq s PRO 277 CO 0.27 -0.54 0.19 0.15 0.04 0.00 0.00 177.00 177.12 1jxq s LYS 278 N 2.48 2.96 -0.13 4.56 1.02 -0.17 -2.11 119.74 128.36 1jxq s LYS 278 Ca 0.59 -0.98 -0.04 0.00 0.02 0.00 0.00 55.97 55.56 1jxq s LYS 278 Cb -0.27 -3.69 -0.03 0.00 -0.52 0.00 0.00 37.83 33.31 1jxq s LYS 278 CO 0.23 -0.63 0.02 -0.51 -0.92 0.00 0.00 175.35 173.55 1jxq s LEU 279 N 1.57 3.65 -0.10 3.17 1.43 -0.33 -1.45 118.68 126.63 1jxq s LEU 279 Ca 0.03 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1jxq s LEU 279 Cb -0.19 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.17 1jxq s LEU 279 CO 0.07 0.28 -0.15 -0.36 0.23 0.00 0.00 176.35 176.42 1jxq s PHE 280 N -0.31 1.91 -0.20 0.29 0.40 0.73 -1.32 117.98 119.48 1jxq s PHE 280 Ca 0.07 -0.87 -0.01 0.00 -0.60 0.00 0.00 56.93 55.52 1jxq s PHE 280 Cb -0.12 -1.38 0.01 0.00 0.51 0.00 0.00 43.02 42.04 1jxq s PHE 280 CO 0.02 -0.45 -0.14 -0.06 0.70 0.00 0.00 175.22 175.29 1jxq s PHE 281 N 0.95 2.85 -0.08 0.36 0.40 0.34 -0.25 117.98 122.54 1jxq s PHE 281 Ca -0.08 -1.38 0.04 0.00 -0.60 0.00 0.00 56.93 54.91 1jxq s PHE 281 Cb -0.15 -1.99 -0.00 0.00 0.51 0.00 0.00 43.02 41.39 1jxq s PHE 281 CO -0.01 -0.71 -0.22 0.42 0.70 0.00 0.00 175.22 175.40 1jxq s ILE 282 N 1.36 1.88 -0.35 0.64 1.09 0.10 -1.57 121.20 124.35 1jxq s ILE 282 Ca 0.05 -0.93 0.02 0.00 -1.10 0.00 0.00 60.65 58.70 1jxq s ILE 282 Cb -0.14 -1.62 0.10 0.00 -1.06 0.00 0.00 42.46 39.75 1jxq s ILE 282 CO -0.09 0.52 0.09 -1.58 -0.10 0.00 0.00 174.94 173.78 1jxq s GLN 283 N 0.28 1.27 -0.72 2.79 2.00 -0.91 -0.26 119.66 124.10 1jxq s GLN 283 Ca -0.15 -1.69 -0.17 0.00 -2.00 0.00 0.00 55.36 51.35 1jxq s GLN 283 Cb -0.16 -2.78 0.15 0.00 0.80 0.00 0.00 33.01 31.01 1jxq s GLN 283 CO 0.07 -0.98 0.78 0.00 -0.50 0.00 0.00 175.29 174.65 1jxq s ALA 284 N 1.00 3.64 -0.97 1.58 0.00 0.11 -2.89 121.76 124.24 1jxq s ALA 284 Ca 0.12 -2.70 -0.12 0.00 0.00 0.00 0.00 51.96 49.25 1jxq s ALA 284 Cb -0.19 -3.59 0.23 0.00 0.00 0.00 0.00 23.12 19.57 1jxq s ALA 284 CO -0.12 -2.41 0.97 0.00 0.00 0.00 0.00 175.76 174.20 1jxq n GLY 286 N 3.60 -0.43 0.00 0.00 0.00 -1.26 -4.43 105.19 102.67 1jxq n GLY 286 Ca 0.20 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 44.03 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 0.00 0.34 0.41 -0.02 0.00 -1.26 0.81 105.19 105.47 1jxq n GLY 287 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1jxq n GLY 287 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1jxq n SER 319 N 0.00 0.00 -5.01 1.61 7.64 -1.26 -4.92 113.62 111.68 1jxq n SER 319 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 1jxq n SER 319 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 1jxq n SER 319 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1jxq s SER 320 N -0.24 5.53 -0.02 6.43 0.01 -1.26 -5.14 113.70 119.03 1jxq s SER 320 Ca 0.00 -0.51 -0.13 0.00 1.31 0.00 0.00 55.95 56.62 1jxq s SER 320 Cb 0.00 -0.49 0.02 0.00 0.21 0.00 0.00 66.02 65.76 1jxq s SER 320 CO 0.00 -0.85 0.28 -0.22 0.41 0.00 0.00 173.24 172.85 1jxq s LEU 321 N -4.39 0.99 0.37 2.44 2.96 -1.26 -5.14 118.68 114.65 1jxq s LEU 321 Ca 0.56 0.05 -0.28 0.00 -0.22 0.00 0.00 54.13 54.24 1jxq s LEU 321 Cb -0.09 1.14 -0.11 0.00 0.50 0.00 0.00 46.19 47.63 1jxq s LEU 321 CO 0.34 -0.42 1.45 -2.84 -1.32 0.00 0.00 176.35 173.57 1jxq s PRO 322 N -1.27 4.16 0.28 0.98 0.02 -1.26 -4.92 135.00 133.00 1jxq s PRO 322 Ca -0.13 2.50 0.02 0.00 0.02 0.00 0.00 61.00 63.41 1jxq s PRO 322 Cb -0.06 -2.99 0.65 0.00 0.02 0.00 0.00 34.50 32.13 1jxq s PRO 322 CO 0.04 -0.47 1.73 1.15 -0.33 0.00 0.00 177.00 179.11 1jxq h THR 323 N 3.00 0.59 -0.41 0.99 2.02 -2.00 -1.62 112.91 115.48 1jxq h THR 323 Ca -0.50 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.50 1jxq h THR 323 Cb 1.24 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1jxq h THR 323 CO 0.65 0.09 0.00 -0.81 0.37 0.00 0.00 175.52 175.82 1jxq n PRO 324 N -4.96 3.17 -1.83 6.66 -0.04 -1.26 -1.66 135.00 135.09 1jxq n PRO 324 Ca 0.20 -1.97 -0.34 0.00 -0.04 0.00 0.00 63.50 61.35 1jxq n PRO 324 Cb 0.56 -1.84 0.05 0.00 -0.04 0.00 0.00 33.50 32.23 1jxq n PRO 324 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1jxq s SER 325 N -0.64 5.06 -1.62 3.54 1.04 -0.61 -3.89 113.70 116.58 1jxq s SER 325 Ca 0.35 2.16 -0.04 0.00 0.48 0.00 0.00 55.95 58.90 1jxq s SER 325 Cb 0.24 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.80 1jxq s SER 325 CO 0.13 -1.67 0.49 0.47 0.98 0.00 0.00 173.24 173.65 1jxq n ASP 326 N -2.14 -6.14 -4.76 7.02 8.00 -0.91 -4.87 116.55 112.76 1jxq n ASP 326 Ca 0.12 -0.23 -0.35 0.00 0.71 0.00 0.00 54.79 55.03 1jxq n ASP 326 Cb 0.51 -4.99 -0.08 0.00 -0.02 0.00 0.00 41.12 36.55 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 -3.16 5.42 -0.07 0.53 -1.09 -1.21 -1.00 121.20 120.62 1jxq s ILE 327 Ca 0.24 0.21 -0.03 0.00 -2.23 0.00 0.00 60.65 58.85 1jxq s ILE 327 Cb -0.11 -3.47 0.04 0.00 -1.58 0.00 0.00 42.46 37.35 1jxq s ILE 327 CO 0.30 0.47 0.12 0.12 -1.23 0.00 0.00 174.94 174.73 1jxq s PHE 328 N 0.12 -0.10 -0.09 3.97 5.36 -0.53 -1.40 117.98 125.31 1jxq s PHE 328 Ca 0.10 0.48 0.04 0.00 -0.96 0.00 0.00 56.93 56.58 1jxq s PHE 328 Cb -0.11 -0.31 -0.01 0.00 -0.34 0.00 0.00 43.02 42.25 1jxq s PHE 328 CO -0.01 -0.23 -0.22 0.08 -1.46 0.00 0.00 175.22 173.38 1jxq s VAL 329 N 2.13 2.30 -0.25 3.12 1.01 -0.79 -0.20 120.40 127.73 1jxq s VAL 329 Ca 0.02 -0.95 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 1jxq s VAL 329 Cb -0.12 -1.88 0.01 0.00 0.00 0.00 0.00 36.38 34.39 1jxq s VAL 329 CO -0.05 0.56 -0.03 -0.55 0.00 0.00 0.00 175.10 175.03 1jxq s SER 330 N 0.11 4.42 -0.19 3.32 0.15 0.65 -1.10 113.70 121.07 1jxq s SER 330 Ca -0.11 -0.72 -0.01 0.00 0.70 0.00 0.00 55.95 55.81 1jxq s SER 330 Cb -0.16 -1.72 0.01 0.00 -1.71 0.00 0.00 66.02 62.45 1jxq s SER 330 CO 0.06 -0.11 -0.14 -0.47 1.20 0.00 0.00 173.24 173.78 1jxq s TYR 331 N 1.39 2.84 -0.06 3.44 6.14 -0.29 -0.72 117.35 130.10 1jxq s TYR 331 Ca 0.02 -1.35 0.03 0.00 0.64 0.00 0.00 57.07 56.41 1jxq s TYR 331 Cb -0.16 -1.98 0.01 0.00 0.42 0.00 0.00 41.96 40.24 1jxq s TYR 331 CO -0.03 -0.69 -0.15 0.45 0.64 0.00 0.00 175.55 175.77 1jxq s SER 332 N 1.32 1.98 -0.22 4.32 0.15 0.64 -1.58 113.70 120.32 1jxq s SER 332 Ca 0.05 -0.33 0.15 0.00 0.70 0.00 0.00 55.95 56.51 1jxq s SER 332 Cb -0.14 -0.77 0.46 0.00 -1.71 0.00 0.00 66.02 63.87 1jxq s SER 332 CO -0.09 0.09 1.17 0.35 1.20 0.00 0.00 173.24 175.96 1jxq n THR 333 N 3.52 1.72 -2.72 6.45 -2.24 -1.26 0.09 114.28 119.84 1jxq n THR 333 Ca -0.21 -3.15 -0.43 0.00 -2.27 0.00 0.00 64.05 58.00 1jxq n THR 333 Cb 0.52 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.78 1jxq n THR 333 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1jxq s PHE 334 N -3.01 3.01 0.84 4.78 5.36 -1.26 -4.90 117.98 122.81 1jxq s PHE 334 Ca 0.39 0.81 -0.12 0.00 -0.96 0.00 0.00 56.93 57.05 1jxq s PHE 334 Cb 0.37 -3.89 0.10 0.00 -0.34 0.00 0.00 43.02 39.26 1jxq s PHE 334 CO -0.04 -0.95 1.16 -1.25 -1.46 0.00 0.00 175.22 172.68 1jxq s PRO 335 N 3.79 1.69 0.00 10.12 0.04 -1.26 -4.76 135.00 144.62 1jxq s PRO 335 Ca 0.42 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.64 1jxq s PRO 335 Cb -0.11 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1jxq s PRO 335 CO 0.22 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.87 1jxq n GLY 336 N -2.93 3.33 3.98 0.56 0.00 -1.26 -4.90 105.19 103.97 1jxq n GLY 336 Ca 0.07 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 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 0.00 3.17 0.33 1.61 0.08 -1.25 -0.16 117.98 121.76 1jxq s PHE 337 Ca 0.00 -0.08 0.02 0.00 0.12 0.00 0.00 56.93 57.00 1jxq s PHE 337 Cb 0.00 -2.05 0.57 0.00 -0.57 0.00 0.00 43.02 40.98 1jxq s PHE 337 CO 0.00 -0.07 1.91 -0.39 -0.10 0.00 0.00 175.22 176.58 1jxq h VAL 338 N 0.78 1.19 -3.62 -0.44 -1.51 -1.53 -3.32 116.25 107.80 1jxq h VAL 338 Ca -0.46 -0.60 -0.69 0.00 -1.23 0.00 0.00 66.70 63.72 1jxq h VAL 338 Cb 1.25 0.62 -0.34 0.00 -2.13 0.00 0.00 31.29 30.69 1jxq h VAL 338 CO 0.55 0.23 -0.62 -0.55 -1.23 0.00 0.00 177.57 175.95 1jxq s SER 339 N -6.61 5.08 0.57 4.19 0.15 -1.26 -4.99 113.70 110.83 1jxq s SER 339 Ca -0.09 -1.71 0.32 0.00 0.70 0.00 0.00 55.95 55.17 1jxq s SER 339 Cb 0.16 -1.77 1.43 0.00 -1.71 0.00 0.00 66.02 64.13 1jxq s SER 339 CO 0.77 -0.41 1.77 4.11 1.20 0.00 0.00 173.24 180.68 1jxq h TRP 340 N 8.00 0.00 0.00 3.44 5.08 -1.98 -0.08 115.95 130.41 1jxq h TRP 340 Ca -0.16 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.78 1jxq h TRP 340 Cb 1.05 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.21 1jxq h TRP 340 CO 0.57 0.00 -0.78 0.00 -1.28 0.00 0.00 178.44 176.95 1jxq h ARG 341 N 0.00 0.00 -3.97 0.12 3.08 -1.95 -3.44 114.38 108.21 1jxq h ARG 341 Ca 0.41 0.00 -0.76 0.00 0.07 0.00 0.00 59.98 59.70 1jxq h ARG 341 Cb 1.93 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 31.71 1jxq h ARG 341 CO -0.00 0.08 -0.14 0.34 -1.07 0.00 0.00 179.97 179.18 1jxq s ASP 342 N -5.71 6.25 0.00 7.04 3.68 -0.04 -4.93 116.67 122.95 1jxq s ASP 342 Ca 0.01 -2.27 0.00 0.00 2.13 0.00 0.00 52.55 52.42 1jxq s ASP 342 Cb 0.08 -2.14 0.01 0.00 -1.45 0.00 0.00 42.92 39.42 1jxq s ASP 342 CO 0.76 -0.67 0.10 -2.65 0.13 0.00 0.00 175.17 172.84 1jxq n PRO 343 N 4.51 0.05 0.00 4.34 -0.02 -1.26 -0.95 135.00 141.67 1jxq n PRO 343 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1jxq n PRO 343 Cb 0.43 -1.05 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 1jxq n PRO 343 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1jxq n LYS 344 N -0.55 1.39 0.00 -0.52 5.02 -1.26 -4.56 118.16 117.68 1jxq n LYS 344 Ca 0.00 -1.03 0.14 0.00 -2.02 0.00 0.00 58.31 55.40 1jxq n LYS 344 Cb 0.00 -0.92 0.58 0.00 -0.02 0.00 0.00 35.03 34.67 1jxq n LYS 344 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1jxq n SER 345 N -0.28 0.38 0.00 4.39 3.41 -0.13 -4.54 113.62 116.86 1jxq n SER 345 Ca 0.00 -0.36 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 1jxq n SER 345 Cb 0.21 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1jxq n SER 345 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jxq n GLY 346 N 1.34 1.19 3.69 5.00 0.00 -1.26 -4.48 105.19 110.67 1jxq n GLY 346 Ca 0.12 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1jxq n GLY 346 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jxq s SER 347 N 0.00 7.19 0.51 1.61 0.15 -1.26 -1.62 113.70 120.27 1jxq s SER 347 Ca 0.00 1.45 0.26 0.00 0.70 0.00 0.00 55.95 58.36 1jxq s SER 347 Cb 0.00 -2.52 1.40 0.00 -1.71 0.00 0.00 66.02 63.19 1jxq s SER 347 CO 0.00 -0.37 2.06 -0.25 1.20 0.00 0.00 173.24 175.88 1jxq h TRP 348 N 7.06 0.00 0.47 3.44 7.01 -0.74 -2.07 115.95 131.12 1jxq h TRP 348 Ca -0.33 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.64 1jxq h TRP 348 Cb 1.16 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.23 1jxq h TRP 348 CO 0.70 0.13 -0.23 -0.92 -2.79 0.00 0.00 178.44 175.33 1jxq h TYR 349 N 0.00 -0.59 -0.89 2.65 3.20 -1.86 -1.46 116.97 118.02 1jxq h TYR 349 Ca -0.00 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.93 1jxq h TYR 349 Cb 0.33 0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.73 1jxq h TYR 349 CO 0.00 -0.31 0.55 -0.39 -1.64 0.00 0.00 178.16 176.37 1jxq h VAL 350 N -1.10 1.02 -0.54 1.81 -1.51 -1.91 0.25 116.25 114.27 1jxq h VAL 350 Ca -0.07 -0.34 -0.03 0.00 -1.23 0.00 0.00 66.70 65.04 1jxq h VAL 350 Cb 0.55 -0.04 -0.02 0.00 -2.13 0.00 0.00 31.29 29.64 1jxq h VAL 350 CO 0.11 0.18 0.22 -0.08 -1.23 0.00 0.00 177.57 176.77 1jxq h GLU 351 N 0.98 0.80 -0.22 5.19 4.57 -1.44 0.52 114.58 124.97 1jxq h GLU 351 Ca 0.40 -0.14 -0.04 0.00 -1.18 0.00 0.00 59.36 58.40 1jxq h GLU 351 Cb 0.22 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1jxq h GLU 351 CO -0.19 0.69 0.00 1.15 -1.18 0.00 0.00 179.01 179.48 1jxq h THR 352 N 0.72 1.25 0.12 0.32 2.02 -0.32 0.63 112.91 117.65 1jxq h THR 352 Ca 0.18 -0.88 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 1jxq h THR 352 Cb 0.18 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1jxq h THR 352 CO -0.02 0.27 -0.06 0.25 0.37 0.00 0.00 175.52 176.34 1jxq h LEU 353 N 0.16 -0.13 -0.79 2.58 6.46 -0.39 -0.54 115.31 122.65 1jxq h LEU 353 Ca 0.06 -0.06 0.09 0.00 -0.12 0.00 0.00 57.88 57.85 1jxq h LEU 353 Cb 0.40 0.03 -0.07 0.00 -0.73 0.00 0.00 40.66 40.29 1jxq h LEU 353 CO 0.01 -0.02 0.44 -0.78 -0.62 0.00 0.00 178.44 177.47 1jxq h ASP 354 N -0.24 0.62 -0.30 1.25 1.82 0.14 0.02 116.42 119.74 1jxq h ASP 354 Ca -0.02 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.65 1jxq h ASP 354 Cb 0.19 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.12 1jxq h ASP 354 CO 0.03 0.36 0.10 -0.78 -1.61 0.00 0.00 179.24 177.33 1jxq h ASP 355 N 0.75 0.44 -0.41 2.28 -0.00 -0.61 -1.11 116.42 117.76 1jxq h ASP 355 Ca 0.38 -0.20 -0.03 0.00 -0.00 0.00 0.00 57.03 57.18 1jxq h ASP 355 Cb 0.35 -0.11 -0.02 0.00 -0.00 0.00 0.00 39.33 39.55 1jxq h ASP 355 CO -0.25 0.52 0.15 0.40 -0.00 0.00 0.00 179.24 180.07 1jxq h ILE 356 N 0.33 1.20 -0.21 2.25 2.04 -0.41 -2.07 117.51 120.64 1jxq h ILE 356 Ca 0.10 -0.63 0.01 0.00 1.00 0.00 0.00 64.86 65.34 1jxq h ILE 356 Cb 0.24 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1jxq h ILE 356 CO -0.00 0.23 0.10 -0.26 0.00 0.00 0.00 178.15 178.21 1jxq h PHE 357 N 0.51 0.18 -0.96 1.37 -1.00 -0.92 0.15 116.94 116.27 1jxq h PHE 357 Ca 0.13 0.01 0.22 0.00 2.81 0.00 0.00 57.97 61.14 1jxq h PHE 357 Cb 0.21 -0.05 -0.08 0.00 3.61 0.00 0.00 35.95 39.63 1jxq h PHE 357 CO 0.00 0.10 0.63 1.49 -1.61 0.00 0.00 178.31 178.92 1jxq h GLU 358 N 0.21 0.45 0.00 1.51 4.57 -0.93 -0.28 114.58 120.11 1jxq h GLU 358 Ca 0.09 -0.03 -0.14 0.00 -1.18 0.00 0.00 59.36 58.10 1jxq h GLU 358 Cb 0.03 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 1jxq h GLU 358 CO -0.07 0.30 -1.57 1.04 -1.18 0.00 0.00 179.01 177.54 1jxq n GLN 359 N -4.58 0.63 0.00 1.92 6.02 -0.65 -4.71 117.38 116.01 1jxq n GLN 359 Ca 0.22 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 1jxq n GLN 359 Cb 0.73 -1.73 0.00 0.00 1.02 0.00 0.00 30.24 30.26 1jxq n GLN 359 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1jxq n TRP 360 N -2.74 0.00 0.33 1.08 7.02 0.44 -4.74 117.44 118.81 1jxq n TRP 360 Ca -0.10 0.00 0.19 0.00 -1.02 0.00 0.00 57.50 56.57 1jxq n TRP 360 Cb 0.80 0.00 1.02 0.00 -2.42 0.00 0.00 31.31 30.71 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 1.13 0.00 6.99 0.00 -1.22 0.24 119.26 126.40 1jxq h ALA 361 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1jxq h ALA 361 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1jxq h ALA 361 CO 0.00 -0.13 -0.09 1.12 0.00 0.00 0.00 179.25 180.15 1jxq h HIS 362 N 0.00 0.00 0.00 0.00 2.07 -1.85 -3.37 115.15 112.00 1jxq h HIS 362 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1jxq h HIS 362 Cb 0.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.25 1jxq h HIS 362 CO 0.00 0.09 0.00 -1.13 -3.07 0.00 0.00 177.93 173.82 1jxq n SER 363 N -3.15 0.23 -4.12 3.10 3.41 -0.10 -5.03 113.62 107.97 1jxq n SER 363 Ca 0.02 -0.81 -0.21 0.00 -0.26 0.00 0.00 58.87 57.62 1jxq n SER 363 Cb 0.49 0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.07 0.98 0.77 4.33 2.02 0.65 -5.14 118.70 122.24 1jxq s GLU 364 Ca 0.00 -0.63 -0.12 0.00 0.02 0.00 0.00 54.97 54.24 1jxq s GLU 364 Cb 0.00 -0.97 0.06 0.00 0.10 0.00 0.00 34.13 33.32 1jxq s GLU 364 CO 0.00 0.25 1.10 0.16 0.02 0.00 0.00 175.26 176.80 1jxq s ASP 365 N -0.78 4.76 0.17 -0.19 3.84 -1.26 -4.46 116.67 118.75 1jxq s ASP 365 Ca 0.03 1.19 -0.25 0.00 -0.00 0.00 0.00 52.55 53.52 1jxq s ASP 365 Cb -0.07 -1.92 0.05 0.00 -1.38 0.00 0.00 42.92 39.60 1jxq s ASP 365 CO 0.00 -1.78 1.56 0.25 -0.00 0.00 0.00 175.17 175.20 1jxq h LEU 366 N -0.96 -1.57 -1.34 2.11 5.85 -1.47 0.62 115.31 118.55 1jxq h LEU 366 Ca -0.46 0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.55 1jxq h LEU 366 Cb 1.27 0.72 -0.04 0.00 0.37 0.00 0.00 40.66 42.98 1jxq h LEU 366 CO 0.61 -0.32 0.47 0.06 -0.34 0.00 0.00 178.44 178.93 1jxq h GLN 367 N -0.18 0.83 -0.40 1.25 3.07 -1.94 -0.61 115.11 117.13 1jxq h GLN 367 Ca 0.19 -0.05 -0.12 0.00 0.09 0.00 0.00 58.65 58.76 1jxq h GLN 367 Cb 0.55 -0.19 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 1jxq h GLN 367 CO -0.75 0.55 -0.25 0.77 0.09 0.00 0.00 178.83 179.24 1jxq h SER 368 N 0.86 0.84 -0.03 0.06 0.02 -1.32 -2.39 113.55 111.59 1jxq h SER 368 Ca 0.29 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1jxq h SER 368 Cb 0.08 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 1jxq h SER 368 CO -0.08 1.05 0.01 -0.07 -1.14 0.00 0.00 176.83 176.60 1jxq h LEU 369 N 0.71 0.04 -2.51 5.07 3.38 -0.19 -2.89 115.31 118.92 1jxq h LEU 369 Ca 0.09 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1jxq h LEU 369 Cb 0.78 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 1jxq h LEU 369 CO 0.06 0.26 -0.02 -0.07 0.09 0.00 0.00 178.44 178.77 1jxq h LEU 370 N -0.18 0.00 -0.07 1.67 4.07 -1.08 -1.31 115.31 118.41 1jxq h LEU 370 Ca 0.01 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.72 1jxq h LEU 370 Cb 0.24 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.99 1jxq h LEU 370 CO 0.00 0.02 -0.99 -0.07 -1.08 0.00 0.00 178.44 176.32 1jxq h LEU 371 N 0.00 0.81 -0.95 1.67 3.38 -1.25 -0.45 115.31 118.52 1jxq h LEU 371 Ca -0.00 -0.63 -0.04 0.00 0.09 0.00 0.00 57.88 57.29 1jxq h LEU 371 Cb 0.09 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1jxq h LEU 371 CO 0.00 1.43 0.27 0.03 0.09 0.00 0.00 178.44 180.26 1jxq h ARG 372 N 0.36 1.02 0.22 1.13 3.08 -1.07 0.12 114.38 119.24 1jxq h ARG 372 Ca -0.11 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 1jxq h ARG 372 Cb 1.64 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.52 1jxq h ARG 372 CO 0.19 0.84 -0.10 0.28 -1.07 0.00 0.00 179.97 180.11 1jxq h VAL 373 N 1.00 0.86 -0.94 2.04 2.07 -1.25 -1.26 116.25 118.77 1jxq h VAL 373 Ca 0.23 -0.53 0.15 0.00 0.82 0.00 0.00 66.70 67.37 1jxq h VAL 373 Cb 0.21 1.17 -0.09 0.00 -1.52 0.00 0.00 31.29 31.05 1jxq h VAL 373 CO -0.02 0.12 0.55 0.00 0.02 0.00 0.00 177.57 178.24 1jxq h ALA 374 N 0.15 1.46 0.11 1.67 0.00 -0.76 -0.06 119.26 121.83 1jxq h ALA 374 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1jxq h ALA 374 Cb 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1jxq h ALA 374 CO 0.05 0.03 -0.05 -0.97 0.00 0.00 0.00 179.25 178.31 1jxq h ASN 375 N 0.79 -0.12 -0.70 0.00 -1.24 -0.59 -2.15 115.58 111.56 1jxq h ASN 375 Ca 0.50 -0.25 0.12 0.00 0.71 0.00 0.00 56.30 57.38 1jxq h ASN 375 Cb 0.65 0.03 -0.09 0.00 0.73 0.00 0.00 38.32 39.65 1jxq h ASN 375 CO -0.33 0.19 0.27 0.00 -1.29 0.00 0.00 177.43 176.28 1jxq h ALA 376 N 0.40 0.96 0.03 1.57 0.00 -0.49 -1.52 119.26 120.21 1jxq h ALA 376 Ca -0.01 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1jxq h ALA 376 Cb 0.37 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1jxq h ALA 376 CO 0.02 -0.20 -0.02 0.28 0.00 0.00 0.00 179.25 179.34 1jxq h VAL 377 N 0.44 1.01 -0.89 0.00 2.07 -0.96 -2.56 116.25 115.36 1jxq h VAL 377 Ca 0.37 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.83 1jxq h VAL 377 Cb 0.53 1.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 1jxq h VAL 377 CO -0.37 0.03 0.55 0.77 0.02 0.00 0.00 177.57 178.58 1jxq h SER 378 N -0.10 0.86 0.05 0.57 4.64 -0.73 0.48 113.55 119.32 1jxq h SER 378 Ca -0.00 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1jxq h SER 378 Cb 0.09 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1jxq h SER 378 CO 0.01 0.55 -0.05 0.58 -0.87 0.00 0.00 176.83 177.04 1jxq h VAL 379 N 1.00 1.05 0.00 0.95 2.07 -1.08 -2.10 116.25 118.13 1jxq h VAL 379 Ca 0.39 -0.22 -0.17 0.00 0.82 0.00 0.00 66.70 67.52 1jxq h VAL 379 Cb 0.19 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1jxq h VAL 379 CO -0.18 0.06 -0.86 0.11 0.02 0.00 0.00 177.57 176.72 1jxq h LYS 380 N 0.02 0.00 -2.24 1.57 1.79 -0.54 -3.42 116.57 113.74 1jxq h LYS 380 Ca 0.00 0.00 -0.43 0.00 -2.18 0.00 0.00 60.65 58.04 1jxq h LYS 380 Cb 0.11 0.00 -0.34 0.00 -1.58 0.00 0.00 32.23 30.41 1jxq h LYS 380 CO 0.01 0.74 -0.73 0.20 -1.08 0.00 0.00 179.45 178.59 1jxq s GLY 381 N -4.64 0.23 0.00 3.86 0.00 -0.52 -5.05 107.32 101.21 1jxq s GLY 381 Ca 0.02 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.65 1jxq s GLY 381 CO 0.79 2.48 0.72 1.39 0.00 0.00 0.00 173.10 178.48 1jxq n ILE 382 N 4.51 0.00 0.05 0.90 5.41 -1.12 -2.85 119.36 126.27 1jxq n ILE 382 Ca 0.07 1.20 -0.14 0.00 1.00 0.00 0.00 62.75 64.88 1jxq n ILE 382 Cb 0.43 -1.68 -0.05 0.00 -0.71 0.00 0.00 39.64 37.63 1jxq n ILE 382 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 176.55 178.43 1jxq h TYR 383 N 0.00 0.71 -1.46 1.39 -1.99 -1.97 -3.47 116.97 110.17 1jxq h TYR 383 Ca 0.00 -0.37 -0.48 0.00 2.00 0.00 0.00 58.73 59.87 1jxq h TYR 383 Cb 0.00 -0.09 0.13 0.00 2.00 0.00 0.00 36.73 38.78 1jxq h TYR 383 CO -0.45 1.19 -0.84 1.17 -0.00 0.00 0.00 178.16 179.23 1jxq n LYS 384 N -3.79 0.00 -1.58 4.88 3.00 -1.13 -4.71 118.16 114.82 1jxq n LYS 384 Ca -0.07 0.00 -0.46 0.00 -0.00 0.00 0.00 58.31 57.77 1jxq n LYS 384 Cb 0.82 -0.79 -0.05 0.00 0.00 0.00 0.00 35.03 35.02 1jxq n LYS 384 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1jxq n GLN 385 N 1.13 1.85 -3.05 1.64 6.02 -1.26 -4.94 117.38 118.77 1jxq n GLN 385 Ca 0.07 0.58 -0.38 0.00 -0.01 0.00 0.00 57.00 57.26 1jxq n GLN 385 Cb 0.35 -2.86 -0.06 0.00 1.02 0.00 0.00 30.24 28.68 1jxq n GLN 385 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1jxq s MET 386 N 5.61 4.43 0.65 -1.09 -2.45 -1.26 -4.46 119.30 120.73 1jxq s MET 386 Ca 1.00 1.02 -0.17 0.00 -1.25 0.00 0.00 55.69 56.30 1jxq s MET 386 Cb -0.57 -3.13 -0.01 0.00 1.25 0.00 0.00 34.83 32.37 1jxq s MET 386 CO 0.44 0.52 1.21 -2.14 1.05 0.00 0.00 175.02 176.10 1jxq s PRO 387 N -1.41 2.64 0.24 4.11 0.02 -1.26 -4.91 135.00 134.43 1jxq s PRO 387 Ca 0.37 1.80 0.08 0.00 0.02 0.00 0.00 61.00 63.27 1jxq s PRO 387 Cb -0.21 -1.89 -0.05 0.00 0.02 0.00 0.00 34.50 32.37 1jxq s PRO 387 CO 0.24 -1.46 -0.11 0.20 -0.33 0.00 0.00 177.00 175.54 1jxq s GLY 388 N -1.79 1.63 -0.10 0.52 0.00 -0.61 -4.98 107.32 101.99 1jxq s GLY 388 Ca 0.76 -1.78 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 1jxq s GLY 388 CO 0.38 -1.81 -0.06 0.00 0.00 0.00 0.00 173.10 171.62 1jxq s PHE 390 N 1.72 3.26 -0.46 0.00 2.99 -0.26 -4.98 117.98 120.24 1jxq s PHE 390 Ca 0.04 -1.39 -0.17 0.00 0.00 0.00 0.00 56.93 55.41 1jxq s PHE 390 Cb -0.13 -4.02 0.05 0.00 0.00 0.00 0.00 43.02 38.92 1jxq s PHE 390 CO -0.07 -1.25 0.47 1.21 -0.00 0.00 0.00 175.22 175.58 1jxq s ASN 392 N 3.20 6.18 -0.26 1.36 3.84 -1.26 -1.88 114.94 126.13 1jxq s ASN 392 Ca 0.19 -0.97 0.11 0.00 0.21 0.00 0.00 52.86 52.39 1jxq s ASN 392 Cb -0.15 -2.22 0.46 0.00 -0.55 0.00 0.00 41.25 38.78 1jxq s ASN 392 CO -0.02 -0.68 1.19 0.49 -2.79 0.00 0.00 177.10 175.28 1jxq n PHE 393 N 5.60 1.89 -2.54 0.43 3.01 -0.49 -5.05 117.46 120.30 1jxq n PHE 393 Ca -0.09 -1.99 -0.25 0.00 1.01 0.00 0.00 57.45 56.13 1jxq n PHE 393 Cb 0.46 -0.30 0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1jxq n PHE 393 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1jxq s LEU 394 N -3.41 3.28 -0.01 4.37 1.43 -1.24 -2.15 118.68 120.96 1jxq s LEU 394 Ca 0.45 0.48 0.10 0.00 -1.03 0.00 0.00 54.13 54.12 1jxq s LEU 394 Cb 0.39 -3.30 -0.14 0.00 0.03 0.00 0.00 46.19 43.17 1jxq s LEU 394 CO -0.00 -1.06 0.25 0.54 0.23 0.00 0.00 176.35 176.31 1jxq n ARG 395 N -2.48 1.08 -4.20 1.70 1.74 -1.26 -4.89 116.66 108.35 1jxq n ARG 395 Ca 0.05 -0.07 -0.12 0.00 -0.77 0.00 0.00 57.85 56.94 1jxq n ARG 395 Cb 0.58 -1.17 -0.10 0.00 -1.02 0.00 0.00 32.46 30.76 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 -2.50 1.17 0.59 5.56 1.02 -1.26 -4.96 119.74 119.36 1jxq s LYS 396 Ca -0.02 -1.61 -0.15 0.00 0.02 0.00 0.00 55.97 54.21 1jxq s LYS 396 Cb 0.06 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.58 1jxq s LYS 396 CO 0.40 -0.37 1.05 0.15 -0.92 0.00 0.00 175.35 175.66 1jxq s LYS 397 N -4.14 3.37 -0.29 1.68 1.02 -0.51 -4.74 119.74 116.14 1jxq s LYS 397 Ca 0.37 1.13 0.02 0.00 0.02 0.00 0.00 55.97 57.50 1jxq s LYS 397 Cb 0.07 -2.04 0.08 0.00 -0.52 0.00 0.00 37.83 35.42 1jxq s LYS 397 CO 0.11 -0.76 0.01 -1.17 -0.92 0.00 0.00 175.35 172.62 1jxq s LEU 398 N -4.57 3.23 -0.38 3.17 2.96 -1.26 -1.24 118.68 120.59 1jxq s LEU 398 Ca 0.62 -1.60 -0.14 0.00 -0.22 0.00 0.00 54.13 52.79 1jxq s LEU 398 Cb -0.15 -1.27 0.01 0.00 0.50 0.00 0.00 46.19 45.28 1jxq s LEU 398 CO 0.38 -0.32 0.27 -0.36 -1.32 0.00 0.00 176.35 175.00 1jxq s PHE 399 N 1.27 3.23 0.61 5.38 0.08 -1.26 -0.99 117.98 126.31 1jxq s PHE 399 Ca 0.03 -0.48 -0.19 0.00 0.12 0.00 0.00 56.93 56.41 1jxq s PHE 399 Cb -0.19 -2.53 -0.03 0.00 -0.57 0.00 0.00 43.02 39.70 1jxq s PHE 399 CO -0.11 -0.51 1.25 -0.06 -0.10 0.00 0.00 175.22 175.69 1jxq s PHE 400 N 1.68 2.28 -0.11 0.36 0.08 -1.26 -4.84 117.98 116.17 1jxq s PHE 400 Ca 0.05 1.49 -0.29 0.00 0.12 0.00 0.00 56.93 58.31 1jxq s PHE 400 Cb -0.18 -3.58 -0.01 0.00 -0.57 0.00 0.00 43.02 38.67 1jxq s PHE 400 CO 0.10 -2.50 0.97 0.21 -0.10 0.00 0.00 175.22 173.90 1jxq s LYS 401 N -3.31 4.41 0.07 0.44 2.20 -1.26 -4.84 119.74 117.45 1jxq s LYS 401 Ca 0.79 1.33 -0.04 0.00 -0.36 0.00 0.00 55.97 57.69 1jxq s LYS 401 Cb -0.34 -3.54 -0.03 0.00 -1.51 0.00 0.00 37.83 32.42 1jxq s LYS 401 CO 0.36 -0.30 0.05 0.95 -0.36 0.00 0.00 175.35 176.06 1jxq s THR 402 N 1.96 0.18 0.00 3.43 -4.23 -1.26 -4.17 115.64 111.56 1jxq s THR 402 Ca 0.47 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 1jxq s THR 402 Cb -0.18 -1.51 0.00 0.00 1.34 0.00 0.00 72.50 72.15 1jxq s THR 402 CO 0.18 -0.84 0.00 -1.20 -0.54 0.00 0.00 174.62 172.22