#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ri3 s TRP 206 N 0.00 3.83 0.01 0.66 -0.00 -1.26 -5.04 118.94 117.13 2ri3 s TRP 206 Ca 0.00 1.81 0.01 0.00 -0.00 0.00 0.00 56.10 57.92 2ri3 s TRP 206 Cb 0.00 -3.09 -0.01 0.00 -0.00 0.00 0.00 33.47 30.37 2ri3 s TRP 206 CO 0.00 0.08 -0.04 -1.54 -0.00 0.00 0.00 176.95 175.45 2ri3 s SER 207 N -0.72 0.45 0.14 5.86 1.04 -1.26 -5.04 113.70 114.17 2ri3 s SER 207 Ca 0.44 -0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.48 2ri3 s SER 207 Cb -0.27 -0.00 0.00 0.00 0.10 0.00 0.00 66.02 65.85 2ri3 s SER 207 CO 0.33 -0.06 1.77 -0.50 0.98 0.00 0.00 173.24 175.76 2ri3 h TRP 208 N 5.54 0.51 -0.26 5.02 4.06 -1.98 -1.87 115.95 126.97 2ri3 h TRP 208 Ca -0.29 -0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.72 2ri3 h TRP 208 Cb 1.20 -0.17 -0.07 0.00 -1.00 0.00 0.00 29.16 29.12 2ri3 h TRP 208 CO 0.49 0.37 -0.26 1.49 -3.56 0.00 0.00 178.44 176.97 2ri3 h GLU 209 N 0.50 -0.26 -0.31 0.49 4.81 -1.99 0.35 114.58 118.18 2ri3 h GLU 209 Ca 0.14 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.39 2ri3 h GLU 209 Cb 0.01 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2ri3 h GLU 209 CO -0.03 -0.17 0.18 0.77 -0.73 0.00 0.00 179.01 179.04 2ri3 h SER 210 N -0.27 0.30 -0.64 1.04 0.02 -1.96 -1.71 113.55 110.34 2ri3 h SER 210 Ca 0.14 -0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.11 2ri3 h SER 210 Cb 0.48 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 2ri3 h SER 210 CO -0.41 0.22 0.41 0.22 -1.14 0.00 0.00 176.83 176.13 2ri3 h TYR 211 N 0.38 0.77 -0.71 3.45 3.20 -0.47 0.15 116.97 123.74 2ri3 h TYR 211 Ca 0.12 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 2ri3 h TYR 211 Cb -0.01 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 37.97 2ri3 h TYR 211 CO -0.07 0.47 0.33 -0.07 -1.64 0.00 0.00 178.16 177.18 2ri3 h LEU 212 N 0.82 0.93 0.07 2.82 3.38 -0.09 0.19 115.31 123.44 2ri3 h LEU 212 Ca 0.25 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 2ri3 h LEU 212 Cb -0.04 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.47 2ri3 h LEU 212 CO -0.08 0.81 -0.03 -0.33 0.09 0.00 0.00 178.44 178.90 2ri3 h GLU 213 N 0.99 -0.09 -0.74 1.13 4.39 -0.86 0.62 114.58 120.03 2ri3 h GLU 213 Ca 0.24 0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.04 2ri3 h GLU 213 Cb 0.13 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.73 2ri3 h GLU 213 CO -0.03 0.03 0.38 1.49 -1.16 0.00 0.00 179.01 179.73 2ri3 h GLU 214 N -0.19 0.62 -0.00 2.33 4.81 -0.31 -2.59 114.58 119.26 2ri3 h GLU 214 Ca -0.01 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2ri3 h GLU 214 Cb 0.16 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2ri3 h GLU 214 CO 0.02 0.41 -0.53 1.04 -0.73 0.00 0.00 179.01 179.22 2ri3 n GLN 215 N -4.84 0.33 -3.48 1.92 1.13 0.62 -4.96 117.38 108.10 2ri3 n GLN 215 Ca 0.12 -0.22 -0.20 0.00 -1.94 0.00 0.00 57.00 54.75 2ri3 n GLN 215 Cb 0.28 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.19 2ri3 n GLN 215 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2ri3 n LYS 216 N -1.14 -3.55 -4.52 -1.09 4.76 0.20 -4.99 118.16 107.83 2ri3 n LYS 216 Ca 0.07 0.72 -0.24 0.00 -2.87 0.00 0.00 58.31 55.99 2ri3 n LYS 216 Cb 0.35 -5.34 -0.10 0.00 -1.84 0.00 0.00 35.03 28.10 2ri3 n LYS 216 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ri3 s ALA 217 N -3.47 2.76 0.12 7.82 0.00 -0.49 -5.05 121.76 123.45 2ri3 s ALA 217 Ca 0.26 -1.92 0.06 0.00 0.00 0.00 0.00 51.96 50.37 2ri3 s ALA 217 Cb -0.05 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.52 2ri3 s ALA 217 CO 0.78 -0.24 -0.15 0.96 0.00 0.00 0.00 175.76 177.10 2ri3 s ILE 218 N -3.10 1.40 0.38 0.00 -4.36 -1.26 -4.79 121.20 109.47 2ri3 s ILE 218 Ca 0.33 -1.66 0.00 0.00 -0.26 0.00 0.00 60.65 59.06 2ri3 s ILE 218 Cb 0.08 -1.50 -0.03 0.00 1.25 0.00 0.00 42.46 42.26 2ri3 s ILE 218 CO 0.15 -0.33 0.59 0.42 0.24 0.00 0.00 174.94 176.01 2ri3 s THR 219 N -1.87 4.83 -0.11 8.37 -4.23 -1.26 -1.31 115.64 120.05 2ri3 s THR 219 Ca 0.08 -0.42 -0.30 0.00 -1.18 0.00 0.00 61.69 59.87 2ri3 s THR 219 Cb -0.06 -3.77 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 2ri3 s THR 219 CO 0.03 -0.53 1.10 0.00 -0.54 0.00 0.00 174.62 174.68 2ri3 s ALA 220 N -2.40 3.49 0.61 3.99 0.00 0.04 -4.62 121.76 122.87 2ri3 s ALA 220 Ca 0.42 0.43 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 2ri3 s ALA 220 Cb -0.10 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 2ri3 s ALA 220 CO 0.37 -0.77 1.00 -2.30 0.00 0.00 0.00 175.76 174.07 2ri3 n PRO 221 N 5.39 0.91 0.26 0.00 -0.02 -1.26 -4.66 135.00 135.61 2ri3 n PRO 221 Ca 0.10 0.35 0.08 0.00 -2.02 0.00 0.00 63.50 62.02 2ri3 n PRO 221 Cb 0.47 -2.21 0.63 0.00 -0.02 0.00 0.00 33.50 32.37 2ri3 n PRO 221 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ri3 h VAL 222 N 0.46 1.00 0.00 -1.45 2.07 -1.97 -2.09 116.25 114.28 2ri3 h VAL 222 Ca -0.49 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2ri3 h VAL 222 Cb 1.36 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 2ri3 h VAL 222 CO 0.51 0.02 0.00 0.77 0.02 0.00 0.00 177.57 178.89 2ri3 h SER 223 N 0.00 0.00 1.71 0.57 4.64 -2.00 -1.97 113.55 116.51 2ri3 h SER 223 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ri3 h SER 223 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2ri3 h SER 223 CO 0.00 0.00 -0.00 -0.07 -0.87 0.00 0.00 176.83 175.89 2ri3 h LEU 224 N 0.00 0.00-10.24 5.97 3.38 -1.73 -3.46 115.31 109.23 2ri3 h LEU 224 Ca 0.00 -0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2ri3 h LEU 224 Cb 0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.87 2ri3 h LEU 224 CO 0.00 0.00 -0.22 -0.36 0.09 0.00 0.00 178.44 177.95 2ri3 s PHE 225 N -3.15 3.47 0.54 1.13 0.40 -0.74 -4.83 117.98 114.79 2ri3 s PHE 225 Ca 0.09 0.28 -0.18 0.00 -0.60 0.00 0.00 56.93 56.52 2ri3 s PHE 225 Cb 0.09 -1.87 -0.06 0.00 0.51 0.00 0.00 43.02 41.68 2ri3 s PHE 225 CO 0.63 0.14 1.03 -0.65 0.70 0.00 0.00 175.22 177.07 2ri3 s GLN 226 N -4.28 3.63 0.37 0.44 -1.52 -1.26 -4.91 119.66 112.14 2ri3 s GLN 226 Ca 0.40 1.20 0.10 0.00 -1.95 0.00 0.00 55.36 55.11 2ri3 s GLN 226 Cb -0.10 -2.08 0.87 0.00 -0.22 0.00 0.00 33.01 31.49 2ri3 s GLN 226 CO 0.35 -0.56 1.89 -0.44 -0.25 0.00 0.00 175.29 176.29 2ri3 h ASP 227 N 0.94 0.59 0.68 5.90 3.32 -1.98 -1.37 116.42 124.50 2ri3 h ASP 227 Ca -0.48 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.57 2ri3 h ASP 227 Cb 1.21 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 2ri3 h ASP 227 CO 0.59 0.31 -0.16 0.77 -1.72 0.00 0.00 179.24 179.03 2ri3 h SER 228 N 0.63 0.00 1.09 6.45 4.64 -1.96 -0.02 113.55 124.38 2ri3 h SER 228 Ca 0.41 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.57 2ri3 h SER 228 Cb 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 2ri3 h SER 228 CO -0.17 0.16 -0.95 1.56 -0.87 0.00 0.00 176.83 176.56 2ri3 h GLN 229 N 0.00 0.00 0.02 4.77 4.20 -1.59 -3.38 115.11 119.13 2ri3 h GLN 229 Ca -0.00 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.37 2ri3 h GLN 229 Cb 0.55 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 2ri3 h GLN 229 CO 0.02 0.58 -2.02 0.00 -0.67 0.00 0.00 178.83 176.74 2ri3 n ALA 230 N -2.33 1.38 -1.67 3.87 0.00 -0.95 -4.52 120.51 116.30 2ri3 n ALA 230 Ca -0.03 -0.92 -0.48 0.00 0.00 0.00 0.00 53.44 52.00 2ri3 n ALA 230 Cb 0.84 -0.56 -0.05 0.00 0.00 0.00 0.00 19.45 19.68 2ri3 n ALA 230 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2ri3 n VAL 231 N -3.07 0.26 0.00 0.00 3.14 -0.06 -4.86 118.33 113.74 2ri3 n VAL 231 Ca -0.27 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.06 2ri3 n VAL 231 Cb 1.07 -1.58 0.00 0.00 -1.06 0.00 0.00 33.84 32.27 2ri3 n VAL 231 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2ri3 n THR 232 N 4.13 0.00 1.39 1.55 -2.24 -1.26 -4.74 114.28 113.11 2ri3 n THR 232 Ca 0.20 -0.39 0.14 0.00 -2.27 0.00 0.00 64.05 61.73 2ri3 n THR 232 Cb 0.27 0.92 0.57 0.00 -2.10 0.00 0.00 70.33 69.98 2ri3 n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ri3 n HIS 233 N -0.98 0.00 -2.53 4.78 1.44 -1.26 -4.55 115.22 112.12 2ri3 n HIS 233 Ca 0.00 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.31 2ri3 n HIS 233 Cb 0.00 -0.16 -0.05 0.00 0.12 0.00 0.00 29.99 29.91 2ri3 n HIS 233 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 2ri3 s ASN 234 N -2.44 7.33 0.16 4.39 0.01 -1.26 -5.02 114.94 118.10 2ri3 s ASN 234 Ca 0.29 2.20 -0.16 0.00 -0.71 0.00 0.00 52.86 54.48 2ri3 s ASN 234 Cb 0.20 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 39.17 2ri3 s ASN 234 CO 0.47 -0.09 0.59 -0.75 -1.51 0.00 0.00 177.10 175.81 2ri3 s LYS 235 N -1.43 4.05 -0.57 -0.60 2.20 -1.26 -5.00 119.74 117.13 2ri3 s LYS 235 Ca 0.44 0.59 -0.18 0.00 -0.36 0.00 0.00 55.97 56.46 2ri3 s LYS 235 Cb -0.30 -2.94 0.10 0.00 -1.51 0.00 0.00 37.83 33.18 2ri3 s LYS 235 CO 0.39 0.47 0.65 1.21 -0.36 0.00 0.00 175.35 177.71 2ri3 s ASN 236 N -1.66 6.19 0.00 1.43 3.84 -1.26 -4.92 114.94 118.56 2ri3 s ASN 236 Ca 0.38 -1.44 0.25 0.00 0.21 0.00 0.00 52.86 52.26 2ri3 s ASN 236 Cb -0.16 -2.28 1.20 0.00 -0.55 0.00 0.00 41.25 39.47 2ri3 s ASN 236 CO 0.19 -1.03 1.81 0.61 -2.79 0.00 0.00 177.10 175.89 2ri3 n GLY 237 N 5.26 -0.39 3.75 1.21 0.00 -1.26 -4.90 105.19 108.87 2ri3 n GLY 237 Ca -0.10 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 2ri3 n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ri3 s PHE 238 N -1.95 3.35 0.10 1.61 0.08 -1.26 -5.01 117.98 114.91 2ri3 s PHE 238 Ca 0.37 1.50 0.07 0.00 0.12 0.00 0.00 56.93 58.98 2ri3 s PHE 238 Cb 0.19 -3.47 -0.03 0.00 -0.57 0.00 0.00 43.02 39.13 2ri3 s PHE 238 CO 0.30 -1.24 -0.16 0.15 -0.10 0.00 0.00 175.22 174.17 2ri3 s LYS 239 N -1.12 1.00 0.23 0.44 -0.14 -1.26 -4.97 119.74 113.92 2ri3 s LYS 239 Ca 0.49 -1.13 -0.31 0.00 -1.36 0.00 0.00 55.97 53.66 2ri3 s LYS 239 Cb -0.35 -1.05 -0.14 0.00 -1.68 0.00 0.00 37.83 34.60 2ri3 s LYS 239 CO 0.43 0.23 1.21 1.28 -0.76 0.00 0.00 175.35 177.74 2ri3 n LEU 240 N 0.93 2.21 0.00 3.17 4.77 -1.26 -1.78 117.00 125.04 2ri3 n LEU 240 Ca -0.18 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.95 2ri3 n LEU 240 Cb 0.55 -1.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2ri3 n LEU 240 CO 0.24 -1.02 0.00 0.61 -1.33 0.00 0.00 177.39 175.89 2ri3 n GLY 241 N 1.80 3.27 3.77 -0.72 0.00 -0.31 -4.97 105.19 108.02 2ri3 n GLY 241 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2ri3 n GLY 241 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ri3 s MET 242 N -0.54 3.96 0.16 1.61 -1.94 -0.73 -4.48 119.30 117.33 2ri3 s MET 242 Ca 0.00 2.36 0.07 0.00 -1.71 0.00 0.00 55.69 56.41 2ri3 s MET 242 Cb 0.00 -2.82 -0.04 0.00 2.01 0.00 0.00 34.83 33.98 2ri3 s MET 242 CO 0.00 -0.58 0.01 0.15 -0.01 0.00 0.00 175.02 174.60 2ri3 s LYS 243 N -2.22 2.48 0.06 2.03 1.02 -0.55 -0.96 119.74 121.60 2ri3 s LYS 243 Ca 0.56 -1.04 -0.02 0.00 0.02 0.00 0.00 55.97 55.49 2ri3 s LYS 243 Cb -0.42 -2.42 0.01 0.00 -0.52 0.00 0.00 37.83 34.48 2ri3 s LYS 243 CO 0.56 0.47 0.13 1.47 -0.92 0.00 0.00 175.35 177.06 2ri3 n LEU 244 N -0.04 0.00 -4.43 3.17 -0.00 0.34 -0.69 117.00 115.36 2ri3 n LEU 244 Ca -0.10 -0.40 -0.29 0.00 -0.00 0.00 0.00 56.01 55.22 2ri3 n LEU 244 Cb 0.55 0.60 -0.12 0.00 -0.00 0.00 0.00 43.42 44.44 2ri3 n LEU 244 CO 0.39 -0.13 -0.54 -1.61 -0.00 0.00 0.00 177.39 175.50 2ri3 s GLU 245 N -2.01 1.60 -0.04 1.47 2.02 0.04 -0.43 118.70 121.34 2ri3 s GLU 245 Ca 0.03 -1.26 -0.30 0.00 0.02 0.00 0.00 54.97 53.46 2ri3 s GLU 245 Cb -0.01 -2.00 0.11 0.00 0.10 0.00 0.00 34.13 32.33 2ri3 s GLU 245 CO 0.02 0.47 0.94 0.20 0.02 0.00 0.00 175.26 176.90 2ri3 s GLY 246 N -2.01 -0.43 0.47 -1.39 0.00 -0.69 0.46 107.32 103.73 2ri3 s GLY 246 Ca 0.15 1.15 -0.20 0.00 0.00 0.00 0.00 44.72 45.82 2ri3 s GLY 246 CO 0.07 0.40 1.02 -0.26 0.00 0.00 0.00 173.10 174.33 2ri3 s ILE 247 N -2.91 3.92 -0.32 0.90 -4.36 -0.85 -0.82 121.20 116.77 2ri3 s ILE 247 Ca 0.05 1.19 -0.25 0.00 -0.26 0.00 0.00 60.65 61.38 2ri3 s ILE 247 Cb -0.01 -3.48 0.01 0.00 1.25 0.00 0.00 42.46 40.23 2ri3 s ILE 247 CO -0.08 -0.26 0.90 -0.62 0.24 0.00 0.00 174.94 175.12 2ri3 s ASP 248 N -2.03 6.75 0.56 4.36 -1.08 -0.52 -4.89 116.67 119.82 2ri3 s ASP 248 Ca 0.66 0.77 0.28 0.00 -0.52 0.00 0.00 52.55 53.74 2ri3 s ASP 248 Cb -0.15 -2.46 1.48 0.00 -1.46 0.00 0.00 42.92 40.33 2ri3 s ASP 248 CO 0.19 -0.73 1.95 -0.65 0.52 0.00 0.00 175.17 176.45 2ri3 h PRO 249 N 8.15 0.00 0.00 4.34 0.11 -1.94 0.14 132.00 142.80 2ri3 h PRO 249 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2ri3 h PRO 249 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2ri3 h PRO 249 CO 0.94 0.00 -0.43 1.96 -0.21 0.00 0.00 178.00 180.26 2ri3 h GLN 250 N 0.00 0.00 -1.98 1.05 1.08 -1.99 -3.37 115.11 109.90 2ri3 h GLN 250 Ca 0.24 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.90 2ri3 h GLN 250 Cb 1.12 0.00 -0.37 0.00 -0.05 0.00 0.00 27.48 28.18 2ri3 h GLN 250 CO -0.00 0.00 -1.03 0.72 -0.95 0.00 0.00 178.83 177.57 2ri3 n HIS 251 N -2.92 -0.77 0.29 2.96 8.25 0.37 -4.63 115.22 118.78 2ri3 n HIS 251 Ca 0.02 -3.34 0.06 0.00 -0.26 0.00 0.00 57.72 54.20 2ri3 n HIS 251 Cb 0.54 -0.04 0.33 0.00 1.12 0.00 0.00 29.99 31.95 2ri3 n HIS 251 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2ri3 h PRO 252 N 4.48 0.00 0.00 -0.41 0.11 -1.40 0.14 132.00 134.92 2ri3 h PRO 252 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2ri3 h PRO 252 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2ri3 h PRO 252 CO 0.42 0.00 -0.69 -1.13 -0.21 0.00 0.00 178.00 176.39 2ri3 n SER 253 N -2.48 0.61 -4.78 -2.05 3.41 -1.26 -4.77 113.62 102.29 2ri3 n SER 253 Ca -0.01 -0.27 -0.34 0.00 -0.26 0.00 0.00 58.87 57.99 2ri3 n SER 253 Cb 0.66 0.43 -0.07 0.00 -0.26 0.00 0.00 64.21 64.97 2ri3 n SER 253 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2ri3 s MET 254 N -3.07 3.15 -0.09 4.33 -1.94 0.49 -5.02 119.30 117.16 2ri3 s MET 254 Ca 0.08 -0.37 0.01 0.00 -1.71 0.00 0.00 55.69 53.70 2ri3 s MET 254 Cb 0.16 -2.93 -0.03 0.00 2.01 0.00 0.00 34.83 34.05 2ri3 s MET 254 CO 0.74 0.70 -0.10 0.71 -0.01 0.00 0.00 175.02 177.06 2ri3 s TYR 255 N -1.08 2.86 0.20 -0.03 2.02 -1.26 -1.44 117.35 118.61 2ri3 s TYR 255 Ca 0.19 -0.19 0.03 0.00 -0.37 0.00 0.00 57.07 56.72 2ri3 s TYR 255 Cb -0.12 -1.74 -0.05 0.00 -0.40 0.00 0.00 41.96 39.65 2ri3 s TYR 255 CO 0.09 0.14 -0.01 -0.06 -1.57 0.00 0.00 175.55 174.14 2ri3 s PHE 256 N -0.42 1.38 -0.05 2.71 0.40 0.00 -0.50 117.98 121.50 2ri3 s PHE 256 Ca 0.06 -0.95 -0.27 0.00 -0.60 0.00 0.00 56.93 55.17 2ri3 s PHE 256 Cb -0.12 -0.78 -0.03 0.00 0.51 0.00 0.00 43.02 42.59 2ri3 s PHE 256 CO 0.02 -0.10 0.84 0.42 0.70 0.00 0.00 175.22 177.10 2ri3 s ILE 257 N -3.51 4.95 0.13 0.64 -1.09 -1.26 -1.71 121.20 119.35 2ri3 s ILE 257 Ca 0.25 1.74 0.07 0.00 -2.23 0.00 0.00 60.65 60.48 2ri3 s ILE 257 Cb 0.05 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.72 2ri3 s ILE 257 CO 0.06 0.18 -0.16 -0.76 -1.23 0.00 0.00 174.94 173.03 2ri3 s LEU 258 N 1.07 2.39 -0.00 2.97 1.43 0.43 -2.91 118.68 124.05 2ri3 s LEU 258 Ca 0.44 -0.79 0.07 0.00 -1.03 0.00 0.00 54.13 52.81 2ri3 s LEU 258 Cb -0.19 -0.68 -0.02 0.00 0.03 0.00 0.00 46.19 45.33 2ri3 s LEU 258 CO 0.22 -0.08 -0.22 -0.89 0.23 0.00 0.00 176.35 175.61 2ri3 s THR 259 N -1.90 1.71 -0.38 5.49 2.01 -0.49 -0.50 115.64 121.57 2ri3 s THR 259 Ca 0.10 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.83 2ri3 s THR 259 Cb -0.06 -1.43 -0.00 0.00 0.01 0.00 0.00 72.50 71.01 2ri3 s THR 259 CO 0.04 0.43 1.56 -0.69 -0.69 0.00 0.00 174.62 175.28 2ri3 s VAL 260 N -0.56 3.74 -0.17 3.82 1.01 -0.13 -0.84 120.40 127.26 2ri3 s VAL 260 Ca 0.08 0.75 0.21 0.00 0.00 0.00 0.00 61.98 63.02 2ri3 s VAL 260 Cb -0.08 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.22 2ri3 s VAL 260 CO -0.00 -0.62 0.87 0.00 0.00 0.00 0.00 175.10 175.35 2ri3 n ALA 261 N 9.37 2.38 -3.52 5.51 0.00 1.00 -1.17 120.51 134.08 2ri3 n ALA 261 Ca 0.19 -0.39 -0.17 0.00 0.00 0.00 0.00 53.44 53.08 2ri3 n ALA 261 Cb 0.47 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.88 2ri3 n ALA 261 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2ri3 s GLU 262 N -3.24 1.01 -0.05 0.00 2.12 -1.12 -4.93 118.70 112.48 2ri3 s GLU 262 Ca -0.03 0.20 0.02 0.00 0.36 0.00 0.00 54.97 55.53 2ri3 s GLU 262 Cb 0.10 0.48 0.01 0.00 0.26 0.00 0.00 34.13 34.98 2ri3 s GLU 262 CO 0.81 -0.32 -0.11 0.08 -0.54 0.00 0.00 175.26 175.18 2ri3 s VAL 263 N -1.33 0.99 -0.22 3.70 1.01 -1.26 -0.68 120.40 122.61 2ri3 s VAL 263 Ca -0.09 -0.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 2ri3 s VAL 263 Cb -0.00 -0.91 0.11 0.00 0.00 0.00 0.00 36.38 35.57 2ri3 s VAL 263 CO 0.08 0.32 0.27 0.00 0.00 0.00 0.00 175.10 175.77 2ri3 n GLY 265 N 5.33 3.33 1.86 0.00 0.00 -1.21 -1.28 105.19 113.22 2ri3 n GLY 265 Ca -0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 2ri3 n GLY 265 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2ri3 n TYR 266 N 13.70 2.13 -4.44 1.61 9.36 -1.25 -4.74 117.16 133.53 2ri3 n TYR 266 Ca 0.00 -0.94 -0.22 0.00 3.32 0.00 0.00 57.90 60.06 2ri3 n TYR 266 Cb 0.00 -0.59 -0.10 0.00 -0.63 0.00 0.00 39.34 38.02 2ri3 n TYR 266 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2ri3 s ARG 267 N -2.69 1.58 -0.04 2.98 0.52 -0.40 -0.24 118.95 120.66 2ri3 s ARG 267 Ca 0.50 -1.80 -0.16 0.00 -0.52 0.00 0.00 55.73 53.75 2ri3 s ARG 267 Cb 0.39 -1.22 0.03 0.00 0.52 0.00 0.00 34.95 34.67 2ri3 s ARG 267 CO 0.13 0.05 0.35 -0.48 0.02 0.00 0.00 175.30 175.37 2ri3 s LEU 268 N -3.46 0.70 -0.21 2.53 2.34 -0.51 -1.61 118.68 118.46 2ri3 s LEU 268 Ca 0.30 0.24 -0.09 0.00 0.06 0.00 0.00 54.13 54.64 2ri3 s LEU 268 Cb 0.04 1.36 -0.04 0.00 -0.56 0.00 0.00 46.19 46.98 2ri3 s LEU 268 CO 0.12 -0.41 0.10 -0.60 -1.06 0.00 0.00 176.35 174.51 2ri3 s ARG 269 N -1.06 4.02 0.01 1.48 3.52 0.14 -1.54 118.95 125.52 2ri3 s ARG 269 Ca -0.11 -0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.19 2ri3 s ARG 269 Cb -0.04 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.95 2ri3 s ARG 269 CO 0.04 0.18 0.04 -0.51 -0.81 0.00 0.00 175.30 174.25 2ri3 s LEU 270 N 0.65 3.70 -0.07 -0.88 1.43 0.12 -0.00 118.68 123.64 2ri3 s LEU 270 Ca 0.06 0.05 0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2ri3 s LEU 270 Cb -0.13 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 43.93 2ri3 s LEU 270 CO 0.01 0.26 -0.21 -2.28 0.23 0.00 0.00 176.35 174.36 2ri3 s HIS 271 N -1.16 2.18 -0.51 0.29 5.65 -0.02 -2.03 115.29 119.69 2ri3 s HIS 271 Ca 0.22 -0.74 -0.28 0.00 0.25 0.00 0.00 55.06 54.51 2ri3 s HIS 271 Cb -0.12 -1.46 0.02 0.00 -1.18 0.00 0.00 32.58 29.84 2ri3 s HIS 271 CO 0.13 -0.27 1.28 -0.06 -0.65 0.00 0.00 174.74 175.17 2ri3 s PHE 272 N 0.12 2.54 0.04 3.88 0.40 -1.26 -1.40 117.98 122.30 2ri3 s PHE 272 Ca -0.09 0.57 -0.37 0.00 -0.60 0.00 0.00 56.93 56.43 2ri3 s PHE 272 Cb -0.15 -4.42 -0.16 0.00 0.51 0.00 0.00 43.02 38.79 2ri3 s PHE 272 CO 0.05 -1.68 1.40 -0.25 0.70 0.00 0.00 175.22 175.44 2ri3 n ASP 273 N 8.64 1.79 0.00 1.36 9.92 -1.14 -0.63 116.55 136.48 2ri3 n ASP 273 Ca 0.12 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.49 2ri3 n ASP 273 Cb 0.49 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.78 2ri3 n ASP 273 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ri3 n GLY 274 N 2.78 2.49 3.99 0.44 0.00 -1.26 -3.34 105.19 110.29 2ri3 n GLY 274 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.04 2ri3 n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ri3 s TYR 275 N -2.48 2.73 0.63 1.61 2.02 0.20 -4.63 117.35 117.43 2ri3 s TYR 275 Ca 0.00 -0.43 -0.14 0.00 -0.37 0.00 0.00 57.07 56.13 2ri3 s TYR 275 Cb 0.00 -2.34 -0.02 0.00 -0.40 0.00 0.00 41.96 39.20 2ri3 s TYR 275 CO 0.00 -0.41 1.06 -1.54 -1.57 0.00 0.00 175.55 173.10 2ri3 s SER 276 N -4.33 5.59 -0.21 2.29 1.04 -1.26 -4.83 113.70 111.98 2ri3 s SER 276 Ca 0.54 1.80 -0.06 0.00 0.48 0.00 0.00 55.95 58.71 2ri3 s SER 276 Cb -0.09 -2.53 -0.07 0.00 0.10 0.00 0.00 66.02 63.44 2ri3 s SER 276 CO 0.32 -1.30 1.33 -0.62 0.98 0.00 0.00 173.24 173.95 2ri3 n GLU 277 N -2.34 0.47 0.00 4.02 1.02 -1.26 -4.30 120.64 118.24 2ri3 n GLU 277 Ca 0.09 -0.81 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 2ri3 n GLU 277 Cb 0.53 -2.19 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 2ri3 n GLU 277 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2ri3 n HIS 279 N 5.47 0.00 -1.58 -0.32 8.25 -1.26 -4.84 115.22 120.93 2ri3 n HIS 279 Ca 0.17 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.23 2ri3 n HIS 279 Cb 0.10 -0.32 0.03 0.00 1.12 0.00 0.00 29.99 30.92 2ri3 n HIS 279 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2ri3 n ASP 280 N 0.00 0.70 -3.70 0.41 9.92 -1.26 -4.81 116.55 117.80 2ri3 n ASP 280 Ca 0.00 0.92 -0.10 0.00 -0.53 0.00 0.00 54.79 55.08 2ri3 n ASP 280 Cb 0.00 -1.33 -0.06 0.00 -0.64 0.00 0.00 41.12 39.10 2ri3 n ASP 280 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 2ri3 s PHE 281 N -1.42 -0.12 -0.04 1.24 -0.71 -0.86 -4.97 117.98 111.10 2ri3 s PHE 281 Ca 0.68 -0.19 -0.01 0.00 -1.04 0.00 0.00 56.93 56.36 2ri3 s PHE 281 Cb -0.50 0.16 -0.04 0.00 -1.21 0.00 0.00 43.02 41.44 2ri3 s PHE 281 CO 0.54 -0.64 0.05 -1.58 -1.34 0.00 0.00 175.22 172.25 2ri3 s TRP 282 N -3.60 3.24 0.15 3.49 0.52 -1.26 0.15 118.94 121.63 2ri3 s TRP 282 Ca 0.02 0.22 -0.02 0.00 0.02 0.00 0.00 56.10 56.34 2ri3 s TRP 282 Cb 0.02 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.54 2ri3 s TRP 282 CO -0.10 0.53 0.10 0.14 0.02 0.00 0.00 176.95 177.63 2ri3 s VAL 283 N -1.05 0.08 0.43 4.03 -7.23 -0.59 -4.99 120.40 111.07 2ri3 s VAL 283 Ca 0.18 -1.87 -0.05 0.00 -1.81 0.00 0.00 61.98 58.43 2ri3 s VAL 283 Cb -0.12 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 2ri3 s VAL 283 CO 0.08 -0.36 0.72 0.20 -0.31 0.00 0.00 175.10 175.44 2ri3 s ASN 284 N -3.06 6.32 0.61 4.85 0.02 -1.26 -1.42 114.94 120.99 2ri3 s ASN 284 Ca 0.26 0.85 0.38 0.00 -1.02 0.00 0.00 52.86 53.33 2ri3 s ASN 284 Cb 0.07 -2.21 1.95 0.00 0.02 0.00 0.00 41.25 41.08 2ri3 s ASN 284 CO 0.04 -0.47 2.22 0.00 0.02 0.00 0.00 177.10 178.90 2ri3 h ALA 285 N 0.57 1.10 -0.76 0.60 0.00 -0.95 -1.97 119.26 117.85 2ri3 h ALA 285 Ca -0.48 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.15 2ri3 h ALA 285 Cb 1.20 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.83 2ri3 h ALA 285 CO 0.62 0.03 0.33 0.27 0.00 0.00 0.00 179.25 180.50 2ri3 n ASN 286 N -3.25 4.57 -4.74 0.00 6.94 -1.26 -4.80 115.26 112.71 2ri3 n ASN 286 Ca -0.02 -3.23 -0.41 0.00 -0.02 0.00 0.00 54.58 50.90 2ri3 n ASN 286 Cb 0.16 -0.76 -0.03 0.00 -2.36 0.00 0.00 39.78 36.80 2ri3 n ASN 286 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2ri3 s SER 287 N -0.98 6.70 0.00 0.53 0.15 -0.74 -4.83 113.70 114.53 2ri3 s SER 287 Ca 0.53 2.59 0.25 0.00 0.70 0.00 0.00 55.95 60.03 2ri3 s SER 287 Cb 0.43 -2.62 1.06 0.00 -1.71 0.00 0.00 66.02 63.18 2ri3 s SER 287 CO 0.13 -0.68 1.73 -0.81 1.20 0.00 0.00 173.24 174.81 2ri3 n PRO 288 N 2.65 1.54 -0.27 5.44 -0.04 -1.26 -3.89 135.00 139.16 2ri3 n PRO 288 Ca 0.08 -0.80 0.10 0.00 -0.04 0.00 0.00 63.50 62.85 2ri3 n PRO 288 Cb 0.41 -1.43 0.27 0.00 -0.04 0.00 0.00 33.50 32.70 2ri3 n PRO 288 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ri3 n ASP 289 N -0.01 3.24 -4.31 3.54 8.00 -1.26 -4.78 116.55 120.96 2ri3 n ASP 289 Ca 0.18 -1.98 -0.22 0.00 0.71 0.00 0.00 54.79 53.48 2ri3 n ASP 289 Cb 0.29 -0.36 -0.12 0.00 -0.02 0.00 0.00 41.12 40.91 2ri3 n ASP 289 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2ri3 s ILE 290 N -1.28 1.76 0.07 0.53 -4.36 -1.25 -2.00 121.20 114.67 2ri3 s ILE 290 Ca 0.40 -1.77 -0.06 0.00 -0.26 0.00 0.00 60.65 58.96 2ri3 s ILE 290 Cb 0.22 -1.72 -0.02 0.00 1.25 0.00 0.00 42.46 42.19 2ri3 s ILE 290 CO 0.29 -0.23 0.11 -1.00 0.24 0.00 0.00 174.94 174.35 2ri3 s HIS 291 N -1.73 0.28 0.61 1.37 3.76 0.17 -4.60 115.29 115.14 2ri3 s HIS 291 Ca 0.12 -0.75 -0.18 0.00 -0.15 0.00 0.00 55.06 54.11 2ri3 s HIS 291 Cb -0.07 -0.17 -0.03 0.00 1.11 0.00 0.00 32.58 33.42 2ri3 s HIS 291 CO 0.06 -0.48 1.15 -2.14 -0.85 0.00 0.00 174.74 172.47 2ri3 s PRO 292 N -3.84 3.00 0.24 8.40 0.02 -1.26 -0.78 135.00 140.78 2ri3 s PRO 292 Ca 0.05 1.60 -0.31 0.00 0.02 0.00 0.00 61.00 62.36 2ri3 s PRO 292 Cb 0.06 -1.96 -0.13 0.00 0.02 0.00 0.00 34.50 32.49 2ri3 s PRO 292 CO -0.10 -1.13 1.43 0.00 -0.33 0.00 0.00 177.00 176.86 2ri3 n ALA 293 N -1.83 1.27 0.00 -1.55 0.00 -1.26 -1.34 120.51 115.80 2ri3 n ALA 293 Ca 0.12 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2ri3 n ALA 293 Cb 0.51 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.66 2ri3 n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ri3 n GLY 294 N 2.18 1.75 0.17 0.00 0.00 -1.26 -4.96 105.19 103.08 2ri3 n GLY 294 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.09 2ri3 n GLY 294 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2ri3 h TRP 295 N 0.00 0.11 -0.65 1.61 7.01 -1.56 -1.99 115.95 120.48 2ri3 h TRP 295 Ca 0.00 0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.09 2ri3 h TRP 295 Cb 0.00 0.01 -0.06 0.00 -2.10 0.00 0.00 29.16 27.01 2ri3 h TRP 295 CO 0.00 -0.00 0.34 0.27 -2.79 0.00 0.00 178.44 176.25 2ri3 h PHE 296 N 0.20 0.61 -0.76 2.65 -0.00 -1.87 -0.08 116.94 117.69 2ri3 h PHE 296 Ca 0.20 0.03 -0.05 0.00 -0.00 0.00 0.00 57.97 58.15 2ri3 h PHE 296 Cb 0.26 -0.18 -0.03 0.00 -0.00 0.00 0.00 35.95 36.00 2ri3 h PHE 296 CO -0.22 0.27 0.26 1.49 -0.00 0.00 0.00 178.31 180.11 2ri3 h GLU 297 N 0.61 1.16 0.00 6.09 4.81 -1.68 0.10 114.58 125.67 2ri3 h GLU 297 Ca 0.30 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2ri3 h GLU 297 Cb 0.24 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2ri3 h GLU 297 CO -0.21 0.97 0.00 -0.22 -0.73 0.00 0.00 179.01 178.82 2ri3 h LYS 298 N 1.12 0.00 -0.25 1.92 3.64 -0.59 -3.29 116.57 119.11 2ri3 h LYS 298 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 2ri3 h LYS 298 Cb 0.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2ri3 h LYS 298 CO -0.01 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.42 2ri3 n THR 299 N -3.07 0.72 -1.06 1.00 -2.24 -0.12 -4.98 114.28 104.53 2ri3 n THR 299 Ca 0.04 -0.86 -0.02 0.00 -2.27 0.00 0.00 64.05 60.94 2ri3 n THR 299 Cb 0.50 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 69.42 2ri3 n THR 299 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ri3 n GLY 300 N 0.55 0.55 3.96 3.38 0.00 -0.68 -5.04 105.19 107.90 2ri3 n GLY 300 Ca 0.10 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2ri3 n GLY 300 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ri3 s HIS 301 N -2.05 3.16 -0.11 1.61 3.76 0.27 -5.02 115.29 116.92 2ri3 s HIS 301 Ca 0.00 0.14 -0.09 0.00 -0.15 0.00 0.00 55.06 54.96 2ri3 s HIS 301 Cb 0.00 -2.32 -0.04 0.00 1.11 0.00 0.00 32.58 31.32 2ri3 s HIS 301 CO 0.00 -0.37 0.20 0.21 -0.85 0.00 0.00 174.74 173.93 2ri3 s LYS 302 N -4.53 3.67 -0.21 1.40 2.20 -1.26 -4.42 119.74 116.58 2ri3 s LYS 302 Ca 0.49 -0.01 -0.03 0.00 -0.36 0.00 0.00 55.97 56.05 2ri3 s LYS 302 Cb -0.10 -3.24 -0.01 0.00 -1.51 0.00 0.00 37.83 32.98 2ri3 s LYS 302 CO 0.37 0.68 -0.06 -1.17 -0.36 0.00 0.00 175.35 174.81 2ri3 s LEU 303 N -0.79 2.82 0.11 5.43 2.96 -1.26 -4.19 118.68 123.74 2ri3 s LEU 303 Ca 0.16 -0.41 -0.30 0.00 -0.22 0.00 0.00 54.13 53.35 2ri3 s LEU 303 Cb -0.13 -1.71 -0.07 0.00 0.50 0.00 0.00 46.19 44.78 2ri3 s LEU 303 CO 0.05 -0.01 1.23 -1.10 -1.32 0.00 0.00 176.35 175.20 2ri3 s GLN 304 N 1.44 4.43 0.64 1.98 -1.52 0.35 -4.75 119.66 122.23 2ri3 s GLN 304 Ca 0.05 1.85 -0.12 0.00 -1.95 0.00 0.00 55.36 55.19 2ri3 s GLN 304 Cb -0.14 -3.30 -0.02 0.00 -0.22 0.00 0.00 33.01 29.33 2ri3 s GLN 304 CO -0.04 -0.23 1.04 -1.25 -0.25 0.00 0.00 175.29 174.56 2ri3 s PRO 305 N 0.65 3.31 0.42 2.91 0.04 -1.26 -4.14 135.00 136.92 2ri3 s PRO 305 Ca 0.58 0.92 -0.27 0.00 0.04 0.00 0.00 61.00 62.28 2ri3 s PRO 305 Cb -0.32 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.09 2ri3 s PRO 305 CO 0.32 -0.80 1.47 -2.14 0.04 0.00 0.00 177.00 175.88 2ri3 s PRO 306 N -4.85 3.87 -0.34 0.56 0.02 -1.26 -4.78 135.00 128.21 2ri3 s PRO 306 Ca 0.58 2.51 -0.33 0.00 0.02 0.00 0.00 61.00 63.79 2ri3 s PRO 306 Cb -0.13 -2.80 -0.10 0.00 0.02 0.00 0.00 34.50 31.50 2ri3 s PRO 306 CO 0.50 -0.71 2.23 1.17 -0.33 0.00 0.00 177.00 179.86 2ri3 n LYS 307 N 0.09 1.29 0.00 5.54 4.81 -1.21 -0.56 118.16 128.12 2ri3 n LYS 307 Ca 0.03 0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.80 2ri3 n LYS 307 Cb 0.40 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.74 2ri3 n LYS 307 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ri3 n GLY 308 N 6.30 1.04 3.23 3.14 0.00 -1.26 -4.68 105.19 112.96 2ri3 n GLY 308 Ca 0.39 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.27 2ri3 n GLY 308 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ri3 s TYR 309 N -1.58 1.27 -0.12 1.61 1.51 0.28 -5.14 117.35 115.18 2ri3 s TYR 309 Ca 0.00 -1.33 0.02 0.00 -1.01 0.00 0.00 57.07 54.75 2ri3 s TYR 309 Cb 0.00 -0.66 -0.00 0.00 -0.11 0.00 0.00 41.96 41.19 2ri3 s TYR 309 CO 0.00 -0.56 -0.19 0.15 -1.11 0.00 0.00 175.55 173.84 2ri3 s LYS 310 N -4.12 3.17 0.56 -0.62 -0.14 -1.26 -4.78 119.74 112.54 2ri3 s LYS 310 Ca 0.39 -0.80 0.28 0.00 -1.36 0.00 0.00 55.97 54.48 2ri3 s LYS 310 Cb 0.07 -2.46 1.63 0.00 -1.68 0.00 0.00 37.83 35.39 2ri3 s LYS 310 CO 0.13 0.14 2.17 1.05 -0.76 0.00 0.00 175.35 178.07 2ri3 h GLU 311 N 6.89 0.00 -0.53 1.68 4.11 -1.93 -0.72 114.58 124.08 2ri3 h GLU 311 Ca -0.25 0.00 0.07 0.00 0.07 0.00 0.00 59.36 59.26 2ri3 h GLU 311 Cb 1.22 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 2ri3 h GLU 311 CO 0.52 0.06 0.36 1.49 0.07 0.00 0.00 179.01 181.51 2ri3 h GLU 312 N 0.00 0.41 -2.14 1.06 4.22 -1.93 -2.91 114.58 113.30 2ri3 h GLU 312 Ca -0.00 -0.02 -0.56 0.00 0.08 0.00 0.00 59.36 58.85 2ri3 h GLU 312 Cb 0.15 -0.09 -0.41 0.00 0.50 0.00 0.00 28.75 28.90 2ri3 h GLU 312 CO 0.01 0.27 -0.84 -0.85 -2.18 0.00 0.00 179.01 175.42 2ri3 n GLU 313 N -4.47 2.02 -4.11 1.92 0.28 -0.28 -5.05 120.64 110.94 2ri3 n GLU 313 Ca 0.08 -4.15 -0.18 0.00 -0.16 0.00 0.00 57.16 52.75 2ri3 n GLU 313 Cb 0.29 -1.91 -0.16 0.00 1.43 0.00 0.00 31.44 31.09 2ri3 n GLU 313 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 2ri3 s PHE 314 N -2.46 0.53 -0.05 -1.84 5.36 -1.10 -4.58 117.98 113.84 2ri3 s PHE 314 Ca 0.41 -0.11 -0.04 0.00 -0.96 0.00 0.00 56.93 56.23 2ri3 s PHE 314 Cb 0.23 -0.46 0.01 0.00 -0.34 0.00 0.00 43.02 42.46 2ri3 s PHE 314 CO -0.08 -0.10 0.12 -1.54 -1.46 0.00 0.00 175.22 172.16 2ri3 s SER 315 N 0.54 -0.13 0.06 6.13 1.04 -1.26 -5.03 113.70 115.05 2ri3 s SER 315 Ca -0.06 0.25 -0.37 0.00 0.48 0.00 0.00 55.95 56.25 2ri3 s SER 315 Cb -0.10 0.24 -0.20 0.00 0.10 0.00 0.00 66.02 66.06 2ri3 s SER 315 CO -0.00 -0.05 1.53 -0.50 0.98 0.00 0.00 173.24 175.19 2ri3 h TRP 316 N 6.07 -1.23 -0.82 5.02 4.06 -2.00 -0.93 115.95 126.12 2ri3 h TRP 316 Ca -0.26 -0.03 0.16 0.00 2.06 0.00 0.00 58.89 60.82 2ri3 h TRP 316 Cb 1.20 0.41 -0.15 0.00 -1.00 0.00 0.00 29.16 29.61 2ri3 h TRP 316 CO 0.41 -0.76 -0.21 -1.13 -3.56 0.00 0.00 178.44 173.19 2ri3 n SER 317 N -5.62 -0.30 0.11 -3.49 3.41 -1.26 -0.43 113.62 106.03 2ri3 n SER 317 Ca -0.16 1.40 -0.17 0.00 -0.26 0.00 0.00 58.87 59.68 2ri3 n SER 317 Cb 0.52 -0.42 -0.14 0.00 -0.26 0.00 0.00 64.21 63.91 2ri3 n SER 317 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2ri3 h GLN 318 N 0.00 0.31 -0.75 4.33 4.15 -1.98 -2.72 115.11 118.45 2ri3 h GLN 318 Ca 0.39 -0.52 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 2ri3 h GLN 318 Cb 0.59 0.19 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 2ri3 h GLN 318 CO -0.84 1.24 0.44 -0.92 -1.93 0.00 0.00 178.83 176.83 2ri3 h TYR 319 N 0.08 0.98 -0.57 3.99 3.20 0.59 0.18 116.97 125.43 2ri3 h TYR 319 Ca -0.16 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.61 2ri3 h TYR 319 Cb 2.00 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 39.93 2ri3 h TYR 319 CO 0.07 0.66 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.14 2ri3 h LEU 320 N 1.03 1.03 -0.37 2.82 3.38 -0.76 -1.15 115.31 121.28 2ri3 h LEU 320 Ca 0.27 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2ri3 h LEU 320 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2ri3 h LEU 320 CO -0.05 1.10 -0.03 -0.09 0.09 0.00 0.00 178.44 179.46 2ri3 h ARG 321 N 0.92 0.68 0.00 1.13 2.43 -1.06 0.59 114.38 119.08 2ri3 h ARG 321 Ca 0.16 -0.23 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2ri3 h ARG 321 Cb 0.60 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2ri3 h ARG 321 CO 0.04 0.80 -0.08 1.03 -1.51 0.00 0.00 179.97 180.25 2ri3 h SER 322 N 0.49 0.00 -0.01 -3.80 0.87 -0.43 -2.36 113.55 108.31 2ri3 h SER 322 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2ri3 h SER 322 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2ri3 h SER 322 CO 0.03 0.08 -0.06 0.35 -0.53 0.00 0.00 176.83 176.70 2ri3 n THR 323 N -3.58 0.00 -3.95 2.23 -2.24 -0.45 -4.99 114.28 101.30 2ri3 n THR 323 Ca -0.02 -0.47 -0.28 0.00 -2.27 0.00 0.00 64.05 61.01 2ri3 n THR 323 Cb 0.20 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 2ri3 n THR 323 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ri3 n ARG 324 N 0.29 -4.16 -4.53 -0.78 1.74 0.20 -4.95 116.66 104.46 2ri3 n ARG 324 Ca 0.05 0.49 -0.30 0.00 -0.77 0.00 0.00 57.85 57.32 2ri3 n ARG 324 Cb 0.22 -5.03 -0.07 0.00 -1.02 0.00 0.00 32.46 26.56 2ri3 n ARG 324 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ri3 s ALA 325 N -3.59 3.87 0.05 7.54 0.00 -0.68 -5.04 121.76 123.92 2ri3 s ALA 325 Ca 0.33 -1.15 0.09 0.00 0.00 0.00 0.00 51.96 51.23 2ri3 s ALA 325 Cb -0.17 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 2ri3 s ALA 325 CO 0.87 -0.12 -0.26 -0.65 0.00 0.00 0.00 175.76 175.60 2ri3 s GLN 326 N -3.90 1.75 0.20 0.00 -1.52 -1.26 -4.77 119.66 110.16 2ri3 s GLN 326 Ca 0.21 -1.11 -0.20 0.00 -1.95 0.00 0.00 55.36 52.31 2ri3 s GLN 326 Cb 0.03 -1.93 -0.08 0.00 -0.22 0.00 0.00 33.01 30.81 2ri3 s GLN 326 CO 0.11 0.50 0.72 0.00 -0.25 0.00 0.00 175.29 176.37 2ri3 s ALA 327 N -0.81 3.43 0.25 6.09 0.00 -1.26 -1.49 121.76 127.97 2ri3 s ALA 327 Ca 0.11 0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.95 2ri3 s ALA 327 Cb -0.10 -2.82 -0.11 0.00 0.00 0.00 0.00 23.12 20.09 2ri3 s ALA 327 CO 0.02 0.33 1.54 0.00 0.00 0.00 0.00 175.76 177.66 2ri3 s ALA 328 N -1.44 3.73 0.35 0.00 0.00 0.14 -4.76 121.76 119.77 2ri3 s ALA 328 Ca 0.41 1.45 -0.28 0.00 0.00 0.00 0.00 51.96 53.53 2ri3 s ALA 328 Cb -0.18 -3.61 -0.12 0.00 0.00 0.00 0.00 23.12 19.21 2ri3 s ALA 328 CO 0.22 -0.85 1.46 -2.30 0.00 0.00 0.00 175.76 174.28 2ri3 n PRO 329 N 2.71 2.54 0.29 0.00 -0.02 -1.26 -4.60 135.00 134.66 2ri3 n PRO 329 Ca 0.09 0.89 0.19 0.00 -2.02 0.00 0.00 63.50 62.65 2ri3 n PRO 329 Cb 0.38 -2.60 0.83 0.00 -0.02 0.00 0.00 33.50 32.10 2ri3 n PRO 329 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2ri3 h LYS 330 N 3.22 0.00 0.00 -0.52 2.10 -1.98 -3.03 116.57 116.37 2ri3 h LYS 330 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2ri3 h LYS 330 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2ri3 h LYS 330 CO 0.67 0.00 0.00 -2.39 -2.00 0.00 0.00 179.45 175.73 2ri3 n HIS 331 N -3.03 0.00 0.07 0.07 1.44 -1.26 -2.37 115.22 110.14 2ri3 n HIS 331 Ca -0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 2ri3 n HIS 331 Cb 0.23 -0.43 -0.05 0.00 0.12 0.00 0.00 29.99 29.86 2ri3 n HIS 331 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2ri3 h LEU 332 N 0.00 0.00 -9.48 2.39 3.38 -1.92 -3.46 115.31 106.22 2ri3 h LEU 332 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2ri3 h LEU 332 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2ri3 h LEU 332 CO 0.00 0.65 0.32 -0.36 0.09 0.00 0.00 178.44 179.14 2ri3 s PHE 333 N -2.88 3.72 -0.22 1.13 0.40 -1.00 -4.89 117.98 114.24 2ri3 s PHE 333 Ca 0.00 1.68 0.19 0.00 -0.60 0.00 0.00 56.93 58.20 2ri3 s PHE 333 Cb 0.08 -3.04 0.26 0.00 0.51 0.00 0.00 43.02 40.84 2ri3 s PHE 333 CO 0.79 0.11 1.55 -0.39 0.70 0.00 0.00 175.22 177.98 2ri3 h VAL 334 N 4.44 0.52 -3.38 -0.44 -1.51 -1.87 -3.43 116.25 110.59 2ri3 h VAL 334 Ca -0.42 -1.67 -0.67 0.00 -1.23 0.00 0.00 66.70 62.71 2ri3 h VAL 334 Cb 1.21 2.20 -0.35 0.00 -2.13 0.00 0.00 31.29 32.22 2ri3 h VAL 334 CO 0.73 0.29 -0.83 -0.55 -1.23 0.00 0.00 177.57 175.99 2ri3 s SER 335 N -6.34 3.71 0.00 4.19 0.15 -1.26 -4.89 113.70 109.26 2ri3 s SER 335 Ca 0.05 -0.91 0.00 0.00 0.70 0.00 0.00 55.95 55.79 2ri3 s SER 335 Cb 0.07 -1.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.85 2ri3 s SER 335 CO 0.71 -0.08 0.57 0.00 1.20 0.00 0.00 173.24 175.64 2ri3 n GLN 336 N 4.57 0.00 -3.37 5.44 6.02 -1.26 -4.63 117.38 124.15 2ri3 n GLN 336 Ca -0.18 -0.55 -0.17 0.00 -0.01 0.00 0.00 57.00 56.09 2ri3 n GLN 336 Cb 0.47 -0.43 0.08 0.00 1.02 0.00 0.00 30.24 31.38 2ri3 n GLN 336 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2ri3 n SER 337 N 0.00 -2.71 -0.06 1.08 7.64 -1.26 -4.91 113.62 113.39 2ri3 n SER 337 Ca 0.00 -0.57 -0.07 0.00 1.01 0.00 0.00 58.87 59.24 2ri3 n SER 337 Cb 0.55 -4.84 -0.09 0.00 -1.01 0.00 0.00 64.21 58.82 2ri3 n SER 337 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2ri3 n HIS 338 N -4.09 0.00 -1.79 1.43 8.25 -1.26 -5.00 115.22 112.76 2ri3 n HIS 338 Ca -0.23 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 56.93 2ri3 n HIS 338 Cb 0.64 -0.60 0.06 0.00 1.12 0.00 0.00 29.99 31.21 2ri3 n HIS 338 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2ri3 s SER 339 N -4.70 5.20 0.42 0.41 1.04 -1.26 -5.03 113.70 109.78 2ri3 s SER 339 Ca -0.09 1.20 -0.26 0.00 0.48 0.00 0.00 55.95 57.27 2ri3 s SER 339 Cb 0.04 -1.98 -0.09 0.00 0.10 0.00 0.00 66.02 64.09 2ri3 s SER 339 CO 0.47 -1.51 1.40 -2.16 0.98 0.00 0.00 173.24 172.42 2ri3 s PRO 340 N -5.29 3.87 0.57 4.02 0.04 -1.26 -4.75 135.00 132.19 2ri3 s PRO 340 Ca 0.59 2.38 -0.14 0.00 0.04 0.00 0.00 61.00 63.86 2ri3 s PRO 340 Cb -0.12 -2.76 -0.06 0.00 0.04 0.00 0.00 34.50 31.60 2ri3 s PRO 340 CO 0.53 -0.65 1.01 -1.25 0.04 0.00 0.00 177.00 176.67 2ri3 s PRO 341 N -2.30 3.74 0.26 0.56 0.04 -1.25 -3.79 135.00 132.26 2ri3 s PRO 341 Ca 0.58 0.88 -0.31 0.00 0.04 0.00 0.00 61.00 62.19 2ri3 s PRO 341 Cb -0.43 -2.10 -0.12 0.00 0.04 0.00 0.00 34.50 31.89 2ri3 s PRO 341 CO 0.56 -0.45 1.58 -0.35 0.04 0.00 0.00 177.00 178.38 2ri3 n PRO 342 N -2.16 2.57 -2.05 0.56 -0.04 -1.25 -4.89 135.00 127.75 2ri3 n PRO 342 Ca 0.06 0.92 -0.42 0.00 -0.04 0.00 0.00 63.50 64.02 2ri3 n PRO 342 Cb 0.54 -2.69 -0.03 0.00 -0.04 0.00 0.00 33.50 31.28 2ri3 n PRO 342 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ri3 s LEU 343 N -0.02 4.35 0.00 1.53 1.43 -1.26 -3.11 118.68 121.60 2ri3 s LEU 343 Ca 0.67 2.38 0.00 0.00 -1.03 0.00 0.00 54.13 56.15 2ri3 s LEU 343 Cb -0.53 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.11 2ri3 s LEU 343 CO 0.45 -0.79 0.00 0.61 0.23 0.00 0.00 176.35 176.85 2ri3 n GLY 344 N 3.78 1.33 3.25 -3.19 0.00 -1.26 -4.75 105.19 104.34 2ri3 n GLY 344 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2ri3 n GLY 344 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ri3 s PHE 345 N -3.41 3.07 0.05 1.61 0.40 -1.18 -4.38 117.98 114.13 2ri3 s PHE 345 Ca 0.00 -1.32 0.05 0.00 -0.60 0.00 0.00 56.93 55.05 2ri3 s PHE 345 Cb 0.00 -2.11 -0.02 0.00 0.51 0.00 0.00 43.02 41.39 2ri3 s PHE 345 CO 0.00 -0.67 -0.13 -0.65 0.70 0.00 0.00 175.22 174.47 2ri3 s GLN 346 N 1.39 0.84 0.19 0.44 -0.21 -1.26 -4.73 119.66 116.32 2ri3 s GLN 346 Ca 0.02 -0.83 -0.32 0.00 0.02 0.00 0.00 55.36 54.25 2ri3 s GLN 346 Cb -0.16 -0.83 -0.15 0.00 1.00 0.00 0.00 33.01 32.87 2ri3 s GLN 346 CO -0.03 0.19 1.27 0.28 -2.12 0.00 0.00 175.29 174.89 2ri3 n VAL 347 N 1.63 0.85 0.00 1.09 0.31 -1.26 -1.78 118.33 119.17 2ri3 n VAL 347 Ca -0.20 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 2ri3 n VAL 347 Cb 0.55 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.39 2ri3 n VAL 347 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ri3 n GLY 348 N 2.13 3.23 3.78 2.92 0.00 0.89 -5.00 105.19 113.14 2ri3 n GLY 348 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2ri3 n GLY 348 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ri3 s MET 349 N -0.67 2.84 0.25 1.61 -1.94 -0.73 -4.41 119.30 116.26 2ri3 s MET 349 Ca 0.00 1.31 0.10 0.00 -1.71 0.00 0.00 55.69 55.39 2ri3 s MET 349 Cb 0.00 -1.96 -0.04 0.00 2.01 0.00 0.00 34.83 34.83 2ri3 s MET 349 CO 0.00 -1.21 -0.08 0.15 -0.01 0.00 0.00 175.02 173.87 2ri3 s LYS 350 N -4.23 2.05 0.21 2.03 1.02 0.15 -1.11 119.74 119.86 2ri3 s LYS 350 Ca 0.65 -1.50 -0.12 0.00 0.02 0.00 0.00 55.97 55.02 2ri3 s LYS 350 Cb -0.19 -2.04 0.04 0.00 -0.52 0.00 0.00 37.83 35.13 2ri3 s LYS 350 CO 0.43 0.37 0.60 1.47 -0.92 0.00 0.00 175.35 177.30 2ri3 n LEU 351 N -0.64 0.00 -4.54 3.17 -0.00 -0.29 -0.58 117.00 114.13 2ri3 n LEU 351 Ca -0.07 -1.44 -0.34 0.00 -0.00 0.00 0.00 56.01 54.17 2ri3 n LEU 351 Cb 0.59 2.31 -0.12 0.00 -0.00 0.00 0.00 43.42 46.20 2ri3 n LEU 351 CO 0.39 -0.48 -0.39 -1.61 -0.00 0.00 0.00 177.39 175.29 2ri3 s GLU 352 N -2.05 2.83 -0.01 1.47 2.02 -0.35 -0.14 118.70 122.47 2ri3 s GLU 352 Ca 0.13 -0.58 -0.03 0.00 0.02 0.00 0.00 54.97 54.50 2ri3 s GLU 352 Cb -0.03 -2.59 -0.00 0.00 0.10 0.00 0.00 34.13 31.62 2ri3 s GLU 352 CO 0.06 0.59 0.07 0.00 0.02 0.00 0.00 175.26 176.00 2ri3 s ALA 353 N -0.62 -0.16 -0.11 5.21 0.00 -0.14 -0.58 121.76 125.36 2ri3 s ALA 353 Ca 0.09 -0.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.71 2ri3 s ALA 353 Cb -0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 2ri3 s ALA 353 CO 0.02 -0.11 1.06 0.08 0.00 0.00 0.00 175.76 176.80 2ri3 s VAL 354 N -0.66 4.65 -0.69 0.00 1.01 0.40 -0.23 120.40 124.88 2ri3 s VAL 354 Ca -0.07 1.94 -0.27 0.00 0.00 0.00 0.00 61.98 63.58 2ri3 s VAL 354 Cb -0.05 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.09 2ri3 s VAL 354 CO 0.00 -0.03 1.57 -0.62 0.00 0.00 0.00 175.10 176.03 2ri3 s ASP 355 N 1.21 5.72 0.11 3.32 -1.08 -0.12 -4.80 116.67 121.03 2ri3 s ASP 355 Ca 0.49 -0.11 0.06 0.00 -0.52 0.00 0.00 52.55 52.48 2ri3 s ASP 355 Cb -0.19 -2.55 0.32 0.00 -1.46 0.00 0.00 42.92 39.05 2ri3 s ASP 355 CO 0.17 -2.11 1.11 0.54 0.52 0.00 0.00 175.17 175.40 2ri3 n ARG 356 N 9.27 0.04 0.01 4.34 1.74 -1.26 0.63 116.66 131.42 2ri3 n ARG 356 Ca 0.13 0.48 -0.08 0.00 -0.77 0.00 0.00 57.85 57.60 2ri3 n ARG 356 Cb 0.50 -1.74 -0.13 0.00 -1.02 0.00 0.00 32.46 30.08 2ri3 n ARG 356 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 2ri3 h MET 357 N 0.00 0.01 -2.31 5.56 2.86 -1.93 -3.39 114.93 115.73 2ri3 h MET 357 Ca 0.00 -0.01 -0.58 0.00 -2.06 0.00 0.00 59.70 57.04 2ri3 h MET 357 Cb 0.21 0.00 -0.39 0.00 0.06 0.00 0.00 31.60 31.48 2ri3 h MET 357 CO 0.00 0.69 -0.92 0.94 1.06 0.00 0.00 176.91 178.68 2ri3 n GLN 358 N -3.17 0.90 0.18 1.72 7.27 0.20 -5.00 117.38 119.49 2ri3 n GLN 358 Ca -0.11 -3.56 0.11 0.00 0.07 0.00 0.00 57.00 53.51 2ri3 n GLN 358 Cb 1.01 -1.66 0.30 0.00 2.41 0.00 0.00 30.24 32.30 2ri3 n GLN 358 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2ri3 h PRO 359 N 4.82 0.00 0.00 3.69 0.11 -1.54 0.66 132.00 139.74 2ri3 h PRO 359 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2ri3 h PRO 359 Cb 0.85 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2ri3 h PRO 359 CO 0.51 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.96 2ri3 h SER 360 N 0.00 0.00 -3.38 -2.05 4.64 -1.95 -3.44 113.55 107.37 2ri3 h SER 360 Ca 0.13 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.85 2ri3 h SER 360 Cb 1.92 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.89 2ri3 h SER 360 CO -0.00 0.00 -0.42 -0.76 -0.87 0.00 0.00 176.83 174.78 2ri3 s LEU 361 N -4.64 4.19 -0.16 5.97 1.43 0.23 -5.00 118.68 120.70 2ri3 s LEU 361 Ca 0.10 0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2ri3 s LEU 361 Cb 0.12 -2.22 0.02 0.00 0.03 0.00 0.00 46.19 44.13 2ri3 s LEU 361 CO 0.58 0.10 -0.20 -0.69 0.23 0.00 0.00 176.35 176.37 2ri3 s VAL 362 N 0.67 2.01 0.28 -1.59 1.01 -1.26 -0.95 120.40 120.58 2ri3 s VAL 362 Ca 0.11 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.22 2ri3 s VAL 362 Cb -0.13 -1.80 -0.06 0.00 0.00 0.00 0.00 36.38 34.39 2ri3 s VAL 362 CO 0.02 0.54 -0.02 0.00 0.00 0.00 0.00 175.10 175.63 2ri3 s VAL 364 N -3.13 3.32 0.22 0.00 1.01 -0.39 -0.97 120.40 120.47 2ri3 s VAL 364 Ca 0.31 0.82 -0.00 0.00 0.00 0.00 0.00 61.98 63.11 2ri3 s VAL 364 Cb 0.05 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2ri3 s VAL 364 CO 0.12 0.02 0.12 0.00 0.00 0.00 0.00 175.10 175.36 2ri3 s ALA 365 N 2.03 1.38 0.06 5.51 0.00 0.81 -3.04 121.76 128.51 2ri3 s ALA 365 Ca 0.67 -1.76 0.01 0.00 0.00 0.00 0.00 51.96 50.88 2ri3 s ALA 365 Cb -0.36 1.27 -0.03 0.00 0.00 0.00 0.00 23.12 24.00 2ri3 s ALA 365 CO 0.29 -0.54 -0.05 -1.12 0.00 0.00 0.00 175.76 174.34 2ri3 s SER 366 N -3.22 0.70 -0.26 0.00 0.01 -0.00 -1.13 113.70 109.79 2ri3 s SER 366 Ca 0.39 -0.80 -0.18 0.00 1.31 0.00 0.00 55.95 56.66 2ri3 s SER 366 Cb 0.07 0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.39 2ri3 s SER 366 CO 0.13 -0.42 0.54 -0.69 0.41 0.00 0.00 173.24 173.21 2ri3 s VAL 367 N -2.79 5.05 -0.59 3.43 1.01 -0.27 -0.62 120.40 125.63 2ri3 s VAL 367 Ca -0.00 0.90 0.11 0.00 0.00 0.00 0.00 61.98 62.99 2ri3 s VAL 367 Cb -0.00 -3.86 -0.10 0.00 0.00 0.00 0.00 36.38 32.42 2ri3 s VAL 367 CO -0.04 0.06 0.49 0.35 0.00 0.00 0.00 175.10 175.95 2ri3 n THR 368 N 5.19 0.00 -3.54 3.92 -2.24 -0.57 -0.08 114.28 116.95 2ri3 n THR 368 Ca -0.03 -0.27 -0.16 0.00 -2.27 0.00 0.00 64.05 61.32 2ri3 n THR 368 Cb 0.50 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.69 2ri3 n THR 368 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ri3 s ASP 369 N -1.94 -0.55 -0.05 3.42 -1.08 -1.26 -4.90 116.67 110.32 2ri3 s ASP 369 Ca 0.05 0.43 -0.02 0.00 -0.52 0.00 0.00 52.55 52.49 2ri3 s ASP 369 Cb 0.08 0.51 0.03 0.00 -1.46 0.00 0.00 42.92 42.09 2ri3 s ASP 369 CO 0.42 -0.67 0.08 -0.69 0.52 0.00 0.00 175.17 174.83 2ri3 s VAL 370 N -1.85 -0.13 -0.04 1.11 1.01 -1.26 -0.44 120.40 118.80 2ri3 s VAL 370 Ca -0.08 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2ri3 s VAL 370 Cb -0.01 -0.17 0.02 0.00 0.00 0.00 0.00 36.38 36.22 2ri3 s VAL 370 CO 0.04 0.17 -0.03 -0.69 0.00 0.00 0.00 175.10 174.59 2ri3 s VAL 371 N 2.13 0.41 0.00 2.92 1.01 -0.25 -5.00 120.40 121.63 2ri3 s VAL 371 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2ri3 s VAL 371 Cb -0.12 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.80 2ri3 s VAL 371 CO -0.03 0.19 0.00 -0.90 0.00 0.00 0.00 175.10 174.36 2ri3 n ASP 372 N 4.03 0.00 -1.60 3.32 5.75 -1.26 -0.78 116.55 126.01 2ri3 n ASP 372 Ca -0.26 0.00 0.07 0.00 -0.01 0.00 0.00 54.79 54.59 2ri3 n ASP 372 Cb 0.51 0.00 0.36 0.00 -1.03 0.00 0.00 41.12 40.96 2ri3 n ASP 372 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2ri3 n SER 373 N 4.43 5.14 -4.48 -1.12 3.41 -1.25 -3.76 113.62 115.98 2ri3 n SER 373 Ca 0.00 -2.98 -0.23 0.00 -0.26 0.00 0.00 58.87 55.39 2ri3 n SER 373 Cb 0.00 -0.65 -0.11 0.00 -0.26 0.00 0.00 64.21 63.20 2ri3 n SER 373 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2ri3 s ARG 374 N -2.81 1.69 0.06 4.33 0.52 0.04 -4.38 118.95 118.40 2ri3 s ARG 374 Ca 0.51 -1.91 -0.03 0.00 -0.52 0.00 0.00 55.73 53.78 2ri3 s ARG 374 Cb 0.40 -1.19 -0.03 0.00 0.52 0.00 0.00 34.95 34.65 2ri3 s ARG 374 CO 0.14 -0.05 0.04 -0.59 0.02 0.00 0.00 175.30 174.85 2ri3 s PHE 375 N -3.02 0.39 -0.24 -0.53 -0.71 -0.24 -1.09 117.98 112.54 2ri3 s PHE 375 Ca 0.33 -0.88 -0.12 0.00 -1.04 0.00 0.00 56.93 55.22 2ri3 s PHE 375 Cb 0.07 -0.28 -0.05 0.00 -1.21 0.00 0.00 43.02 41.55 2ri3 s PHE 375 CO 0.15 -0.41 0.24 -1.17 -1.34 0.00 0.00 175.22 172.68 2ri3 s LEU 376 N -2.78 4.10 -0.21 -1.99 2.96 0.42 -1.55 118.68 119.64 2ri3 s LEU 376 Ca 0.05 0.20 -0.17 0.00 -0.22 0.00 0.00 54.13 53.98 2ri3 s LEU 376 Cb 0.06 -2.23 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 2ri3 s LEU 376 CO -0.09 -0.01 0.45 -0.69 -1.32 0.00 0.00 176.35 174.69 2ri3 s VAL 377 N 1.33 5.15 0.02 1.68 1.01 0.01 -1.52 120.40 128.08 2ri3 s VAL 377 Ca 0.11 0.81 0.09 0.00 0.00 0.00 0.00 61.98 62.98 2ri3 s VAL 377 Cb -0.14 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2ri3 s VAL 377 CO 0.07 0.21 -0.26 -2.28 0.00 0.00 0.00 175.10 172.84 2ri3 s HIS 378 N 1.52 2.29 -0.45 5.22 2.46 0.21 -2.09 115.29 124.45 2ri3 s HIS 378 Ca 0.21 -0.42 -0.19 0.00 0.47 0.00 0.00 55.06 55.13 2ri3 s HIS 378 Cb -0.15 -1.41 0.03 0.00 -0.13 0.00 0.00 32.58 30.92 2ri3 s HIS 378 CO 0.09 0.07 0.55 -0.06 -2.47 0.00 0.00 174.74 172.91 2ri3 s PHE 379 N -0.73 3.11 -0.46 3.88 0.08 -1.26 -0.82 117.98 121.78 2ri3 s PHE 379 Ca 0.11 -0.32 -0.44 0.00 0.12 0.00 0.00 56.93 56.40 2ri3 s PHE 379 Cb -0.10 -3.20 -0.19 0.00 -0.57 0.00 0.00 43.02 38.96 2ri3 s PHE 379 CO 0.01 -0.84 1.49 -0.25 -0.10 0.00 0.00 175.22 175.53 2ri3 n ASP 380 N 5.94 1.11 -0.69 1.36 9.92 -1.17 -0.70 116.55 132.32 2ri3 n ASP 380 Ca -0.05 1.11 -0.09 0.00 -0.53 0.00 0.00 54.79 55.23 2ri3 n ASP 380 Cb 0.47 -0.82 -0.04 0.00 -0.64 0.00 0.00 41.12 40.09 2ri3 n ASP 380 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2ri3 n ASN 381 N 3.69 -5.47 -4.08 -2.24 5.15 -1.26 -3.14 115.26 107.92 2ri3 n ASN 381 Ca 0.29 0.22 -0.17 0.00 -0.60 0.00 0.00 54.58 54.32 2ri3 n ASN 381 Cb -0.05 -3.76 0.02 0.00 -0.53 0.00 0.00 39.78 35.46 2ri3 n ASN 381 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 2ri3 n TRP 382 N -2.28 -1.58 -2.46 1.20 7.02 0.12 -4.54 117.44 114.92 2ri3 n TRP 382 Ca -0.09 -1.61 -0.37 0.00 -1.02 0.00 0.00 57.50 54.41 2ri3 n TRP 382 Cb 0.53 -0.36 -0.03 0.00 -2.42 0.00 0.00 31.31 29.03 2ri3 n TRP 382 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2ri3 s ASP 383 N -3.45 6.64 0.00 -0.99 -1.08 -1.26 -4.89 116.67 111.64 2ri3 s ASP 383 Ca 0.32 2.13 0.09 0.00 -0.52 0.00 0.00 52.55 54.56 2ri3 s ASP 383 Cb -0.03 -2.59 0.38 0.00 -1.46 0.00 0.00 42.92 39.22 2ri3 s ASP 383 CO 0.20 -0.58 1.26 -0.90 0.52 0.00 0.00 175.17 175.68 2ri3 n ASP 384 N -0.09 0.00 -0.12 -0.34 5.75 -1.26 -2.76 116.55 117.72 2ri3 n ASP 384 Ca 0.05 0.45 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 2ri3 n ASP 384 Cb 0.49 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2ri3 n ASP 384 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2ri3 n THR 385 N -1.47 0.00 -0.12 2.12 5.66 -1.26 -2.10 114.28 117.11 2ri3 n THR 385 Ca 0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 2ri3 n THR 385 Cb 0.10 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 68.73 2ri3 n THR 385 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2ri3 n TYR 386 N -0.37 0.00 -1.46 1.09 4.01 -1.11 -5.03 117.16 114.29 2ri3 n TYR 386 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.42 2ri3 n TYR 386 Cb 0.06 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.16 2ri3 n TYR 386 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2ri3 s ASP 387 N -0.29 4.75 -0.11 7.72 1.01 -0.89 -4.86 116.67 124.00 2ri3 s ASP 387 Ca 0.00 1.89 -0.26 0.00 0.71 0.00 0.00 52.55 54.89 2ri3 s ASP 387 Cb 0.00 -2.53 0.06 0.00 1.01 0.00 0.00 42.92 41.46 2ri3 s ASP 387 CO 0.00 -1.87 0.61 -0.72 0.21 0.00 0.00 175.17 173.40 2ri3 s TYR 388 N -2.68 -0.60 0.32 4.23 -0.85 -0.89 -4.83 117.35 112.05 2ri3 s TYR 388 Ca 0.63 1.19 -0.18 0.00 -0.52 0.00 0.00 57.07 58.20 2ri3 s TYR 388 Cb -0.18 0.31 -0.09 0.00 0.38 0.00 0.00 41.96 42.37 2ri3 s TYR 388 CO 0.50 -0.49 0.78 -1.58 -1.52 0.00 0.00 175.55 173.25 2ri3 s TRP 389 N -0.71 3.43 0.21 -3.49 0.52 -1.26 -0.81 118.94 116.82 2ri3 s TRP 389 Ca -0.08 1.35 -0.20 0.00 0.02 0.00 0.00 56.10 57.19 2ri3 s TRP 389 Cb -0.02 -2.63 0.07 0.00 -1.15 0.00 0.00 33.47 29.74 2ri3 s TRP 389 CO 0.06 0.11 0.97 0.00 0.02 0.00 0.00 176.95 178.11 2ri3 s ASP 391 N -3.33 3.47 0.65 0.00 1.47 -1.26 -1.08 116.67 116.59 2ri3 s ASP 391 Ca 0.21 -1.59 0.34 0.00 1.18 0.00 0.00 52.55 52.69 2ri3 s ASP 391 Cb -0.03 0.33 1.87 0.00 -0.34 0.00 0.00 42.92 44.75 2ri3 s ASP 391 CO 0.06 -0.80 2.09 -0.65 0.68 0.00 0.00 175.17 176.55 2ri3 h PRO 392 N 1.63 0.00 -0.06 2.11 0.11 -1.88 -1.87 132.00 132.05 2ri3 h PRO 392 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2ri3 h PRO 392 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2ri3 h PRO 392 CO 0.69 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.35 2ri3 n SER 393 N -3.14 1.67 -4.70 -2.05 3.41 -1.25 -2.12 113.62 105.45 2ri3 n SER 393 Ca -0.01 -1.59 -0.44 0.00 -0.26 0.00 0.00 58.87 56.57 2ri3 n SER 393 Cb 0.29 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 2ri3 n SER 393 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2ri3 n SER 394 N 0.31 3.44 -0.08 4.04 2.88 -0.70 -1.70 113.62 121.80 2ri3 n SER 394 Ca 0.18 1.10 0.13 0.00 -1.33 0.00 0.00 58.87 58.95 2ri3 n SER 394 Cb 0.37 -1.50 0.70 0.00 -0.75 0.00 0.00 64.21 63.03 2ri3 n SER 394 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2ri3 n PRO 395 N 3.07 1.11 -0.08 -1.46 -0.04 -1.26 -3.58 135.00 132.77 2ri3 n PRO 395 Ca 0.14 -0.17 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 2ri3 n PRO 395 Cb 0.33 -1.40 0.20 0.00 -0.04 0.00 0.00 33.50 32.58 2ri3 n PRO 395 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2ri3 n TYR 396 N -0.71 0.20 -4.35 0.54 4.01 -1.26 -4.94 117.16 110.65 2ri3 n TYR 396 Ca 0.19 -0.10 -0.25 0.00 -0.16 0.00 0.00 57.90 57.58 2ri3 n TYR 396 Cb 0.13 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.04 2ri3 n TYR 396 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2ri3 s ILE 397 N -1.80 2.00 0.05 -0.72 -4.36 -1.23 -0.45 121.20 114.68 2ri3 s ILE 397 Ca 0.33 -1.81 -0.09 0.00 -0.26 0.00 0.00 60.65 58.82 2ri3 s ILE 397 Cb 0.21 -1.86 -0.00 0.00 1.25 0.00 0.00 42.46 42.06 2ri3 s ILE 397 CO 0.31 -0.12 0.17 -1.00 0.24 0.00 0.00 174.94 174.54 2ri3 s HIS 398 N -1.53 0.10 0.78 1.37 3.76 0.25 -5.00 115.29 115.03 2ri3 s HIS 398 Ca 0.14 -0.38 -0.11 0.00 -0.15 0.00 0.00 55.06 54.57 2ri3 s HIS 398 Cb -0.08 -0.06 0.06 0.00 1.11 0.00 0.00 32.58 33.61 2ri3 s HIS 398 CO 0.07 -0.44 1.09 -1.25 -0.85 0.00 0.00 174.74 173.36 2ri3 s PRO 399 N -2.80 2.23 0.23 8.40 0.04 -1.26 -1.21 135.00 140.62 2ri3 s PRO 399 Ca -0.03 1.03 -0.32 0.00 0.04 0.00 0.00 61.00 61.72 2ri3 s PRO 399 Cb 0.00 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.51 2ri3 s PRO 399 CO -0.05 -1.62 1.50 0.28 0.04 0.00 0.00 177.00 177.14 2ri3 n VAL 400 N -3.49 0.66 -0.00 -0.36 0.31 -1.26 -2.02 118.33 112.16 2ri3 n VAL 400 Ca 0.08 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2ri3 n VAL 400 Cb 0.54 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.88 2ri3 n VAL 400 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ri3 n GLY 401 N 2.58 0.16 0.05 2.92 0.00 -1.26 -4.99 105.19 104.65 2ri3 n GLY 401 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 2ri3 n GLY 401 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2ri3 h TRP 402 N 0.00 -0.01 -0.91 1.61 7.01 -1.76 -2.41 115.95 119.48 2ri3 h TRP 402 Ca 0.00 0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.09 2ri3 h TRP 402 Cb 0.00 0.01 -0.07 0.00 -2.10 0.00 0.00 29.16 27.00 2ri3 h TRP 402 CO 0.00 -0.01 0.56 0.00 -2.79 0.00 0.00 178.44 176.19 2ri3 h GLN 404 N 0.96 0.36 0.00 0.00 4.15 -1.71 0.95 115.11 119.82 2ri3 h GLN 404 Ca 0.42 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.80 2ri3 h GLN 404 Cb 0.29 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.91 2ri3 h GLN 404 CO -0.21 0.31 0.00 0.87 -1.93 0.00 0.00 178.83 177.86 2ri3 h LYS 405 N 0.31 0.00 -0.02 1.69 1.57 -0.87 -2.78 116.57 116.47 2ri3 h LYS 405 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2ri3 h LYS 405 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2ri3 h LYS 405 CO -0.02 0.00 -0.24 1.04 -0.57 0.00 0.00 179.45 179.67 2ri3 n GLN 406 N -3.00 1.75 -1.67 3.15 1.13 -0.27 -4.96 117.38 113.52 2ri3 n GLN 406 Ca 0.01 -1.44 -0.12 0.00 -1.94 0.00 0.00 57.00 53.51 2ri3 n GLN 406 Cb 0.28 -1.46 -0.03 0.00 0.11 0.00 0.00 30.24 29.14 2ri3 n GLN 406 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ri3 n GLY 407 N 1.36 0.77 3.81 1.08 0.00 -0.31 -5.01 105.19 106.89 2ri3 n GLY 407 Ca 0.11 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 2ri3 n GLY 407 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ri3 s LYS 408 N -3.59 3.00 0.10 1.61 1.02 0.18 -5.03 119.74 117.02 2ri3 s LYS 408 Ca 0.00 -0.66 -0.31 0.00 0.02 0.00 0.00 55.97 55.02 2ri3 s LYS 408 Cb 0.00 -2.78 -0.07 0.00 -0.52 0.00 0.00 37.83 34.46 2ri3 s LYS 408 CO 0.00 0.57 1.31 -2.14 -0.92 0.00 0.00 175.35 174.17 2ri3 s PRO 409 N -2.49 4.37 -0.21 -1.68 0.02 -1.26 -4.30 135.00 129.44 2ri3 s PRO 409 Ca 0.31 1.96 -0.08 0.00 0.02 0.00 0.00 61.00 63.21 2ri3 s PRO 409 Cb -0.12 -3.28 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 2ri3 s PRO 409 CO 0.23 -0.36 0.08 -1.17 -0.33 0.00 0.00 177.00 175.46 2ri3 s LEU 410 N 1.01 3.76 -0.32 -5.54 2.96 -1.26 -4.50 118.68 114.78 2ri3 s LEU 410 Ca 0.62 0.00 -0.24 0.00 -0.22 0.00 0.00 54.13 54.29 2ri3 s LEU 410 Cb -0.34 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.38 2ri3 s LEU 410 CO 0.30 0.10 0.84 -0.89 -1.32 0.00 0.00 176.35 175.38 2ri3 s THR 411 N 0.83 4.73 0.88 3.68 2.01 0.25 -4.98 115.64 123.04 2ri3 s THR 411 Ca 0.04 1.21 -0.13 0.00 0.31 0.00 0.00 61.69 63.13 2ri3 s THR 411 Cb -0.13 -4.21 0.12 0.00 0.01 0.00 0.00 72.50 68.29 2ri3 s THR 411 CO 0.02 -0.33 1.18 -2.16 -0.69 0.00 0.00 174.62 172.64 2ri3 s PRO 412 N 3.11 1.42 0.54 4.92 0.04 -1.26 -1.26 135.00 142.51 2ri3 s PRO 412 Ca 0.34 0.12 -0.21 0.00 0.04 0.00 0.00 61.00 61.30 2ri3 s PRO 412 Cb -0.14 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 2ri3 s PRO 412 CO 0.14 -1.97 1.00 -2.30 0.04 0.00 0.00 177.00 173.91 2ri3 n PRO 413 N -3.58 1.13 -1.70 0.56 -0.02 -1.26 -4.77 135.00 125.36 2ri3 n PRO 413 Ca 0.08 0.42 -0.44 0.00 -2.02 0.00 0.00 63.50 61.54 2ri3 n PRO 413 Cb 0.60 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 2ri3 n PRO 413 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2ri3 n GLN 414 N -0.59 2.32 -1.30 -0.52 7.27 -1.19 -1.58 117.38 121.80 2ri3 n GLN 414 Ca 0.12 0.83 -0.10 0.00 0.07 0.00 0.00 57.00 57.91 2ri3 n GLN 414 Cb 0.44 -2.57 -0.04 0.00 2.41 0.00 0.00 30.24 30.48 2ri3 n GLN 414 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2ri3 n ASP 415 N 2.68 -5.16 -4.73 1.69 8.00 -1.26 -4.90 116.55 112.87 2ri3 n ASP 415 Ca 0.13 0.26 -0.42 0.00 0.71 0.00 0.00 54.79 55.47 2ri3 n ASP 415 Cb 0.33 -3.57 -0.02 0.00 -0.02 0.00 0.00 41.12 37.83 2ri3 n ASP 415 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ri3 n TYR 416 N -2.40 2.82 -1.86 1.24 9.36 -0.61 -4.87 117.16 120.85 2ri3 n TYR 416 Ca -0.10 0.12 -0.42 0.00 3.32 0.00 0.00 57.90 60.82 2ri3 n TYR 416 Cb 0.49 -2.65 -0.03 0.00 -0.63 0.00 0.00 39.34 36.53 2ri3 n TYR 416 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2ri3 s PRO 417 N 0.46 4.18 -1.00 2.98 0.04 -1.26 -3.08 135.00 137.31 2ri3 s PRO 417 Ca 0.70 2.44 -0.05 0.00 0.04 0.00 0.00 61.00 64.13 2ri3 s PRO 417 Cb -0.50 -3.33 -0.06 0.00 0.04 0.00 0.00 34.50 30.65 2ri3 s PRO 417 CO 0.39 -0.71 0.88 -3.47 0.04 0.00 0.00 177.00 174.13 2ri3 n ASP 418 N 4.70 -6.23 -0.35 6.66 2.03 -1.26 -4.90 116.55 117.20 2ri3 n ASP 418 Ca 0.15 -0.67 0.05 0.00 0.52 0.00 0.00 54.79 54.85 2ri3 n ASP 418 Cb 0.38 -4.97 0.13 0.00 -0.72 0.00 0.00 41.12 35.94 2ri3 n ASP 418 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2ri3 n PRO 419 N -3.18 -0.10 0.00 -0.67 -0.02 -1.18 -1.47 135.00 128.39 2ri3 n PRO 419 Ca -0.08 1.53 0.08 0.00 -2.02 0.00 0.00 63.50 63.02 2ri3 n PRO 419 Cb 0.62 -2.28 0.50 0.00 -0.02 0.00 0.00 33.50 32.31 2ri3 n PRO 419 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2ri3 n ASP 420 N -5.59 0.00 -0.83 2.55 5.68 -1.26 -2.65 116.55 114.46 2ri3 n ASP 420 Ca 0.15 -1.25 0.03 0.00 -0.50 0.00 0.00 54.79 53.23 2ri3 n ASP 420 Cb 0.48 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.67 2ri3 n ASP 420 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2ri3 n ASN 421 N -0.80 2.79 -3.39 -1.12 4.13 -0.54 -5.20 115.26 111.13 2ri3 n ASN 421 Ca 0.13 -3.44 -0.31 0.00 1.68 0.00 0.00 54.58 52.63 2ri3 n ASN 421 Cb 0.06 -0.56 0.28 0.00 -1.54 0.00 0.00 39.78 38.02 2ri3 n ASN 421 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2ri3 s PHE 422 N -3.06 -0.59 -0.01 3.10 5.36 -1.08 -5.09 117.98 116.61 2ri3 s PHE 422 Ca 0.41 0.44 -0.00 0.00 -0.96 0.00 0.00 56.93 56.82 2ri3 s PHE 422 Cb 0.36 -3.10 -0.00 0.00 -0.34 0.00 0.00 43.02 39.93 2ri3 s PHE 422 CO 0.02 -4.79 -0.01 0.91 -1.46 0.00 0.00 175.22 169.89 2ri3 n TRP 424 N -5.44 0.00 -0.33 10.12 5.03 -1.26 -5.08 117.44 120.47 2ri3 n TRP 424 Ca 0.15 0.00 0.06 0.00 3.03 0.00 0.00 57.50 60.74 2ri3 n TRP 424 Cb 0.61 -0.04 0.22 0.00 -1.03 0.00 0.00 31.31 31.07 2ri3 n TRP 424 CO 0.00 0.00 0.00 1.49 -0.03 0.00 0.00 177.69 179.15 2ri3 h GLU 425 N -0.03 0.85 0.04 -0.99 4.81 -2.03 0.12 114.58 117.34 2ri3 h GLU 425 Ca -0.03 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2ri3 h GLU 425 Cb 1.02 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2ri3 h GLU 425 CO -0.01 0.56 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.59 2ri3 h LYS 426 N 0.87 -0.05 -1.00 1.92 1.63 -1.99 -2.51 116.57 115.44 2ri3 h LYS 426 Ca 0.47 0.00 0.05 0.00 -0.85 0.00 0.00 60.65 60.32 2ri3 h LYS 426 Cb 0.51 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.09 2ri3 h LYS 426 CO -0.28 0.31 0.65 -0.92 -3.45 0.00 0.00 179.45 175.76 2ri3 h TYR 427 N -0.42 1.22 -0.30 1.91 3.20 -1.81 0.12 116.97 120.89 2ri3 h TYR 427 Ca -0.01 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 2ri3 h TYR 427 Cb 0.38 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 2ri3 h TYR 427 CO 0.05 0.68 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.98 2ri3 h LEU 428 N 1.23 0.54 -0.28 2.82 3.38 -0.79 -1.30 115.31 120.92 2ri3 h LEU 428 Ca 0.41 -0.17 -0.17 0.00 0.09 0.00 0.00 57.88 58.05 2ri3 h LEU 428 Cb 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2ri3 h LEU 428 CO -0.14 0.75 -0.48 -0.08 0.09 0.00 0.00 178.44 178.58 2ri3 h GLU 429 N 0.49 0.81 -0.66 1.13 4.81 -0.82 0.52 114.58 120.87 2ri3 h GLU 429 Ca 0.08 -0.50 -0.05 0.00 -0.13 0.00 0.00 59.36 58.76 2ri3 h GLU 429 Cb 0.62 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 2ri3 h GLU 429 CO 0.04 1.13 0.21 0.93 -0.73 0.00 0.00 179.01 180.59 2ri3 h GLU 430 N 0.57 1.01 0.00 1.92 5.08 -0.51 -3.07 114.58 119.58 2ri3 h GLU 430 Ca 0.02 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2ri3 h GLU 430 Cb 1.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2ri3 h GLU 430 CO 0.11 0.86 -1.21 0.25 -1.00 0.00 0.00 179.01 178.02 2ri3 n THR 431 N -4.27 0.20 -1.20 1.13 -2.24 -0.52 -4.96 114.28 102.43 2ri3 n THR 431 Ca 0.05 -0.33 -0.07 0.00 -2.27 0.00 0.00 64.05 61.43 2ri3 n THR 431 Cb 0.21 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.53 2ri3 n THR 431 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ri3 n GLY 432 N 1.32 0.83 3.90 3.38 0.00 0.18 -4.99 105.19 109.80 2ri3 n GLY 432 Ca 0.01 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 2ri3 n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ri3 s ALA 433 N -2.00 3.45 0.13 4.61 0.00 -1.03 -5.01 121.76 121.90 2ri3 s ALA 433 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 51.96 51.54 2ri3 s ALA 433 Cb 0.00 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2ri3 s ALA 433 CO 0.00 -0.05 0.30 -1.12 0.00 0.00 0.00 175.76 174.89 2ri3 s SER 434 N -3.49 6.38 0.21 0.00 0.01 -1.26 -4.78 113.70 110.77 2ri3 s SER 434 Ca 0.48 0.32 -0.19 0.00 1.31 0.00 0.00 55.95 57.86 2ri3 s SER 434 Cb -0.10 -1.98 -0.08 0.00 0.21 0.00 0.00 66.02 64.07 2ri3 s SER 434 CO 0.35 0.07 0.71 0.00 0.41 0.00 0.00 173.24 174.78 2ri3 s ALA 435 N -1.68 3.43 0.22 1.44 0.00 -1.26 -0.68 121.76 123.23 2ri3 s ALA 435 Ca 0.37 0.14 -0.32 0.00 0.00 0.00 0.00 51.96 52.14 2ri3 s ALA 435 Cb -0.12 -2.79 -0.12 0.00 0.00 0.00 0.00 23.12 20.09 2ri3 s ALA 435 CO 0.28 0.34 1.63 0.28 0.00 0.00 0.00 175.76 178.29 2ri3 n VAL 436 N 0.77 0.32 -2.04 0.00 0.31 0.26 -4.75 118.33 113.20 2ri3 n VAL 436 Ca -0.03 -0.08 -0.38 0.00 -0.01 0.00 0.00 64.34 63.84 2ri3 n VAL 436 Cb 0.51 -1.83 0.01 0.00 -0.91 0.00 0.00 33.84 31.61 2ri3 n VAL 436 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2ri3 s PRO 437 N 0.58 3.68 0.38 5.55 0.04 -1.26 -4.64 135.00 139.32 2ri3 s PRO 437 Ca 0.73 2.07 0.10 0.00 0.04 0.00 0.00 61.00 63.93 2ri3 s PRO 437 Cb -0.56 -2.52 0.86 0.00 0.04 0.00 0.00 34.50 32.33 2ri3 s PRO 437 CO 0.39 -0.70 1.90 1.15 0.04 0.00 0.00 177.00 179.78 2ri3 h THR 438 N 2.01 0.87 0.00 1.26 2.02 -1.98 -1.72 112.91 115.37 2ri3 h THR 438 Ca -0.50 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.46 2ri3 h THR 438 Cb 1.26 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2ri3 h THR 438 CO 0.60 0.12 0.00 4.11 0.37 0.00 0.00 175.52 180.72 2ri3 h TRP 439 N 0.64 0.00 0.00 3.16 5.08 -2.00 -2.67 115.95 120.15 2ri3 h TRP 439 Ca 0.39 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.34 2ri3 h TRP 439 Cb 0.64 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.79 2ri3 h TRP 439 CO -0.00 0.00 -0.10 0.00 -1.28 0.00 0.00 178.44 177.06 2ri3 h ALA 440 N 2.01 1.00 -2.08 0.11 0.00 -1.60 -3.43 119.26 115.26 2ri3 h ALA 440 Ca 0.00 -0.09 -0.59 0.00 0.00 0.00 0.00 54.91 54.23 2ri3 h ALA 440 Cb 0.23 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 2ri3 h ALA 440 CO 0.00 0.12 0.62 -0.06 0.00 0.00 0.00 179.25 179.93 2ri3 s PHE 441 N -3.58 3.15 -0.52 0.00 0.40 -1.01 -4.83 117.98 111.59 2ri3 s PHE 441 Ca 0.02 0.95 0.07 0.00 -0.60 0.00 0.00 56.93 57.37 2ri3 s PHE 441 Cb 0.09 -3.50 0.25 0.00 0.51 0.00 0.00 43.02 40.37 2ri3 s PHE 441 CO 0.60 -0.70 0.64 1.63 0.70 0.00 0.00 175.22 178.08 2ri3 n LYS 442 N 6.59 1.65 -1.65 0.44 5.02 -0.90 -5.05 118.16 124.26 2ri3 n LYS 442 Ca 0.08 -3.97 -0.44 0.00 -2.02 0.00 0.00 58.31 51.95 2ri3 n LYS 442 Cb 0.48 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 2ri3 n LYS 442 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2ri3 n VAL 443 N 1.12 1.46 -1.52 -0.18 3.14 -1.26 -3.82 118.33 117.27 2ri3 n VAL 443 Ca 0.26 -0.37 -0.31 0.00 -2.96 0.00 0.00 64.34 60.96 2ri3 n VAL 443 Cb 0.47 -1.34 0.06 0.00 -1.06 0.00 0.00 33.84 31.97 2ri3 n VAL 443 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ri3 s ARG 444 N -1.06 2.71 0.55 1.45 1.70 -0.69 -4.99 118.95 118.61 2ri3 s ARG 444 Ca 0.63 1.11 -0.18 0.00 -0.47 0.00 0.00 55.73 56.82 2ri3 s ARG 444 Cb -0.66 -1.96 -0.06 0.00 -0.57 0.00 0.00 34.95 31.71 2ri3 s ARG 444 CO 0.56 -1.29 1.07 -2.14 -1.08 0.00 0.00 175.30 172.42 2ri3 s PRO 445 N -4.79 3.48 0.66 3.89 0.02 -1.26 -4.98 135.00 132.03 2ri3 s PRO 445 Ca 0.61 1.36 -0.17 0.00 0.02 0.00 0.00 61.00 62.81 2ri3 s PRO 445 Cb -0.16 -2.05 -0.00 0.00 0.02 0.00 0.00 34.50 32.31 2ri3 s PRO 445 CO 0.52 -0.70 1.27 -2.14 -0.33 0.00 0.00 177.00 175.63 2ri3 s PRO 446 N -3.59 2.47 0.96 5.54 0.02 -1.26 -4.97 135.00 134.17 2ri3 s PRO 446 Ca 0.67 1.99 -0.12 0.00 0.02 0.00 0.00 61.00 63.56 2ri3 s PRO 446 Cb -0.18 -1.84 0.17 0.00 0.02 0.00 0.00 34.50 32.66 2ri3 s PRO 446 CO 0.29 -1.64 1.09 -3.38 -0.33 0.00 0.00 177.00 173.03 2ri3 s HIS 447 N -1.52 2.17 -0.19 6.54 -3.43 -0.75 -5.00 115.29 113.12 2ri3 s HIS 447 Ca 0.81 1.11 0.16 0.00 -0.80 0.00 0.00 55.06 56.33 2ri3 s HIS 447 Cb -0.35 -3.22 0.47 0.00 -1.43 0.00 0.00 32.58 28.05 2ri3 s HIS 447 CO 0.40 -2.71 1.37 0.43 -2.00 0.00 0.00 174.74 172.23 2ri3 n SER 448 N -4.07 3.25 -4.75 7.38 7.64 -1.26 -4.99 113.62 116.81 2ri3 n SER 448 Ca 0.06 -3.19 -0.41 0.00 1.01 0.00 0.00 58.87 56.34 2ri3 n SER 448 Cb 0.56 -0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 63.19 2ri3 n SER 448 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2ri3 s PHE 449 N -2.93 3.32 0.10 1.43 0.08 -1.26 -5.03 117.98 113.68 2ri3 s PHE 449 Ca 0.40 1.43 0.08 0.00 0.12 0.00 0.00 56.93 58.96 2ri3 s PHE 449 Cb 0.34 -3.51 -0.04 0.00 -0.57 0.00 0.00 43.02 39.24 2ri3 s PHE 449 CO 0.06 -1.41 -0.17 -0.51 -0.10 0.00 0.00 175.22 173.09 2ri3 s LEU 450 N -0.87 2.74 0.34 -0.37 1.43 -1.26 -4.97 118.68 115.72 2ri3 s LEU 450 Ca 0.51 -0.50 -0.28 0.00 -1.03 0.00 0.00 54.13 52.84 2ri3 s LEU 450 Cb -0.35 -1.59 -0.13 0.00 0.03 0.00 0.00 46.19 44.15 2ri3 s LEU 450 CO 0.42 0.20 1.21 0.52 0.23 0.00 0.00 176.35 178.93 2ri3 n VAL 451 N 0.96 2.04 0.00 -1.59 0.31 -1.26 -2.25 118.33 116.54 2ri3 n VAL 451 Ca -0.15 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.68 2ri3 n VAL 451 Cb 0.52 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 2ri3 n VAL 451 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2ri3 n ASN 452 N 0.84 0.00 -4.77 4.52 5.03 0.12 -4.95 115.26 116.04 2ri3 n ASN 452 Ca 0.06 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.11 2ri3 n ASN 452 Cb 0.35 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.10 2ri3 n ASN 452 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 2ri3 s MET 453 N -0.39 4.10 0.10 3.52 -1.94 -0.96 -4.62 119.30 119.11 2ri3 s MET 453 Ca 0.00 2.21 0.02 0.00 -1.71 0.00 0.00 55.69 56.22 2ri3 s MET 453 Cb 0.00 -2.87 -0.04 0.00 2.01 0.00 0.00 34.83 33.93 2ri3 s MET 453 CO 0.00 -0.41 0.16 0.15 -0.01 0.00 0.00 175.02 174.92 2ri3 s LYS 454 N -2.09 3.16 0.00 2.03 1.02 -0.43 -0.83 119.74 122.60 2ri3 s LYS 454 Ca 0.54 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.91 2ri3 s LYS 454 Cb -0.39 -2.86 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 2ri3 s LYS 454 CO 0.51 0.56 0.00 1.47 -0.92 0.00 0.00 175.35 176.98 2ri3 n LEU 455 N 0.12 0.00 -4.28 3.17 -0.00 0.10 -0.78 117.00 115.33 2ri3 n LEU 455 Ca -0.07 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.64 2ri3 n LEU 455 Cb 0.52 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.78 2ri3 n LEU 455 CO 0.47 0.00 -0.56 -1.61 -0.00 0.00 0.00 177.39 175.70 2ri3 s GLU 456 N -1.30 1.96 -0.06 1.47 2.02 0.11 -0.33 118.70 122.56 2ri3 s GLU 456 Ca 0.00 -0.88 -0.06 0.00 0.02 0.00 0.00 54.97 54.05 2ri3 s GLU 456 Cb 0.00 -1.90 0.01 0.00 0.10 0.00 0.00 34.13 32.34 2ri3 s GLU 456 CO 0.00 0.52 0.16 0.00 0.02 0.00 0.00 175.26 175.96 2ri3 s ALA 457 N -0.58 -0.39 0.33 5.21 0.00 -0.83 -0.36 121.76 125.14 2ri3 s ALA 457 Ca 0.09 0.41 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 2ri3 s ALA 457 Cb -0.09 -0.24 -0.11 0.00 0.00 0.00 0.00 23.12 22.68 2ri3 s ALA 457 CO -0.01 -0.08 1.45 0.08 0.00 0.00 0.00 175.76 177.19 2ri3 s VAL 458 N -0.02 2.33 -0.07 0.00 1.01 -0.65 -1.24 120.40 121.77 2ri3 s VAL 458 Ca -0.01 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.99 2ri3 s VAL 458 Cb -0.02 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2ri3 s VAL 458 CO 0.00 0.07 1.23 -0.62 0.00 0.00 0.00 175.10 175.78 2ri3 s ASP 459 N -0.07 7.02 0.47 3.32 -1.08 0.14 -4.87 116.67 121.60 2ri3 s ASP 459 Ca 0.54 1.82 0.24 0.00 -0.52 0.00 0.00 52.55 54.63 2ri3 s ASP 459 Cb -0.44 -2.56 1.15 0.00 -1.46 0.00 0.00 42.92 39.61 2ri3 s ASP 459 CO 0.55 -0.62 1.95 0.03 0.52 0.00 0.00 175.17 177.59 2ri3 h ARG 460 N 7.61 0.00 0.16 4.34 2.47 -1.92 -2.57 114.38 124.47 2ri3 h ARG 460 Ca -0.33 0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.09 2ri3 h ARG 460 Cb 1.15 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.48 2ri3 h ARG 460 CO 0.90 0.20 -1.50 0.00 0.56 0.00 0.00 179.97 180.13 2ri3 h ARG 461 N 0.00 0.33 -3.13 0.04 3.08 -1.97 -3.41 114.38 109.32 2ri3 h ARG 461 Ca -0.00 -0.57 -0.62 0.00 0.07 0.00 0.00 59.98 58.85 2ri3 h ARG 461 Cb 0.53 0.21 -0.41 0.00 0.08 0.00 0.00 29.97 30.39 2ri3 h ARG 461 CO 0.03 1.27 -0.68 1.21 -1.07 0.00 0.00 179.97 180.73 2ri3 s ASN 462 N -7.18 3.99 0.58 7.04 3.84 -1.21 -4.98 114.94 117.03 2ri3 s ASN 462 Ca -0.17 -2.98 0.20 0.00 0.21 0.00 0.00 52.86 50.11 2ri3 s ASN 462 Cb 0.04 -1.34 1.06 0.00 -0.55 0.00 0.00 41.25 40.47 2ri3 s ASN 462 CO 0.82 -0.22 1.57 -0.65 -2.79 0.00 0.00 177.10 175.83 2ri3 h PRO 463 N 6.39 0.00 0.00 0.43 0.11 -1.70 0.67 132.00 137.90 2ri3 h PRO 463 Ca -0.00 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 2ri3 h PRO 463 Cb 0.89 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 2ri3 h PRO 463 CO 0.60 0.00 -0.41 0.00 -0.21 0.00 0.00 178.00 177.98 2ri3 h ALA 464 N 1.00 0.98 -2.72 -0.75 0.00 -1.94 -3.44 119.26 112.40 2ri3 h ALA 464 Ca 0.00 -0.37 -0.60 0.00 0.00 0.00 0.00 54.91 53.94 2ri3 h ALA 464 Cb 0.93 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2ri3 h ALA 464 CO 0.00 0.51 -0.32 -0.51 0.00 0.00 0.00 179.25 178.93 2ri3 s LEU 465 N -7.10 4.32 -0.06 0.00 1.43 0.23 -5.00 118.68 112.49 2ri3 s LEU 465 Ca 0.00 0.62 0.02 0.00 -1.03 0.00 0.00 54.13 53.75 2ri3 s LEU 465 Cb 0.11 -3.04 0.01 0.00 0.03 0.00 0.00 46.19 43.30 2ri3 s LEU 465 CO 0.70 0.14 -0.12 -0.63 0.23 0.00 0.00 176.35 176.67 2ri3 s ILE 466 N -1.49 1.13 0.36 -0.59 1.01 -1.26 0.27 121.20 120.63 2ri3 s ILE 466 Ca 0.35 -0.49 0.09 0.00 0.00 0.00 0.00 60.65 60.60 2ri3 s ILE 466 Cb -0.13 -1.03 -0.07 0.00 0.01 0.00 0.00 42.46 41.24 2ri3 s ILE 466 CO 0.21 0.35 -0.07 -0.13 0.00 0.00 0.00 174.94 175.30 2ri3 s ARG 467 N 0.61 1.84 0.17 2.79 0.52 -0.37 -0.49 118.95 124.01 2ri3 s ARG 467 Ca -0.13 -1.97 -0.30 0.00 -0.52 0.00 0.00 55.73 52.80 2ri3 s ARG 467 Cb -0.15 -1.65 -0.08 0.00 0.52 0.00 0.00 34.95 33.58 2ri3 s ARG 467 CO 0.04 0.09 1.32 0.08 0.02 0.00 0.00 175.30 176.84 2ri3 s VAL 468 N -2.66 3.29 0.15 3.52 1.01 -0.97 -1.96 120.40 122.78 2ri3 s VAL 468 Ca 0.33 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.33 2ri3 s VAL 468 Cb 0.04 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2ri3 s VAL 468 CO 0.17 0.13 0.03 0.00 0.00 0.00 0.00 175.10 175.43 2ri3 s ALA 469 N 0.41 1.08 0.07 5.51 0.00 0.55 -2.96 121.76 126.42 2ri3 s ALA 469 Ca 0.59 -1.53 0.03 0.00 0.00 0.00 0.00 51.96 51.05 2ri3 s ALA 469 Cb -0.36 0.73 -0.03 0.00 0.00 0.00 0.00 23.12 23.46 2ri3 s ALA 469 CO 0.36 -0.42 -0.09 -1.12 0.00 0.00 0.00 175.76 174.49 2ri3 s SER 470 N -3.10 1.15 -0.41 0.00 0.01 -0.26 -0.72 113.70 110.36 2ri3 s SER 470 Ca 0.24 -0.69 -0.26 0.00 1.31 0.00 0.00 55.95 56.55 2ri3 s SER 470 Cb 0.07 0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.35 2ri3 s SER 470 CO 0.03 -0.24 0.92 -0.69 0.41 0.00 0.00 173.24 173.67 2ri3 s VAL 471 N -1.97 4.53 -0.06 3.43 1.01 -0.01 -1.38 120.40 125.95 2ri3 s VAL 471 Ca -0.02 0.97 -0.16 0.00 0.00 0.00 0.00 61.98 62.77 2ri3 s VAL 471 Cb -0.06 -4.38 -0.30 0.00 0.00 0.00 0.00 36.38 31.64 2ri3 s VAL 471 CO -0.00 -0.68 0.72 -0.08 0.00 0.00 0.00 175.10 175.05 2ri3 h GLU 472 N 8.77 0.34 -3.71 2.72 4.57 -0.24 0.33 114.58 127.36 2ri3 h GLU 472 Ca -0.24 -0.58 -0.08 0.00 -1.18 0.00 0.00 59.36 57.29 2ri3 h GLU 472 Cb 1.08 0.21 -0.09 0.00 -0.16 0.00 0.00 28.75 29.79 2ri3 h GLU 472 CO 1.00 1.28 -0.14 0.34 -1.18 0.00 0.00 179.01 180.31 2ri3 s ASP 473 N -7.17 -0.03 0.07 1.04 -1.08 -1.19 -4.82 116.67 103.49 2ri3 s ASP 473 Ca -0.16 -0.98 -0.06 0.00 -0.52 0.00 0.00 52.55 50.83 2ri3 s ASP 473 Cb 0.04 0.59 -0.02 0.00 -1.46 0.00 0.00 42.92 42.07 2ri3 s ASP 473 CO 0.83 -1.14 0.10 0.68 0.52 0.00 0.00 175.17 176.15 2ri3 s VAL 474 N -3.95 0.17 0.35 1.11 -7.23 -1.26 -0.01 120.40 109.58 2ri3 s VAL 474 Ca 0.24 -1.39 0.07 0.00 -1.81 0.00 0.00 61.98 59.09 2ri3 s VAL 474 Cb -0.00 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.58 2ri3 s VAL 474 CO 0.10 -0.77 0.27 -0.62 -0.31 0.00 0.00 175.10 173.77 2ri3 n GLU 475 N 0.13 0.43 -0.24 4.82 1.02 -0.40 -4.99 120.64 121.42 2ri3 n GLU 475 Ca -0.15 -3.40 -0.02 0.00 -0.02 0.00 0.00 57.16 53.57 2ri3 n GLU 475 Cb 0.61 2.67 0.09 0.00 -0.02 0.00 0.00 31.44 34.79 2ri3 n GLU 475 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2ri3 h ASP 476 N 2.02 0.60 0.00 1.62 3.32 -2.00 -3.31 116.42 118.67 2ri3 h ASP 476 Ca -0.25 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2ri3 h ASP 476 Cb 1.22 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.67 2ri3 h ASP 476 CO 0.37 0.39 0.00 1.41 -1.72 0.00 0.00 179.24 179.69 2ri3 n HIS 477 N -4.75 0.00 -4.21 4.55 8.25 -1.26 -1.80 115.22 116.00 2ri3 n HIS 477 Ca 0.08 -0.13 -0.14 0.00 -0.26 0.00 0.00 57.72 57.28 2ri3 n HIS 477 Cb 0.15 -0.01 -0.10 0.00 1.12 0.00 0.00 29.99 31.15 2ri3 n HIS 477 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2ri3 s ARG 478 N -0.25 0.94 0.10 -0.41 0.52 -1.25 -1.97 118.95 116.62 2ri3 s ARG 478 Ca 0.00 -1.31 0.06 0.00 -0.52 0.00 0.00 55.73 53.97 2ri3 s ARG 478 Cb 0.00 -0.53 -0.03 0.00 0.52 0.00 0.00 34.95 34.90 2ri3 s ARG 478 CO 0.00 0.07 -0.17 0.96 0.02 0.00 0.00 175.30 176.18 2ri3 s ILE 479 N -2.97 1.39 -0.28 1.52 -4.36 -0.33 -1.27 121.20 114.90 2ri3 s ILE 479 Ca 0.11 -1.50 -0.10 0.00 -0.26 0.00 0.00 60.65 58.90 2ri3 s ILE 479 Cb 0.00 -1.36 -0.04 0.00 1.25 0.00 0.00 42.46 42.32 2ri3 s ILE 479 CO -0.00 -0.21 0.16 -0.75 0.24 0.00 0.00 174.94 174.38 2ri3 s LYS 480 N -2.03 3.74 0.05 0.37 2.20 0.99 -1.45 119.74 123.61 2ri3 s LYS 480 Ca 0.04 -0.45 -0.20 0.00 -0.36 0.00 0.00 55.97 55.00 2ri3 s LYS 480 Cb -0.09 -3.59 -0.06 0.00 -1.51 0.00 0.00 37.83 32.58 2ri3 s LYS 480 CO 0.03 -0.25 0.59 0.42 -0.36 0.00 0.00 175.35 175.79 2ri3 s ILE 481 N 1.70 4.77 -0.07 5.43 -1.09 0.01 0.53 121.20 132.49 2ri3 s ILE 481 Ca 0.06 1.26 0.02 0.00 -2.23 0.00 0.00 60.65 59.77 2ri3 s ILE 481 Cb -0.16 -3.93 0.01 0.00 -1.58 0.00 0.00 42.46 36.81 2ri3 s ILE 481 CO 0.09 0.50 -0.12 -2.28 -1.23 0.00 0.00 174.94 171.90 2ri3 s HIS 482 N -0.79 1.42 -0.38 3.97 5.65 -0.48 -1.91 115.29 122.78 2ri3 s HIS 482 Ca 0.30 -0.53 -0.23 0.00 0.25 0.00 0.00 55.06 54.85 2ri3 s HIS 482 Cb -0.19 -1.06 0.01 0.00 -1.18 0.00 0.00 32.58 30.16 2ri3 s HIS 482 CO 0.19 -0.28 0.76 -0.06 -0.65 0.00 0.00 174.74 174.69 2ri3 s PHE 483 N 0.73 3.10 0.11 3.88 0.08 -1.26 -1.11 117.98 123.51 2ri3 s PHE 483 Ca -0.13 0.46 -0.36 0.00 0.12 0.00 0.00 56.93 57.02 2ri3 s PHE 483 Cb -0.16 -3.40 -0.16 0.00 -0.57 0.00 0.00 43.02 38.73 2ri3 s PHE 483 CO 0.03 -0.75 1.32 -0.25 -0.10 0.00 0.00 175.22 175.47 2ri3 n ASP 484 N 6.40 1.67 0.00 1.36 9.92 -1.15 -1.17 116.55 133.58 2ri3 n ASP 484 Ca 0.02 1.12 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 2ri3 n ASP 484 Cb 0.48 -1.21 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 2ri3 n ASP 484 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ri3 n GLY 485 N 2.47 1.47 3.87 0.44 0.00 -1.26 -2.16 105.19 110.02 2ri3 n GLY 485 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 2ri3 n GLY 485 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2ri3 s TRP 486 N -2.86 2.60 0.44 1.61 0.52 -0.32 -4.30 118.94 116.63 2ri3 s TRP 486 Ca 0.00 -0.53 -0.24 0.00 0.02 0.00 0.00 56.10 55.36 2ri3 s TRP 486 Cb 0.00 -2.14 -0.08 0.00 -1.15 0.00 0.00 33.47 30.10 2ri3 s TRP 486 CO 0.00 -0.14 1.15 0.45 0.02 0.00 0.00 176.95 178.43 2ri3 s SER 487 N -4.13 6.31 0.00 2.95 0.15 -1.26 -4.88 113.70 112.84 2ri3 s SER 487 Ca 0.47 2.28 0.12 0.00 0.70 0.00 0.00 55.95 59.52 2ri3 s SER 487 Cb -0.03 -2.60 0.57 0.00 -1.71 0.00 0.00 66.02 62.25 2ri3 s SER 487 CO 0.27 -0.82 1.34 1.41 1.20 0.00 0.00 173.24 176.65 2ri3 n HIS 488 N -0.32 0.00 0.30 3.44 8.25 -1.26 -1.81 115.22 123.82 2ri3 n HIS 488 Ca 0.06 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.70 2ri3 n HIS 488 Cb 0.48 -0.39 0.84 0.00 1.12 0.00 0.00 29.99 32.04 2ri3 n HIS 488 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2ri3 h GLY 489 N 2.03 0.00 0.36 -1.41 0.00 -2.01 -0.46 103.07 101.59 2ri3 h GLY 489 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ri3 h GLY 489 CO 0.00 0.00 -0.55 -1.72 0.00 0.00 0.00 176.54 174.27 2ri3 n TYR 490 N -2.78 0.00 -1.71 5.60 4.01 -0.75 -4.94 117.16 116.58 2ri3 n TYR 490 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 2ri3 n TYR 490 Cb 0.15 -0.13 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 2ri3 n TYR 490 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2ri3 n ASP 491 N -1.12 3.09 -3.83 7.72 9.92 -0.18 -4.88 116.55 127.26 2ri3 n ASP 491 Ca 0.07 1.19 -0.11 0.00 -0.53 0.00 0.00 54.79 55.41 2ri3 n ASP 491 Cb 0.35 -1.51 -0.09 0.00 -0.64 0.00 0.00 41.12 39.23 2ri3 n ASP 491 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 2ri3 s PHE 492 N -0.74 -0.01 0.22 1.24 -0.71 -0.80 -4.96 117.98 112.22 2ri3 s PHE 492 Ca 0.59 -0.09 -0.18 0.00 -1.04 0.00 0.00 56.93 56.20 2ri3 s PHE 492 Cb -0.56 -0.00 -0.08 0.00 -1.21 0.00 0.00 43.02 41.17 2ri3 s PHE 492 CO 0.58 -0.37 0.70 -1.58 -1.34 0.00 0.00 175.22 173.21 2ri3 s TRP 493 N -1.85 3.61 -0.11 3.49 0.52 -1.26 -0.81 118.94 122.54 2ri3 s TRP 493 Ca -0.11 1.33 -0.18 0.00 0.02 0.00 0.00 56.10 57.16 2ri3 s TRP 493 Cb -0.04 -2.58 0.04 0.00 -1.15 0.00 0.00 33.47 29.74 2ri3 s TRP 493 CO 0.00 0.32 0.46 -1.50 0.02 0.00 0.00 176.95 176.25 2ri3 s ILE 494 N -1.56 0.02 0.32 2.03 2.07 -0.53 -4.96 121.20 118.59 2ri3 s ILE 494 Ca 0.43 -0.15 -0.29 0.00 -1.41 0.00 0.00 60.65 59.24 2ri3 s ILE 494 Cb -0.16 -0.71 -0.10 0.00 0.13 0.00 0.00 42.46 41.62 2ri3 s ILE 494 CO 0.20 -0.08 1.32 -1.81 -1.91 0.00 0.00 174.94 172.67 2ri3 s ASP 495 N -0.48 6.75 0.65 4.50 1.01 -1.26 -1.18 116.67 126.66 2ri3 s ASP 495 Ca -0.06 2.69 0.41 0.00 0.71 0.00 0.00 52.55 56.30 2ri3 s ASP 495 Cb -0.03 -2.65 2.24 0.00 1.01 0.00 0.00 42.92 43.49 2ri3 s ASP 495 CO 0.03 -0.56 2.26 0.00 0.21 0.00 0.00 175.17 177.11 2ri3 h ALA 496 N 3.55 1.06 -0.61 5.23 0.00 -1.73 -0.81 119.26 125.96 2ri3 h ALA 496 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2ri3 h ALA 496 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2ri3 h ALA 496 CO 0.67 -0.06 0.00 -0.40 0.00 0.00 0.00 179.25 179.46 2ri3 n ASP 497 N -3.00 4.01 -4.74 0.00 5.75 -1.26 -4.82 116.55 112.49 2ri3 n ASP 497 Ca -0.03 -2.19 -0.41 0.00 -0.01 0.00 0.00 54.79 52.15 2ri3 n ASP 497 Cb 0.12 -0.47 -0.02 0.00 -1.03 0.00 0.00 41.12 39.72 2ri3 n ASP 497 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2ri3 s HIS 498 N -1.36 2.94 -0.91 2.11 2.46 -0.31 -4.88 115.29 115.33 2ri3 s HIS 498 Ca 0.44 0.91 0.08 0.00 0.47 0.00 0.00 55.06 56.96 2ri3 s HIS 498 Cb 0.26 -3.91 0.35 0.00 -0.13 0.00 0.00 32.58 29.15 2ri3 s HIS 498 CO 0.26 -3.04 1.25 -0.35 -2.47 0.00 0.00 174.74 170.38 2ri3 n PRO 499 N 2.44 0.02 -0.75 2.88 -0.04 -1.26 -3.09 135.00 135.20 2ri3 n PRO 499 Ca 0.08 0.42 0.08 0.00 -0.04 0.00 0.00 63.50 64.04 2ri3 n PRO 499 Cb 0.39 -1.56 0.37 0.00 -0.04 0.00 0.00 33.50 32.67 2ri3 n PRO 499 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ri3 n ASP 500 N -1.60 5.17 -4.31 3.54 8.00 -1.26 -4.86 116.55 121.23 2ri3 n ASP 500 Ca 0.01 -2.69 -0.30 0.00 0.71 0.00 0.00 54.79 52.52 2ri3 n ASP 500 Cb 0.07 -0.63 -0.15 0.00 -0.02 0.00 0.00 41.12 40.38 2ri3 n ASP 500 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2ri3 s ILE 501 N -2.32 2.01 0.10 0.53 -4.36 -1.18 -1.63 121.20 114.34 2ri3 s ILE 501 Ca 0.51 -1.20 -0.07 0.00 -0.26 0.00 0.00 60.65 59.63 2ri3 s ILE 501 Cb 0.37 -1.69 -0.01 0.00 1.25 0.00 0.00 42.46 42.37 2ri3 s ILE 501 CO 0.19 0.45 0.15 -1.00 0.24 0.00 0.00 174.94 174.97 2ri3 s HIS 502 N -0.69 0.32 0.69 1.37 3.76 0.51 -4.86 115.29 116.39 2ri3 s HIS 502 Ca 0.10 -0.76 -0.11 0.00 -0.15 0.00 0.00 55.06 54.15 2ri3 s HIS 502 Cb -0.10 -0.16 0.00 0.00 1.11 0.00 0.00 32.58 33.44 2ri3 s HIS 502 CO 0.00 -0.54 1.06 -1.25 -0.85 0.00 0.00 174.74 173.16 2ri3 s PRO 503 N -3.90 3.00 0.29 8.40 0.04 -1.26 -0.71 135.00 140.85 2ri3 s PRO 503 Ca 0.09 0.92 -0.29 0.00 0.04 0.00 0.00 61.00 61.75 2ri3 s PRO 503 Cb 0.05 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 32.46 2ri3 s PRO 503 CO -0.08 -1.04 1.27 0.00 0.04 0.00 0.00 177.00 177.19 2ri3 n ALA 504 N -3.09 0.85 0.00 8.56 0.00 -1.26 -2.21 120.51 123.36 2ri3 n ALA 504 Ca 0.07 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2ri3 n ALA 504 Cb 0.54 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.78 2ri3 n ALA 504 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ri3 n GLY 505 N 1.40 1.15 0.10 0.00 0.00 -1.26 -4.96 105.19 101.62 2ri3 n GLY 505 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 2ri3 n GLY 505 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2ri3 h TRP 506 N 0.00 0.07 -0.22 1.61 7.01 -1.81 -0.80 115.95 121.80 2ri3 h TRP 506 Ca 0.00 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.01 2ri3 h TRP 506 Cb 0.00 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.05 2ri3 h TRP 506 CO 0.00 0.02 0.14 0.00 -2.79 0.00 0.00 178.44 175.82 2ri3 h SER 508 N 0.30 0.44 0.89 0.00 0.87 -1.67 0.73 113.55 115.10 2ri3 h SER 508 Ca 0.08 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.57 2ri3 h SER 508 Cb -0.02 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 2ri3 h SER 508 CO -0.02 0.32 -0.30 0.11 -0.53 0.00 0.00 176.83 176.41 2ri3 h LYS 509 N 0.52 0.00 0.00 2.24 1.57 -1.02 -3.18 116.57 116.70 2ri3 h LYS 509 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2ri3 h LYS 509 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2ri3 h LYS 509 CO -0.04 0.30 -0.91 0.25 -0.57 0.00 0.00 179.45 178.48 2ri3 n THR 510 N -3.47 0.01 -1.38 -0.16 -2.24 -0.36 -4.88 114.28 101.80 2ri3 n THR 510 Ca -0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2ri3 n THR 510 Cb 0.47 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 2ri3 n THR 510 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ri3 n GLY 511 N 1.49 0.97 3.44 3.38 0.00 -0.18 -3.74 105.19 110.54 2ri3 n GLY 511 Ca 0.04 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 2ri3 n GLY 511 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ri3 s HIS 512 N -2.21 2.66 0.48 1.61 5.04 0.07 -3.36 115.29 119.58 2ri3 s HIS 512 Ca 0.00 -0.27 -0.23 0.00 -1.54 0.00 0.00 55.06 53.02 2ri3 s HIS 512 Cb 0.00 -1.64 -0.07 0.00 0.04 0.00 0.00 32.58 30.92 2ri3 s HIS 512 CO 0.00 0.10 1.25 -2.14 -2.34 0.00 0.00 174.74 171.61 2ri3 s PRO 513 N -0.58 3.59 -0.12 2.88 0.02 -1.26 -4.20 135.00 135.34 2ri3 s PRO 513 Ca 0.08 1.98 0.03 0.00 0.02 0.00 0.00 61.00 63.11 2ri3 s PRO 513 Cb -0.11 -2.41 -0.00 0.00 0.02 0.00 0.00 34.50 31.99 2ri3 s PRO 513 CO 0.01 -0.75 -0.21 -1.17 -0.33 0.00 0.00 177.00 174.55 2ri3 s LEU 514 N -3.09 2.23 -0.23 -5.54 2.96 -1.26 -4.48 118.68 109.26 2ri3 s LEU 514 Ca 0.65 -0.52 -0.26 0.00 -0.22 0.00 0.00 54.13 53.78 2ri3 s LEU 514 Cb -0.34 -1.46 -0.00 0.00 0.50 0.00 0.00 46.19 44.89 2ri3 s LEU 514 CO 0.41 0.14 0.90 -1.10 -1.32 0.00 0.00 176.35 175.38 2ri3 s GLN 515 N 0.46 4.22 0.93 1.98 -1.52 0.36 -4.99 119.66 121.10 2ri3 s GLN 515 Ca -0.15 1.08 -0.12 0.00 -1.95 0.00 0.00 55.36 54.23 2ri3 s GLN 515 Cb -0.17 -3.64 0.15 0.00 -0.22 0.00 0.00 33.01 29.13 2ri3 s GLN 515 CO 0.06 -0.54 1.10 -1.25 -0.25 0.00 0.00 175.29 174.41 2ri3 s PRO 516 N 2.91 1.00 0.41 2.91 0.04 -1.26 -2.28 135.00 138.72 2ri3 s PRO 516 Ca 0.38 0.59 -0.24 0.00 0.04 0.00 0.00 61.00 61.77 2ri3 s PRO 516 Cb -0.15 -1.80 -0.12 0.00 0.04 0.00 0.00 34.50 32.47 2ri3 s PRO 516 CO 0.07 -2.36 0.81 -2.30 0.04 0.00 0.00 177.00 173.27 2ri3 n PRO 517 N -3.93 0.99 -1.91 0.56 -0.02 -1.26 -4.79 135.00 124.63 2ri3 n PRO 517 Ca 0.06 0.36 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 2ri3 n PRO 517 Cb 0.57 -1.79 -0.03 0.00 -0.02 0.00 0.00 33.50 32.23 2ri3 n PRO 517 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2ri3 s LEU 518 N 0.48 4.37 0.00 2.45 2.96 -0.92 -4.92 118.68 123.10 2ri3 s LEU 518 Ca 0.63 2.54 0.00 0.00 -0.22 0.00 0.00 54.13 57.08 2ri3 s LEU 518 Cb -0.59 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.53 2ri3 s LEU 518 CO 0.57 -0.88 0.00 0.61 -1.32 0.00 0.00 176.35 175.33