#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 -0.63 -3.31 -2.53 0.00 -1.26 -2.13 120.51 110.65 1jxq n ALA 149 Ca 0.00 0.16 -0.16 0.00 0.00 0.00 0.00 53.44 53.44 1jxq n ALA 149 Cb 0.00 -1.88 0.08 0.00 0.00 0.00 0.00 19.45 17.65 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 -1.79 -4.80 -0.58 0.00 2.03 -1.26 -4.94 116.55 105.21 1jxq n ASP 150 Ca -0.20 -0.67 0.08 0.00 0.52 0.00 0.00 54.79 54.52 1jxq n ASP 150 Cb 0.64 -5.15 0.05 0.00 -0.72 0.00 0.00 41.12 35.95 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 -3.57 2.18 -3.71 -2.67 4.77 -0.91 -4.93 117.00 108.16 1jxq n LEU 151 Ca -0.16 -0.96 -0.14 0.00 -0.03 0.00 0.00 56.01 54.72 1jxq n LEU 151 Cb 0.64 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.64 1jxq n LEU 151 CO 0.59 0.39 0.14 0.00 -1.33 0.00 0.00 177.39 177.18 1jxq s ALA 152 N -1.38 -1.10 0.34 -1.18 0.00 -1.26 -2.10 121.76 115.08 1jxq s ALA 152 Ca 0.17 1.01 -0.28 0.00 0.00 0.00 0.00 51.96 52.86 1jxq s ALA 152 Cb 0.13 -0.42 -0.10 0.00 0.00 0.00 0.00 23.12 22.73 1jxq s ALA 152 CO 0.22 -0.25 1.32 0.71 0.00 0.00 0.00 175.76 177.77 1jxq s TYR 153 N -0.38 3.00 -0.27 0.00 1.51 -0.43 -4.87 117.35 115.90 1jxq s TYR 153 Ca -0.05 1.40 -0.22 0.00 -1.01 0.00 0.00 57.07 57.18 1jxq s TYR 153 Cb -0.03 -3.71 -0.01 0.00 -0.11 0.00 0.00 41.96 38.10 1jxq s TYR 153 CO 0.03 -1.96 0.73 0.42 -1.11 0.00 0.00 175.55 173.66 1jxq s ILE 154 N -1.15 4.88 -0.75 2.71 -1.09 -1.26 -4.72 121.20 119.83 1jxq s ILE 154 Ca 0.50 1.22 0.04 0.00 -2.23 0.00 0.00 60.65 60.17 1jxq s ILE 154 Cb -0.40 -4.05 0.26 0.00 -1.58 0.00 0.00 42.46 36.68 1jxq s ILE 154 CO 0.54 -0.11 0.91 0.18 -1.23 0.00 0.00 174.94 175.22 1jxq n LEU 155 N 5.96 4.35 -0.08 2.97 4.32 -1.26 -4.85 117.00 128.42 1jxq n LEU 155 Ca 0.02 -5.38 -0.14 0.00 -0.02 0.00 0.00 56.01 50.49 1jxq n LEU 155 Cb 0.48 -0.82 -0.10 0.00 -1.62 0.00 0.00 43.42 41.37 1jxq n LEU 155 CO 0.47 1.96 0.01 0.77 -1.22 0.00 0.00 177.39 179.38 1jxq h SER 156 N 4.53 0.00 -2.43 -1.43 4.64 -1.97 -3.46 113.55 113.43 1jxq h SER 156 Ca 0.20 -0.64 -0.57 0.00 -0.47 0.00 0.00 61.79 60.32 1jxq h SER 156 Cb 0.66 0.00 0.21 0.00 -0.31 0.00 0.00 62.40 62.95 1jxq h SER 156 CO 0.95 1.05 -1.18 0.80 -0.87 0.00 0.00 176.83 177.58 1jxq n MET 156 N -4.58 0.04 -3.50 4.77 0.00 -1.26 -4.99 117.12 107.59 1jxq n MET 156 Ca -0.15 0.03 -0.14 0.00 -0.00 0.00 0.00 57.70 57.44 1jxq n MET 156 Cb 0.45 -1.29 -0.12 0.00 0.00 0.00 0.00 33.22 32.27 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 -2.06 0.23 0.91 2.12 2.56 -1.26 -3.73 118.70 117.46 1jxq s GLU 161 Ca 0.53 0.46 -0.10 0.00 0.00 0.00 0.00 54.97 55.85 1jxq s GLU 161 Cb -0.31 -0.66 0.14 0.00 2.00 0.00 0.00 34.13 35.30 1jxq s GLU 161 CO 0.71 -0.54 1.12 -1.25 -0.56 0.00 0.00 175.26 174.74 1jxq s PRO 162 N 2.42 1.09 0.24 4.30 0.04 -1.26 -5.09 135.00 136.73 1jxq s PRO 162 Ca 0.07 1.38 0.04 0.00 0.04 0.00 0.00 61.00 62.52 1jxq s PRO 162 Cb -0.15 -1.75 0.26 0.00 0.04 0.00 0.00 34.50 32.91 1jxq s PRO 162 CO -0.12 -2.53 1.57 0.00 0.04 0.00 0.00 177.00 175.96 1jxq n GLY 163 N 0.20 -1.26 3.91 0.00 0.00 -1.25 -0.83 105.19 105.96 1jxq n GLY 163 Ca -0.02 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.64 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 3.53 -0.05 1.61 3.76 -1.20 -0.93 115.29 119.02 1jxq s HIS 164 Ca 0.00 0.37 -0.02 0.00 -0.15 0.00 0.00 55.06 55.26 1jxq s HIS 164 Cb 0.00 -1.85 0.03 0.00 1.11 0.00 0.00 32.58 31.88 1jxq s HIS 164 CO 0.00 0.58 0.07 0.00 -0.85 0.00 0.00 174.74 174.55 1jxq s LEU 166 N 2.02 3.35 -0.29 0.00 2.96 0.60 -0.64 118.68 126.68 1jxq s LEU 166 Ca 0.02 -0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 1jxq s LEU 166 Cb -0.12 -1.79 0.06 0.00 0.50 0.00 0.00 46.19 44.84 1jxq s LEU 166 CO -0.04 0.24 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.57 1jxq s ILE 167 N -0.05 2.54 -0.39 6.68 1.01 -0.23 0.29 121.20 131.05 1jxq s ILE 167 Ca 0.02 -1.67 -0.23 0.00 0.00 0.00 0.00 60.65 58.78 1jxq s ILE 167 Cb -0.13 -2.54 0.01 0.00 0.01 0.00 0.00 42.46 39.81 1jxq s ILE 167 CO 0.02 -0.17 0.75 -0.63 0.00 0.00 0.00 174.94 174.92 1jxq s ILE 168 N 1.13 4.74 -0.51 2.92 -1.09 0.27 -1.38 121.20 127.28 1jxq s ILE 168 Ca -0.04 0.69 -0.04 0.00 -2.23 0.00 0.00 60.65 59.03 1jxq s ILE 168 Cb -0.20 -4.21 0.13 0.00 -1.58 0.00 0.00 42.46 36.60 1jxq s ILE 168 CO -0.04 -0.49 0.33 0.21 -1.23 0.00 0.00 174.94 173.72 1jxq s ASN 169 N 1.91 5.37 -0.32 3.58 2.47 -0.22 -0.48 114.94 127.25 1jxq s ASN 169 Ca 0.29 -2.34 -0.19 0.00 0.42 0.00 0.00 52.86 51.05 1jxq s ASN 169 Cb -0.13 -1.88 -0.01 0.00 -1.45 0.00 0.00 41.25 37.78 1jxq s ASN 169 CO 0.18 -0.51 0.56 0.20 -3.72 0.00 0.00 177.10 173.81 1jxq s ASN 170 N 1.56 6.41 -0.04 -4.21 -0.87 -0.15 -1.29 114.94 116.34 1jxq s ASN 170 Ca 0.11 0.26 0.00 0.00 -1.57 0.00 0.00 52.86 51.66 1jxq s ASN 170 Cb -0.22 -2.29 -0.03 0.00 -0.02 0.00 0.00 41.25 38.69 1jxq s ASN 170 CO -0.04 -0.44 -0.04 0.52 -2.57 0.00 0.00 177.10 174.54 1jxq n VAL 171 N 5.37 0.24 -4.01 1.60 0.31 -1.26 -4.49 118.33 116.09 1jxq n VAL 171 Ca -0.03 -0.09 -0.35 0.00 -0.01 0.00 0.00 64.34 63.86 1jxq n VAL 171 Cb 0.49 -0.66 -0.13 0.00 -0.91 0.00 0.00 33.84 32.63 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 -4.41 4.54 0.14 4.52 0.01 -1.26 -0.57 114.94 117.90 1jxq s ASN 172 Ca -0.06 -0.30 0.08 0.00 -0.71 0.00 0.00 52.86 51.87 1jxq s ASN 172 Cb 0.01 -1.78 -0.04 0.00 0.41 0.00 0.00 41.25 39.86 1jxq s ASN 172 CO 0.09 0.02 -0.08 -0.36 -1.51 0.00 0.00 177.10 175.26 1jxq s PHE 173 N 1.26 2.73 0.75 2.20 0.40 -1.26 -4.76 117.98 119.30 1jxq s PHE 173 Ca 0.03 -0.17 -0.12 0.00 -0.60 0.00 0.00 56.93 56.08 1jxq s PHE 173 Cb -0.14 -1.38 0.05 0.00 0.51 0.00 0.00 43.02 42.05 1jxq s PHE 173 CO -0.00 0.46 1.10 0.00 0.70 0.00 0.00 175.22 177.48 1jxq h ARG 175 N -0.90 0.43 -0.49 0.00 3.08 -1.93 -3.08 114.38 111.49 1jxq h ARG 175 Ca -0.44 -0.22 0.14 0.00 0.07 0.00 0.00 59.98 59.53 1jxq h ARG 175 Cb 1.24 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 1jxq h ARG 175 CO 0.51 0.77 0.38 1.49 -1.07 0.00 0.00 179.97 182.05 1jxq h GLU 175 N 0.36 0.00 0.17 0.04 4.81 -1.95 -1.91 114.58 116.10 1jxq h GLU 175 Ca 0.03 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.94 1jxq h GLU 175 Cb 0.88 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.27 1jxq h GLU 175 CO 0.07 0.00 -1.56 0.66 -0.73 0.00 0.00 179.01 177.46 1jxq h SER 175 N 0.00 0.57 0.00 1.04 4.64 -1.84 -3.48 113.55 114.48 1jxq h SER 175 Ca 0.23 -0.74 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1jxq h SER 175 Cb 0.98 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1jxq h SER 175 CO -0.00 1.60 0.00 0.61 -0.87 0.00 0.00 176.83 178.17 1jxq n GLY 175 N 1.72 0.55 3.68 -0.77 0.00 -0.72 -5.00 105.19 104.65 1jxq n GLY 175 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 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 4.20 0.62 0.99 1.43 -1.26 -5.01 118.68 119.66 1jxq s LEU 176 Ca 0.00 1.49 -0.18 0.00 -1.03 0.00 0.00 54.13 54.41 1jxq s LEU 176 Cb 0.00 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.65 1jxq s LEU 176 CO 0.00 -0.52 1.23 -0.13 0.23 0.00 0.00 176.35 177.16 1jxq s ARG 177 N 2.41 2.76 0.24 1.70 0.52 -1.26 -4.51 118.95 120.81 1jxq s ARG 177 Ca 0.47 1.89 -0.31 0.00 -0.52 0.00 0.00 55.73 57.26 1jxq s ARG 177 Cb -0.17 -1.89 -0.11 0.00 0.52 0.00 0.00 34.95 33.29 1jxq s ARG 177 CO 0.14 -1.39 1.59 0.99 0.02 0.00 0.00 175.30 176.65 1jxq s THR 178 N -1.58 2.26 -1.23 0.02 2.01 -1.26 -4.78 115.64 111.08 1jxq s THR 178 Ca 0.79 0.21 -0.06 0.00 0.31 0.00 0.00 61.69 62.93 1jxq s THR 178 Cb -0.32 -3.13 0.20 0.00 0.01 0.00 0.00 72.50 69.25 1jxq s THR 178 CO 0.36 0.03 1.92 0.54 -0.69 0.00 0.00 174.62 176.78 1jxq n ARG 179 N 2.94 4.22 -2.22 4.92 1.74 0.26 -4.98 116.66 123.54 1jxq n ARG 179 Ca 0.11 -3.83 -0.41 0.00 -0.77 0.00 0.00 57.85 52.95 1jxq n ARG 179 Cb 0.38 -2.72 -0.03 0.00 -1.02 0.00 0.00 32.46 29.06 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 -1.10 3.01 0.00 0.55 -4.23 -1.26 -2.59 115.64 110.01 1jxq s THR 180 Ca 0.41 0.96 0.00 0.00 -1.18 0.00 0.00 61.69 61.89 1jxq s THR 180 Cb 0.12 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.34 1jxq s THR 180 CO -0.01 0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.89 1jxq n GLY 181 N 1.27 2.75 0.24 3.99 0.00 -1.26 -4.54 105.19 107.64 1jxq n GLY 181 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 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 0.16 0.00 -0.62 1.61 0.87 -1.84 -2.03 113.55 111.71 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 0.18 0.06 0.78 -0.53 0.00 0.00 176.83 177.32 1jxq h ASN 183 N 0.00 1.03 -0.15 6.23 2.35 -1.91 0.31 115.58 123.43 1jxq h ASN 183 Ca -0.00 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.51 1jxq h ASN 183 Cb 0.48 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1jxq h ASN 183 CO 0.02 1.04 0.03 0.40 -1.65 0.00 0.00 177.43 177.27 1jxq h ILE 184 N 0.98 0.93 -0.40 2.81 1.08 -1.74 0.90 117.51 122.08 1jxq h ILE 184 Ca 0.19 -0.03 0.05 0.00 -0.39 0.00 0.00 64.86 64.67 1jxq h ILE 184 Cb 0.49 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 35.02 1jxq h ILE 184 CO 0.02 0.02 0.14 0.44 -0.69 0.00 0.00 178.15 178.08 1jxq h ASP 185 N 0.09 0.15 -0.21 1.72 3.45 -1.12 -1.34 116.42 119.16 1jxq h ASP 185 Ca 0.07 0.04 -0.00 0.00 0.43 0.00 0.00 57.03 57.57 1jxq h ASP 185 Cb 0.06 0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.85 1jxq h ASP 185 CO -0.09 0.12 0.12 0.00 -1.57 0.00 0.00 179.24 177.81 1jxq h GLU 187 N 0.23 1.25 0.06 0.00 4.57 -0.47 0.14 114.58 120.36 1jxq h GLU 187 Ca 0.07 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1jxq h GLU 187 Cb 0.06 -0.28 0.00 0.00 -0.16 0.00 0.00 28.75 28.37 1jxq h GLU 187 CO -0.01 0.83 -0.03 0.87 -1.18 0.00 0.00 179.01 179.49 1jxq h LYS 188 N 1.29 -0.08 -0.46 1.92 1.57 -0.93 -1.69 116.57 118.19 1jxq h LYS 188 Ca 0.36 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.08 1jxq h LYS 188 Cb -0.12 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1jxq h LYS 188 CO -0.09 -0.03 0.03 -0.07 -0.57 0.00 0.00 179.45 178.73 1jxq h LEU 189 N -0.10 0.77 -0.21 2.94 3.38 -0.84 0.11 115.31 121.35 1jxq h LEU 189 Ca -0.01 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.69 1jxq h LEU 189 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1jxq h LEU 189 CO 0.01 0.86 0.09 -0.09 0.09 0.00 0.00 178.44 179.41 1jxq h ARG 190 N 0.64 0.19 -0.74 1.13 2.43 -0.70 0.17 114.38 117.50 1jxq h ARG 190 Ca 0.13 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 1jxq h ARG 190 Cb 0.45 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1jxq h ARG 190 CO 0.02 0.13 0.36 -0.09 -1.51 0.00 0.00 179.97 178.88 1jxq h ARG 191 N 0.20 1.06 0.58 0.20 9.65 -1.18 -2.22 114.38 122.67 1jxq h ARG 191 Ca 0.09 -0.14 -0.03 0.00 -1.10 0.00 0.00 59.98 58.80 1jxq h ARG 191 Cb 0.04 -0.20 0.01 0.00 -1.39 0.00 0.00 29.97 28.42 1jxq h ARG 191 CO -0.07 0.81 -0.28 -0.09 2.80 0.00 0.00 179.97 183.14 1jxq h ARG 192 N 1.05 -0.75 0.00 0.20 9.65 0.11 -2.82 114.38 121.82 1jxq h ARG 192 Ca 0.26 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 1jxq h ARG 192 Cb 0.10 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 1jxq h ARG 192 CO -0.03 -0.50 0.00 0.74 2.80 0.00 0.00 179.97 182.98 1jxq h PHE 193 N -1.04 0.00 -0.20 2.20 -1.00 -0.75 0.71 116.94 116.86 1jxq h PHE 193 Ca -0.08 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.52 1jxq h PHE 193 Cb 0.60 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.16 1jxq h PHE 193 CO 0.03 0.00 -0.57 1.03 -1.61 0.00 0.00 178.31 177.19 1jxq h SER 194 N 0.00 0.85 0.32 2.17 0.87 -1.33 -2.37 113.55 114.05 1jxq h SER 194 Ca 0.00 -0.58 -0.03 0.00 -1.23 0.00 0.00 61.79 59.95 1jxq h SER 194 Cb 0.10 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 1jxq h SER 194 CO 0.00 1.28 -0.15 0.28 -0.53 0.00 0.00 176.83 177.71 1jxq h SER 195 N 0.46 0.00 -0.09 6.23 0.02 -0.61 -0.57 113.55 118.99 1jxq h SER 195 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1jxq h SER 195 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1jxq h SER 195 CO 0.12 0.15 0.00 0.18 -1.14 0.00 0.00 176.83 176.14 1jxq n LEU 196 N -3.84 0.75 -2.41 5.07 4.77 -0.95 -3.79 117.00 116.61 1jxq n LEU 196 Ca -0.02 -0.38 -0.13 0.00 -0.03 0.00 0.00 56.01 55.46 1jxq n LEU 196 Cb 0.25 -0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.23 1jxq n LEU 196 CO 0.32 0.17 0.11 1.41 -1.33 0.00 0.00 177.39 178.07 1jxq n HIS 197 N -0.15 -1.56 -4.35 -1.77 8.25 -0.22 -4.33 115.22 111.09 1jxq n HIS 197 Ca 0.03 0.59 -0.25 0.00 -0.26 0.00 0.00 57.72 57.83 1jxq n HIS 197 Cb 0.14 -3.62 -0.09 0.00 1.12 0.00 0.00 29.99 27.53 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 -3.20 2.53 -0.91 4.41 0.40 -0.92 0.06 117.98 120.35 1jxq s PHE 198 Ca 0.20 -0.26 -0.17 0.00 -0.60 0.00 0.00 56.93 56.10 1jxq s PHE 198 Cb -0.09 -1.19 0.17 0.00 0.51 0.00 0.00 43.02 42.42 1jxq s PHE 198 CO 0.44 0.57 1.01 -1.64 0.70 0.00 0.00 175.22 176.31 1jxq s MET 199 N -3.12 3.63 0.14 0.44 -1.94 -0.10 -4.58 119.30 113.77 1jxq s MET 199 Ca 0.27 -2.06 -0.30 0.00 -1.71 0.00 0.00 55.69 51.88 1jxq s MET 199 Cb -0.07 -4.75 -0.06 0.00 2.01 0.00 0.00 34.83 31.95 1jxq s MET 199 CO 0.15 -1.59 0.97 0.08 -0.01 0.00 0.00 175.02 174.62 1jxq s VAL 200 N 1.69 4.36 -0.10 -6.03 1.01 -1.26 -2.35 120.40 117.72 1jxq s VAL 200 Ca 0.28 2.02 -0.00 0.00 0.00 0.00 0.00 61.98 64.28 1jxq s VAL 200 Cb -0.07 -4.29 0.02 0.00 0.00 0.00 0.00 36.38 32.05 1jxq s VAL 200 CO -0.09 0.34 -0.07 -0.70 0.00 0.00 0.00 175.10 174.58 1jxq s GLU 201 N -0.22 1.40 0.04 2.72 2.12 0.19 -4.97 118.70 119.97 1jxq s GLU 201 Ca 0.46 -0.21 -0.02 0.00 0.36 0.00 0.00 54.97 55.56 1jxq s GLU 201 Cb -0.24 -1.49 -0.04 0.00 0.26 0.00 0.00 34.13 32.62 1jxq s GLU 201 CO 0.31 -0.26 0.23 0.08 -0.54 0.00 0.00 175.26 175.08 1jxq s VAL 202 N 1.70 5.37 -0.13 3.70 1.01 -1.26 -1.06 120.40 129.72 1jxq s VAL 202 Ca 0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 1jxq s VAL 202 Cb -0.13 -3.59 0.07 0.00 0.00 0.00 0.00 36.38 32.73 1jxq s VAL 202 CO -0.07 0.23 0.23 -0.54 0.00 0.00 0.00 175.10 174.95 1jxq s LYS 203 N -2.20 0.13 0.39 2.72 1.02 -0.48 -4.94 119.74 116.38 1jxq s LYS 203 Ca 0.32 0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.92 1jxq s LYS 203 Cb -0.13 -0.29 -0.02 0.00 -0.52 0.00 0.00 37.83 36.87 1jxq s LYS 203 CO 0.22 -0.36 0.60 0.20 -0.92 0.00 0.00 175.35 175.10 1jxq s GLY 204 N 2.38 1.45 -0.28 -3.33 0.00 -1.26 -1.05 107.32 105.22 1jxq s GLY 204 Ca 0.03 -0.98 -0.25 0.00 0.00 0.00 0.00 44.72 43.52 1jxq s GLY 204 CO -0.08 -0.87 0.41 1.22 0.00 0.00 0.00 173.10 173.78 1jxq n ASP 205 N -1.91 -3.70 -4.58 1.64 8.00 -0.41 -4.90 116.55 110.69 1jxq n ASP 205 Ca -0.02 -0.08 -0.32 0.00 0.71 0.00 0.00 54.79 55.08 1jxq n ASP 205 Cb 0.57 -1.06 -0.11 0.00 -0.02 0.00 0.00 41.12 40.50 1jxq n ASP 205 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1jxq s LEU 206 N -1.56 3.09 0.58 0.64 1.02 -1.26 -4.91 118.68 116.28 1jxq s LEU 206 Ca 0.24 -0.21 -0.09 0.00 0.02 0.00 0.00 54.13 54.08 1jxq s LEU 206 Cb -0.02 -1.80 -0.04 0.00 0.02 0.00 0.00 46.19 44.35 1jxq s LEU 206 CO 0.54 0.26 0.96 -0.89 0.02 0.00 0.00 176.35 177.24 1jxq s THR 207 N -1.03 4.75 0.24 5.49 2.01 -1.26 -0.16 115.64 125.68 1jxq s THR 207 Ca 0.18 0.68 -0.05 0.00 0.31 0.00 0.00 61.69 62.81 1jxq s THR 207 Cb -0.11 -3.86 0.20 0.00 0.01 0.00 0.00 72.50 68.73 1jxq s THR 207 CO 0.08 -1.06 1.77 0.00 -0.69 0.00 0.00 174.62 174.72 1jxq h ALA 208 N -0.17 1.06 0.22 7.40 0.00 -1.86 0.97 119.26 126.87 1jxq h ALA 208 Ca -0.45 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1jxq h ALA 208 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1jxq h ALA 208 CO 0.62 -0.07 -0.10 -0.22 0.00 0.00 0.00 179.25 179.47 1jxq h LYS 209 N 0.59 -0.28 -0.77 0.00 3.64 -1.93 -2.15 116.57 115.67 1jxq h LYS 209 Ca 0.38 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1jxq h LYS 209 Cb 0.46 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 1jxq h LYS 209 CO -0.31 -0.03 0.48 0.87 -2.27 0.00 0.00 179.45 178.19 1jxq h LYS 210 N -0.50 1.03 0.16 1.90 1.57 -1.63 -1.52 116.57 117.58 1jxq h LYS 210 Ca -0.03 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1jxq h LYS 210 Cb 0.38 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1jxq h LYS 210 CO 0.05 0.71 -0.15 0.52 -0.57 0.00 0.00 179.45 180.01 1jxq h MET 211 N 1.06 -0.33 -0.59 3.15 2.86 0.10 0.76 114.93 121.94 1jxq h MET 211 Ca 0.28 0.02 0.09 0.00 -2.06 0.00 0.00 59.70 58.03 1jxq h MET 211 Cb -0.07 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.60 1jxq h MET 211 CO -0.06 -0.22 0.23 0.28 1.06 0.00 0.00 176.91 178.21 1jxq h VAL 212 N -0.34 0.80 -0.33 -2.22 2.07 -0.97 0.81 116.25 116.07 1jxq h VAL 212 Ca 0.00 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.38 1jxq h VAL 212 Cb 0.32 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1jxq h VAL 212 CO -0.04 0.08 0.21 -0.07 0.02 0.00 0.00 177.57 177.77 1jxq h LEU 213 N 0.42 0.36 -0.63 2.57 -0.00 -0.83 0.63 115.31 117.83 1jxq h LEU 213 Ca 0.29 -0.00 0.08 0.00 -0.00 0.00 0.00 57.88 58.24 1jxq h LEU 213 Cb 0.34 -0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 40.85 1jxq h LEU 213 CO -0.28 0.26 0.30 0.00 -0.00 0.00 0.00 178.44 178.72 1jxq h ALA 214 N 1.13 0.84 -0.36 1.53 0.00 0.43 0.45 119.26 123.28 1jxq h ALA 214 Ca 0.13 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1jxq h ALA 214 Cb -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1jxq h ALA 214 CO -0.04 -0.08 0.14 -0.07 0.00 0.00 0.00 179.25 179.20 1jxq h LEU 215 N 0.54 0.50 -0.68 0.00 3.38 -0.22 -1.65 115.31 117.18 1jxq h LEU 215 Ca 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1jxq h LEU 215 Cb 0.29 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1jxq h LEU 215 CO -0.24 0.53 0.34 -0.07 0.09 0.00 0.00 178.44 179.10 1jxq h LEU 216 N 0.43 0.88 -2.11 1.67 3.38 -0.10 -0.51 115.31 118.95 1jxq h LEU 216 Ca 0.12 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1jxq h LEU 216 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1jxq h LEU 216 CO -0.01 0.75 0.12 -0.08 0.09 0.00 0.00 178.44 179.31 1jxq h GLU 217 N 0.94 0.00 0.14 1.13 4.57 0.22 0.01 114.58 121.59 1jxq h GLU 217 Ca 0.24 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 58.12 1jxq h GLU 217 Cb 0.10 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1jxq h GLU 217 CO -0.03 0.00 -1.27 1.25 -1.18 0.00 0.00 179.01 177.78 1jxq h LEU 218 N 0.00 0.72 -0.85 1.64 5.85 -0.16 -3.27 115.31 119.23 1jxq h LEU 218 Ca 0.07 -0.70 -0.06 0.00 0.84 0.00 0.00 57.88 58.02 1jxq h LEU 218 Cb 0.30 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1jxq h LEU 218 CO -0.00 1.53 -0.30 0.00 -0.34 0.00 0.00 178.44 179.33 1jxq h ALA 219 N 0.38 0.96 0.00 1.25 0.00 -0.40 -2.56 119.26 118.88 1jxq h ALA 219 Ca -0.18 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1jxq h ALA 219 Cb 1.95 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1jxq h ALA 219 CO 0.23 0.38 0.00 0.54 0.00 0.00 0.00 179.25 180.40 1jxq n ARG 220 N -3.39 0.07 -1.38 0.00 1.74 -0.13 -4.77 116.66 108.80 1jxq n ARG 220 Ca 0.00 0.16 -0.30 0.00 -0.77 0.00 0.00 57.85 56.94 1jxq n ARG 220 Cb 0.50 -1.50 0.11 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 -2.88 1.86 -0.48 5.56 2.00 -0.97 -5.00 119.66 119.75 1jxq s GLN 221 Ca 0.12 0.81 -0.11 0.00 -2.00 0.00 0.00 55.36 54.18 1jxq s GLN 221 Cb 0.13 -1.88 0.11 0.00 0.80 0.00 0.00 33.01 32.17 1jxq s GLN 221 CO 0.33 -1.82 0.36 0.34 -0.50 0.00 0.00 175.29 174.00 1jxq s ASP 222 N -3.64 5.80 0.00 6.67 2.15 -1.26 -4.85 116.67 121.54 1jxq s ASP 222 Ca 0.62 -1.81 0.18 0.00 0.43 0.00 0.00 52.55 51.97 1jxq s ASP 222 Cb -0.16 -2.05 0.76 0.00 -0.30 0.00 0.00 42.92 41.17 1jxq s ASP 222 CO 0.56 -0.70 1.53 1.41 -0.17 0.00 0.00 175.17 177.80 1jxq n HIS 224 N 4.98 0.17 -0.18 -5.34 8.25 -1.26 -4.59 115.22 117.25 1jxq n HIS 224 Ca -0.09 -0.08 -0.05 0.00 -0.26 0.00 0.00 57.72 57.24 1jxq n HIS 224 Cb 0.41 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.48 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 1.00 -1.46 0.46 -1.41 0.00 -1.26 0.73 105.19 103.25 1jxq n GLY 225 Ca 0.14 0.57 0.07 0.00 0.00 0.00 0.00 46.02 46.80 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 -3.36 2.49 -2.87 4.61 0.00 -1.26 -4.89 120.51 115.24 1jxq n ALA 226 Ca 0.01 -0.45 -0.21 0.00 0.00 0.00 0.00 53.44 52.79 1jxq n ALA 226 Cb 0.11 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.25 4.22 -0.02 0.00 1.43 0.22 -4.80 118.68 118.48 1jxq s LEU 227 Ca 0.24 -0.00 0.16 0.00 -1.03 0.00 0.00 54.13 53.49 1jxq s LEU 227 Cb 0.12 -2.80 -0.24 0.00 0.03 0.00 0.00 46.19 43.31 1jxq s LEU 227 CO 0.18 -0.13 0.37 0.47 0.23 0.00 0.00 176.35 177.47 1jxq n ASP 228 N -1.43 1.33 -3.57 2.29 8.00 -0.01 -4.99 116.55 118.16 1jxq n ASP 228 Ca -0.07 -0.08 -0.13 0.00 0.71 0.00 0.00 54.79 55.22 1jxq n ASP 228 Cb 0.57 1.65 -0.05 0.00 -0.02 0.00 0.00 41.12 43.28 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 0.49 -0.05 0.00 1.01 -0.12 -1.55 120.40 119.41 1jxq s VAL 231 Ca 0.06 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1jxq s VAL 231 Cb -0.08 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.86 1jxq s VAL 231 CO 0.01 0.16 -0.09 -0.69 0.00 0.00 0.00 175.10 174.49 1jxq s VAL 232 N 0.19 0.88 -0.03 2.92 1.01 -0.19 -0.29 120.40 124.89 1jxq s VAL 232 Ca -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1jxq s VAL 232 Cb -0.06 -0.83 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 1jxq s VAL 232 CO -0.00 0.29 -0.12 -0.69 0.00 0.00 0.00 175.10 174.58 1jxq s VAL 233 N 0.63 1.00 -0.06 2.92 1.01 0.14 -0.37 120.40 125.67 1jxq s VAL 233 Ca -0.11 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.39 1jxq s VAL 233 Cb -0.14 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.39 1jxq s VAL 233 CO 0.02 0.30 -0.05 -0.63 0.00 0.00 0.00 175.10 174.74 1jxq s ILE 234 N 0.07 0.65 -0.22 2.22 1.01 -0.68 0.96 121.20 125.21 1jxq s ILE 234 Ca -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.46 1jxq s ILE 234 Cb -0.09 -0.68 0.01 0.00 0.01 0.00 0.00 42.46 41.72 1jxq s ILE 234 CO 0.01 0.26 -0.09 -0.76 0.00 0.00 0.00 174.94 174.37 1jxq s LEU 235 N 1.12 2.87 0.00 2.97 1.43 0.36 -2.17 118.68 125.27 1jxq s LEU 235 Ca -0.07 -0.68 -0.17 0.00 -1.03 0.00 0.00 54.13 52.17 1jxq s LEU 235 Cb -0.14 -1.65 0.06 0.00 0.03 0.00 0.00 46.19 44.49 1jxq s LEU 235 CO -0.01 -0.07 0.80 -0.24 0.23 0.00 0.00 176.35 177.06 1jxq n SER 236 N 4.70 -0.91 -4.79 2.29 2.88 -1.13 -0.98 113.62 115.69 1jxq n SER 236 Ca -0.18 -1.30 -0.36 0.00 -1.33 0.00 0.00 58.87 55.70 1jxq n SER 236 Cb 0.49 1.43 -0.04 0.00 -0.75 0.00 0.00 64.21 65.34 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 -2.71 3.21 0.27 0.66 3.76 -1.26 -1.30 115.29 117.92 1jxq s HIS 237 Ca 0.18 1.63 -0.06 0.00 -0.15 0.00 0.00 55.06 56.66 1jxq s HIS 237 Cb -0.01 -3.11 -0.06 0.00 1.11 0.00 0.00 32.58 30.51 1jxq s HIS 237 CO 0.01 -0.66 0.54 0.20 -0.85 0.00 0.00 174.74 173.97 1jxq s GLY 238 N -1.66 1.98 -0.12 -2.22 0.00 0.31 -0.61 107.32 104.99 1jxq s GLY 238 Ca 0.60 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.83 1jxq s GLY 238 CO 0.26 -0.39 -0.16 0.00 0.00 0.00 0.00 173.10 172.81 1jxq n GLN 240 N 3.53 2.57 -1.93 0.00 6.02 -1.26 -3.83 117.38 122.48 1jxq n GLN 240 Ca -0.18 -3.19 -0.33 0.00 -0.01 0.00 0.00 57.00 53.29 1jxq n GLN 240 Cb 0.53 -2.25 0.02 0.00 1.02 0.00 0.00 30.24 29.56 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 -3.67 2.65 0.36 -1.58 0.00 -1.26 -5.03 121.76 113.23 1jxq s ALA 240 Ca 0.62 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.96 1jxq s ALA 240 Cb 0.50 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 20.32 1jxq s ALA 240 CO 0.02 -0.98 0.64 -1.54 0.00 0.00 0.00 175.76 173.90 1jxq s SER 240 N -2.79 6.38 0.37 0.00 1.04 -1.26 -4.66 113.70 112.79 1jxq s SER 240 Ca 0.64 0.77 0.07 0.00 0.48 0.00 0.00 55.95 57.91 1jxq s SER 240 Cb -0.17 -2.17 -0.03 0.00 0.10 0.00 0.00 66.02 63.75 1jxq s SER 240 CO 0.39 -0.33 0.25 -1.00 0.98 0.00 0.00 173.24 173.53 1jxq s HIS 240 N -2.32 1.80 -0.25 5.02 3.76 -1.26 -5.07 115.29 116.96 1jxq s HIS 240 Ca 0.45 -1.59 -0.17 0.00 -0.15 0.00 0.00 55.06 53.60 1jxq s HIS 240 Cb -0.10 -0.85 -0.15 0.00 1.11 0.00 0.00 32.58 32.58 1jxq s HIS 240 CO 0.35 -0.73 -0.11 1.28 -0.85 0.00 0.00 174.74 174.67 1jxq n LEU 240 N -0.75 1.95 -0.08 0.89 4.32 -1.26 -4.85 117.00 117.22 1jxq n LEU 240 Ca 0.04 0.36 -0.09 0.00 -0.02 0.00 0.00 56.01 56.30 1jxq n LEU 240 Cb 0.63 -0.89 -0.03 0.00 -1.62 0.00 0.00 43.42 41.51 1jxq n LEU 240 CO 0.33 0.47 -0.54 1.67 -1.22 0.00 0.00 177.39 178.09 1jxq n GLN 240 N -4.29 0.50 -4.47 3.23 7.27 -1.26 -5.02 117.38 113.34 1jxq n GLN 240 Ca -0.45 0.39 -0.25 0.00 0.07 0.00 0.00 57.00 56.76 1jxq n GLN 240 Cb 0.81 -1.58 -0.13 0.00 2.41 0.00 0.00 30.24 31.75 1jxq n GLN 240 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1jxq s PHE 240 N -2.53 1.83 0.62 3.69 2.99 -1.26 -5.08 117.98 118.24 1jxq s PHE 240 Ca -0.22 -0.40 -0.07 0.00 0.00 0.00 0.00 56.93 56.24 1jxq s PHE 240 Cb 0.04 -1.05 0.01 0.00 0.00 0.00 0.00 43.02 42.02 1jxq s PHE 240 CO 0.34 0.16 0.95 -1.25 -0.00 0.00 0.00 175.22 175.42 1jxq s PRO 240 N -1.57 2.91 0.00 0.24 0.04 -1.26 -4.41 135.00 130.96 1jxq s PRO 240 Ca 0.07 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.24 1jxq s PRO 240 Cb -0.09 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.24 1jxq s PRO 240 CO 0.03 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 176.70 1jxq n GLY 241 N -2.70 1.24 3.52 0.56 0.00 -1.26 -4.45 105.19 102.11 1jxq n GLY 241 Ca 0.05 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.91 -1.81 -0.00 4.61 0.00 -1.25 -0.37 121.76 121.02 1jxq s ALA 242 Ca 0.00 1.21 0.01 0.00 0.00 0.00 0.00 51.96 53.17 1jxq s ALA 242 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1jxq s ALA 242 CO 0.00 -0.50 -0.03 0.14 0.00 0.00 0.00 175.76 175.37 1jxq s VAL 243 N -2.07 0.24 0.15 0.00 -7.23 -0.80 -1.98 120.40 108.71 1jxq s VAL 243 Ca -0.02 -0.12 -0.30 0.00 -1.81 0.00 0.00 61.98 59.74 1jxq s VAL 243 Cb -0.01 -0.22 -0.07 0.00 0.56 0.00 0.00 36.38 36.64 1jxq s VAL 243 CO -0.01 0.08 1.07 -0.31 -0.31 0.00 0.00 175.10 175.62 1jxq s TYR 244 N 0.03 3.63 0.87 2.82 1.51 0.22 -2.37 117.35 124.06 1jxq s TYR 244 Ca 0.00 1.62 -0.11 0.00 -1.01 0.00 0.00 57.07 57.58 1jxq s TYR 244 Cb -0.02 -3.23 0.16 0.00 -0.11 0.00 0.00 41.96 38.76 1jxq s TYR 244 CO -0.00 -0.46 1.20 0.20 -1.11 0.00 0.00 175.55 175.37 1jxq s GLY 245 N 0.04 1.76 0.48 0.71 0.00 -0.61 -4.47 107.32 105.23 1jxq s GLY 245 Ca 0.50 -1.30 0.24 0.00 0.00 0.00 0.00 44.72 44.16 1jxq s GLY 245 CO 0.33 -0.63 1.98 -0.91 0.00 0.00 0.00 173.10 173.88 1jxq h THR 246 N -1.22 0.69 0.00 0.90 1.35 -0.85 -2.28 112.91 111.50 1jxq h THR 246 Ca -0.42 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.67 1jxq h THR 246 Cb 1.26 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1jxq h THR 246 CO 0.42 0.18 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 1jxq n ASP 247 N -3.68 0.00 0.00 5.36 5.75 -1.26 -2.30 116.55 120.42 1jxq n ASP 247 Ca -0.01 -0.11 0.00 0.00 -0.01 0.00 0.00 54.79 54.65 1jxq n ASP 247 Cb 0.30 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 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 0.87 0.75 3.86 6.12 0.00 -0.86 -4.77 105.19 111.16 1jxq n GLY 248 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.07 3.50 -0.22 0.00 0.04 -1.26 -1.57 135.00 134.43 1jxq s PRO 255 Ca 0.20 0.57 -0.03 0.00 0.04 0.00 0.00 61.00 61.78 1jxq s PRO 255 Cb -0.15 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.31 1jxq s PRO 255 CO 0.09 -0.53 0.07 0.08 0.04 0.00 0.00 177.00 176.76 1jxq s VAL 256 N -3.09 0.29 0.58 -0.36 1.01 -1.00 -4.92 120.40 112.93 1jxq s VAL 256 Ca 0.53 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 1jxq s VAL 256 Cb -0.11 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 1jxq s VAL 256 CO 0.51 -0.37 1.20 -0.94 0.00 0.00 0.00 175.10 175.50 1jxq s SER 257 N 1.95 5.27 0.30 3.32 1.04 -1.26 -1.90 113.70 122.41 1jxq s SER 257 Ca 0.03 2.37 -0.02 0.00 0.48 0.00 0.00 55.95 58.81 1jxq s SER 257 Cb -0.17 -2.60 0.44 0.00 0.10 0.00 0.00 66.02 63.79 1jxq s SER 257 CO -0.15 -1.54 1.96 0.58 0.98 0.00 0.00 173.24 175.07 1jxq h VAL 258 N 0.96 1.21 -0.20 5.02 2.07 -0.92 -2.02 116.25 122.36 1jxq h VAL 258 Ca -0.50 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 66.62 1jxq h VAL 258 Cb 1.29 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1jxq h VAL 258 CO 0.55 0.21 0.14 1.05 0.02 0.00 0.00 177.57 179.55 1jxq h GLU 259 N 1.10 0.17 0.01 1.57 4.11 -1.77 -0.06 114.58 119.69 1jxq h GLU 259 Ca 0.29 -0.01 -0.27 0.00 0.07 0.00 0.00 59.36 59.44 1jxq h GLU 259 Cb -0.09 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 29.14 1jxq h GLU 259 CO -0.06 0.11 -1.06 -0.22 0.07 0.00 0.00 179.01 177.85 1jxq h LYS 260 N 0.17 0.70 -0.11 1.06 3.64 -1.74 -3.11 116.57 117.18 1jxq h LYS 260 Ca 0.08 -0.76 -0.00 0.00 -1.27 0.00 0.00 60.65 58.70 1jxq h LYS 260 Cb 0.12 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1jxq h LYS 260 CO -0.01 1.33 0.06 0.82 -2.27 0.00 0.00 179.45 179.38 1jxq h ILE 261 N 0.39 1.06 0.12 2.00 2.04 -1.00 -2.52 117.51 119.60 1jxq h ILE 261 Ca -0.13 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.59 1jxq h ILE 261 Cb 1.71 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 38.72 1jxq h ILE 261 CO 0.21 0.05 -0.31 0.58 0.00 0.00 0.00 178.15 178.68 1jxq h VAL 262 N 0.11 0.34 0.00 1.67 2.07 -1.13 -2.73 116.25 116.58 1jxq h VAL 262 Ca 0.04 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1jxq h VAL 262 Cb 0.03 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.14 1jxq h VAL 262 CO -0.01 0.00 -0.05 0.78 0.02 0.00 0.00 177.57 178.32 1jxq h ASN 263 N -0.53 0.00 0.10 0.57 2.35 -1.49 0.24 115.58 116.82 1jxq h ASN 263 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1jxq h ASN 263 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 1jxq h ASN 263 CO -0.18 0.05 0.00 0.40 -1.65 0.00 0.00 177.43 176.05 1jxq h ILE 264 N 0.00 0.00 -0.22 2.81 2.04 -1.12 -1.50 117.51 119.53 1jxq h ILE 264 Ca -0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1jxq h ILE 264 Cb 0.10 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1jxq h ILE 264 CO 0.01 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.65 1jxq n PHE 265 N -2.57 0.51 -1.23 1.37 3.72 0.07 -4.49 117.46 114.84 1jxq n PHE 265 Ca -0.02 -0.71 -0.24 0.00 -0.05 0.00 0.00 57.45 56.43 1jxq n PHE 265 Cb 0.07 -0.15 0.19 0.00 -0.94 0.00 0.00 39.48 38.65 1jxq n PHE 265 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1jxq n ASN 266 N -0.28 -1.20 -0.19 4.37 0.23 -0.57 -4.66 115.26 112.96 1jxq n ASN 266 Ca 0.14 -1.17 -0.07 0.00 -0.53 0.00 0.00 54.58 52.96 1jxq n ASN 266 Cb 0.60 -0.82 0.03 0.00 -2.08 0.00 0.00 39.78 37.51 1jxq n ASN 266 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1jxq h GLY 267 N -2.00 0.79 0.79 4.83 0.00 -1.55 0.83 103.07 106.76 1jxq h GLY 267 Ca -0.34 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 1jxq h GLY 267 CO 0.23 0.30 -0.10 -0.84 0.00 0.00 0.00 176.54 176.13 1jxq h THR 268 N 0.75 1.31 0.00 4.70 2.02 -1.93 -1.44 112.91 118.33 1jxq h THR 268 Ca 0.20 -1.18 -0.12 0.00 0.77 0.00 0.00 66.41 66.08 1jxq h THR 268 Cb -0.06 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1jxq h THR 268 CO -0.04 0.35 -0.58 0.28 0.37 0.00 0.00 175.52 175.90 1jxq h SER 269 N 0.09 0.00 -2.01 4.18 0.02 -1.83 -3.37 113.55 110.64 1jxq h SER 269 Ca 0.04 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.44 1jxq h SER 269 Cb 0.60 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.74 1jxq h SER 269 CO 0.03 0.58 -1.10 0.00 -1.14 0.00 0.00 176.83 175.20 1jxq h PRO 271 N 3.87 0.18 -1.01 0.00 0.13 -1.44 -1.27 132.00 132.46 1jxq h PRO 271 Ca 0.08 -0.01 0.24 0.00 -0.87 0.00 0.00 66.00 65.44 1jxq h PRO 271 Cb 0.88 -0.04 -0.09 0.00 0.13 0.00 0.00 31.00 31.88 1jxq h PRO 271 CO 0.48 0.12 0.64 1.03 -0.23 0.00 0.00 178.00 180.04 1jxq h SER 272 N 0.19 0.51 -0.64 1.44 0.87 -1.89 0.12 113.55 114.15 1jxq h SER 272 Ca 0.34 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 1jxq h SER 272 Cb 1.07 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 1jxq h SER 272 CO -0.06 0.13 0.00 0.18 -0.53 0.00 0.00 176.83 176.55 1jxq n LEU 273 N -4.65 3.53 -4.65 2.23 4.77 -0.48 -4.06 117.00 113.68 1jxq n LEU 273 Ca 0.24 -1.74 -0.47 0.00 -0.03 0.00 0.00 56.01 54.01 1jxq n LEU 273 Cb 0.78 -0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1jxq n LEU 273 CO 0.25 0.87 1.09 0.61 -1.33 0.00 0.00 177.39 178.88 1jxq n GLY 274 N 1.55 0.91 3.21 -0.72 0.00 0.03 -0.94 105.19 109.22 1jxq n GLY 274 Ca 0.22 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.86 1jxq n GLY 274 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jxq n GLY 275 N 2.94 2.98 3.90 -0.02 0.00 -1.26 -5.00 105.19 108.73 1jxq n GLY 275 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.01 3.57 -0.05 1.61 1.02 -0.12 -5.02 119.74 120.74 1jxq s LYS 276 Ca 0.00 -0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.50 1jxq s LYS 276 Cb 0.00 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.35 1jxq s LYS 276 CO 0.00 0.52 1.33 -1.25 -0.92 0.00 0.00 175.35 175.02 1jxq s PRO 277 N -2.57 4.29 -0.34 -1.68 0.04 -1.25 -4.82 135.00 128.67 1jxq s PRO 277 Ca 0.39 1.83 -0.12 0.00 0.04 0.00 0.00 61.00 63.14 1jxq s PRO 277 Cb -0.12 -3.62 -0.00 0.00 0.04 0.00 0.00 34.50 30.79 1jxq s PRO 277 CO 0.25 -0.57 0.21 0.15 0.04 0.00 0.00 177.00 177.09 1jxq s LYS 278 N 2.59 3.30 -0.13 4.56 1.02 0.08 -2.53 119.74 128.62 1jxq s LYS 278 Ca 0.60 -0.77 -0.03 0.00 0.02 0.00 0.00 55.97 55.80 1jxq s LYS 278 Cb -0.28 -3.73 -0.03 0.00 -0.52 0.00 0.00 37.83 33.27 1jxq s LYS 278 CO 0.23 -0.50 -0.04 -0.51 -0.92 0.00 0.00 175.35 173.61 1jxq s LEU 279 N 1.66 3.25 -0.12 3.17 1.43 -0.59 -0.76 118.68 126.72 1jxq s LEU 279 Ca 0.05 -0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1jxq s LEU 279 Cb -0.18 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.29 1jxq s LEU 279 CO 0.08 0.22 -0.16 -0.36 0.23 0.00 0.00 176.35 176.37 1jxq s PHE 280 N 0.05 2.08 -0.24 0.29 0.40 0.11 -1.02 117.98 119.64 1jxq s PHE 280 Ca -0.00 -1.03 -0.03 0.00 -0.60 0.00 0.00 56.93 55.27 1jxq s PHE 280 Cb -0.13 -1.50 0.01 0.00 0.51 0.00 0.00 43.02 41.91 1jxq s PHE 280 CO 0.03 -0.53 -0.05 -0.06 0.70 0.00 0.00 175.22 175.31 1jxq s PHE 281 N 1.09 3.03 -0.11 0.36 0.40 0.50 0.01 117.98 123.26 1jxq s PHE 281 Ca -0.04 -1.32 0.04 0.00 -0.60 0.00 0.00 56.93 55.01 1jxq s PHE 281 Cb -0.14 -2.09 0.00 0.00 0.51 0.00 0.00 43.02 41.30 1jxq s PHE 281 CO -0.04 -0.67 -0.23 0.42 0.70 0.00 0.00 175.22 175.40 1jxq s ILE 282 N 1.39 2.06 -0.36 0.64 1.09 0.43 -1.69 121.20 124.75 1jxq s ILE 282 Ca 0.02 -1.01 0.03 0.00 -1.10 0.00 0.00 60.65 58.60 1jxq s ILE 282 Cb -0.16 -1.79 0.11 0.00 -1.06 0.00 0.00 42.46 39.56 1jxq s ILE 282 CO -0.04 0.56 0.09 -1.58 -0.10 0.00 0.00 174.94 173.87 1jxq s GLN 283 N 0.49 1.42 -0.81 2.79 2.00 -0.92 -0.01 119.66 124.62 1jxq s GLN 283 Ca -0.15 -1.86 -0.17 0.00 -2.00 0.00 0.00 55.36 51.18 1jxq s GLN 283 Cb -0.17 -3.00 0.16 0.00 0.80 0.00 0.00 33.01 30.80 1jxq s GLN 283 CO 0.06 -0.98 0.87 0.00 -0.50 0.00 0.00 175.29 174.74 1jxq s ALA 284 N 0.82 3.69 -0.95 1.58 0.00 0.15 -2.82 121.76 124.23 1jxq s ALA 284 Ca 0.12 -2.88 -0.13 0.00 0.00 0.00 0.00 51.96 49.06 1jxq s ALA 284 Cb -0.20 -3.70 0.22 0.00 0.00 0.00 0.00 23.12 19.44 1jxq s ALA 284 CO -0.09 -2.53 0.96 0.00 0.00 0.00 0.00 175.76 174.10 1jxq n GLY 286 N 3.84 -0.41 0.00 0.00 0.00 -1.26 -4.39 105.19 102.97 1jxq n GLY 286 Ca 0.20 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 44.02 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 0.36 0.34 -0.02 0.00 -1.26 0.11 105.19 104.72 1jxq n GLY 287 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -4.93 113.62 111.68 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 -0.19 5.59 -0.06 6.43 0.01 -1.26 -5.13 113.70 119.08 1jxq s SER 320 Ca 0.00 -0.39 -0.12 0.00 1.31 0.00 0.00 55.95 56.75 1jxq s SER 320 Cb 0.00 -0.65 0.02 0.00 0.21 0.00 0.00 66.02 65.61 1jxq s SER 320 CO 0.00 -0.83 0.29 -0.22 0.41 0.00 0.00 173.24 172.89 1jxq s LEU 321 N -4.41 0.90 0.30 2.44 2.96 -1.26 -5.14 118.68 114.47 1jxq s LEU 321 Ca 0.56 0.32 -0.30 0.00 -0.22 0.00 0.00 54.13 54.49 1jxq s LEU 321 Cb -0.10 1.12 -0.12 0.00 0.50 0.00 0.00 46.19 47.58 1jxq s LEU 321 CO 0.34 -0.27 1.46 -2.65 -1.32 0.00 0.00 176.35 173.91 1jxq n PRO 322 N 2.09 2.38 -0.32 0.98 -0.02 -1.26 -4.90 135.00 133.95 1jxq n PRO 322 Ca -0.17 0.84 0.14 0.00 -2.02 0.00 0.00 63.50 62.28 1jxq n PRO 322 Cb 0.57 -2.54 0.32 0.00 -0.02 0.00 0.00 33.50 31.83 1jxq n PRO 322 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1jxq h THR 323 N 3.04 0.54 -0.44 3.45 2.02 -2.00 -1.00 112.91 118.52 1jxq h THR 323 Ca -0.47 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1jxq h THR 323 Cb 1.25 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1jxq h THR 323 CO 0.73 0.09 0.00 -0.81 0.37 0.00 0.00 175.52 175.90 1jxq n PRO 324 N -4.96 3.20 -1.72 6.66 -0.04 -1.26 -1.58 135.00 135.29 1jxq n PRO 324 Ca 0.23 -2.07 -0.34 0.00 -0.04 0.00 0.00 63.50 61.28 1jxq n PRO 324 Cb 0.64 -1.82 0.06 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.69 4.87 -1.45 3.54 1.04 -0.38 -3.88 113.70 116.74 1jxq s SER 325 Ca 0.37 2.18 -0.11 0.00 0.48 0.00 0.00 55.95 58.87 1jxq s SER 325 Cb 0.25 -2.57 0.05 0.00 0.10 0.00 0.00 66.02 63.85 1jxq s SER 325 CO 0.15 -1.80 1.02 0.47 0.98 0.00 0.00 173.24 174.06 1jxq n ASP 326 N -2.32 -5.59 -4.61 7.02 8.00 -0.65 -4.88 116.55 113.52 1jxq n ASP 326 Ca 0.12 -0.62 -0.35 0.00 0.71 0.00 0.00 54.79 54.65 1jxq n ASP 326 Cb 0.51 -4.44 -0.10 0.00 -0.02 0.00 0.00 41.12 37.07 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 -3.28 4.83 -0.06 0.53 -1.09 -1.09 -0.74 121.20 120.30 1jxq s ILE 327 Ca 0.59 -0.01 -0.01 0.00 -2.23 0.00 0.00 60.65 58.99 1jxq s ILE 327 Cb -0.28 -3.20 0.03 0.00 -1.58 0.00 0.00 42.46 37.42 1jxq s ILE 327 CO 0.73 0.42 0.00 0.12 -1.23 0.00 0.00 174.94 174.98 1jxq s PHE 328 N 0.70 0.61 -0.07 3.97 5.36 0.06 -1.08 117.98 127.54 1jxq s PHE 328 Ca 0.04 -0.13 0.05 0.00 -0.96 0.00 0.00 56.93 55.93 1jxq s PHE 328 Cb -0.13 -0.74 -0.01 0.00 -0.34 0.00 0.00 43.02 41.80 1jxq s PHE 328 CO 0.02 -0.29 -0.24 0.08 -1.46 0.00 0.00 175.22 173.33 1jxq s VAL 329 N 1.81 2.15 -0.28 3.12 1.01 -0.80 0.04 120.40 127.46 1jxq s VAL 329 Ca 0.02 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 1jxq s VAL 329 Cb -0.13 -1.80 0.04 0.00 0.00 0.00 0.00 36.38 34.49 1jxq s VAL 329 CO -0.04 0.57 -0.02 -0.55 0.00 0.00 0.00 175.10 175.05 1jxq s SER 330 N -0.04 4.63 -0.23 3.32 0.15 0.10 -1.18 113.70 120.45 1jxq s SER 330 Ca -0.07 -1.05 -0.03 0.00 0.70 0.00 0.00 55.95 55.50 1jxq s SER 330 Cb -0.15 -1.70 0.01 0.00 -1.71 0.00 0.00 66.02 62.47 1jxq s SER 330 CO 0.05 -0.19 -0.05 -0.47 1.20 0.00 0.00 173.24 173.78 1jxq s TYR 331 N 1.30 3.00 -0.07 3.44 6.14 -0.53 -0.43 117.35 130.20 1jxq s TYR 331 Ca -0.02 -1.20 0.02 0.00 0.64 0.00 0.00 57.07 56.50 1jxq s TYR 331 Cb -0.18 -2.09 0.01 0.00 0.42 0.00 0.00 41.96 40.12 1jxq s TYR 331 CO -0.02 -0.63 -0.12 0.45 0.64 0.00 0.00 175.55 175.87 1jxq s SER 332 N 1.41 1.86 -0.52 4.32 0.15 0.98 -2.03 113.70 119.89 1jxq s SER 332 Ca 0.04 -0.31 0.07 0.00 0.70 0.00 0.00 55.95 56.45 1jxq s SER 332 Cb -0.15 -0.84 0.33 0.00 -1.71 0.00 0.00 66.02 63.64 1jxq s SER 332 CO -0.04 0.01 0.84 0.35 1.20 0.00 0.00 173.24 175.60 1jxq n THR 333 N 3.99 1.88 -3.66 6.45 -2.24 -1.26 0.34 114.28 119.77 1jxq n THR 333 Ca -0.21 -5.18 -0.39 0.00 -2.27 0.00 0.00 64.05 55.99 1jxq n THR 333 Cb 0.51 -1.18 -0.12 0.00 -2.10 0.00 0.00 70.33 67.45 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 -2.95 3.23 1.00 4.78 5.36 -1.26 -4.80 117.98 123.34 1jxq s PHE 334 Ca 0.45 -1.03 -0.14 0.00 -0.96 0.00 0.00 56.93 55.25 1jxq s PHE 334 Cb 0.28 -2.37 0.19 0.00 -0.34 0.00 0.00 43.02 40.78 1jxq s PHE 334 CO -0.11 -0.64 1.16 -1.25 -1.46 0.00 0.00 175.22 172.92 1jxq s PRO 335 N 1.52 0.43 0.00 10.12 0.04 -1.26 -4.76 135.00 141.09 1jxq s PRO 335 Ca 0.01 0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.17 1jxq s PRO 335 Cb -0.19 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1jxq s PRO 335 CO 0.05 -2.64 0.00 0.41 0.04 0.00 0.00 177.00 174.86 1jxq n GLY 336 N -2.06 2.70 3.92 0.56 0.00 -1.26 -4.87 105.19 104.18 1jxq n GLY 336 Ca 0.09 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 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 3.48 0.32 1.61 0.08 -1.26 -0.20 117.98 122.01 1jxq s PHE 337 Ca 0.00 0.41 0.09 0.00 0.12 0.00 0.00 56.93 57.56 1jxq s PHE 337 Cb 0.00 -1.91 0.91 0.00 -0.57 0.00 0.00 43.02 41.45 1jxq s PHE 337 CO 0.00 0.36 1.68 0.28 -0.10 0.00 0.00 175.22 177.45 1jxq h VAL 338 N 1.61 0.40 -3.67 -0.44 2.07 -1.00 -3.14 116.25 112.08 1jxq h VAL 338 Ca -0.48 -0.13 -0.67 0.00 0.82 0.00 0.00 66.70 66.24 1jxq h VAL 338 Cb 1.19 -0.03 -0.37 0.00 -1.52 0.00 0.00 31.29 30.56 1jxq h VAL 338 CO 0.69 0.07 -0.68 -0.55 0.02 0.00 0.00 177.57 177.12 1jxq s SER 339 N -5.06 4.88 0.40 0.57 0.15 -1.26 -4.96 113.70 108.42 1jxq s SER 339 Ca -0.11 -1.91 0.23 0.00 0.70 0.00 0.00 55.95 54.86 1jxq s SER 339 Cb 0.28 -1.69 1.27 0.00 -1.71 0.00 0.00 66.02 64.17 1jxq s SER 339 CO 0.79 -0.39 1.66 4.11 1.20 0.00 0.00 173.24 180.61 1jxq h TRP 340 N 7.80 0.67 0.00 3.44 5.08 -1.96 0.15 115.95 131.14 1jxq h TRP 340 Ca -0.11 0.03 -0.00 0.00 1.08 0.00 0.00 58.89 59.89 1jxq h TRP 340 Cb 1.04 -0.17 -0.00 0.00 -3.00 0.00 0.00 29.16 27.02 1jxq h TRP 340 CO 0.53 -0.16 -0.02 0.00 -1.28 0.00 0.00 178.44 177.51 1jxq h ARG 341 N 0.20 0.00 -5.00 0.12 3.08 -1.95 -3.44 114.38 107.39 1jxq h ARG 341 Ca 0.75 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 60.14 1jxq h ARG 341 Cb 2.11 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 31.83 1jxq h ARG 341 CO -0.46 0.02 -0.80 0.34 -1.07 0.00 0.00 179.97 177.99 1jxq s ASP 342 N -5.89 3.71 0.00 7.04 3.68 0.54 -4.99 116.67 120.76 1jxq s ASP 342 Ca 0.03 -0.70 0.19 0.00 2.13 0.00 0.00 52.55 54.20 1jxq s ASP 342 Cb 0.08 -1.57 1.09 0.00 -1.45 0.00 0.00 42.92 41.06 1jxq s ASP 342 CO 0.59 -0.05 1.57 -2.65 0.13 0.00 0.00 175.17 174.76 1jxq n PRO 343 N 4.65 0.48 -0.01 4.34 -0.02 -1.26 -2.65 135.00 140.54 1jxq n PRO 343 Ca -0.19 0.04 0.09 0.00 -2.02 0.00 0.00 63.50 61.42 1jxq n PRO 343 Cb 0.49 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.34 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 -1.11 0.74 0.31 -0.52 5.02 -1.26 -4.41 118.16 116.93 1jxq n LYS 344 Ca 0.13 -0.12 0.18 0.00 -2.02 0.00 0.00 58.31 56.48 1jxq n LYS 344 Cb 0.10 -1.39 0.97 0.00 -0.02 0.00 0.00 35.03 34.68 1jxq n LYS 344 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1jxq h SER 345 N 0.00 0.00 -5.00 4.39 4.64 -1.81 -3.40 113.55 112.37 1jxq h SER 345 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jxq h SER 345 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1jxq h SER 345 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1jxq n GLY 346 N -1.20 1.17 3.69 -0.77 0.00 -1.26 -4.52 105.19 102.29 1jxq n GLY 346 Ca -0.02 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 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 7.21 0.49 1.61 0.15 -1.26 -0.47 113.70 121.44 1jxq s SER 347 Ca 0.00 1.49 0.18 0.00 0.70 0.00 0.00 55.95 58.33 1jxq s SER 347 Cb 0.00 -2.54 1.22 0.00 -1.71 0.00 0.00 66.02 62.99 1jxq s SER 347 CO 0.00 -0.44 2.07 -0.25 1.20 0.00 0.00 173.24 175.82 1jxq h TRP 348 N 7.11 0.00 0.62 3.44 7.01 -0.80 -2.07 115.95 131.26 1jxq h TRP 348 Ca -0.31 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.66 1jxq h TRP 348 Cb 1.15 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 28.21 1jxq h TRP 348 CO 0.71 0.12 -0.30 -0.92 -2.79 0.00 0.00 178.44 175.26 1jxq h TYR 349 N 0.00 -0.77 -0.89 2.65 3.20 -1.86 -0.66 116.97 118.65 1jxq h TYR 349 Ca -0.00 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.95 1jxq h TYR 349 Cb 0.22 0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.68 1jxq h TYR 349 CO 0.00 -0.48 0.57 -0.39 -1.64 0.00 0.00 178.16 176.22 1jxq h VAL 350 N -1.03 0.97 -0.56 1.81 -1.51 -1.91 0.25 116.25 114.27 1jxq h VAL 350 Ca -0.09 -0.30 -0.09 0.00 -1.23 0.00 0.00 66.70 64.99 1jxq h VAL 350 Cb 0.64 0.01 -0.02 0.00 -2.13 0.00 0.00 31.29 29.79 1jxq h VAL 350 CO 0.14 0.16 -0.00 -0.08 -1.23 0.00 0.00 177.57 176.56 1jxq h GLU 351 N 0.88 0.99 -0.31 5.19 4.57 -1.38 0.40 114.58 124.92 1jxq h GLU 351 Ca 0.41 -0.32 -0.08 0.00 -1.18 0.00 0.00 59.36 58.20 1jxq h GLU 351 Cb 0.41 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 1jxq h GLU 351 CO -0.18 0.99 -0.10 1.15 -1.18 0.00 0.00 179.01 179.69 1jxq h THR 352 N 0.87 1.29 -0.10 0.32 2.02 0.25 0.27 112.91 117.82 1jxq h THR 352 Ca 0.16 -1.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1jxq h THR 352 Cb 0.55 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1jxq h THR 352 CO 0.03 0.38 0.01 0.25 0.37 0.00 0.00 175.52 176.56 1jxq h LEU 353 N 0.38 0.16 -1.18 2.58 6.46 -0.42 -0.79 115.31 122.50 1jxq h LEU 353 Ca 0.07 -0.27 0.04 0.00 -0.12 0.00 0.00 57.88 57.61 1jxq h LEU 353 Cb 0.61 -0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 40.44 1jxq h LEU 353 CO 0.04 0.39 0.57 -0.78 -0.62 0.00 0.00 178.44 178.04 1jxq h ASP 354 N -0.07 0.91 -0.23 1.25 1.82 -0.12 0.18 116.42 120.16 1jxq h ASP 354 Ca 0.03 -0.01 -0.07 0.00 -0.39 0.00 0.00 57.03 56.59 1jxq h ASP 354 Cb 0.30 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 1jxq h ASP 354 CO 0.00 0.61 -0.14 -0.78 -1.61 0.00 0.00 179.24 177.33 1jxq h ASP 355 N 1.05 0.52 -0.48 2.28 -0.00 -0.75 -1.54 116.42 117.49 1jxq h ASP 355 Ca 0.35 -0.43 -0.03 0.00 -0.00 0.00 0.00 57.03 56.92 1jxq h ASP 355 Cb 0.08 -0.14 -0.02 0.00 -0.00 0.00 0.00 39.33 39.24 1jxq h ASP 355 CO -0.11 0.83 0.17 0.40 -0.00 0.00 0.00 179.24 180.53 1jxq h ILE 356 N 0.21 1.22 -0.14 2.25 2.04 -0.67 -2.20 117.51 120.22 1jxq h ILE 356 Ca 0.05 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1jxq h ILE 356 Cb 0.65 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1jxq h ILE 356 CO 0.04 0.26 0.09 -0.26 0.00 0.00 0.00 178.15 178.28 1jxq h PHE 357 N 0.65 0.17 -1.00 1.37 -1.00 -0.94 0.14 116.94 116.32 1jxq h PHE 357 Ca 0.16 0.00 0.23 0.00 2.81 0.00 0.00 57.97 61.18 1jxq h PHE 357 Cb 0.24 -0.06 -0.09 0.00 3.61 0.00 0.00 35.95 39.64 1jxq h PHE 357 CO 0.01 0.12 0.64 1.49 -1.61 0.00 0.00 178.31 178.96 1jxq h GLU 358 N 0.17 0.49 0.00 1.51 4.57 -1.07 -0.12 114.58 120.13 1jxq h GLU 358 Ca 0.05 -0.03 -0.15 0.00 -1.18 0.00 0.00 59.36 58.05 1jxq h GLU 358 Cb -0.00 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.45 1jxq h GLU 358 CO -0.01 0.32 -1.38 1.04 -1.18 0.00 0.00 179.01 177.80 1jxq n GLN 359 N -4.66 0.62 0.00 1.92 6.02 -0.67 -4.68 117.38 115.92 1jxq n GLN 359 Ca 0.24 0.21 0.00 0.00 -0.01 0.00 0.00 57.00 57.44 1jxq n GLN 359 Cb 0.76 -1.81 0.00 0.00 1.02 0.00 0.00 30.24 30.21 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 -2.86 0.00 0.29 1.08 7.02 0.39 -4.73 117.44 118.63 1jxq n TRP 360 Ca -0.09 0.00 0.17 0.00 -1.02 0.00 0.00 57.50 56.56 1jxq n TRP 360 Cb 0.81 0.00 0.84 0.00 -2.42 0.00 0.00 31.31 30.54 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 1.46 0.00 6.99 0.00 -1.19 0.26 119.26 126.78 1jxq h ALA 361 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1jxq h ALA 361 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1jxq h ALA 361 CO 0.00 -0.36 -0.20 1.12 0.00 0.00 0.00 179.25 179.81 1jxq h HIS 362 N 0.00 0.00 0.00 0.00 2.07 -1.85 -3.38 115.15 111.99 1jxq h HIS 362 Ca 0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.56 1jxq h HIS 362 Cb 0.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 1jxq h HIS 362 CO 0.00 0.20 -0.03 -1.13 -3.07 0.00 0.00 177.93 173.90 1jxq n SER 363 N -3.22 0.13 -4.37 3.10 3.41 0.31 -5.00 113.62 107.98 1jxq n SER 363 Ca 0.02 -0.24 -0.29 0.00 -0.26 0.00 0.00 58.87 58.10 1jxq n SER 363 Cb 0.52 0.50 -0.14 0.00 -0.26 0.00 0.00 64.21 64.83 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 -0.53 1.58 0.82 4.33 2.02 0.66 -5.14 118.70 122.44 1jxq s GLU 364 Ca 0.00 -1.23 -0.12 0.00 0.02 0.00 0.00 54.97 53.64 1jxq s GLU 364 Cb 0.00 -1.92 0.09 0.00 0.10 0.00 0.00 34.13 32.40 1jxq s GLU 364 CO 0.00 0.48 1.17 0.16 0.02 0.00 0.00 175.26 177.08 1jxq s ASP 365 N -1.67 4.36 0.13 -0.19 3.84 -1.26 -4.51 116.67 117.36 1jxq s ASP 365 Ca 0.13 0.83 -0.32 0.00 -0.00 0.00 0.00 52.55 53.19 1jxq s ASP 365 Cb -0.10 -1.34 -0.09 0.00 -1.38 0.00 0.00 42.92 40.01 1jxq s ASP 365 CO 0.04 -2.00 1.56 0.25 -0.00 0.00 0.00 175.17 175.02 1jxq h LEU 366 N -1.12 -1.64 -0.77 2.11 5.85 -1.57 -0.58 115.31 117.60 1jxq h LEU 366 Ca -0.47 0.21 0.13 0.00 0.84 0.00 0.00 57.88 58.59 1jxq h LEU 366 Cb 1.33 0.66 -0.09 0.00 0.37 0.00 0.00 40.66 42.93 1jxq h LEU 366 CO 0.65 -0.44 0.36 0.06 -0.34 0.00 0.00 178.44 178.73 1jxq h GLN 367 N -0.50 0.54 -0.66 1.25 3.07 -1.94 0.81 115.11 117.68 1jxq h GLN 367 Ca 0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.75 1jxq h GLN 367 Cb 0.65 -0.12 -0.03 0.00 0.08 0.00 0.00 27.48 28.05 1jxq h GLN 367 CO -0.48 0.36 0.34 0.77 0.09 0.00 0.00 178.83 179.91 1jxq h SER 368 N 0.56 0.84 -0.19 0.06 0.02 -1.71 -1.33 113.55 111.79 1jxq h SER 368 Ca 0.41 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 1jxq h SER 368 Cb 0.55 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 1jxq h SER 368 CO -0.35 0.71 0.07 -0.07 -1.14 0.00 0.00 176.83 176.06 1jxq h LEU 369 N 0.90 0.26 -2.06 5.07 3.38 0.08 -2.67 115.31 120.28 1jxq h LEU 369 Ca 0.23 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1jxq h LEU 369 Cb 0.07 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1jxq h LEU 369 CO -0.03 0.36 -0.05 -0.07 0.09 0.00 0.00 178.44 178.74 1jxq h LEU 370 N 0.15 0.00 -0.25 1.67 4.07 -0.57 -1.50 115.31 118.88 1jxq h LEU 370 Ca 0.06 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.87 1jxq h LEU 370 Cb 0.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.92 1jxq h LEU 370 CO -0.00 0.05 -0.44 -0.07 -1.08 0.00 0.00 178.44 176.90 1jxq h LEU 371 N 0.00 0.82 -0.48 1.67 3.38 -0.99 0.61 115.31 120.32 1jxq h LEU 371 Ca -0.00 -0.53 0.03 0.00 0.09 0.00 0.00 57.88 57.46 1jxq h LEU 371 Cb 0.10 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1jxq h LEU 371 CO 0.01 1.19 0.28 0.03 0.09 0.00 0.00 178.44 180.04 1jxq h ARG 372 N 0.48 0.54 0.64 1.13 3.08 -0.98 0.27 114.38 119.52 1jxq h ARG 372 Ca 0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1jxq h ARG 372 Cb 1.04 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 1jxq h ARG 372 CO 0.10 0.35 -0.36 0.28 -1.07 0.00 0.00 179.97 179.28 1jxq h VAL 373 N 0.55 0.28 -0.76 2.04 2.07 -1.17 -0.73 116.25 118.53 1jxq h VAL 373 Ca 0.20 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.89 1jxq h VAL 373 Cb 0.04 0.28 -0.13 0.00 -1.52 0.00 0.00 31.29 29.96 1jxq h VAL 373 CO -0.10 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.57 1jxq h ALA 374 N -0.60 0.88 -0.12 1.67 0.00 -0.44 -0.24 119.26 120.41 1jxq h ALA 374 Ca -0.08 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1jxq h ALA 374 Cb 0.73 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1jxq h ALA 374 CO 0.11 -0.41 0.06 -0.97 0.00 0.00 0.00 179.25 178.04 1jxq h ASN 375 N 0.16 0.15 -0.92 0.00 -1.24 -0.06 -1.82 115.58 111.85 1jxq h ASN 375 Ca 0.43 -0.10 0.06 0.00 0.71 0.00 0.00 56.30 57.40 1jxq h ASN 375 Cb 0.76 -0.04 -0.06 0.00 0.73 0.00 0.00 38.32 39.71 1jxq h ASN 375 CO -0.62 0.21 0.58 0.00 -1.29 0.00 0.00 177.43 176.30 1jxq h ALA 376 N 0.95 1.27 0.16 1.57 0.00 -0.02 0.07 119.26 123.26 1jxq h ALA 376 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1jxq h ALA 376 Cb 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1jxq h ALA 376 CO -0.01 0.34 -0.08 0.28 0.00 0.00 0.00 179.25 179.79 1jxq h VAL 377 N 1.05 0.92 -0.57 0.00 2.07 -0.86 -2.58 116.25 116.28 1jxq h VAL 377 Ca 0.40 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.61 1jxq h VAL 377 Cb 0.17 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1jxq h VAL 377 CO -0.17 0.08 0.34 0.77 0.02 0.00 0.00 177.57 178.60 1jxq h SER 378 N -0.38 0.53 0.09 0.57 4.64 -1.03 0.24 113.55 118.22 1jxq h SER 378 Ca -0.02 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1jxq h SER 378 Cb 0.30 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1jxq h SER 378 CO 0.04 0.37 0.00 0.52 -0.87 0.00 0.00 176.83 176.89 1jxq n VAL 379 N -4.78 0.63 0.29 0.95 0.31 -0.02 -1.10 118.33 114.62 1jxq n VAL 379 Ca 0.05 0.16 0.03 0.00 -0.01 0.00 0.00 64.34 64.57 1jxq n VAL 379 Cb 0.09 -1.04 0.02 0.00 -0.91 0.00 0.00 33.84 32.00 1jxq n VAL 379 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1jxq n LYS 380 N -1.20 0.74 -2.66 5.55 4.81 0.78 -4.87 118.16 121.31 1jxq n LYS 380 Ca 0.04 -0.78 -0.03 0.00 -0.87 0.00 0.00 58.31 56.67 1jxq n LYS 380 Cb 0.05 -1.08 0.04 0.00 0.02 0.00 0.00 35.03 34.06 1jxq n LYS 380 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jxq n GLY 381 N 0.51 -1.84 0.45 3.14 0.00 -0.26 -5.04 105.19 102.16 1jxq n GLY 381 Ca 0.04 1.34 -0.14 0.00 0.00 0.00 0.00 46.02 47.26 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 2.14 0.00 -0.17 -0.61 2.04 -1.72 -1.59 117.51 117.59 1jxq h ILE 382 Ca -0.05 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1jxq h ILE 382 Cb 1.18 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1jxq h ILE 382 CO -0.14 0.00 -0.07 1.88 0.00 0.00 0.00 178.15 179.82 1jxq h TYR 383 N -0.43 0.26 -1.97 1.37 -1.99 -1.97 -3.45 116.97 108.78 1jxq h TYR 383 Ca 0.06 -0.02 -0.19 0.00 2.00 0.00 0.00 58.73 60.59 1jxq h TYR 383 Cb 0.61 -0.08 0.11 0.00 2.00 0.00 0.00 36.73 39.37 1jxq h TYR 383 CO -0.70 0.34 -0.09 1.63 -0.00 0.00 0.00 178.16 179.34 1jxq n LYS 384 N -4.32 -1.54 -3.18 4.88 4.01 -0.60 -4.91 118.16 112.50 1jxq n LYS 384 Ca -0.00 -0.74 -0.43 0.00 -0.51 0.00 0.00 58.31 56.62 1jxq n LYS 384 Cb 0.23 -1.45 -0.07 0.00 -0.51 0.00 0.00 35.03 33.22 1jxq n LYS 384 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1jxq s GLN 385 N -3.56 3.16 0.18 1.97 -0.21 -1.26 -5.06 119.66 114.88 1jxq s GLN 385 Ca 0.34 -0.72 -0.30 0.00 0.02 0.00 0.00 55.36 54.70 1jxq s GLN 385 Cb -0.06 -4.03 -0.08 0.00 1.00 0.00 0.00 33.01 29.84 1jxq s GLN 385 CO 0.29 -1.09 1.06 1.41 -2.12 0.00 0.00 175.29 174.84 1jxq s MET 386 N 2.58 4.65 1.00 2.91 -2.45 -1.26 -4.60 119.30 122.12 1jxq s MET 386 Ca 0.16 1.66 -0.11 0.00 -1.25 0.00 0.00 55.69 56.15 1jxq s MET 386 Cb -0.17 -3.29 0.20 0.00 1.25 0.00 0.00 34.83 32.82 1jxq s MET 386 CO 0.14 0.16 1.11 -2.14 1.05 0.00 0.00 175.02 175.34 1jxq s PRO 387 N -0.51 0.32 0.20 4.11 0.02 -1.26 -4.96 135.00 132.92 1jxq s PRO 387 Ca 0.47 1.35 0.03 0.00 0.02 0.00 0.00 61.00 62.87 1jxq s PRO 387 Cb -0.28 -1.66 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 1jxq s PRO 387 CO 0.34 -3.04 0.00 0.20 -0.33 0.00 0.00 177.00 174.17 1jxq s GLY 388 N -2.58 1.38 -0.09 0.52 0.00 -0.86 -5.01 107.32 100.68 1jxq s GLY 388 Ca 0.68 -1.67 -0.00 0.00 0.00 0.00 0.00 44.72 43.72 1jxq s GLY 388 CO 0.60 -1.59 -0.07 0.00 0.00 0.00 0.00 173.10 172.05 1jxq s PHE 390 N 1.52 3.24 -0.41 0.00 2.99 -0.33 -4.99 117.98 120.00 1jxq s PHE 390 Ca 0.00 -1.32 -0.17 0.00 0.00 0.00 0.00 56.93 55.44 1jxq s PHE 390 Cb -0.13 -3.98 0.02 0.00 0.00 0.00 0.00 43.02 38.93 1jxq s PHE 390 CO -0.05 -1.21 0.43 1.21 -0.00 0.00 0.00 175.22 175.60 1jxq s ASN 392 N 3.27 6.19 -0.29 1.36 3.84 -1.26 -1.91 114.94 126.14 1jxq s ASN 392 Ca 0.15 -0.62 0.12 0.00 0.21 0.00 0.00 52.86 52.72 1jxq s ASN 392 Cb -0.19 -2.22 0.47 0.00 -0.55 0.00 0.00 41.25 38.76 1jxq s ASN 392 CO -0.00 -0.55 1.15 0.49 -2.79 0.00 0.00 177.10 175.40 1jxq n PHE 393 N 5.57 2.29 -2.88 0.43 3.01 -0.24 -5.04 117.46 120.60 1jxq n PHE 393 Ca -0.07 -2.28 -0.23 0.00 1.01 0.00 0.00 57.45 55.88 1jxq n PHE 393 Cb 0.48 -0.29 0.02 0.00 -0.01 0.00 0.00 39.48 39.67 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 -3.64 3.56 -0.01 4.37 1.43 -1.24 -1.64 118.68 121.50 1jxq s LEU 394 Ca 0.43 0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.89 1jxq s LEU 394 Cb 0.38 -3.16 -0.11 0.00 0.03 0.00 0.00 46.19 43.33 1jxq s LEU 394 CO -0.00 -0.80 0.20 0.54 0.23 0.00 0.00 176.35 176.52 1jxq n ARG 395 N -2.16 1.06 -4.23 1.70 1.74 -1.26 -4.89 116.66 108.63 1jxq n ARG 395 Ca 0.03 -0.06 -0.13 0.00 -0.77 0.00 0.00 57.85 56.92 1jxq n ARG 395 Cb 0.58 -1.12 -0.10 0.00 -1.02 0.00 0.00 32.46 30.80 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 -2.37 1.18 0.70 5.56 1.02 -1.26 -4.94 119.74 119.63 1jxq s LYS 396 Ca -0.02 -1.61 -0.11 0.00 0.02 0.00 0.00 55.97 54.25 1jxq s LYS 396 Cb 0.05 0.04 0.01 0.00 -0.52 0.00 0.00 37.83 37.41 1jxq s LYS 396 CO 0.32 -0.30 1.06 0.15 -0.92 0.00 0.00 175.35 175.66 1jxq s LYS 397 N -4.06 2.88 -0.28 1.68 1.02 -0.89 -4.74 119.74 115.35 1jxq s LYS 397 Ca 0.33 0.86 -0.01 0.00 0.02 0.00 0.00 55.97 57.17 1jxq s LYS 397 Cb 0.07 -1.99 0.09 0.00 -0.52 0.00 0.00 37.83 35.48 1jxq s LYS 397 CO 0.09 -1.11 0.06 -1.17 -0.92 0.00 0.00 175.35 172.30 1jxq s LEU 398 N -5.53 2.25 -0.41 3.17 2.96 -1.26 -1.31 118.68 118.55 1jxq s LEU 398 Ca 0.58 -1.45 -0.16 0.00 -0.22 0.00 0.00 54.13 52.88 1jxq s LEU 398 Cb -0.14 -0.91 0.02 0.00 0.50 0.00 0.00 46.19 45.67 1jxq s LEU 398 CO 0.55 -0.37 0.37 -0.36 -1.32 0.00 0.00 176.35 175.22 1jxq s PHE 399 N 1.58 3.21 0.67 5.38 0.08 -1.26 -1.22 117.98 126.42 1jxq s PHE 399 Ca 0.06 -0.48 -0.17 0.00 0.12 0.00 0.00 56.93 56.45 1jxq s PHE 399 Cb -0.18 -2.74 0.01 0.00 -0.57 0.00 0.00 43.02 39.54 1jxq s PHE 399 CO -0.18 -0.64 1.27 -0.06 -0.10 0.00 0.00 175.22 175.51 1jxq s PHE 400 N 1.90 2.05 -0.61 0.36 0.08 -1.26 -4.84 117.98 115.66 1jxq s PHE 400 Ca 0.08 1.52 -0.28 0.00 0.12 0.00 0.00 56.93 58.38 1jxq s PHE 400 Cb -0.18 -3.64 0.02 0.00 -0.57 0.00 0.00 43.02 38.65 1jxq s PHE 400 CO 0.12 -2.86 1.35 0.21 -0.10 0.00 0.00 175.22 173.93 1jxq s LYS 401 N -3.52 3.30 0.29 0.44 2.47 -1.26 -4.87 119.74 116.59 1jxq s LYS 401 Ca 0.80 0.27 -0.13 0.00 -1.56 0.00 0.00 55.97 55.35 1jxq s LYS 401 Cb -0.35 -4.12 -0.08 0.00 -1.46 0.00 0.00 37.83 31.81 1jxq s LYS 401 CO 0.41 -1.95 0.67 0.99 0.16 0.00 0.00 175.35 175.63 1jxq s THR 402 N 5.84 4.77 0.00 3.43 2.01 -1.26 -4.10 115.64 126.33 1jxq s THR 402 Ca 0.47 0.77 0.00 0.00 0.31 0.00 0.00 61.69 63.24 1jxq s THR 402 Cb -0.09 -3.61 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1jxq s THR 402 CO 0.23 -0.15 0.00 -1.20 -0.69 0.00 0.00 174.62 172.81