#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1re3 n ARG 166 N 0.00 1.37 -0.02 3.23 1.74 -1.26 -4.04 116.66 117.68 1re3 n ARG 166 Ca 0.00 -1.07 0.10 0.00 -0.77 0.00 0.00 57.85 56.11 1re3 n ARG 166 Cb 0.00 -1.48 0.54 0.00 -1.02 0.00 0.00 32.46 30.50 1re3 n ARG 166 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1re3 n VAL 167 N 0.12 0.05 0.32 1.55 0.24 -1.26 -3.16 118.33 116.19 1re3 n VAL 167 Ca 0.11 -0.08 0.14 0.00 -2.04 0.00 0.00 64.34 62.48 1re3 n VAL 167 Cb 0.46 -0.14 0.48 0.00 -1.47 0.00 0.00 33.84 33.17 1re3 n VAL 167 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 1re3 h LEU 168 N 0.54 0.00 -0.66 1.34 5.85 -2.03 -2.95 115.31 117.41 1re3 h LEU 168 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 1re3 h LEU 168 Cb 0.12 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1re3 h LEU 168 CO 0.00 0.00 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.78 1re3 h ARG 169 N 0.00 0.81 0.00 1.25 2.43 -1.87 -2.56 114.38 114.44 1re3 h ARG 169 Ca 0.00 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 58.83 1re3 h ARG 169 Cb 0.65 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1re3 h ARG 169 CO 0.00 0.95 -0.04 1.03 -1.51 0.00 0.00 179.97 180.40 1re3 h SER 170 N 0.70 0.00 0.20 -3.80 0.87 -1.77 -1.69 113.55 108.06 1re3 h SER 170 Ca 0.10 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1re3 h SER 170 Cb 0.75 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1re3 h SER 170 CO 0.06 0.04 -0.10 0.40 -0.53 0.00 0.00 176.83 176.71 1re3 h ILE 171 N 0.00 0.61 -0.74 2.23 1.08 -1.56 -1.79 117.51 117.34 1re3 h ILE 171 Ca -0.00 -1.04 0.03 0.00 -0.39 0.00 0.00 64.86 63.46 1re3 h ILE 171 Cb 0.32 1.04 -0.04 0.00 -3.07 0.00 0.00 36.82 35.06 1re3 h ILE 171 CO 0.01 0.16 0.49 -0.07 -0.69 0.00 0.00 178.15 178.05 1re3 h LEU 172 N -0.94 0.79 -0.33 1.44 -0.00 -1.45 -1.00 115.31 113.81 1re3 h LEU 172 Ca -0.03 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.83 1re3 h LEU 172 Cb 0.47 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 1re3 h LEU 172 CO 0.05 0.55 0.16 -0.33 -0.00 0.00 0.00 178.44 178.87 1re3 h GLU 173 N 0.92 0.48 -0.34 1.13 4.39 -1.37 -0.60 114.58 119.19 1re3 h GLU 173 Ca 0.29 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.94 1re3 h GLU 173 Cb 0.01 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 1re3 h GLU 173 CO -0.08 0.43 0.18 -0.97 -1.16 0.00 0.00 179.01 177.41 1re3 h ASN 174 N 0.40 0.27 -0.13 1.42 -1.24 -0.41 -1.92 115.58 113.97 1re3 h ASN 174 Ca 0.11 0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.13 1re3 h ASN 174 Cb 0.11 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1re3 h ASN 174 CO -0.02 0.20 0.04 -0.07 -1.29 0.00 0.00 177.43 176.30 1re3 h LEU 175 N 0.37 0.19 -1.27 0.34 3.38 -0.98 -1.26 115.31 116.08 1re3 h LEU 175 Ca 0.14 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1re3 h LEU 175 Cb 0.03 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1re3 h LEU 175 CO -0.08 0.34 0.49 -0.09 0.09 0.00 0.00 178.44 179.19 1re3 h ARG 176 N 0.03 0.98 -0.50 1.13 2.43 -1.04 0.20 114.38 117.62 1re3 h ARG 176 Ca 0.04 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 1re3 h ARG 176 Cb 0.22 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1re3 h ARG 176 CO -0.00 0.65 -0.03 1.03 -1.51 0.00 0.00 179.97 180.11 1re3 h SER 177 N 1.01 0.83 -0.93 -3.80 0.87 -1.17 -2.45 113.55 107.91 1re3 h SER 177 Ca 0.27 -0.22 0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1re3 h SER 177 Cb -0.12 -0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 61.57 1re3 h SER 177 CO -0.06 0.91 0.61 0.11 -0.53 0.00 0.00 176.83 177.87 1re3 h LYS 178 N 0.79 1.17 -0.56 2.24 1.79 0.22 -2.20 116.57 120.02 1re3 h LYS 178 Ca 0.15 -0.07 -0.07 0.00 -2.18 0.00 0.00 60.65 58.47 1re3 h LYS 178 Cb 0.51 -0.26 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 1re3 h LYS 178 CO 0.03 0.78 0.06 0.82 -1.08 0.00 0.00 179.45 180.06 1re3 h ILE 179 N 1.21 1.25 -0.71 1.86 2.04 -0.77 -1.64 117.51 120.74 1re3 h ILE 179 Ca 0.35 -0.99 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1re3 h ILE 179 Cb -0.06 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 1re3 h ILE 179 CO -0.09 0.36 0.47 1.56 0.00 0.00 0.00 178.15 180.45 1re3 h GLN 180 N 0.86 0.93 0.57 2.37 4.20 -1.13 0.10 115.11 123.01 1re3 h GLN 180 Ca 0.17 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1re3 h GLN 180 Cb 0.42 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.00 1re3 h GLN 180 CO 0.01 0.62 -0.27 -0.22 -0.67 0.00 0.00 178.83 178.30 1re3 h LYS 181 N 0.96 -0.73 -0.91 1.46 1.63 -1.27 -1.80 116.57 115.90 1re3 h LYS 181 Ca 0.26 0.05 0.16 0.00 -0.85 0.00 0.00 60.65 60.28 1re3 h LYS 181 Cb -0.10 0.17 -0.10 0.00 -0.60 0.00 0.00 32.23 31.60 1re3 h LYS 181 CO -0.06 -0.43 0.50 -0.07 -3.45 0.00 0.00 179.45 175.94 1re3 h LEU 182 N -0.93 0.63 -0.64 5.20 3.38 -1.09 0.84 115.31 122.70 1re3 h LEU 182 Ca -0.08 0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1re3 h LEU 182 Cb 0.64 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1re3 h LEU 182 CO 0.13 0.24 0.22 -0.33 0.09 0.00 0.00 178.44 178.79 1re3 h GLU 183 N 0.68 0.98 -0.23 1.13 5.08 -0.67 -1.87 114.58 119.67 1re3 h GLU 183 Ca 0.51 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.64 1re3 h GLU 183 Cb 0.75 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1re3 h GLU 183 CO -0.37 0.85 0.03 1.03 -1.00 0.00 0.00 179.01 179.55 1re3 h SER 184 N 0.91 0.38 0.17 1.42 0.87 -0.11 -1.88 113.55 115.31 1re3 h SER 184 Ca 0.21 -0.27 0.01 0.00 -1.23 0.00 0.00 61.79 60.51 1re3 h SER 184 Cb 0.27 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 1re3 h SER 184 CO -0.01 0.55 -0.29 0.44 -0.53 0.00 0.00 176.83 177.00 1re3 h ASP 185 N 0.19 -0.81 -0.92 6.23 3.32 -0.78 0.98 116.42 124.63 1re3 h ASP 185 Ca 0.07 0.09 0.10 0.00 0.02 0.00 0.00 57.03 57.31 1re3 h ASP 185 Cb 0.34 0.30 -0.07 0.00 0.22 0.00 0.00 39.33 40.12 1re3 h ASP 185 CO 0.01 -0.39 0.59 0.58 -1.72 0.00 0.00 179.24 178.31 1re3 h VAL 186 N -0.53 0.96 0.04 -1.35 2.07 -1.34 -1.43 116.25 114.67 1re3 h VAL 186 Ca 0.02 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1re3 h VAL 186 Cb 0.54 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1re3 h VAL 186 CO -0.13 0.17 -0.02 -1.28 0.02 0.00 0.00 177.57 176.33 1re3 h SER 187 N 0.92 -0.04 -0.18 0.57 0.87 -0.73 -1.30 113.55 113.65 1re3 h SER 187 Ca 0.43 -0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.83 1re3 h SER 187 Cb 0.42 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 1re3 h SER 187 CO -0.19 0.18 -0.10 0.00 -0.53 0.00 0.00 176.83 176.19 1re3 h ALA 188 N 0.68 0.05 -0.85 6.23 0.00 0.00 -0.75 119.26 124.62 1re3 h ALA 188 Ca -0.01 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1re3 h ALA 188 Cb 0.25 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1re3 h ALA 188 CO 0.01 -0.53 0.56 0.37 0.00 0.00 0.00 179.25 179.65 1re3 h GLN 189 N -0.09 1.08 -0.50 0.00 5.75 -1.26 0.23 115.11 120.31 1re3 h GLN 189 Ca 0.10 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1re3 h GLN 189 Cb 0.24 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 1re3 h GLN 189 CO -0.24 0.71 0.26 1.98 -2.65 0.00 0.00 178.83 178.89 1re3 h MET 190 N 1.11 0.70 -0.26 1.69 4.05 -0.63 0.27 114.93 121.85 1re3 h MET 190 Ca 0.32 -0.08 -0.14 0.00 -0.28 0.00 0.00 59.70 59.53 1re3 h MET 190 Cb -0.06 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 30.59 1re3 h MET 190 CO -0.09 0.53 -0.40 1.49 0.23 0.00 0.00 176.91 178.67 1re3 h GLU 191 N 0.70 0.74 0.00 0.39 4.57 0.36 -2.76 114.58 118.57 1re3 h GLU 191 Ca 0.18 -0.44 -0.03 0.00 -1.18 0.00 0.00 59.36 57.89 1re3 h GLU 191 Cb 0.05 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.68 1re3 h GLU 191 CO -0.03 1.06 -0.14 1.88 -1.18 0.00 0.00 179.01 180.61 1re3 h TYR 192 N 0.48 0.00 -0.03 0.92 0.05 0.59 -2.53 116.97 116.44 1re3 h TYR 192 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1re3 h TYR 192 Cb 0.99 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.73 1re3 h TYR 192 CO 0.08 0.14 0.00 0.00 -1.05 0.00 0.00 178.16 177.33 1re3 h ARG 194 N 0.41 0.00 -5.24 0.00 2.43 -1.45 -3.41 114.38 107.11 1re3 h ARG 194 Ca 0.00 0.00 -0.44 0.00 -0.81 0.00 0.00 59.98 58.73 1re3 h ARG 194 Cb 0.09 0.00 -0.25 0.00 -0.42 0.00 0.00 29.97 29.39 1re3 h ARG 194 CO 0.00 0.09 -0.79 -0.08 -1.51 0.00 0.00 179.97 177.68 1re3 s THR 195 N -4.34 1.06 0.57 0.20 -1.32 -1.23 -5.16 115.64 105.42 1re3 s THR 195 Ca -0.03 -0.92 -0.03 0.00 -1.21 0.00 0.00 61.69 59.50 1re3 s THR 195 Cb 0.14 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 70.20 1re3 s THR 195 CO 0.58 0.03 0.84 -2.16 -2.21 0.00 0.00 174.62 171.71 1re3 s PRO 196 N -1.01 2.70 0.47 7.08 0.04 -1.26 -5.00 135.00 138.02 1re3 s PRO 196 Ca 0.02 -0.36 -0.16 0.00 0.04 0.00 0.00 61.00 60.53 1re3 s PRO 196 Cb -0.07 -2.37 -0.08 0.00 0.04 0.00 0.00 34.50 32.02 1re3 s PRO 196 CO 0.01 -0.72 0.92 0.00 0.04 0.00 0.00 177.00 177.25 1re3 s THR 198 N -2.47 1.39 0.08 0.00 -4.23 -1.26 -5.15 115.64 104.00 1re3 s THR 198 Ca 0.58 -2.12 -0.05 0.00 -1.18 0.00 0.00 61.69 58.92 1re3 s THR 198 Cb -0.10 -1.97 -0.02 0.00 1.34 0.00 0.00 72.50 71.75 1re3 s THR 198 CO 0.27 -0.65 0.08 0.68 -0.54 0.00 0.00 174.62 174.46 1re3 s VAL 199 N -3.19 0.17 -0.47 2.29 -7.23 -1.26 -4.96 120.40 105.75 1re3 s VAL 199 Ca 0.20 -1.54 0.04 0.00 -1.81 0.00 0.00 61.98 58.87 1re3 s VAL 199 Cb 0.02 -1.51 0.16 0.00 0.56 0.00 0.00 36.38 35.61 1re3 s VAL 199 CO 0.04 -0.78 0.36 -0.44 -0.31 0.00 0.00 175.10 173.96 1re3 s SER 200 N -2.91 2.46 -0.89 4.85 0.01 -1.26 -5.06 113.70 110.90 1re3 s SER 200 Ca 0.08 -3.13 -0.18 0.00 1.31 0.00 0.00 55.95 54.03 1re3 s SER 200 Cb 0.06 -0.74 0.15 0.00 0.21 0.00 0.00 66.02 65.70 1re3 s SER 200 CO -0.09 -0.17 1.03 0.00 0.41 0.00 0.00 173.24 174.42 1re3 s ASN 202 N 3.33 6.66 -0.11 0.00 0.01 -1.25 -4.92 114.94 118.66 1re3 s ASN 202 Ca 0.29 2.73 -0.26 0.00 -0.71 0.00 0.00 52.86 54.91 1re3 s ASN 202 Cb -0.07 -2.64 -0.02 0.00 0.41 0.00 0.00 41.25 38.93 1re3 s ASN 202 CO -0.08 -0.66 0.84 -0.63 -1.51 0.00 0.00 177.10 175.06 1re3 s ILE 203 N -0.64 4.91 0.35 0.60 1.01 -1.26 -4.66 121.20 121.51 1re3 s ILE 203 Ca 0.54 1.70 -0.28 0.00 0.00 0.00 0.00 60.65 62.61 1re3 s ILE 203 Cb -0.42 -4.16 -0.12 0.00 0.01 0.00 0.00 42.46 37.77 1re3 s ILE 203 CO 0.50 0.11 1.38 -2.65 0.00 0.00 0.00 174.94 174.28 1re3 n PRO 204 N 4.59 2.35 -0.17 2.79 -0.02 -1.26 -4.91 135.00 138.37 1re3 n PRO 204 Ca 0.04 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.25 1re3 n PRO 204 Cb 0.50 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1re3 n PRO 204 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1re3 h VAL 205 N 2.74 1.24 -2.98 -1.45 2.07 -1.98 -3.43 116.25 112.46 1re3 h VAL 205 Ca -0.48 -0.83 -0.53 0.00 0.82 0.00 0.00 66.70 65.68 1re3 h VAL 205 Cb 1.27 0.86 0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1re3 h VAL 205 CO 0.64 0.30 0.75 0.54 0.02 0.00 0.00 177.57 179.81 1re3 s VAL 206 N -5.31 3.39 0.21 2.57 0.11 -1.26 -5.01 120.40 115.10 1re3 s VAL 206 Ca -0.13 0.97 -0.00 0.00 -2.93 0.00 0.00 61.98 59.89 1re3 s VAL 206 Cb 0.11 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.30 1re3 s VAL 206 CO 0.79 0.06 0.11 -0.55 -3.33 0.00 0.00 175.10 172.18 1re3 s SER 207 N 1.29 0.49 0.01 3.54 0.15 -1.26 -4.69 113.70 113.22 1re3 s SER 207 Ca 0.65 -1.37 -0.07 0.00 0.70 0.00 0.00 55.95 55.86 1re3 s SER 207 Cb -0.36 0.30 0.02 0.00 -1.71 0.00 0.00 66.02 64.28 1re3 s SER 207 CO 0.30 -0.79 0.32 0.61 1.20 0.00 0.00 173.24 174.87 1re3 n GLY 208 N -0.31 0.67 0.30 9.45 0.00 -1.25 -4.80 105.19 109.24 1re3 n GLY 208 Ca 0.01 -0.91 -0.06 0.00 0.00 0.00 0.00 46.02 45.06 1re3 n GLY 208 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1re3 h LYS 209 N 0.00 1.02 0.00 1.61 1.57 -1.89 -1.62 116.57 117.26 1re3 h LYS 209 Ca -0.06 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1re3 h LYS 209 Cb 0.31 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1re3 h LYS 209 CO 0.08 0.81 0.15 -0.85 -0.57 0.00 0.00 179.45 179.07 1re3 n GLU 210 N -4.43 0.79 0.17 3.15 -0.00 -1.26 -2.85 120.64 116.22 1re3 n GLU 210 Ca 0.06 -1.72 0.06 0.00 -0.00 0.00 0.00 57.16 55.56 1re3 n GLU 210 Cb 0.13 2.05 0.54 0.00 -0.00 0.00 0.00 31.44 34.17 1re3 n GLU 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1re3 h GLU 212 N 0.17 0.09 -0.60 0.00 4.57 -1.82 -0.12 114.58 116.88 1re3 h GLU 212 Ca 0.04 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.16 1re3 h GLU 212 Cb 0.05 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.60 1re3 h GLU 212 CO -0.00 0.21 0.18 1.49 -1.18 0.00 0.00 179.01 179.70 1re3 h GLU 213 N -0.06 0.91 -0.44 1.92 4.81 -1.83 -2.01 114.58 117.88 1re3 h GLU 213 Ca 0.02 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.06 1re3 h GLU 213 Cb 0.15 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1re3 h GLU 213 CO -0.00 0.79 0.21 0.82 -0.73 0.00 0.00 179.01 180.10 1re3 h ILE 214 N 0.88 1.18 0.00 2.32 2.04 -0.94 0.04 117.51 123.02 1re3 h ILE 214 Ca 0.20 -0.51 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 1re3 h ILE 214 Cb 0.27 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1re3 h ILE 214 CO -0.01 0.20 -0.29 -0.29 0.00 0.00 0.00 178.15 177.75 1re3 h ILE 215 N 0.56 0.99 0.00 -0.67 2.10 -0.83 -0.94 117.51 118.73 1re3 h ILE 215 Ca 0.15 -1.09 -0.04 0.00 1.08 0.00 0.00 64.86 64.96 1re3 h ILE 215 Cb 0.12 1.63 -0.01 0.00 -1.09 0.00 0.00 36.82 37.47 1re3 h ILE 215 CO -0.02 0.29 -0.19 0.03 -1.08 0.00 0.00 178.15 177.18 1re3 h ARG 216 N 0.00 0.00 -0.51 2.19 3.08 -0.59 -2.59 114.38 115.96 1re3 h ARG 216 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1re3 h ARG 216 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1re3 h ARG 216 CO 0.04 0.19 0.00 1.63 -1.07 0.00 0.00 179.97 180.76 1re3 n LYS 217 N -3.30 2.28 0.00 0.04 5.02 -0.08 -4.91 118.16 117.23 1re3 n LYS 217 Ca 0.01 -1.60 0.00 0.00 -2.02 0.00 0.00 58.31 54.70 1re3 n LYS 217 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 1re3 n LYS 217 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1re3 n GLY 218 N 0.99 0.22 3.56 0.72 0.00 -0.98 -5.02 105.19 104.68 1re3 n GLY 218 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1re3 n GLY 218 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1re3 s GLY 219 N -1.74 0.77 0.15 -0.02 0.00 -0.60 -4.77 107.32 101.10 1re3 s GLY 219 Ca 0.00 -1.96 0.24 0.00 0.00 0.00 0.00 44.72 43.00 1re3 s GLY 219 CO 0.00 3.07 1.38 0.83 0.00 0.00 0.00 173.10 178.38 1re3 h GLU 220 N 10.34 0.00 -5.91 2.90 5.08 -1.86 -3.34 114.58 121.78 1re3 h GLU 220 Ca 0.17 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.90 1re3 h GLU 220 Cb 1.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.19 1re3 h GLU 220 CO 1.33 0.00 -0.31 0.95 -1.00 0.00 0.00 179.01 179.98 1re3 s THR 221 N -3.17 5.21 -0.26 1.13 -4.23 -1.26 -4.74 115.64 108.32 1re3 s THR 221 Ca 0.06 0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 60.81 1re3 s THR 221 Cb 0.13 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.37 1re3 s THR 221 CO 0.70 0.52 1.21 -0.44 -0.54 0.00 0.00 174.62 176.08 1re3 s SER 222 N -1.24 6.85 0.00 3.99 0.01 -1.26 -4.66 113.70 117.39 1re3 s SER 222 Ca 0.23 1.32 -0.00 0.00 1.31 0.00 0.00 55.95 58.81 1re3 s SER 222 Cb -0.15 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.54 1re3 s SER 222 CO 0.12 -0.90 0.00 -1.84 0.41 0.00 0.00 173.24 171.03 1re3 n GLU 223 N 6.92 0.00 -2.92 12.44 0.28 -0.97 -4.75 120.64 131.64 1re3 n GLU 223 Ca 0.14 -0.01 -0.39 0.00 -0.16 0.00 0.00 57.16 56.74 1re3 n GLU 223 Cb 0.46 0.01 -0.06 0.00 1.43 0.00 0.00 31.44 33.28 1re3 n GLU 223 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 177.13 178.38 1re3 s MET 224 N -2.00 4.64 0.13 3.44 -2.45 -0.86 -0.32 119.30 121.88 1re3 s MET 224 Ca 0.00 1.24 -0.01 0.00 -1.25 0.00 0.00 55.69 55.67 1re3 s MET 224 Cb -0.00 -3.25 -0.04 0.00 1.25 0.00 0.00 34.83 32.79 1re3 s MET 224 CO 0.00 0.55 0.04 0.71 1.05 0.00 0.00 175.02 177.37 1re3 s TYR 225 N -1.17 0.86 -0.20 4.11 1.51 -0.21 -4.50 117.35 117.75 1re3 s TYR 225 Ca 0.37 -1.20 -0.09 0.00 -1.01 0.00 0.00 57.07 55.15 1re3 s TYR 225 Cb -0.24 -0.49 -0.04 0.00 -0.11 0.00 0.00 41.96 41.08 1re3 s TYR 225 CO 0.28 -0.47 0.10 -1.17 -1.11 0.00 0.00 175.55 173.17 1re3 s LEU 226 N -3.05 3.98 0.13 -1.29 2.96 -1.26 -1.83 118.68 118.32 1re3 s LEU 226 Ca 0.22 0.13 0.08 0.00 -0.22 0.00 0.00 54.13 54.34 1re3 s LEU 226 Cb 0.07 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 1re3 s LEU 226 CO 0.01 0.16 -0.18 0.27 -1.32 0.00 0.00 176.35 175.28 1re3 s ILE 227 N 0.49 1.64 -0.40 6.68 -4.36 0.02 -3.87 121.20 121.39 1re3 s ILE 227 Ca 0.05 -1.69 0.02 0.00 -0.26 0.00 0.00 60.65 58.77 1re3 s ILE 227 Cb -0.12 -1.62 0.15 0.00 1.25 0.00 0.00 42.46 42.12 1re3 s ILE 227 CO -0.00 -0.22 0.26 -1.58 0.24 0.00 0.00 174.94 173.64 1re3 s GLN 228 N -2.34 0.91 0.34 0.37 0.74 -0.61 -0.83 119.66 118.23 1re3 s GLN 228 Ca 0.09 -1.79 0.08 0.00 0.05 0.00 0.00 55.36 53.80 1re3 s GLN 228 Cb -0.08 -1.68 0.79 0.00 1.10 0.00 0.00 33.01 33.15 1re3 s GLN 228 CO 0.05 -1.25 1.83 -1.35 -0.55 0.00 0.00 175.29 174.02 1re3 h PRO 229 N 6.52 0.71 -3.67 1.67 0.11 -1.75 -3.36 132.00 132.22 1re3 h PRO 229 Ca 0.10 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 66.01 1re3 h PRO 229 Cb 0.93 -0.16 -0.21 0.00 0.11 0.00 0.00 31.00 31.67 1re3 h PRO 229 CO 0.36 0.47 -0.57 0.34 -0.21 0.00 0.00 178.00 178.39 1re3 s ASP 230 N -5.62 0.09 0.33 -2.05 2.15 -1.26 -4.86 116.67 105.45 1re3 s ASP 230 Ca -0.10 -0.28 0.25 0.00 0.43 0.00 0.00 52.55 52.84 1re3 s ASP 230 Cb 0.23 0.17 1.17 0.00 -0.30 0.00 0.00 42.92 44.19 1re3 s ASP 230 CO 0.80 -0.32 1.75 0.77 -0.17 0.00 0.00 175.17 177.99 1re3 h SER 231 N 4.51 0.00 0.77 -0.34 4.64 -2.02 -0.17 113.55 120.94 1re3 h SER 231 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1re3 h SER 231 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1re3 h SER 231 CO 0.41 0.00 -0.39 -1.54 -0.87 0.00 0.00 176.83 174.44 1re3 n SER 232 N -2.36 0.46 -4.74 4.97 3.41 -1.26 -4.83 113.62 109.27 1re3 n SER 232 Ca 0.00 0.07 -0.35 0.00 -0.26 0.00 0.00 58.87 58.33 1re3 n SER 232 Cb 0.15 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.01 1re3 n SER 232 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1re3 s VAL 233 N -3.05 5.03 0.17 -3.33 -7.23 -0.08 -5.07 120.40 106.85 1re3 s VAL 233 Ca 0.10 0.04 -0.32 0.00 -1.81 0.00 0.00 61.98 60.00 1re3 s VAL 233 Cb 0.16 -3.22 -0.10 0.00 0.56 0.00 0.00 36.38 33.78 1re3 s VAL 233 CO 0.66 0.54 1.58 -0.75 -0.31 0.00 0.00 175.10 176.82 1re3 s LYS 234 N -0.34 4.21 0.38 4.82 2.20 -1.26 -4.71 119.74 125.03 1re3 s LYS 234 Ca 0.10 2.39 -0.27 0.00 -0.36 0.00 0.00 55.97 57.83 1re3 s LYS 234 Cb -0.12 -3.14 -0.11 0.00 -1.51 0.00 0.00 37.83 32.95 1re3 s LYS 234 CO 0.01 -0.62 1.27 -2.30 -0.36 0.00 0.00 175.35 173.36 1re3 n PRO 235 N 3.91 2.03 -4.16 4.03 -0.02 -1.26 -4.92 135.00 134.61 1re3 n PRO 235 Ca 0.14 0.72 -0.10 0.00 -2.02 0.00 0.00 63.50 62.23 1re3 n PRO 235 Cb 0.38 -2.34 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 1re3 n PRO 235 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1re3 s TYR 236 N -1.14 0.90 0.26 6.00 -0.85 -0.01 -4.93 117.35 117.59 1re3 s TYR 236 Ca 0.58 -1.19 -0.15 0.00 -0.52 0.00 0.00 57.07 55.78 1re3 s TYR 236 Cb -0.54 -0.51 -0.08 0.00 0.38 0.00 0.00 41.96 41.20 1re3 s TYR 236 CO 0.60 -0.46 0.68 1.03 -1.52 0.00 0.00 175.55 175.89 1re3 s ARG 237 N -4.02 4.03 0.15 -3.49 0.52 -1.26 -0.80 118.95 114.08 1re3 s ARG 237 Ca 0.23 0.64 -0.20 0.00 -0.52 0.00 0.00 55.73 55.88 1re3 s ARG 237 Cb 0.07 -2.63 0.05 0.00 0.52 0.00 0.00 34.95 32.97 1re3 s ARG 237 CO 0.01 0.28 0.53 0.54 0.02 0.00 0.00 175.30 176.68 1re3 s VAL 238 N -1.78 0.03 -0.21 3.52 0.11 -0.76 -4.95 120.40 116.35 1re3 s VAL 238 Ca 0.48 -0.26 -0.11 0.00 -2.93 0.00 0.00 61.98 59.17 1re3 s VAL 238 Cb -0.13 -1.10 -0.05 0.00 -1.53 0.00 0.00 36.38 33.57 1re3 s VAL 238 CO 0.19 -0.12 0.18 -0.47 -3.33 0.00 0.00 175.10 171.55 1re3 s TYR 239 N -3.78 3.37 -0.22 1.54 5.04 -1.26 -1.04 117.35 121.00 1re3 s TYR 239 Ca 0.02 0.34 -0.08 0.00 -2.44 0.00 0.00 57.07 54.91 1re3 s TYR 239 Cb -0.00 -2.25 -0.04 0.00 0.35 0.00 0.00 41.96 40.02 1re3 s TYR 239 CO -0.12 0.17 0.08 0.00 -1.34 0.00 0.00 175.55 174.34 1re3 s ASP 241 N 1.04 6.22 -0.01 0.00 -1.08 0.05 -2.30 116.67 120.60 1re3 s ASP 241 Ca 0.04 -0.91 0.21 0.00 -0.52 0.00 0.00 52.55 51.38 1re3 s ASP 241 Cb -0.14 -2.27 0.60 0.00 -1.46 0.00 0.00 42.92 39.65 1re3 s ASP 241 CO 0.03 -0.83 1.50 0.23 0.52 0.00 0.00 175.17 176.62 1re3 n MET 242 N 6.02 2.80 -0.01 4.34 2.81 -1.26 -1.94 117.12 129.88 1re3 n MET 242 Ca -0.07 -2.59 0.00 0.00 -1.81 0.00 0.00 57.70 53.23 1re3 n MET 242 Cb 0.45 -1.54 -0.04 0.00 -0.71 0.00 0.00 33.22 31.38 1re3 n MET 242 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1re3 n ASN 243 N 1.46 3.83 -4.63 7.83 4.13 -1.26 -4.14 115.26 122.49 1re3 n ASN 243 Ca 0.23 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 56.06 1re3 n ASN 243 Cb 0.61 0.96 -0.03 0.00 -1.54 0.00 0.00 39.78 39.78 1re3 n ASN 243 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1re3 s THR 244 N -2.25 4.54 -0.71 3.41 2.01 -1.26 -4.52 115.64 116.86 1re3 s THR 244 Ca -0.02 1.53 -0.12 0.00 0.31 0.00 0.00 61.69 63.39 1re3 s THR 244 Cb 0.02 -4.38 0.02 0.00 0.01 0.00 0.00 72.50 68.17 1re3 s THR 244 CO 0.20 -0.50 0.62 1.21 -0.69 0.00 0.00 174.62 175.47 1re3 n GLU 245 N 6.84 -1.67 -0.29 4.92 2.13 -1.26 -2.24 120.64 129.07 1re3 n GLU 245 Ca 0.10 0.99 0.00 0.00 0.66 0.00 0.00 57.16 58.91 1re3 n GLU 245 Cb 0.48 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.85 1re3 n GLU 245 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1re3 n ASN 246 N -1.86 0.00 -0.85 4.31 4.13 -1.26 -4.95 115.26 114.78 1re3 n ASN 246 Ca -0.24 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.02 1re3 n ASN 246 Cb 0.69 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.93 1re3 n ASN 246 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1re3 n GLY 247 N -2.00 -0.75 1.85 7.41 0.00 -0.95 -4.93 105.19 105.82 1re3 n GLY 247 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1re3 n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1re3 n GLY 248 N 0.00 0.47 3.70 -0.02 0.00 -1.08 -4.94 105.19 103.32 1re3 n GLY 248 Ca 0.00 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 1re3 n GLY 248 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1re3 s TRP 249 N -2.00 3.52 -0.41 1.61 0.52 -0.82 -2.34 118.94 119.03 1re3 s TRP 249 Ca 0.00 1.21 -0.15 0.00 0.02 0.00 0.00 56.10 57.18 1re3 s TRP 249 Cb 0.00 -2.85 0.02 0.00 -1.15 0.00 0.00 33.47 29.49 1re3 s TRP 249 CO 0.00 -0.01 0.33 0.99 0.02 0.00 0.00 176.95 178.29 1re3 s THR 250 N 1.19 5.21 -0.03 2.01 2.01 -0.38 -0.77 115.64 124.88 1re3 s THR 250 Ca 0.37 -0.53 -0.30 0.00 0.31 0.00 0.00 61.69 61.54 1re3 s THR 250 Cb -0.17 -3.94 -0.06 0.00 0.01 0.00 0.00 72.50 68.33 1re3 s THR 250 CO 0.16 -0.32 1.68 -0.69 -0.69 0.00 0.00 174.62 174.77 1re3 s VAL 251 N 1.81 3.47 -0.13 3.82 1.01 -0.74 -1.58 120.40 128.06 1re3 s VAL 251 Ca 0.07 0.62 0.15 0.00 0.00 0.00 0.00 61.98 62.82 1re3 s VAL 251 Cb -0.18 -3.40 -0.21 0.00 0.00 0.00 0.00 36.38 32.58 1re3 s VAL 251 CO 0.11 -0.05 0.12 -0.38 0.00 0.00 0.00 175.10 174.90 1re3 n ILE 252 N 5.37 0.89 -3.74 2.22 -0.00 0.12 -4.54 119.36 119.69 1re3 n ILE 252 Ca 0.17 -0.63 -0.13 0.00 -0.00 0.00 0.00 62.75 62.16 1re3 n ILE 252 Cb 0.42 -0.43 -0.10 0.00 -0.00 0.00 0.00 39.64 39.53 1re3 n ILE 252 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.55 174.97 1re3 s GLN 253 N -2.56 0.48 -0.18 0.38 -0.44 -1.01 -1.29 119.66 115.04 1re3 s GLN 253 Ca -0.08 0.47 -0.10 0.00 -2.50 0.00 0.00 55.36 53.15 1re3 s GLN 253 Cb 0.06 0.23 0.06 0.00 -1.64 0.00 0.00 33.01 31.72 1re3 s GLN 253 CO 0.68 -0.07 0.44 1.21 0.50 0.00 0.00 175.29 178.05 1re3 s ASN 254 N 0.05 -0.56 0.04 6.67 2.47 -0.74 -0.55 114.94 122.33 1re3 s ASN 254 Ca -0.01 0.95 0.06 0.00 0.42 0.00 0.00 52.86 54.28 1re3 s ASN 254 Cb -0.03 0.83 -0.02 0.00 -1.45 0.00 0.00 41.25 40.58 1re3 s ASN 254 CO 0.01 -0.20 -0.17 -0.13 -3.72 0.00 0.00 177.10 172.90 1re3 s ARG 255 N 1.38 1.09 0.00 0.43 1.81 0.15 -2.55 118.95 121.26 1re3 s ARG 255 Ca -0.09 -0.84 0.00 0.00 -1.72 0.00 0.00 55.73 53.08 1re3 s ARG 255 Cb -0.08 -1.15 0.00 0.00 -0.45 0.00 0.00 34.95 33.27 1re3 s ARG 255 CO -0.13 0.29 0.00 0.00 -0.68 0.00 0.00 175.30 174.78 1re3 n GLN 256 N 1.84 0.00 0.00 3.54 10.64 -1.25 -2.44 117.38 129.71 1re3 n GLN 256 Ca -0.18 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.99 1re3 n GLN 256 Cb 0.54 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.92 1re3 n GLN 256 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1re3 n ASP 257 N -0.11 0.00 -0.35 2.61 5.68 -1.26 -4.77 116.55 118.35 1re3 n ASP 257 Ca 0.00 -0.68 -0.04 0.00 -0.50 0.00 0.00 54.79 53.56 1re3 n ASP 257 Cb 0.00 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 39.97 1re3 n ASP 257 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1re3 n GLY 258 N 0.00 0.57 0.00 6.12 0.00 -1.26 -4.93 105.19 105.68 1re3 n GLY 258 Ca 0.00 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.30 1re3 n GLY 258 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1re3 n SER 259 N 1.32 0.00 -4.06 1.61 3.41 -1.26 -4.78 113.62 109.86 1re3 n SER 259 Ca -0.04 0.16 -0.22 0.00 -0.26 0.00 0.00 58.87 58.51 1re3 n SER 259 Cb 0.24 -0.38 -0.15 0.00 -0.26 0.00 0.00 64.21 63.66 1re3 n SER 259 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1re3 s VAL 260 N -2.75 1.00 -0.07 -3.33 1.01 -1.26 -5.04 120.40 109.95 1re3 s VAL 260 Ca 0.20 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1re3 s VAL 260 Cb 0.17 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 1re3 s VAL 260 CO 0.43 0.30 1.16 -0.62 0.00 0.00 0.00 175.10 176.37 1re3 s ASP 261 N 0.00 7.10 0.00 3.32 -1.08 -1.26 -4.91 116.67 119.83 1re3 s ASP 261 Ca -0.01 1.75 0.17 0.00 -0.52 0.00 0.00 52.55 53.95 1re3 s ASP 261 Cb -0.08 -2.56 0.10 0.00 -1.46 0.00 0.00 42.92 38.92 1re3 s ASP 261 CO 0.01 -0.55 1.01 0.49 0.52 0.00 0.00 175.17 176.65 1re3 n PHE 262 N 5.14 0.00 -1.81 -5.34 3.01 -1.26 -4.70 117.46 112.50 1re3 n PHE 262 Ca 0.10 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.16 1re3 n PHE 262 Cb 0.47 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.93 1re3 n PHE 262 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1re3 n GLY 263 N 1.05 4.67 3.82 1.37 0.00 -1.26 -3.97 105.19 110.88 1re3 n GLY 263 Ca 0.09 -1.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.09 1re3 n GLY 263 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1re3 s ARG 264 N 1.04 2.58 1.05 1.61 0.52 -1.26 -4.50 118.95 119.99 1re3 s ARG 264 Ca 0.54 -1.43 -0.18 0.00 -0.52 0.00 0.00 55.73 54.15 1re3 s ARG 264 Cb 0.16 -2.36 0.24 0.00 0.52 0.00 0.00 34.95 33.51 1re3 s ARG 264 CO -0.06 0.04 1.31 0.15 0.02 0.00 0.00 175.30 176.75 1re3 s LYS 265 N -3.98 -0.07 0.13 3.54 1.02 -1.26 -4.48 119.74 114.64 1re3 s LYS 265 Ca 0.41 -0.47 -0.24 0.00 0.02 0.00 0.00 55.97 55.70 1re3 s LYS 265 Cb -0.04 -1.77 -0.03 0.00 -0.52 0.00 0.00 37.83 35.47 1re3 s LYS 265 CO 0.26 -2.88 1.65 2.35 -0.92 0.00 0.00 175.35 175.81 1re3 h TRP 266 N -1.98 -0.54 -0.56 3.18 2.91 -1.91 -2.83 115.95 114.22 1re3 h TRP 266 Ca -0.44 0.02 0.06 0.00 1.13 0.00 0.00 58.89 59.67 1re3 h TRP 266 Cb 1.23 0.25 -0.06 0.00 -0.51 0.00 0.00 29.16 30.07 1re3 h TRP 266 CO -1.75 -0.28 0.26 0.22 -1.03 0.00 0.00 178.44 175.85 1re3 h ASP 267 N -0.28 0.34 -0.83 2.65 3.58 -1.98 -0.10 116.42 119.80 1re3 h ASP 267 Ca 0.09 0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.56 1re3 h ASP 267 Cb 0.40 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.41 1re3 h ASP 267 CO -0.25 0.22 0.42 -0.65 -2.88 0.00 0.00 179.24 176.10 1re3 h PRO 268 N 0.49 1.18 0.00 0.28 0.11 -1.88 0.14 132.00 132.32 1re3 h PRO 268 Ca 0.26 -0.16 -0.06 0.00 0.11 0.00 0.00 66.00 66.16 1re3 h PRO 268 Cb 0.23 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1re3 h PRO 268 CO -0.21 0.89 -0.27 1.88 -0.21 0.00 0.00 178.00 180.09 1re3 h TYR 269 N 1.17 0.00 -0.04 0.65 0.05 -1.18 0.91 116.97 118.52 1re3 h TYR 269 Ca 0.29 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.94 1re3 h TYR 269 Cb 0.09 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.84 1re3 h TYR 269 CO 0.01 0.27 -0.46 -0.22 -1.05 0.00 0.00 178.16 176.71 1re3 h LYS 270 N 0.00 0.39 0.00 4.88 3.64 -0.19 0.13 116.57 125.41 1re3 h LYS 270 Ca -0.00 -0.36 -0.20 0.00 -1.27 0.00 0.00 60.65 58.82 1re3 h LYS 270 Cb 0.61 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 1re3 h LYS 270 CO 0.03 1.02 -1.16 1.96 -2.27 0.00 0.00 179.45 179.03 1re3 h GLN 271 N -0.11 0.00 0.00 1.90 1.08 -0.47 -2.80 115.11 114.72 1re3 h GLN 271 Ca -0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1re3 h GLN 271 Cb 1.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 1re3 h GLN 271 CO 0.09 0.62 0.00 0.41 -0.95 0.00 0.00 178.83 179.01 1re3 n GLY 272 N 1.39 2.32 3.67 3.46 0.00 0.31 -4.55 105.19 111.78 1re3 n GLY 272 Ca -0.06 -1.84 -0.07 0.00 0.00 0.00 0.00 46.02 44.05 1re3 n GLY 272 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1re3 s PHE 273 N -2.60 -0.27 0.00 1.61 -0.12 -0.36 -4.81 117.98 111.43 1re3 s PHE 273 Ca 0.00 -0.02 0.00 0.00 -0.05 0.00 0.00 56.93 56.86 1re3 s PHE 273 Cb 0.00 0.62 0.00 0.00 -0.63 0.00 0.00 43.02 43.01 1re3 s PHE 273 CO 0.00 -0.89 0.00 0.41 -0.05 0.00 0.00 175.22 174.69 1re3 n GLY 274 N -0.40 -2.57 3.49 1.99 0.00 -1.26 -1.16 105.19 105.28 1re3 n GLY 274 Ca -0.08 -2.07 -0.38 0.00 0.00 0.00 0.00 46.02 43.49 1re3 n GLY 274 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1re3 s ASN 275 N -2.70 5.57 0.06 1.61 0.01 0.16 -4.91 114.94 114.75 1re3 s ASN 275 Ca 0.00 -0.26 -0.22 0.00 -0.71 0.00 0.00 52.86 51.67 1re3 s ASN 275 Cb 0.00 -2.02 -0.13 0.00 0.41 0.00 0.00 41.25 39.52 1re3 s ASN 275 CO 0.00 -0.10 1.53 0.58 -1.51 0.00 0.00 177.10 177.60 1re3 h VAL 276 N 5.53 1.22 -2.97 1.60 2.07 -1.88 -3.00 116.25 118.82 1re3 h VAL 276 Ca -0.35 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 1re3 h VAL 276 Cb 1.17 1.43 -0.13 0.00 -1.52 0.00 0.00 31.29 32.25 1re3 h VAL 276 CO 0.58 0.20 0.16 0.00 0.02 0.00 0.00 177.57 178.54 1re3 s ALA 277 N -5.17 -1.51 0.15 1.67 0.00 -1.26 -1.62 121.76 114.02 1re3 s ALA 277 Ca -0.14 0.48 0.03 0.00 0.00 0.00 0.00 51.96 52.34 1re3 s ALA 277 Cb 0.06 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1re3 s ALA 277 CO 0.70 -0.71 -0.07 0.95 0.00 0.00 0.00 175.76 176.63 1re3 s THR 278 N -3.50 0.98 0.33 0.00 -4.23 -0.23 -4.82 115.64 104.16 1re3 s THR 278 Ca 0.00 -2.02 -0.28 0.00 -1.18 0.00 0.00 61.69 58.21 1re3 s THR 278 Cb -0.01 -1.89 -0.10 0.00 1.34 0.00 0.00 72.50 71.85 1re3 s THR 278 CO -0.11 -0.70 1.19 0.20 -0.54 0.00 0.00 174.62 174.66 1re3 s ASN 279 N -3.15 6.90 0.23 3.99 -0.87 -1.26 -2.95 114.94 117.82 1re3 s ASN 279 Ca 0.18 2.43 -0.14 0.00 -1.57 0.00 0.00 52.86 53.75 1re3 s ASN 279 Cb 0.04 -2.63 -0.08 0.00 -0.02 0.00 0.00 41.25 38.56 1re3 s ASN 279 CO 0.01 -0.42 0.63 -0.89 -2.57 0.00 0.00 177.10 173.85 1re3 s THR 280 N -1.23 4.78 0.00 1.60 2.01 -1.25 -4.89 115.64 116.66 1re3 s THR 280 Ca 0.49 0.85 0.00 0.00 0.31 0.00 0.00 61.69 63.34 1re3 s THR 280 Cb -0.34 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.47 1re3 s THR 280 CO 0.44 0.05 0.00 -0.90 -0.69 0.00 0.00 174.62 173.52 1re3 n ASP 281 N 0.25 0.00 0.00 3.53 5.68 -1.26 -1.10 116.55 123.66 1re3 n ASP 281 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.28 1re3 n ASP 281 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1re3 n ASP 281 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1re3 n GLY 282 N 0.00 0.72 3.65 6.12 0.00 -1.26 -5.11 105.19 109.31 1re3 n GLY 282 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1re3 n GLY 282 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1re3 n LYS 283 N -0.19 1.07 -0.80 1.61 4.01 -0.25 -4.92 118.16 118.69 1re3 n LYS 283 Ca 0.00 0.41 -0.16 0.00 -0.51 0.00 0.00 58.31 58.05 1re3 n LYS 283 Cb 0.07 -2.29 0.11 0.00 -0.51 0.00 0.00 35.03 32.41 1re3 n LYS 283 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1re3 n ASN 284 N -0.96 3.87 -3.74 4.39 0.23 -1.26 -4.44 115.26 113.36 1re3 n ASN 284 Ca 0.13 -3.04 -0.14 0.00 -0.53 0.00 0.00 54.58 51.01 1re3 n ASN 284 Cb 0.47 -0.75 -0.08 0.00 -2.08 0.00 0.00 39.78 37.33 1re3 n ASN 284 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1re3 s TYR 285 N -2.10 -0.23 -0.76 -2.53 -0.85 -1.26 -3.78 117.35 105.83 1re3 s TYR 285 Ca 0.36 0.36 -0.22 0.00 -0.52 0.00 0.00 57.07 57.06 1re3 s TYR 285 Cb 0.30 0.13 0.08 0.00 0.38 0.00 0.00 41.96 42.86 1re3 s TYR 285 CO 0.06 -0.41 1.06 0.00 -1.52 0.00 0.00 175.55 174.74 1re3 n GLY 287 N 5.49 -0.03 3.49 0.00 0.00 -1.18 -2.02 105.19 110.94 1re3 n GLY 287 Ca 0.07 -0.54 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 1re3 n GLY 287 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1re3 s LEU 288 N -2.34 3.06 0.57 0.99 1.43 -1.15 -4.52 118.68 116.71 1re3 s LEU 288 Ca 0.25 -0.15 -0.16 0.00 -1.03 0.00 0.00 54.13 53.04 1re3 s LEU 288 Cb 0.19 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.67 1re3 s LEU 288 CO 0.48 0.25 1.04 -2.16 0.23 0.00 0.00 176.35 176.18 1re3 s PRO 289 N -0.11 3.51 0.09 1.29 0.04 -1.26 -1.07 135.00 137.49 1re3 s PRO 289 Ca 0.01 1.15 0.01 0.00 0.04 0.00 0.00 61.00 62.21 1re3 s PRO 289 Cb -0.13 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.35 1re3 s PRO 289 CO 0.03 -0.65 0.08 0.41 0.04 0.00 0.00 177.00 176.90 1re3 n GLY 290 N -1.08 2.87 3.74 0.56 0.00 -0.64 -4.70 105.19 105.93 1re3 n GLY 290 Ca 0.08 -2.19 -0.38 0.00 0.00 0.00 0.00 46.02 43.54 1re3 n GLY 290 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1re3 s GLU 291 N -2.38 4.28 0.17 1.61 2.02 -1.15 -4.73 118.70 118.51 1re3 s GLU 291 Ca 0.06 0.36 -0.24 0.00 0.02 0.00 0.00 54.97 55.17 1re3 s GLU 291 Cb -0.00 -3.41 0.06 0.00 0.10 0.00 0.00 34.13 30.88 1re3 s GLU 291 CO 0.04 0.23 0.95 1.52 0.02 0.00 0.00 175.26 178.02 1re3 s TYR 292 N 0.40 -0.11 -0.15 1.61 1.13 -1.06 -0.66 117.35 118.51 1re3 s TYR 292 Ca 0.24 -0.22 -0.01 0.00 -1.41 0.00 0.00 57.07 55.67 1re3 s TYR 292 Cb -0.15 0.65 0.04 0.00 -1.10 0.00 0.00 41.96 41.41 1re3 s TYR 292 CO 0.09 -0.88 -0.05 -0.46 -2.51 0.00 0.00 175.55 171.75 1re3 s TRP 293 N -3.21 1.56 0.38 -3.49 -0.11 -0.31 -1.79 118.94 111.96 1re3 s TRP 293 Ca 0.13 -0.96 0.09 0.00 1.22 0.00 0.00 56.10 56.58 1re3 s TRP 293 Cb -0.02 -1.25 0.85 0.00 -1.50 0.00 0.00 33.47 31.55 1re3 s TRP 293 CO 0.03 -0.58 1.92 1.25 -4.62 0.00 0.00 176.95 174.94 1re3 h LEU 294 N 8.15 0.59 0.00 5.86 5.85 -1.46 -0.95 115.31 133.35 1re3 h LEU 294 Ca -0.24 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1re3 h LEU 294 Cb 1.12 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1re3 h LEU 294 CO 0.39 0.34 0.00 0.61 -0.34 0.00 0.00 178.44 179.43 1re3 n GLY 295 N -1.46 3.88 0.35 3.75 0.00 -1.26 -4.21 105.19 106.24 1re3 n GLY 295 Ca 0.14 -1.34 -0.03 0.00 0.00 0.00 0.00 46.02 44.79 1re3 n GLY 295 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1re3 h ASN 296 N 0.00 1.08 -0.22 1.61 -0.26 -0.73 0.11 115.58 117.16 1re3 h ASN 296 Ca 0.00 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.63 1re3 h ASN 296 Cb 0.00 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.98 1re3 h ASN 296 CO 0.00 0.87 0.12 0.44 -1.06 0.00 0.00 177.43 177.80 1re3 h ASP 297 N 1.20 0.29 -0.64 5.81 3.32 -1.77 -0.00 116.42 124.62 1re3 h ASP 297 Ca 0.30 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.17 1re3 h ASP 297 Cb 0.05 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1re3 h ASP 297 CO -0.05 0.31 0.10 0.11 -1.72 0.00 0.00 179.24 177.99 1re3 h LYS 298 N 0.24 1.08 -0.32 3.56 1.57 -1.72 -1.40 116.57 119.58 1re3 h LYS 298 Ca 0.08 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1re3 h LYS 298 Cb 0.09 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1re3 h LYS 298 CO -0.01 0.99 -0.01 0.82 -0.57 0.00 0.00 179.45 180.67 1re3 h ILE 299 N 1.01 1.26 0.06 1.86 2.04 -0.64 -1.17 117.51 121.92 1re3 h ILE 299 Ca 0.20 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.09 1re3 h ILE 299 Cb 0.44 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1re3 h ILE 299 CO 0.01 0.32 -0.14 -1.28 0.00 0.00 0.00 178.15 177.06 1re3 h SER 300 N 0.37 -0.39 -0.91 1.72 0.87 -0.82 -1.10 113.55 113.29 1re3 h SER 300 Ca 0.09 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1re3 h SER 300 Cb 0.46 0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.53 1re3 h SER 300 CO 0.02 -0.20 0.60 -0.61 -0.53 0.00 0.00 176.83 176.11 1re3 h GLN 301 N -0.26 1.21 -0.10 2.24 -0.00 -1.18 -2.17 115.11 114.84 1re3 h GLN 301 Ca 0.03 -0.08 -0.01 0.00 -0.00 0.00 0.00 58.65 58.59 1re3 h GLN 301 Cb 0.29 -0.27 -0.00 0.00 0.00 0.00 0.00 27.48 27.50 1re3 h GLN 301 CO -0.09 0.80 0.04 -0.07 0.00 0.00 0.00 178.83 179.51 1re3 h LEU 302 N 1.24 0.14 -1.65 -2.39 3.38 -0.85 -2.98 115.31 112.21 1re3 h LEU 302 Ca 0.33 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1re3 h LEU 302 Cb -0.13 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1re3 h LEU 302 CO -0.07 0.28 0.00 0.71 0.09 0.00 0.00 178.44 179.45 1re3 h THR 303 N -0.00 0.00 -0.09 0.22 1.35 -0.99 -2.89 112.91 110.51 1re3 h THR 303 Ca 0.03 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1re3 h THR 303 Cb 0.19 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1re3 h THR 303 CO -0.00 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.81 1re3 n ARG 304 N -2.86 2.18 0.23 4.72 5.12 -0.84 -4.10 116.66 121.11 1re3 n ARG 304 Ca -0.00 -1.72 0.11 0.00 -1.93 0.00 0.00 57.85 54.31 1re3 n ARG 304 Cb 0.22 -1.47 0.40 0.00 -1.16 0.00 0.00 32.46 30.45 1re3 n ARG 304 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 1re3 h MET 305 N 4.01 0.00 0.00 5.56 2.86 -1.41 -3.48 114.93 122.47 1re3 h MET 305 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1re3 h MET 305 Cb 0.86 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.52 1re3 h MET 305 CO 0.00 0.15 0.00 0.41 1.06 0.00 0.00 176.91 178.53 1re3 n GLY 306 N 0.47 -0.47 3.60 8.32 0.00 -1.26 -5.11 105.19 110.74 1re3 n GLY 306 Ca 0.01 -1.10 -0.49 0.00 0.00 0.00 0.00 46.02 44.44 1re3 n GLY 306 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1re3 n PRO 307 N -0.45 1.38 -4.35 1.61 -0.02 -1.26 -4.86 135.00 127.06 1re3 n PRO 307 Ca 0.00 0.50 -0.20 0.00 -2.02 0.00 0.00 63.50 61.78 1re3 n PRO 307 Cb 0.00 -2.10 -0.15 0.00 -0.02 0.00 0.00 33.50 31.23 1re3 n PRO 307 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1re3 s THR 308 N 0.21 0.72 0.25 3.45 2.01 -1.26 -0.81 115.64 120.21 1re3 s THR 308 Ca 0.77 -0.33 0.07 0.00 0.31 0.00 0.00 61.69 62.52 1re3 s THR 308 Cb -0.84 -0.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 1re3 s THR 308 CO 0.48 0.23 0.18 -1.83 -0.69 0.00 0.00 174.62 172.99 1re3 s GLU 309 N 0.22 2.89 -0.05 4.92 -1.05 -0.19 0.01 118.70 125.46 1re3 s GLU 309 Ca -0.03 -1.06 0.02 0.00 -0.15 0.00 0.00 54.97 53.74 1re3 s GLU 309 Cb -0.08 -2.54 0.01 0.00 -0.44 0.00 0.00 34.13 31.07 1re3 s GLU 309 CO 0.00 0.40 -0.09 -1.17 0.95 0.00 0.00 175.26 175.35 1re3 s LEU 310 N -3.78 1.59 -0.25 1.83 2.96 0.20 -2.01 118.68 119.21 1re3 s LEU 310 Ca 0.33 -0.22 -0.02 0.00 -0.22 0.00 0.00 54.13 54.00 1re3 s LEU 310 Cb -0.08 -0.66 0.03 0.00 0.50 0.00 0.00 46.19 45.98 1re3 s LEU 310 CO 0.24 0.02 -0.06 -0.22 -1.32 0.00 0.00 176.35 175.01 1re3 s LEU 311 N 0.62 3.24 -0.18 -0.68 2.96 0.19 -0.82 118.68 124.01 1re3 s LEU 311 Ca -0.11 -0.91 -0.06 0.00 -0.22 0.00 0.00 54.13 52.83 1re3 s LEU 311 Cb -0.14 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 1re3 s LEU 311 CO 0.02 -0.14 0.03 -0.63 -1.32 0.00 0.00 176.35 174.32 1re3 s ILE 312 N 1.32 4.45 0.07 6.68 1.01 -0.38 -1.10 121.20 133.24 1re3 s ILE 312 Ca -0.00 -0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.56 1re3 s ILE 312 Cb -0.17 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 1re3 s ILE 312 CO -0.04 0.45 -0.19 -1.61 0.00 0.00 0.00 174.94 173.55 1re3 s GLU 313 N 0.56 1.12 0.06 2.79 2.02 -0.85 -1.08 118.70 123.31 1re3 s GLU 313 Ca 0.01 -1.00 -0.15 0.00 0.02 0.00 0.00 54.97 53.85 1re3 s GLU 313 Cb -0.13 -1.26 0.03 0.00 0.10 0.00 0.00 34.13 32.86 1re3 s GLU 313 CO 0.02 0.30 0.34 0.00 0.02 0.00 0.00 175.26 175.94 1re3 s MET 314 N -1.55 0.89 -0.02 1.61 0.23 -1.09 -0.96 119.30 118.42 1re3 s MET 314 Ca 0.05 -0.54 -0.01 0.00 -1.03 0.00 0.00 55.69 54.16 1re3 s MET 314 Cb -0.09 0.39 0.01 0.00 -1.53 0.00 0.00 34.83 33.61 1re3 s MET 314 CO 0.03 -0.30 0.04 -2.00 -2.03 0.00 0.00 175.02 170.75 1re3 s GLU 315 N -2.87 0.02 0.73 3.16 2.12 0.14 -2.57 118.70 119.43 1re3 s GLU 315 Ca -0.03 0.11 -0.04 0.00 0.36 0.00 0.00 54.97 55.38 1re3 s GLU 315 Cb 0.00 -0.08 0.11 0.00 0.26 0.00 0.00 34.13 34.43 1re3 s GLU 315 CO -0.05 -0.07 1.01 0.16 -0.54 0.00 0.00 175.26 175.77 1re3 s ASP 316 N 0.42 4.39 0.00 -1.70 1.47 -0.52 -0.52 116.67 120.20 1re3 s ASP 316 Ca -0.03 -0.09 0.25 0.00 1.18 0.00 0.00 52.55 53.85 1re3 s ASP 316 Cb -0.05 -0.36 1.45 0.00 -0.34 0.00 0.00 42.92 43.62 1re3 s ASP 316 CO -0.01 -1.83 1.83 0.79 0.68 0.00 0.00 175.17 176.62 1re3 n TRP 317 N -2.90 0.00 0.65 2.11 7.02 -1.26 -1.99 117.44 121.06 1re3 n TRP 317 Ca 0.13 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.72 1re3 n TRP 317 Cb 0.60 -0.02 -0.06 0.00 -2.42 0.00 0.00 31.31 29.41 1re3 n TRP 317 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1re3 n LYS 318 N -1.02 0.23 0.00 -0.99 4.81 -1.26 -4.99 118.16 114.95 1re3 n LYS 318 Ca 0.18 -0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1re3 n LYS 318 Cb 0.09 -1.53 0.00 0.00 0.02 0.00 0.00 35.03 33.61 1re3 n LYS 318 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1re3 n GLY 319 N 1.41 0.30 3.86 3.14 0.00 -0.84 -5.09 105.19 107.97 1re3 n GLY 319 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 1re3 n GLY 319 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1re3 s ASP 320 N -2.34 6.63 0.08 1.61 1.01 -1.26 -4.84 116.67 117.56 1re3 s ASP 320 Ca 0.00 1.27 0.00 0.00 0.71 0.00 0.00 52.55 54.53 1re3 s ASP 320 Cb 0.00 -2.37 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 1re3 s ASP 320 CO 0.00 -0.37 -0.04 -1.59 0.21 0.00 0.00 175.17 173.38 1re3 s LYS 321 N -3.60 0.74 0.27 8.23 0.00 -1.26 -1.44 119.74 122.67 1re3 s LYS 321 Ca 0.54 -1.29 -0.04 0.00 0.00 0.00 0.00 55.97 55.17 1re3 s LYS 321 Cb -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 37.83 37.70 1re3 s LYS 321 CO 0.26 -0.07 0.35 0.14 0.00 0.00 0.00 175.35 176.03 1re3 s VAL 322 N -3.77 0.00 0.09 1.79 -7.23 -1.06 -5.03 120.40 105.19 1re3 s VAL 322 Ca 0.10 -1.70 -0.10 0.00 -1.81 0.00 0.00 61.98 58.47 1re3 s VAL 322 Cb 0.07 -2.45 0.01 0.00 0.56 0.00 0.00 36.38 34.56 1re3 s VAL 322 CO -0.07 0.00 0.23 -1.59 -0.31 0.00 0.00 175.10 173.36 1re3 s LYS 323 N -3.74 0.86 -0.15 4.82 -2.85 -1.26 -2.66 119.74 114.77 1re3 s LYS 323 Ca 0.32 -0.87 -0.02 0.00 -1.00 0.00 0.00 55.97 54.40 1re3 s LYS 323 Cb 0.02 0.36 0.04 0.00 -2.06 0.00 0.00 37.83 36.19 1re3 s LYS 323 CO 0.15 -0.28 0.01 0.00 0.10 0.00 0.00 175.35 175.32 1re3 s ALA 324 N -3.69 0.99 -0.11 0.59 0.00 -0.24 -0.56 121.76 118.75 1re3 s ALA 324 Ca 0.03 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 1re3 s ALA 324 Cb 0.04 -1.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.11 1re3 s ALA 324 CO -0.10 -0.85 0.04 -1.58 0.00 0.00 0.00 175.76 173.27 1re3 s HIS 325 N 1.86 3.28 -0.30 0.00 2.46 0.55 -1.25 115.29 121.89 1re3 s HIS 325 Ca 0.02 0.25 -0.00 0.00 0.47 0.00 0.00 55.06 55.80 1re3 s HIS 325 Cb -0.15 -1.86 0.09 0.00 -0.13 0.00 0.00 32.58 30.53 1re3 s HIS 325 CO -0.07 0.49 0.08 0.71 -2.47 0.00 0.00 174.74 173.48 1re3 s TYR 326 N -0.75 1.95 0.61 3.88 2.02 -0.00 -1.54 117.35 123.52 1re3 s TYR 326 Ca 0.12 -1.82 0.28 0.00 -0.37 0.00 0.00 57.07 55.29 1re3 s TYR 326 Cb -0.12 -1.79 1.46 0.00 -0.40 0.00 0.00 41.96 41.11 1re3 s TYR 326 CO 0.02 -0.86 1.87 0.78 -1.57 0.00 0.00 175.55 175.80 1re3 h GLY 327 N 8.03 0.00 -5.47 0.71 0.00 -0.95 0.59 103.07 105.99 1re3 h GLY 327 Ca -0.13 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.72 1re3 h GLY 327 CO 0.46 0.00 -0.81 -0.32 0.00 0.00 0.00 176.54 175.88 1re3 s GLY 328 N -3.82 0.68 -0.18 4.60 0.00 -1.08 -3.75 107.32 103.77 1re3 s GLY 328 Ca -0.04 -0.46 -0.09 0.00 0.00 0.00 0.00 44.72 44.13 1re3 s GLY 328 CO 0.48 -0.17 0.43 -0.12 0.00 0.00 0.00 173.10 173.72 1re3 s PHE 329 N 0.17 -0.67 -0.03 1.90 5.36 0.10 -2.05 117.98 122.77 1re3 s PHE 329 Ca -0.04 1.38 -0.04 0.00 -0.96 0.00 0.00 56.93 57.27 1re3 s PHE 329 Cb -0.10 0.29 0.01 0.00 -0.34 0.00 0.00 43.02 42.88 1re3 s PHE 329 CO 0.01 -0.38 0.10 0.99 -1.46 0.00 0.00 175.22 174.48 1re3 s THR 330 N 1.67 0.02 -0.13 0.12 2.01 0.27 -4.36 115.64 115.25 1re3 s THR 330 Ca -0.08 -0.20 -0.01 0.00 0.31 0.00 0.00 61.69 61.70 1re3 s THR 330 Cb -0.09 -0.22 0.04 0.00 0.01 0.00 0.00 72.50 72.24 1re3 s THR 330 CO -0.13 -0.11 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.99 1re3 s VAL 331 N -0.33 0.66 1.14 3.82 1.01 -1.26 -0.57 120.40 124.88 1re3 s VAL 331 Ca -0.04 -0.30 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 1re3 s VAL 331 Cb -0.03 -0.92 0.26 0.00 0.00 0.00 0.00 36.38 35.70 1re3 s VAL 331 CO 0.00 0.10 1.16 -1.10 0.00 0.00 0.00 175.10 175.26 1re3 s GLN 332 N 1.83 -0.73 1.01 2.72 -1.52 -0.28 -4.35 119.66 118.34 1re3 s GLN 332 Ca 0.02 -0.13 -0.17 0.00 -1.95 0.00 0.00 55.36 53.13 1re3 s GLN 332 Cb -0.14 -1.66 0.24 0.00 -0.22 0.00 0.00 33.01 31.22 1re3 s GLN 332 CO -0.07 -3.37 1.18 0.27 -0.25 0.00 0.00 175.29 173.05 1re3 n ASN 333 N -4.50 -0.63 -0.30 5.90 0.23 -1.26 -3.98 115.26 110.71 1re3 n ASN 333 Ca 0.13 -1.34 -0.02 0.00 -0.53 0.00 0.00 54.58 52.82 1re3 n ASN 333 Cb 0.59 -0.96 0.15 0.00 -2.08 0.00 0.00 39.78 37.48 1re3 n ASN 333 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1re3 h GLU 334 N 0.00 1.17 -0.32 -3.83 4.81 -1.93 -0.40 114.58 114.08 1re3 h GLU 334 Ca -0.40 -0.10 0.09 0.00 -0.13 0.00 0.00 59.36 58.82 1re3 h GLU 334 Cb 1.14 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1re3 h GLU 334 CO 0.28 0.82 0.32 0.00 -0.73 0.00 0.00 179.01 179.70 1re3 h ALA 335 N 1.38 2.02 -0.57 2.92 0.00 -2.04 0.93 119.26 123.91 1re3 h ALA 335 Ca 0.31 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.96 1re3 h ALA 335 Cb -0.05 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.61 1re3 h ALA 335 CO -0.06 -0.49 0.18 0.09 0.00 0.00 0.00 179.25 178.97 1re3 n ASN 336 N -3.85 3.40 -2.88 0.00 3.02 -0.44 -4.93 115.26 109.59 1re3 n ASN 336 Ca 0.05 -3.53 -0.16 0.00 -0.03 0.00 0.00 54.58 50.91 1re3 n ASN 336 Cb 0.48 -0.69 -0.01 0.00 -0.61 0.00 0.00 39.78 38.95 1re3 n ASN 336 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1re3 n LYS 337 N -0.88 -2.81 -3.75 3.52 5.02 0.32 -1.89 118.16 117.70 1re3 n LYS 337 Ca 0.40 0.46 -0.26 0.00 -2.02 0.00 0.00 58.31 56.88 1re3 n LYS 337 Cb 1.24 -5.09 0.05 0.00 -0.02 0.00 0.00 35.03 31.21 1re3 n LYS 337 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1re3 n TYR 338 N -3.51 -2.40 -1.70 2.13 4.01 -0.29 -1.36 117.16 114.04 1re3 n TYR 338 Ca -0.07 0.93 -0.44 0.00 -0.16 0.00 0.00 57.90 58.17 1re3 n TYR 338 Cb 0.56 -4.44 -0.03 0.00 -0.31 0.00 0.00 39.34 35.13 1re3 n TYR 338 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1re3 n GLN 339 N -4.67 2.40 -3.83 -0.72 7.27 -0.79 -4.19 117.38 112.85 1re3 n GLN 339 Ca -0.05 0.86 -0.33 0.00 0.07 0.00 0.00 57.00 57.55 1re3 n GLN 339 Cb 0.57 -2.61 -0.05 0.00 2.41 0.00 0.00 30.24 30.56 1re3 n GLN 339 CO 0.00 0.00 0.00 -1.50 0.07 0.00 0.00 177.06 175.63 1re3 s ILE 340 N 0.37 5.36 -0.05 1.69 2.07 -0.70 -1.13 121.20 128.81 1re3 s ILE 340 Ca 0.70 -0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.87 1re3 s ILE 340 Cb -0.58 -3.57 0.03 0.00 0.13 0.00 0.00 42.46 38.47 1re3 s ILE 340 CO 0.44 0.28 0.08 -0.55 -1.91 0.00 0.00 174.94 173.29 1re3 s SER 341 N -1.98 0.51 0.01 4.50 0.15 0.27 -1.11 113.70 116.04 1re3 s SER 341 Ca 0.30 0.15 -0.00 0.00 0.70 0.00 0.00 55.95 57.10 1re3 s SER 341 Cb -0.13 0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.19 1re3 s SER 341 CO 0.20 -0.19 -0.02 0.68 1.20 0.00 0.00 173.24 175.11 1re3 s VAL 342 N 1.67 0.07 0.25 4.45 -7.23 -1.26 -0.56 120.40 117.78 1re3 s VAL 342 Ca -0.02 -0.54 -0.05 0.00 -1.81 0.00 0.00 61.98 59.56 1re3 s VAL 342 Cb -0.12 -0.16 0.02 0.00 0.56 0.00 0.00 36.38 36.68 1re3 s VAL 342 CO -0.04 -0.30 0.41 -0.46 -0.31 0.00 0.00 175.10 174.41 1re3 n ASN 343 N 2.20 -1.17 -3.55 4.85 0.23 -0.87 -4.94 115.26 112.00 1re3 n ASN 343 Ca -0.19 -2.20 -0.25 0.00 -0.53 0.00 0.00 54.58 51.41 1re3 n ASN 343 Cb 0.57 2.07 0.05 0.00 -2.08 0.00 0.00 39.78 40.39 1re3 n ASN 343 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1re3 n LYS 344 N -0.38 -2.14 -2.56 -3.83 5.02 -1.26 -2.63 118.16 110.38 1re3 n LYS 344 Ca -0.02 0.61 -0.33 0.00 -2.02 0.00 0.00 58.31 56.55 1re3 n LYS 344 Cb 0.40 -4.82 -0.05 0.00 -0.02 0.00 0.00 35.03 30.54 1re3 n LYS 344 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1re3 s TYR 345 N -3.48 3.28 -0.21 2.13 5.04 -1.26 -1.12 117.35 121.73 1re3 s TYR 345 Ca 0.39 1.55 -0.28 0.00 -2.44 0.00 0.00 57.07 56.29 1re3 s TYR 345 Cb -0.11 -2.88 0.13 0.00 0.35 0.00 0.00 41.96 39.45 1re3 s TYR 345 CO 0.82 -0.40 1.02 -0.98 -1.34 0.00 0.00 175.55 174.66 1re3 s ARG 346 N -3.57 0.55 0.00 4.97 1.70 -0.59 -4.98 118.95 117.03 1re3 s ARG 346 Ca 0.62 0.33 0.00 0.00 -0.47 0.00 0.00 55.73 56.21 1re3 s ARG 346 Cb -0.11 0.26 0.00 0.00 -0.57 0.00 0.00 34.95 34.53 1re3 s ARG 346 CO 0.22 -0.13 0.00 0.41 -1.08 0.00 0.00 175.30 174.72 1re3 n GLY 347 N 1.36 0.18 0.00 3.88 0.00 -1.26 -0.33 105.19 109.02 1re3 n GLY 347 Ca -0.11 -1.59 0.01 0.00 0.00 0.00 0.00 46.02 44.33 1re3 n GLY 347 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1re3 n THR 348 N 9.00 0.00 0.50 2.61 -2.24 0.23 -4.68 114.28 119.70 1re3 n THR 348 Ca 0.00 -0.17 0.13 0.00 -2.27 0.00 0.00 64.05 61.73 1re3 n THR 348 Cb 0.00 0.63 0.45 0.00 -2.10 0.00 0.00 70.33 69.31 1re3 n THR 348 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1re3 n ALA 349 N -1.40 1.98 0.00 6.98 0.00 0.28 -4.75 120.51 123.60 1re3 n ALA 349 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1re3 n ALA 349 Cb 0.04 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.05 1re3 n ALA 349 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1re3 n GLY 350 N 0.66 0.24 2.61 0.00 0.00 -1.26 -3.62 105.19 103.83 1re3 n GLY 350 Ca 0.04 -1.31 -0.23 0.00 0.00 0.00 0.00 46.02 44.52 1re3 n GLY 350 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1re3 n ASN 351 N -0.21 5.01 -0.32 1.61 4.05 -1.26 -4.69 115.26 119.46 1re3 n ASN 351 Ca 0.00 -2.33 0.07 0.00 0.45 0.00 0.00 54.58 52.77 1re3 n ASN 351 Cb 0.00 -1.11 0.27 0.00 1.23 0.00 0.00 39.78 40.17 1re3 n ASN 351 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1re3 h ALA 352 N 6.30 1.59 -0.59 5.20 0.00 -1.86 -1.46 119.26 128.44 1re3 h ALA 352 Ca 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.37 1re3 h ALA 352 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1re3 h ALA 352 CO 1.46 0.20 0.17 -0.07 0.00 0.00 0.00 179.25 181.01 1re3 h LEU 353 N 0.94 0.87 0.05 0.00 3.38 -1.89 -2.44 115.31 116.21 1re3 h LEU 353 Ca 0.45 -0.22 -0.34 0.00 0.09 0.00 0.00 57.88 57.86 1re3 h LEU 353 Cb 0.44 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1re3 h LEU 353 CO -0.21 0.86 -2.01 0.23 0.09 0.00 0.00 178.44 177.39 1re3 n MET 354 N -4.40 0.69 0.00 1.13 2.81 -1.10 -0.81 117.12 115.44 1re3 n MET 354 Ca 0.03 0.22 0.08 0.00 -1.81 0.00 0.00 57.70 56.22 1re3 n MET 354 Cb 0.22 -1.69 -0.05 0.00 -0.71 0.00 0.00 33.22 30.99 1re3 n MET 354 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1re3 n ASP 355 N -3.20 1.15 0.00 7.83 8.00 -0.57 -4.84 116.55 124.91 1re3 n ASP 355 Ca -0.29 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.14 1re3 n ASP 355 Cb 1.06 0.75 0.00 0.00 -0.02 0.00 0.00 41.12 42.91 1re3 n ASP 355 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1re3 n GLY 356 N 1.26 -2.41 3.71 0.44 0.00 -0.92 -4.72 105.19 102.55 1re3 n GLY 356 Ca 0.05 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 1re3 n GLY 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1re3 s ALA 357 N -1.01 3.71 0.19 4.61 0.00 -1.26 -4.55 121.76 123.44 1re3 s ALA 357 Ca 0.00 1.25 0.35 0.00 0.00 0.00 0.00 51.96 53.56 1re3 s ALA 357 Cb 0.00 -3.63 1.61 0.00 0.00 0.00 0.00 23.12 21.09 1re3 s ALA 357 CO 0.00 -0.87 2.05 0.66 0.00 0.00 0.00 175.76 177.60 1re3 h SER 358 N 7.38 0.00 1.68 0.00 4.64 -1.89 -2.58 113.55 122.78 1re3 h SER 358 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1re3 h SER 358 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1re3 h SER 358 CO 0.91 0.00 0.00 1.56 -0.87 0.00 0.00 176.83 178.43 1re3 h GLN 359 N 0.00 0.00 -6.57 4.77 7.50 -1.91 -3.45 115.11 115.45 1re3 h GLN 359 Ca 0.00 0.00 -0.44 0.00 0.50 0.00 0.00 58.65 58.71 1re3 h GLN 359 Cb 0.36 0.00 0.03 0.00 0.05 0.00 0.00 27.48 27.91 1re3 h GLN 359 CO 0.00 0.00 -0.19 -0.51 -1.50 0.00 0.00 178.83 176.63 1re3 s LEU 360 N -6.14 3.62 0.05 1.46 1.43 -0.97 -5.12 118.68 113.01 1re3 s LEU 360 Ca 0.05 -0.14 -0.03 0.00 -1.03 0.00 0.00 54.13 52.99 1re3 s LEU 360 Cb 0.06 -2.82 -0.03 0.00 0.03 0.00 0.00 46.19 43.43 1re3 s LEU 360 CO 0.63 -0.79 0.02 -0.04 0.23 0.00 0.00 176.35 176.40 1re3 s MET 361 N -4.46 0.64 7.58 1.70 -1.94 -1.26 -4.79 119.30 116.76 1re3 s MET 361 Ca 0.52 -1.11 0.00 0.00 -1.71 0.00 0.00 55.69 53.39 1re3 s MET 361 Cb -0.10 0.23 0.00 0.00 2.01 0.00 0.00 34.83 36.97 1re3 s MET 361 CO 0.35 -0.14 0.00 0.41 -0.01 0.00 0.00 175.02 175.63 1re3 n GLY 362 N 0.19 3.26 0.18 -0.03 0.00 -1.26 -3.20 105.19 104.33 1re3 n GLY 362 Ca -0.15 -0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.51 1re3 n GLY 362 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1re3 h GLU 363 N 0.00 0.58 -0.58 1.61 4.81 -1.99 -2.73 114.58 116.28 1re3 h GLU 363 Ca 0.00 -0.55 0.17 0.00 -0.13 0.00 0.00 59.36 58.85 1re3 h GLU 363 Cb 0.00 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1re3 h GLU 363 CO 0.00 1.17 0.57 -0.91 -0.73 0.00 0.00 179.01 179.11 1re3 h ASN 364 N 0.20 0.00 0.00 1.04 2.35 -1.97 -1.43 115.58 115.76 1re3 h ASN 364 Ca -0.07 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.62 1re3 h ASN 364 Cb 1.37 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.73 1re3 h ASN 364 CO 0.14 0.00 -0.40 -0.09 -1.65 0.00 0.00 177.43 175.43 1re3 h ARG 365 N 0.00 0.00 -0.63 0.81 2.43 -1.54 -3.36 114.38 112.09 1re3 h ARG 365 Ca 0.27 0.00 0.18 0.00 -0.81 0.00 0.00 59.98 59.63 1re3 h ARG 365 Cb 1.41 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.94 1re3 h ARG 365 CO -0.00 0.62 0.47 1.79 -1.51 0.00 0.00 179.97 181.34 1re3 h THR 366 N -1.00 0.62 0.00 0.20 1.35 -1.00 0.21 112.91 113.30 1re3 h THR 366 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1re3 h THR 366 Cb 0.78 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1re3 h THR 366 CO -0.05 0.00 0.00 1.15 -0.25 0.00 0.00 175.52 176.37 1re3 n MET 367 N -4.25 0.91 -0.31 4.72 0.00 -0.63 -2.58 117.12 114.98 1re3 n MET 367 Ca 0.12 0.00 0.07 0.00 0.00 0.00 0.00 57.70 57.89 1re3 n MET 367 Cb 0.72 -1.48 0.21 0.00 0.00 0.00 0.00 33.22 32.68 1re3 n MET 367 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1re3 n THR 368 N -0.98 1.44 -2.85 3.17 -2.24 0.75 -0.64 114.28 112.93 1re3 n THR 368 Ca 0.21 -1.26 -0.41 0.00 -2.27 0.00 0.00 64.05 60.32 1re3 n THR 368 Cb 0.10 0.26 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 1re3 n THR 368 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1re3 s ILE 369 N -1.59 4.73 -0.12 2.28 1.01 -1.07 -2.98 121.20 123.47 1re3 s ILE 369 Ca 0.33 1.84 0.17 0.00 0.00 0.00 0.00 60.65 62.98 1re3 s ILE 369 Cb 0.21 -4.21 -0.21 0.00 0.01 0.00 0.00 42.46 38.25 1re3 s ILE 369 CO 0.16 0.29 0.54 1.41 0.00 0.00 0.00 174.94 177.34 1re3 n HIS 370 N 3.15 0.62 -1.66 3.97 8.25 -0.54 -4.57 115.22 124.45 1re3 n HIS 370 Ca 0.01 0.21 -0.47 0.00 -0.26 0.00 0.00 57.72 57.21 1re3 n HIS 370 Cb 0.50 -1.03 -0.04 0.00 1.12 0.00 0.00 29.99 30.54 1re3 n HIS 370 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1re3 n ASN 371 N -2.83 2.79 0.00 0.41 5.15 0.00 -1.15 115.26 119.65 1re3 n ASN 371 Ca -0.17 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 54.90 1re3 n ASN 371 Cb 0.95 -1.39 0.00 0.00 -0.53 0.00 0.00 39.78 38.82 1re3 n ASN 371 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1re3 n GLY 372 N 3.09 2.47 3.78 8.20 0.00 -0.26 -5.03 105.19 117.44 1re3 n GLY 372 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1re3 n GLY 372 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1re3 s MET 373 N -0.44 2.41 0.48 1.61 -1.94 -0.30 -4.65 119.30 116.47 1re3 s MET 373 Ca 0.00 1.04 0.02 0.00 -1.71 0.00 0.00 55.69 55.04 1re3 s MET 373 Cb 0.00 -1.92 0.01 0.00 2.01 0.00 0.00 34.83 34.93 1re3 s MET 373 CO 0.00 -1.50 0.68 -0.06 -0.01 0.00 0.00 175.02 174.14 1re3 s PHE 374 N -2.97 3.01 0.16 -0.03 0.08 -1.26 -1.72 117.98 115.25 1re3 s PHE 374 Ca 0.60 0.01 -0.18 0.00 0.12 0.00 0.00 56.93 57.48 1re3 s PHE 374 Cb -0.16 -2.48 -0.07 0.00 -0.57 0.00 0.00 43.02 39.74 1re3 s PHE 374 CO 0.56 -0.55 0.63 0.12 -0.10 0.00 0.00 175.22 175.88 1re3 s PHE 375 N -2.58 3.69 0.03 0.36 5.36 -0.46 -3.87 117.98 120.51 1re3 s PHE 375 Ca 0.53 1.27 0.01 0.00 -0.96 0.00 0.00 56.93 57.77 1re3 s PHE 375 Cb -0.10 -2.52 -0.02 0.00 -0.34 0.00 0.00 43.02 40.04 1re3 s PHE 375 CO 0.37 0.44 -0.05 -1.12 -1.46 0.00 0.00 175.22 173.39 1re3 s SER 376 N -1.52 0.57 0.09 6.13 0.01 -0.25 -4.43 113.70 114.31 1re3 s SER 376 Ca 0.38 -0.57 0.02 0.00 1.31 0.00 0.00 55.95 57.09 1re3 s SER 376 Cb -0.17 0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.09 1re3 s SER 376 CO 0.20 -0.28 -0.07 0.42 0.41 0.00 0.00 173.24 173.93 1re3 s THR 377 N -1.62 0.69 0.32 1.44 -4.23 -0.80 -1.80 115.64 109.65 1re3 s THR 377 Ca -0.11 -1.79 0.27 0.00 -1.18 0.00 0.00 61.69 58.88 1re3 s THR 377 Cb -0.09 -1.50 0.27 0.00 1.34 0.00 0.00 72.50 72.52 1re3 s THR 377 CO -0.01 -0.78 1.81 0.10 -0.54 0.00 0.00 174.62 175.20 1re3 h TYR 378 N 3.23 0.00 -0.42 3.99 -0.00 -1.79 0.19 116.97 122.17 1re3 h TYR 378 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.38 1re3 h TYR 378 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.90 1re3 h TYR 378 CO 0.60 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 178.36 1re3 n ASP 379 N -2.59 3.13 -3.29 0.10 5.75 -1.26 -4.78 116.55 113.61 1re3 n ASP 379 Ca -0.02 -1.97 -0.09 0.00 -0.01 0.00 0.00 54.79 52.70 1re3 n ASP 379 Cb 0.23 -0.28 -0.05 0.00 -1.03 0.00 0.00 41.12 39.99 1re3 n ASP 379 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1re3 s ARG 380 N -1.01 0.65 -0.45 0.11 6.06 0.68 -4.91 118.95 120.07 1re3 s ARG 380 Ca 0.29 -0.43 -0.26 0.00 -2.50 0.00 0.00 55.73 52.83 1re3 s ARG 380 Cb 0.15 -0.35 0.03 0.00 0.06 0.00 0.00 34.95 34.84 1re3 s ARG 380 CO 0.20 -1.16 0.94 0.34 -2.50 0.00 0.00 175.30 173.13 1re3 s ASP 381 N 1.83 6.52 -0.10 -2.12 2.15 -1.25 -1.90 116.67 121.80 1re3 s ASP 381 Ca 0.15 0.18 0.16 0.00 0.43 0.00 0.00 52.55 53.48 1re3 s ASP 381 Cb -0.11 -2.46 0.37 0.00 -0.30 0.00 0.00 42.92 40.42 1re3 s ASP 381 CO -0.11 -1.05 1.17 0.59 -0.17 0.00 0.00 175.17 175.61 1re3 n ASN 382 N 7.19 1.35 -3.92 -0.34 3.02 -1.26 -5.06 115.26 116.24 1re3 n ASN 382 Ca 0.07 -2.93 -0.30 0.00 -0.03 0.00 0.00 54.58 51.39 1re3 n ASN 382 Cb 0.48 -0.40 0.22 0.00 -0.61 0.00 0.00 39.78 39.47 1re3 n ASN 382 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 1re3 s ASP 383 N -2.53 2.01 0.00 6.41 1.47 -1.26 -4.41 116.67 118.36 1re3 s ASP 383 Ca 0.32 0.38 0.28 0.00 1.18 0.00 0.00 52.55 54.71 1re3 s ASP 383 Cb 0.33 -0.47 1.08 0.00 -0.34 0.00 0.00 42.92 43.53 1re3 s ASP 383 CO -0.09 -3.43 1.76 0.61 0.68 0.00 0.00 175.17 174.70 1re3 n GLY 384 N -2.55 -0.21 3.47 2.12 0.00 0.16 -4.61 105.19 103.56 1re3 n GLY 384 Ca 0.15 -0.41 -0.44 0.00 0.00 0.00 0.00 46.02 45.32 1re3 n GLY 384 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1re3 s TRP 385 N -2.10 3.23 0.66 1.61 -0.00 -1.12 -4.85 118.94 116.38 1re3 s TRP 385 Ca 0.36 -1.67 -0.14 0.00 -0.00 0.00 0.00 56.10 54.66 1re3 s TRP 385 Cb 0.21 -4.33 0.00 0.00 -0.00 0.00 0.00 33.47 29.35 1re3 s TRP 385 CO 0.37 -1.48 1.09 -0.51 -0.00 0.00 0.00 176.95 176.41 1re3 s LEU 386 N 2.41 3.33 0.00 5.86 1.43 -1.26 -4.94 118.68 125.50 1re3 s LEU 386 Ca 0.38 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1re3 s LEU 386 Cb -0.03 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.65 1re3 s LEU 386 CO -0.05 -1.54 0.00 1.07 0.23 0.00 0.00 176.35 176.05 1re3 n THR 387 N -2.59 0.00 -2.45 5.49 5.66 -1.26 -4.99 114.28 114.14 1re3 n THR 387 Ca 0.09 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.13 1re3 n THR 387 Cb 0.53 0.00 0.02 0.00 -1.55 0.00 0.00 70.33 69.32 1re3 n THR 387 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1re3 n SER 388 N 0.44 0.90 -4.46 1.09 3.41 -1.26 -5.04 113.62 108.69 1re3 n SER 388 Ca 0.00 -2.00 -0.43 0.00 -0.26 0.00 0.00 58.87 56.18 1re3 n SER 388 Cb 0.00 -0.29 -0.07 0.00 -0.26 0.00 0.00 64.21 63.60 1re3 n SER 388 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1re3 s ASP 389 N -1.90 6.24 0.53 4.04 -1.08 -1.26 -4.95 116.67 118.29 1re3 s ASP 389 Ca 0.31 -0.77 0.20 0.00 -0.52 0.00 0.00 52.55 51.76 1re3 s ASP 389 Cb 0.35 -2.29 1.38 0.00 -1.46 0.00 0.00 42.92 40.91 1re3 s ASP 389 CO -0.15 -0.84 2.15 1.55 0.52 0.00 0.00 175.17 178.40 1re3 h PRO 390 N 8.94 0.00 -0.01 4.34 0.13 -2.03 -2.13 132.00 141.24 1re3 h PRO 390 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1re3 h PRO 390 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1re3 h PRO 390 CO 0.93 0.00 -0.46 0.54 -0.23 0.00 0.00 178.00 178.79 1re3 n ARG 391 N -4.39 0.59 -3.44 0.86 1.74 -1.26 -4.56 116.66 106.20 1re3 n ARG 391 Ca -0.01 -0.40 -0.30 0.00 -0.77 0.00 0.00 57.85 56.37 1re3 n ARG 391 Cb 0.15 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.03 1re3 n ARG 391 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1re3 n LYS 392 N -0.86 2.74 -4.48 5.56 5.02 -0.80 -5.03 118.16 120.30 1re3 n LYS 392 Ca 0.09 -4.62 -0.24 0.00 -2.02 0.00 0.00 58.31 51.51 1re3 n LYS 392 Cb 0.36 -2.31 -0.10 0.00 -0.02 0.00 0.00 35.03 32.96 1re3 n LYS 392 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1re3 s GLN 393 N -2.32 1.70 0.17 1.97 -0.21 -1.26 -4.78 119.66 114.94 1re3 s GLN 393 Ca 0.36 -1.81 -0.10 0.00 0.02 0.00 0.00 55.36 53.83 1re3 s GLN 393 Cb 0.09 -1.72 0.05 0.00 1.00 0.00 0.00 33.01 32.43 1re3 s GLN 393 CO -0.02 0.27 1.62 0.00 -2.12 0.00 0.00 175.29 175.04 1re3 s SER 395 N -6.56 5.47 0.41 0.00 0.15 -1.26 -5.04 113.70 106.87 1re3 s SER 395 Ca -0.12 -0.40 0.01 0.00 0.70 0.00 0.00 55.95 56.14 1re3 s SER 395 Cb 0.13 -1.99 0.01 0.00 -1.71 0.00 0.00 66.02 62.46 1re3 s SER 395 CO 0.85 -0.14 0.06 0.29 1.20 0.00 0.00 173.24 175.51 1re3 n LYS 396 N 4.97 0.99 -1.56 5.44 5.02 -1.26 -4.05 118.16 127.72 1re3 n LYS 396 Ca -0.14 -2.89 -0.49 0.00 -2.02 0.00 0.00 58.31 52.76 1re3 n LYS 396 Cb 0.50 0.69 -0.04 0.00 -0.02 0.00 0.00 35.03 36.16 1re3 n LYS 396 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1re3 n GLU 397 N -1.10 0.98 0.00 1.97 2.13 -1.26 -0.12 120.64 123.24 1re3 n GLU 397 Ca -0.14 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.03 1re3 n GLU 397 Cb 0.51 -1.78 0.00 0.00 0.27 0.00 0.00 31.44 30.44 1re3 n GLU 397 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1re3 n ALA 398 N 1.16 0.00 -1.81 4.31 0.00 -1.26 -4.97 120.51 117.94 1re3 n ALA 398 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.27 1re3 n ALA 398 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 1re3 n ALA 398 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1re3 s GLY 399 N -1.86 2.14 0.70 0.00 0.00 0.83 -4.03 107.32 105.09 1re3 s GLY 399 Ca 0.00 0.27 -0.08 0.00 0.00 0.00 0.00 44.72 44.91 1re3 s GLY 399 CO 0.00 0.55 1.03 -0.32 0.00 0.00 0.00 173.10 174.36 1re3 s GLY 400 N -2.85 1.65 0.08 0.20 0.00 -1.22 -4.17 107.32 101.01 1re3 s GLY 400 Ca 0.60 -0.76 -0.23 0.00 0.00 0.00 0.00 44.72 44.34 1re3 s GLY 400 CO 0.29 -0.37 0.69 -0.32 0.00 0.00 0.00 173.10 173.39 1re3 s GLY 401 N -4.46 2.78 0.28 0.20 0.00 -1.25 -4.74 107.32 100.12 1re3 s GLY 401 Ca 0.59 0.21 -0.20 0.00 0.00 0.00 0.00 44.72 45.32 1re3 s GLY 401 CO 0.46 0.82 0.84 0.86 0.00 0.00 0.00 173.10 176.08 1re3 s TRP 402 N -0.68 -0.02 -1.25 1.90 -0.00 -0.74 -4.70 118.94 113.44 1re3 s TRP 402 Ca 0.34 -0.49 -0.07 0.00 -0.00 0.00 0.00 56.10 55.88 1re3 s TRP 402 Cb -0.21 0.75 0.18 0.00 -0.00 0.00 0.00 33.47 34.19 1re3 s TRP 402 CO 0.22 -1.24 1.98 0.91 -0.00 0.00 0.00 176.95 178.81 1re3 n TRP 403 N -0.53 2.72 -1.85 5.86 8.01 -1.26 -1.09 117.44 129.31 1re3 n TRP 403 Ca -0.06 -2.75 -0.35 0.00 -1.31 0.00 0.00 57.50 53.03 1re3 n TRP 403 Cb 0.60 -1.78 0.05 0.00 -2.01 0.00 0.00 31.31 28.16 1re3 n TRP 403 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 1re3 s TYR 404 N -0.74 2.38 0.00 -5.99 2.02 -1.25 -4.67 117.35 109.10 1re3 s TYR 404 Ca 0.43 1.55 0.00 0.00 -0.37 0.00 0.00 57.07 58.67 1re3 s TYR 404 Cb 0.12 -3.40 0.00 0.00 -0.40 0.00 0.00 41.96 38.28 1re3 s TYR 404 CO -0.02 -2.15 0.00 -1.71 -1.57 0.00 0.00 175.55 170.10 1re3 n ASN 405 N -2.00 0.00 -2.80 2.29 2.85 -1.26 -4.08 115.26 110.26 1re3 n ASN 405 Ca 0.13 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.49 1re3 n ASN 405 Cb 0.50 0.00 0.07 0.00 1.24 0.00 0.00 39.78 41.59 1re3 n ASN 405 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1re3 n ARG 406 N 0.00 1.03 -0.02 1.20 0.63 0.18 -0.66 116.66 119.02 1re3 n ARG 406 Ca 0.00 -2.19 -0.03 0.00 -0.92 0.00 0.00 57.85 54.71 1re3 n ARG 406 Cb 0.00 -1.06 -0.01 0.00 0.45 0.00 0.00 32.46 31.84 1re3 n ARG 406 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1re3 s HIS 408 N -2.06 -0.53 -0.06 0.00 -3.43 -1.26 -4.56 115.29 103.39 1re3 s HIS 408 Ca -0.04 0.60 0.07 0.00 -0.80 0.00 0.00 55.06 54.89 1re3 s HIS 408 Cb 0.01 0.50 -0.10 0.00 -1.43 0.00 0.00 32.58 31.56 1re3 s HIS 408 CO 0.06 -0.67 0.06 0.00 -2.00 0.00 0.00 174.74 172.20 1re3 n ALA 409 N 0.18 1.93 -3.10 -1.38 0.00 -1.16 -4.88 120.51 112.10 1re3 n ALA 409 Ca -0.16 -0.41 -0.12 0.00 0.00 0.00 0.00 53.44 52.75 1re3 n ALA 409 Cb 0.61 0.01 -0.11 0.00 0.00 0.00 0.00 19.45 19.96 1re3 n ALA 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1re3 s ALA 410 N -2.27 -0.45 -0.37 0.00 0.00 -1.26 -0.97 121.76 116.44 1re3 s ALA 410 Ca -0.03 0.27 0.04 0.00 0.00 0.00 0.00 51.96 52.23 1re3 s ALA 410 Cb 0.03 -0.12 0.16 0.00 0.00 0.00 0.00 23.12 23.18 1re3 s ALA 410 CO 0.31 -0.15 0.40 1.21 0.00 0.00 0.00 175.76 177.53 1re3 s ASN 411 N -0.60 0.85 0.55 0.00 3.84 0.16 -4.96 114.94 114.78 1re3 s ASN 411 Ca -0.07 -1.45 0.32 0.00 0.21 0.00 0.00 52.86 51.86 1re3 s ASN 411 Cb -0.04 0.73 1.53 0.00 -0.55 0.00 0.00 41.25 42.92 1re3 s ASN 411 CO 0.01 -0.25 2.07 -0.65 -2.79 0.00 0.00 177.10 175.49 1re3 h PRO 412 N 7.09 0.00 -0.95 0.43 0.11 -1.88 -2.41 132.00 134.40 1re3 h PRO 412 Ca 0.04 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.75 1re3 h PRO 412 Cb 1.07 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 31.94 1re3 h PRO 412 CO 0.19 0.08 0.51 0.09 -0.21 0.00 0.00 178.00 178.66 1re3 n ASN 413 N -3.36 3.90 -4.33 -2.05 3.02 -1.26 -4.88 115.26 106.31 1re3 n ASN 413 Ca -0.01 -3.36 -0.27 0.00 -0.03 0.00 0.00 54.58 50.90 1re3 n ASN 413 Cb 0.25 -0.79 0.16 0.00 -0.61 0.00 0.00 39.78 38.79 1re3 n ASN 413 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1re3 s GLY 414 N -1.02 1.78 0.34 7.41 0.00 -1.10 -3.41 107.32 111.32 1re3 s GLY 414 Ca 0.51 -1.46 -0.28 0.00 0.00 0.00 0.00 44.72 43.48 1re3 s GLY 414 CO 0.11 -0.76 1.32 0.50 0.00 0.00 0.00 173.10 174.26 1re3 s ARG 415 N -5.60 4.30 -0.93 2.90 1.81 0.15 -4.37 118.95 117.21 1re3 s ARG 415 Ca 0.71 2.23 -0.20 0.00 -1.72 0.00 0.00 55.73 56.76 1re3 s ARG 415 Cb -0.04 -3.03 0.11 0.00 -0.45 0.00 0.00 34.95 31.54 1re3 s ARG 415 CO 0.50 -0.24 1.19 -0.47 -0.68 0.00 0.00 175.30 175.59 1re3 s TYR 416 N -1.15 2.97 -0.14 -0.53 5.04 -1.26 -2.55 117.35 119.72 1re3 s TYR 416 Ca 0.50 -1.22 -0.28 0.00 -2.44 0.00 0.00 57.07 53.63 1re3 s TYR 416 Cb -0.40 -4.37 -0.01 0.00 0.35 0.00 0.00 41.96 37.53 1re3 s TYR 416 CO 0.53 -1.60 0.94 0.71 -1.34 0.00 0.00 175.55 174.80 1re3 s TYR 417 N 3.26 3.47 0.30 4.97 1.51 -1.26 -4.96 117.35 124.63 1re3 s TYR 417 Ca 0.35 1.46 -0.29 0.00 -1.01 0.00 0.00 57.07 57.58 1re3 s TYR 417 Cb -0.04 -3.13 -0.10 0.00 -0.11 0.00 0.00 41.96 38.58 1re3 s TYR 417 CO -0.08 -0.24 1.20 -0.46 -1.11 0.00 0.00 175.55 174.85 1re3 s TRP 418 N 2.13 3.33 0.00 2.71 -0.11 -1.26 -3.34 118.94 122.40 1re3 s TRP 418 Ca 0.44 1.55 0.00 0.00 1.22 0.00 0.00 56.10 59.31 1re3 s TRP 418 Cb -0.17 -3.47 0.00 0.00 -1.50 0.00 0.00 33.47 28.33 1re3 s TRP 418 CO 0.15 -1.18 0.00 0.41 -4.62 0.00 0.00 176.95 171.71 1re3 n GLY 419 N 1.11 2.93 0.70 5.86 0.00 -1.26 -4.76 105.19 109.77 1re3 n GLY 419 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1re3 n GLY 419 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1re3 n GLY 420 N -2.00 1.99 3.73 -0.02 0.00 -1.21 -4.77 105.19 102.91 1re3 n GLY 420 Ca 0.00 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 1re3 n GLY 420 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1re3 s GLN 421 N 0.00 4.22 0.09 1.61 2.00 -1.26 -0.14 119.66 126.18 1re3 s GLN 421 Ca 0.00 2.38 -0.06 0.00 -2.00 0.00 0.00 55.36 55.67 1re3 s GLN 421 Cb 0.00 -3.12 -0.01 0.00 0.80 0.00 0.00 33.01 30.68 1re3 s GLN 421 CO 0.00 -0.55 0.14 1.52 -0.50 0.00 0.00 175.29 175.90 1re3 s TYR 422 N 0.59 0.32 0.31 1.67 1.13 -1.00 -4.93 117.35 115.44 1re3 s TYR 422 Ca 0.66 -0.76 0.08 0.00 -1.41 0.00 0.00 57.07 55.64 1re3 s TYR 422 Cb -0.44 -0.16 -0.06 0.00 -1.10 0.00 0.00 41.96 40.20 1re3 s TYR 422 CO 0.38 -0.53 -0.09 0.95 -2.51 0.00 0.00 175.55 173.75 1re3 s THR 423 N -3.90 2.01 0.54 -3.49 -4.23 -1.26 -4.76 115.64 100.54 1re3 s THR 423 Ca 0.08 -2.19 0.20 0.00 -1.18 0.00 0.00 61.69 58.61 1re3 s THR 423 Cb 0.06 -2.53 0.31 0.00 1.34 0.00 0.00 72.50 71.67 1re3 s THR 423 CO -0.09 -0.26 2.14 4.11 -0.54 0.00 0.00 174.62 179.99 1re3 h TRP 424 N 2.15 0.00 -0.25 3.99 5.08 -1.91 -0.99 115.95 124.02 1re3 h TRP 424 Ca -0.41 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.56 1re3 h TRP 424 Cb 1.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.40 1re3 h TRP 424 CO 0.74 0.00 0.00 -0.40 -1.28 0.00 0.00 178.44 177.50 1re3 n ASP 425 N -4.36 1.80 -0.01 0.11 5.75 -1.26 -3.02 116.55 115.55 1re3 n ASP 425 Ca -0.01 -2.09 0.01 0.00 -0.01 0.00 0.00 54.79 52.69 1re3 n ASP 425 Cb 0.17 -0.29 -0.04 0.00 -1.03 0.00 0.00 41.12 39.93 1re3 n ASP 425 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 1re3 n MET 426 N 0.27 1.06 -2.65 0.11 2.81 -0.39 -5.02 117.12 113.32 1re3 n MET 426 Ca 0.09 -0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.53 1re3 n MET 426 Cb 0.33 -1.13 -0.04 0.00 -0.71 0.00 0.00 33.22 31.67 1re3 n MET 426 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1re3 s ALA 427 N -2.30 3.26 0.36 3.04 0.00 -1.11 -4.96 121.76 120.05 1re3 s ALA 427 Ca -0.02 0.64 0.15 0.00 0.00 0.00 0.00 51.96 52.73 1re3 s ALA 427 Cb 0.03 -3.33 1.03 0.00 0.00 0.00 0.00 23.12 20.85 1re3 s ALA 427 CO 0.22 -0.15 1.73 -0.22 0.00 0.00 0.00 175.76 177.34 1re3 h LYS 428 N 5.93 0.44 -0.06 0.00 3.64 -1.88 -1.84 116.57 122.80 1re3 h LYS 428 Ca -0.43 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1re3 h LYS 428 Cb 1.21 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1re3 h LYS 428 CO 0.74 0.29 0.00 0.72 -2.27 0.00 0.00 179.45 178.93 1re3 n HIS 429 N -4.78 0.11 -1.95 1.91 8.25 -1.26 -4.98 115.22 112.52 1re3 n HIS 429 Ca 0.27 -0.63 -0.11 0.00 -0.26 0.00 0.00 57.72 56.99 1re3 n HIS 429 Cb 0.87 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.87 1re3 n HIS 429 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1re3 n GLY 430 N -0.58 0.31 3.44 -1.41 0.00 -0.69 -5.02 105.19 101.23 1re3 n GLY 430 Ca 0.06 -0.44 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 1re3 n GLY 430 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1re3 s THR 431 N -2.52 1.91 -1.10 2.61 -4.23 -1.26 -4.89 115.64 106.15 1re3 s THR 431 Ca 0.00 -2.21 -0.15 0.00 -1.18 0.00 0.00 61.69 58.15 1re3 s THR 431 Cb 0.00 -2.36 0.16 0.00 1.34 0.00 0.00 72.50 71.64 1re3 s THR 431 CO 0.00 -0.37 1.30 1.51 -0.54 0.00 0.00 174.62 176.52 1re3 s ASP 432 N -3.45 6.91 -0.19 3.99 -4.77 -1.26 -4.77 116.67 113.13 1re3 s ASP 432 Ca 0.28 -2.66 0.10 0.00 -3.30 0.00 0.00 52.55 46.97 1re3 s ASP 432 Cb 0.01 -2.39 0.61 0.00 -1.09 0.00 0.00 42.92 40.05 1re3 s ASP 432 CO 0.12 -0.85 1.45 -0.90 0.70 0.00 0.00 175.17 175.70 1re3 n ASP 433 N 5.87 4.48 -2.03 2.11 5.75 -1.26 -4.94 116.55 126.53 1re3 n ASP 433 Ca 0.31 -2.74 0.00 0.00 -0.01 0.00 0.00 54.79 52.36 1re3 n ASP 433 Cb 0.45 -0.65 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 1re3 n ASP 433 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1re3 n GLY 434 N 0.38 -0.59 3.50 6.12 0.00 -1.26 0.30 105.19 113.64 1re3 n GLY 434 Ca 0.23 -1.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 1re3 n GLY 434 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1re3 s VAL 435 N -0.60 4.38 0.07 1.61 1.01 -1.06 -3.85 120.40 121.96 1re3 s VAL 435 Ca 0.00 -1.30 0.03 0.00 0.00 0.00 0.00 61.98 60.71 1re3 s VAL 435 Cb 0.00 -4.92 -0.04 0.00 0.00 0.00 0.00 36.38 31.42 1re3 s VAL 435 CO 0.00 -1.72 0.04 -0.69 0.00 0.00 0.00 175.10 172.73 1re3 s VAL 436 N 3.66 4.32 -0.46 2.92 1.01 -0.93 -1.53 120.40 129.39 1re3 s VAL 436 Ca 0.40 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.61 1re3 s VAL 436 Cb -0.02 -3.05 0.19 0.00 0.00 0.00 0.00 36.38 33.49 1re3 s VAL 436 CO -0.08 0.15 0.55 1.87 0.00 0.00 0.00 175.10 177.59 1re3 n TRP 437 N 0.61 -2.26 -0.26 5.22 -0.00 -1.26 0.39 117.44 119.88 1re3 n TRP 437 Ca -0.10 -2.42 0.07 0.00 -0.00 0.00 0.00 57.50 55.05 1re3 n TRP 437 Cb 0.52 0.81 0.19 0.00 -0.00 0.00 0.00 31.31 32.83 1re3 n TRP 437 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 177.69 178.21 1re3 h MET 438 N 5.15 0.18 0.00 5.87 2.86 -1.15 -1.00 114.93 126.84 1re3 h MET 438 Ca 0.14 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1re3 h MET 438 Cb 1.00 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1re3 h MET 438 CO 0.23 0.12 0.17 0.09 1.06 0.00 0.00 176.91 178.57 1re3 n ASN 439 N -5.25 0.00 0.00 1.22 3.02 -1.26 -1.38 115.26 111.60 1re3 n ASN 439 Ca 0.15 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 1re3 n ASN 439 Cb 0.51 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1re3 n ASN 439 CO 0.00 0.00 0.00 1.87 -2.62 0.00 0.00 177.26 176.51 1re3 n TRP 440 N -1.31 0.00 0.28 3.10 -0.00 -0.42 -4.59 117.44 114.50 1re3 n TRP 440 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.50 57.53 1re3 n TRP 440 Cb 0.17 0.05 -0.01 0.00 -0.00 0.00 0.00 31.31 31.52 1re3 n TRP 440 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1re3 n LYS 441 N -2.84 3.09 0.00 5.87 4.76 -0.94 -5.12 118.16 122.97 1re3 n LYS 441 Ca 0.00 -0.34 0.00 0.00 -2.87 0.00 0.00 58.31 55.10 1re3 n LYS 441 Cb 0.44 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.72 1re3 n LYS 441 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1re3 n GLY 442 N 0.85 0.62 0.23 0.72 0.00 -0.48 -4.69 105.19 102.44 1re3 n GLY 442 Ca 0.02 -2.09 0.14 0.00 0.00 0.00 0.00 46.02 44.09 1re3 n GLY 442 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1re3 h SER 443 N 0.00 0.00 -1.70 1.61 4.64 -1.92 -3.32 113.55 112.87 1re3 h SER 443 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 1re3 h SER 443 Cb 0.00 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 61.67 1re3 h SER 443 CO 0.00 0.00 -0.72 0.79 -0.87 0.00 0.00 176.83 176.03 1re3 n TRP 444 N -3.08 3.50 -3.83 4.77 7.02 -1.26 -4.78 117.44 119.78 1re3 n TRP 444 Ca 0.03 -3.33 -0.18 0.00 -1.02 0.00 0.00 57.50 53.00 1re3 n TRP 444 Cb 0.46 -0.19 -0.17 0.00 -2.42 0.00 0.00 31.31 29.00 1re3 n TRP 444 CO 0.00 0.00 0.00 -0.47 -2.02 0.00 0.00 177.69 175.20 1re3 s TYR 445 N -3.51 0.25 -0.25 -5.99 6.14 -1.26 -2.38 117.35 110.35 1re3 s TYR 445 Ca 0.48 0.06 -0.07 0.00 0.64 0.00 0.00 57.07 58.18 1re3 s TYR 445 Cb 0.37 -0.43 -0.02 0.00 0.42 0.00 0.00 41.96 42.30 1re3 s TYR 445 CO -0.17 -0.16 0.06 0.45 0.64 0.00 0.00 175.55 176.37 1re3 s SER 446 N 1.36 5.02 0.72 4.32 0.15 0.80 -4.30 113.70 121.79 1re3 s SER 446 Ca -0.05 -0.30 -0.16 0.00 0.70 0.00 0.00 55.95 56.14 1re3 s SER 446 Cb -0.13 -1.89 0.02 0.00 -1.71 0.00 0.00 66.02 62.31 1re3 s SER 446 CO -0.03 -0.06 1.13 0.23 1.20 0.00 0.00 173.24 175.72 1re3 n MET 447 N 4.90 0.61 0.01 5.44 0.00 -0.58 -3.77 117.12 123.74 1re3 n MET 447 Ca -0.16 0.27 -0.09 0.00 0.00 0.00 0.00 57.70 57.72 1re3 n MET 447 Cb 0.51 -2.38 -0.13 0.00 0.00 0.00 0.00 33.22 31.22 1re3 n MET 447 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1re3 h ARG 448 N -0.18 0.01 -4.05 0.03 2.43 -1.06 -3.46 114.38 108.09 1re3 h ARG 448 Ca -0.48 -0.02 -0.30 0.00 -0.81 0.00 0.00 59.98 58.36 1re3 h ARG 448 Cb 1.33 0.01 -0.29 0.00 -0.42 0.00 0.00 29.97 30.59 1re3 h ARG 448 CO 0.49 0.68 -0.74 0.15 -1.51 0.00 0.00 179.97 179.03 1re3 s LYS 449 N -2.63 0.29 -0.13 0.20 1.02 -0.76 -3.96 119.74 113.77 1re3 s LYS 449 Ca -0.03 -0.10 -0.16 0.00 0.02 0.00 0.00 55.97 55.71 1re3 s LYS 449 Cb 0.09 -0.31 0.04 0.00 -0.52 0.00 0.00 37.83 37.13 1re3 s LYS 449 CO 0.82 0.04 0.42 1.41 -0.92 0.00 0.00 175.35 177.13 1re3 s MET 450 N 0.08 0.55 0.12 1.68 -2.45 -1.02 -0.68 119.30 117.59 1re3 s MET 450 Ca -0.00 0.45 -0.24 0.00 -1.25 0.00 0.00 55.69 54.64 1re3 s MET 450 Cb -0.03 0.26 0.07 0.00 1.25 0.00 0.00 34.83 36.38 1re3 s MET 450 CO -0.00 -0.09 0.64 -1.54 1.05 0.00 0.00 175.02 175.07 1re3 s SER 451 N -0.09 -0.56 -0.06 1.11 1.04 -0.13 0.29 113.70 115.30 1re3 s SER 451 Ca -0.03 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.48 1re3 s SER 451 Cb -0.03 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.69 1re3 s SER 451 CO 0.02 -0.90 -0.03 -0.04 0.98 0.00 0.00 173.24 173.27 1re3 s MET 452 N -3.41 0.78 0.00 4.02 -1.94 0.29 -2.01 119.30 117.02 1re3 s MET 452 Ca 0.00 -0.04 0.05 0.00 -1.71 0.00 0.00 55.69 54.00 1re3 s MET 452 Cb -0.01 -0.92 -0.02 0.00 2.01 0.00 0.00 34.83 35.89 1re3 s MET 452 CO -0.10 -0.17 -0.16 0.15 -0.01 0.00 0.00 175.02 174.73 1re3 s LYS 453 N 1.34 1.19 0.30 2.03 1.02 -0.26 0.15 119.74 125.51 1re3 s LYS 453 Ca -0.04 -0.63 0.08 0.00 0.02 0.00 0.00 55.97 55.40 1re3 s LYS 453 Cb -0.13 -1.18 -0.06 0.00 -0.52 0.00 0.00 37.83 35.94 1re3 s LYS 453 CO -0.02 0.31 -0.09 0.96 -0.92 0.00 0.00 175.35 175.59 1re3 s ILE 454 N -0.50 1.97 -0.17 2.17 -4.36 -0.61 0.53 121.20 120.22 1re3 s ILE 454 Ca 0.05 -2.19 -0.29 0.00 -0.26 0.00 0.00 60.65 57.96 1re3 s ILE 454 Cb -0.07 -2.51 0.12 0.00 1.25 0.00 0.00 42.46 41.26 1re3 s ILE 454 CO 0.00 -0.28 0.95 -0.60 0.24 0.00 0.00 174.94 175.26 1re3 s ARG 455 N -3.66 0.65 0.29 0.37 3.52 -0.85 -1.25 118.95 118.02 1re3 s ARG 455 Ca 0.31 0.26 -0.30 0.00 -0.13 0.00 0.00 55.73 55.86 1re3 s ARG 455 Cb 0.02 0.31 -0.11 0.00 -1.56 0.00 0.00 34.95 33.61 1re3 s ARG 455 CO 0.14 -0.18 1.55 -2.14 -0.81 0.00 0.00 175.30 173.85 1re3 s PRO 456 N -0.86 4.16 0.34 5.12 0.02 -1.26 -1.02 135.00 141.50 1re3 s PRO 456 Ca -0.02 2.51 -0.13 0.00 0.02 0.00 0.00 61.00 63.38 1re3 s PRO 456 Cb -0.01 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.39 1re3 s PRO 456 CO 0.01 -0.57 0.73 0.12 -0.33 0.00 0.00 177.00 176.96 1re3 s PHE 457 N -0.11 3.41 0.00 6.54 5.36 0.01 -4.76 117.98 128.42 1re3 s PHE 457 Ca 0.61 1.12 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 1re3 s PHE 457 Cb -0.46 -2.47 0.00 0.00 -0.34 0.00 0.00 43.02 39.74 1re3 s PHE 457 CO 0.48 0.05 0.00 1.19 -1.46 0.00 0.00 175.22 175.48