#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i6s n LYS 224 N 0.00 -0.83 -2.89 1.43 5.02 -1.26 -4.94 118.16 114.68 2i6s n LYS 224 Ca 0.00 0.62 -0.40 0.00 -2.02 0.00 0.00 58.31 56.51 2i6s n LYS 224 Cb 0.00 -0.71 -0.05 0.00 -0.02 0.00 0.00 35.03 34.25 2i6s n LYS 224 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2i6s s ILE 225 N -2.44 4.55 -0.07 -0.18 1.01 0.21 -4.80 121.20 119.48 2i6s s ILE 225 Ca 0.00 1.81 -0.24 0.00 0.00 0.00 0.00 60.65 62.22 2i6s s ILE 225 Cb 0.00 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 2i6s s ILE 225 CO 0.00 0.39 0.74 -1.10 0.00 0.00 0.00 174.94 174.96 2i6s s GLN 226 N -0.32 4.43 -0.33 2.79 -0.21 -1.26 0.11 119.66 124.87 2i6s s GLN 226 Ca 0.41 0.93 -0.08 0.00 0.02 0.00 0.00 55.36 56.64 2i6s s GLN 226 Cb -0.22 -3.46 0.03 0.00 1.00 0.00 0.00 33.01 30.35 2i6s s GLN 226 CO 0.26 0.01 0.12 0.42 -2.12 0.00 0.00 175.29 173.98 2i6s s ILE 227 N 0.97 4.04 0.18 1.08 -1.09 0.16 -4.90 121.20 121.63 2i6s s ILE 227 Ca 0.39 -0.92 -0.18 0.00 -2.23 0.00 0.00 60.65 57.71 2i6s s ILE 227 Cb -0.18 -3.21 0.03 0.00 -1.58 0.00 0.00 42.46 37.52 2i6s s ILE 227 CO 0.18 -0.11 0.50 0.00 -1.23 0.00 0.00 174.94 174.29 2i6s s GLN 228 N 1.47 1.30 0.26 2.79 -2.07 -1.26 -4.01 119.66 118.14 2i6s s GLN 228 Ca 0.01 -0.80 0.26 0.00 -1.82 0.00 0.00 55.36 53.00 2i6s s GLN 228 Cb -0.19 0.51 0.82 0.00 -1.09 0.00 0.00 33.01 33.07 2i6s s GLN 228 CO 0.04 -0.55 1.75 0.00 -1.32 0.00 0.00 175.29 175.22 2i6s h ARG 229 N 2.22 0.00 -6.24 9.60 2.47 -1.96 -3.43 114.38 117.03 2i6s h ARG 229 Ca -0.30 0.00 -0.55 0.00 -1.26 0.00 0.00 59.98 57.87 2i6s h ARG 229 Cb 1.26 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.55 2i6s h ARG 229 CO 0.40 0.00 0.30 -1.12 0.56 0.00 0.00 179.97 180.11 2i6s s SER 230 N -4.69 7.21 0.22 7.04 0.01 -1.26 -4.88 113.70 117.35 2i6s s SER 230 Ca 0.08 1.46 0.00 0.00 1.31 0.00 0.00 55.95 58.81 2i6s s SER 230 Cb 0.11 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2i6s s SER 230 CO 0.56 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.57 2i6s n GLY 231 N 3.03 0.50 3.12 3.44 0.00 -1.26 -4.91 105.19 109.10 2i6s n GLY 231 Ca 0.04 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.07 2i6s n GLY 231 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2i6s s HIS 232 N 0.00 0.17 -0.20 1.61 2.46 -1.14 -4.70 115.29 113.49 2i6s s HIS 232 Ca 0.00 -0.44 -0.00 0.00 0.47 0.00 0.00 55.06 55.09 2i6s s HIS 232 Cb 0.00 -0.12 0.02 0.00 -0.13 0.00 0.00 32.58 32.34 2i6s s HIS 232 CO 0.00 -0.36 -0.15 -1.17 -2.47 0.00 0.00 174.74 170.59 2i6s s LEU 233 N -2.02 2.49 -0.36 8.88 2.96 -0.21 -0.63 118.68 129.79 2i6s s LEU 233 Ca -0.06 -0.69 -0.17 0.00 -0.22 0.00 0.00 54.13 52.99 2i6s s LEU 233 Cb -0.02 -1.55 -0.00 0.00 0.50 0.00 0.00 46.19 45.12 2i6s s LEU 233 CO -0.04 -0.03 0.46 0.20 -1.32 0.00 0.00 176.35 175.62 2i6s s ASN 234 N 1.31 6.25 -0.21 3.68 -0.87 0.18 0.02 114.94 125.30 2i6s s ASN 234 Ca 0.03 -0.21 -0.08 0.00 -1.57 0.00 0.00 52.86 51.03 2i6s s ASN 234 Cb -0.14 -2.24 -0.04 0.00 -0.02 0.00 0.00 41.25 38.81 2i6s s ASN 234 CO -0.10 -0.47 0.08 -0.22 -2.57 0.00 0.00 177.10 173.82 2i6s s LEU 235 N 2.26 3.73 -0.22 0.60 2.96 0.17 -1.14 118.68 127.04 2i6s s LEU 235 Ca 0.16 -0.01 -0.00 0.00 -0.22 0.00 0.00 54.13 54.06 2i6s s LEU 235 Cb -0.16 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.59 2i6s s LEU 235 CO 0.13 0.09 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.82 2i6s s TYR 236 N 0.85 2.96 -0.39 5.38 2.02 0.34 0.01 117.35 128.52 2i6s s TYR 236 Ca 0.04 -1.62 -0.11 0.00 -0.37 0.00 0.00 57.07 55.01 2i6s s TYR 236 Cb -0.14 -1.99 0.04 0.00 -0.40 0.00 0.00 41.96 39.47 2i6s s TYR 236 CO 0.02 -0.76 0.24 -0.51 -1.57 0.00 0.00 175.55 172.97 2i6s s LEU 237 N 1.30 4.89 -0.24 -1.29 1.43 -0.16 -0.43 118.68 124.18 2i6s s LEU 237 Ca 0.02 -1.09 -0.08 0.00 -1.03 0.00 0.00 54.13 51.94 2i6s s LEU 237 Cb -0.15 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 2i6s s LEU 237 CO -0.08 -0.44 0.10 -0.76 0.23 0.00 0.00 176.35 175.41 2i6s s LEU 238 N 1.55 3.70 -0.16 1.79 1.02 0.21 -1.90 118.68 124.89 2i6s s LEU 238 Ca 0.02 -0.08 -0.01 0.00 0.02 0.00 0.00 54.13 54.09 2i6s s LEU 238 Cb -0.20 -1.99 -0.01 0.00 0.02 0.00 0.00 46.19 44.01 2i6s s LEU 238 CO 0.06 0.01 -0.13 -0.76 0.02 0.00 0.00 176.35 175.56 2i6s s LEU 239 N 1.34 2.61 0.19 1.79 1.02 -0.39 0.10 118.68 125.34 2i6s s LEU 239 Ca 0.06 -0.42 -0.30 0.00 0.02 0.00 0.00 54.13 53.49 2i6s s LEU 239 Cb -0.15 -1.61 -0.08 0.00 0.02 0.00 0.00 46.19 44.38 2i6s s LEU 239 CO 0.05 0.08 1.13 -0.62 0.02 0.00 0.00 176.35 177.01 2i6s s ASP 240 N 0.84 7.21 -0.01 2.29 3.68 -0.18 -1.54 116.67 128.96 2i6s s ASP 240 Ca -0.04 2.15 0.01 0.00 2.13 0.00 0.00 52.55 56.80 2i6s s ASP 240 Cb -0.15 -2.61 0.01 0.00 -1.45 0.00 0.00 42.92 38.73 2i6s s ASP 240 CO 0.00 -0.26 0.71 0.00 0.13 0.00 0.00 175.17 175.75 2i6s s SER 242 N -0.50 1.25 0.31 0.00 1.04 -1.26 -4.86 113.70 109.68 2i6s s SER 242 Ca 0.02 1.07 0.03 0.00 0.48 0.00 0.00 55.95 57.54 2i6s s SER 242 Cb 0.01 -1.63 0.60 0.00 0.10 0.00 0.00 66.02 65.10 2i6s s SER 242 CO 0.00 -3.97 1.88 -0.61 0.98 0.00 0.00 173.24 171.52 2i6s h GLN 243 N -2.47 0.92 -0.93 4.02 5.75 -1.70 -1.81 115.11 118.89 2i6s h GLN 243 Ca -0.53 -0.06 0.26 0.00 -0.15 0.00 0.00 58.65 58.17 2i6s h GLN 243 Cb 1.33 -0.21 -0.14 0.00 1.07 0.00 0.00 27.48 29.53 2i6s h GLN 243 CO 0.47 0.61 0.40 1.03 -2.65 0.00 0.00 178.83 178.68 2i6s h SER 244 N 0.95 0.28 -3.55 -0.69 0.87 -1.91 -3.36 113.55 106.13 2i6s h SER 244 Ca 0.43 0.18 -0.62 0.00 -1.23 0.00 0.00 61.79 60.55 2i6s h SER 244 Cb 0.39 0.18 -0.13 0.00 -0.44 0.00 0.00 62.40 62.41 2i6s h SER 244 CO -0.19 -0.10 0.12 -0.69 -0.53 0.00 0.00 176.83 175.44 2i6s s VAL 245 N -5.83 4.94 0.81 2.23 1.01 -0.68 -5.06 120.40 117.81 2i6s s VAL 245 Ca -0.11 0.77 -0.11 0.00 0.00 0.00 0.00 61.98 62.52 2i6s s VAL 245 Cb 0.27 -4.00 0.07 0.00 0.00 0.00 0.00 36.38 32.72 2i6s s VAL 245 CO 0.78 -0.17 1.09 -0.94 0.00 0.00 0.00 175.10 175.86 2i6s s SER 246 N 1.67 4.32 0.41 3.32 1.04 -1.26 -4.67 113.70 118.53 2i6s s SER 246 Ca 0.24 1.54 0.11 0.00 0.48 0.00 0.00 55.95 58.32 2i6s s SER 246 Cb -0.15 -2.28 0.86 0.00 0.10 0.00 0.00 66.02 64.56 2i6s s SER 246 CO 0.12 -2.11 1.96 -0.08 0.98 0.00 0.00 173.24 174.11 2i6s h GLU 247 N -1.18 0.21 -0.03 4.02 4.81 -1.94 -0.89 114.58 119.57 2i6s h GLU 247 Ca -0.46 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.62 2i6s h GLU 247 Cb 1.25 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2i6s h GLU 247 CO 0.55 0.31 -0.49 -0.91 -0.73 0.00 0.00 179.01 177.75 2i6s h ASN 248 N 0.21 0.08 -0.24 1.04 -0.26 -2.00 -2.76 115.58 111.66 2i6s h ASN 248 Ca 0.05 -0.04 -0.15 0.00 -0.56 0.00 0.00 56.30 55.60 2i6s h ASN 248 Cb 0.29 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 2i6s h ASN 248 CO 0.01 0.56 -0.45 0.44 -1.06 0.00 0.00 177.43 176.93 2i6s h ASP 249 N 0.06 0.80 0.19 5.81 3.45 -1.55 -3.07 116.42 122.10 2i6s h ASP 249 Ca 0.00 -0.54 -0.06 0.00 0.43 0.00 0.00 57.03 56.86 2i6s h ASP 249 Cb 0.88 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 39.41 2i6s h ASP 249 CO 0.07 1.19 -0.25 0.15 -1.57 0.00 0.00 179.24 178.83 2i6s h PHE 250 N 0.44 0.12 -0.39 4.55 3.57 -1.32 -2.07 116.94 121.85 2i6s h PHE 250 Ca 0.01 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 2i6s h PHE 250 Cb 1.05 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 2i6s h PHE 250 CO 0.08 0.36 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.41 2i6s h LEU 251 N 0.11 0.61 -0.05 0.59 3.38 -1.46 -1.03 115.31 117.47 2i6s h LEU 251 Ca 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2i6s h LEU 251 Cb 0.50 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2i6s h LEU 251 CO 0.04 0.71 -0.05 0.16 0.09 0.00 0.00 178.44 179.39 2i6s h ILE 252 N 0.60 0.09 -0.42 1.22 3.07 -1.37 -2.49 117.51 118.21 2i6s h ILE 252 Ca 0.12 -1.11 -0.11 0.00 1.55 0.00 0.00 64.86 65.31 2i6s h ILE 252 Cb 0.44 2.03 -0.01 0.00 -0.27 0.00 0.00 36.82 39.01 2i6s h ILE 252 CO 0.02 0.05 -0.16 -0.26 -1.05 0.00 0.00 178.15 176.75 2i6s h PHE 253 N 0.00 0.97 -0.52 0.16 0.04 -0.96 -1.74 116.94 114.89 2i6s h PHE 253 Ca -0.00 -0.23 0.03 0.00 2.80 0.00 0.00 57.97 60.57 2i6s h PHE 253 Cb 1.02 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.91 2i6s h PHE 253 CO 0.00 0.99 0.30 0.87 -0.60 0.00 0.00 178.31 179.87 2i6s h LYS 254 N 0.67 0.57 -0.37 1.51 1.57 -1.02 0.14 116.57 119.64 2i6s h LYS 254 Ca 0.10 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 2i6s h LYS 254 Cb 0.71 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2i6s h LYS 254 CO 0.05 0.38 -0.20 1.49 -0.57 0.00 0.00 179.45 180.60 2i6s h GLU 255 N 0.59 0.70 -0.06 3.15 4.81 -1.47 -1.96 114.58 120.35 2i6s h GLU 255 Ca 0.21 -0.26 -0.14 0.00 -0.13 0.00 0.00 59.36 59.04 2i6s h GLU 255 Cb 0.05 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2i6s h GLU 255 CO -0.11 0.85 -0.60 0.77 -0.73 0.00 0.00 179.01 179.20 2i6s h SER 256 N 0.62 0.23 0.50 1.04 0.02 -0.87 -2.95 113.55 112.15 2i6s h SER 256 Ca 0.09 -0.13 -0.22 0.00 -0.84 0.00 0.00 61.79 60.70 2i6s h SER 256 Cb 0.68 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2i6s h SER 256 CO 0.05 0.77 -0.94 0.00 -1.14 0.00 0.00 176.83 175.57 2i6s h ALA 257 N 1.23 0.41 0.12 3.77 0.00 -0.60 -2.96 119.26 121.23 2i6s h ALA 257 Ca -0.01 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2i6s h ALA 257 Cb 1.09 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2i6s h ALA 257 CO 0.09 0.89 -0.09 0.77 0.00 0.00 0.00 179.25 180.91 2i6s h SER 258 N 0.15 -0.24 -0.49 0.00 0.02 -1.31 -2.15 113.55 109.53 2i6s h SER 258 Ca -0.07 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.92 2i6s h SER 258 Cb 1.58 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 64.17 2i6s h SER 258 CO 0.15 -0.15 0.30 -0.07 -1.14 0.00 0.00 176.83 175.92 2i6s h LEU 259 N -0.22 0.48 -0.67 5.07 3.38 -1.57 0.15 115.31 121.93 2i6s h LEU 259 Ca -0.00 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.08 2i6s h LEU 259 Cb 0.20 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 2i6s h LEU 259 CO -0.01 0.34 0.26 0.24 0.09 0.00 0.00 178.44 179.36 2i6s h MET 260 N 0.59 0.42 -0.32 1.13 2.86 -1.44 0.32 114.93 118.50 2i6s h MET 260 Ca 0.19 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.78 2i6s h MET 260 Cb 0.00 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 2i6s h MET 260 CO -0.08 0.28 0.07 0.28 1.06 0.00 0.00 176.91 178.52 2i6s h VAL 261 N 0.43 1.22 -0.85 -2.22 2.07 -0.63 -1.48 116.25 114.79 2i6s h VAL 261 Ca 0.35 -0.76 0.02 0.00 0.82 0.00 0.00 66.70 67.13 2i6s h VAL 261 Cb 0.47 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 2i6s h VAL 261 CO -0.34 0.25 0.56 0.44 0.02 0.00 0.00 177.57 178.49 2i6s h ASP 262 N 0.36 0.94 -0.17 0.57 3.32 0.12 -2.62 116.42 118.94 2i6s h ASP 262 Ca 0.10 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 2i6s h ASP 262 Cb 0.31 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2i6s h ASP 262 CO 0.00 0.66 -0.17 -0.09 -1.72 0.00 0.00 179.24 177.93 2i6s h ARG 263 N 1.10 0.41 0.00 3.56 9.65 -0.26 -3.02 114.38 125.82 2i6s h ARG 263 Ca 0.33 -0.21 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2i6s h ARG 263 Cb -0.05 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2i6s h ARG 263 CO -0.10 0.78 0.00 0.97 2.80 0.00 0.00 179.97 184.42 2i6s h ILE 264 N 0.05 0.00 -0.02 1.20 6.09 -1.17 -1.27 117.51 122.40 2i6s h ILE 264 Ca 0.03 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 63.24 2i6s h ILE 264 Cb 0.70 1.09 0.00 0.00 0.47 0.00 0.00 36.82 39.08 2i6s h ILE 264 CO 0.04 0.00 -0.16 0.49 -3.07 0.00 0.00 178.15 175.45 2i6s n PHE 265 N -2.58 0.00 1.29 2.19 3.72 -1.00 -4.19 117.46 116.89 2i6s n PHE 265 Ca 0.01 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.54 2i6s n PHE 265 Cb 0.22 -0.01 0.37 0.00 -0.94 0.00 0.00 39.48 39.12 2i6s n PHE 265 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2i6s n SER 266 N 0.62 1.47 -0.95 4.37 3.41 -0.48 -3.90 113.62 118.16 2i6s n SER 266 Ca 0.13 -1.27 0.12 0.00 -0.26 0.00 0.00 58.87 57.59 2i6s n SER 266 Cb 0.51 0.11 0.16 0.00 -0.26 0.00 0.00 64.21 64.73 2i6s n SER 266 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2i6s n PHE 267 N -0.12 0.10 -2.50 7.33 3.72 -1.25 -4.94 117.46 119.81 2i6s n PHE 267 Ca 0.14 -0.05 -0.20 0.00 -0.05 0.00 0.00 57.45 57.29 2i6s n PHE 267 Cb 0.38 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.92 2i6s n PHE 267 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2i6s n GLU 268 N 1.26 -2.19 -3.54 -1.08 1.02 -1.25 -4.99 120.64 109.87 2i6s n GLU 268 Ca 0.16 0.95 -0.19 0.00 -0.02 0.00 0.00 57.16 58.05 2i6s n GLU 268 Cb 0.58 -5.64 -0.01 0.00 -0.02 0.00 0.00 31.44 26.34 2i6s n GLU 268 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2i6s s ILE 269 N -3.02 3.83 -0.63 -3.67 -4.36 -1.26 -5.03 121.20 107.06 2i6s s ILE 269 Ca 0.05 -1.10 -0.28 0.00 -0.26 0.00 0.00 60.65 59.05 2i6s s ILE 269 Cb -0.02 -3.32 0.02 0.00 1.25 0.00 0.00 42.46 40.40 2i6s s ILE 269 CO 0.06 -0.15 1.30 0.20 0.24 0.00 0.00 174.94 176.59 2i6s s ASN 270 N -4.13 6.22 0.07 4.36 -0.87 -1.26 -4.99 114.94 114.34 2i6s s ASN 270 Ca 0.45 -0.03 0.06 0.00 -1.57 0.00 0.00 52.86 51.77 2i6s s ASN 270 Cb -0.08 -2.55 -0.03 0.00 -0.02 0.00 0.00 41.25 38.56 2i6s s ASN 270 CO 0.30 -1.70 -0.16 0.54 -2.57 0.00 0.00 177.10 173.51 2i6s s VAL 271 N 5.66 1.27 -0.04 1.60 0.11 -1.26 -1.04 120.40 126.69 2i6s s VAL 271 Ca 0.44 -1.29 0.03 0.00 -2.93 0.00 0.00 61.98 58.22 2i6s s VAL 271 Cb -0.09 -1.18 0.00 0.00 -1.53 0.00 0.00 36.38 33.58 2i6s s VAL 271 CO 0.22 -0.12 -0.13 -0.44 -3.33 0.00 0.00 175.10 171.29 2i6s s SER 272 N -1.63 1.76 -0.20 3.54 0.01 0.10 -4.34 113.70 112.94 2i6s s SER 272 Ca 0.01 -0.29 -0.03 0.00 1.31 0.00 0.00 55.95 56.95 2i6s s SER 272 Cb -0.10 -0.58 -0.01 0.00 0.21 0.00 0.00 66.02 65.55 2i6s s SER 272 CO 0.02 0.09 -0.07 -0.69 0.41 0.00 0.00 173.24 173.00 2i6s s VAL 273 N 0.26 3.17 -0.11 3.43 1.01 -0.28 0.45 120.40 128.34 2i6s s VAL 273 Ca -0.07 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 2i6s s VAL 273 Cb -0.12 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 2i6s s VAL 273 CO 0.02 0.45 0.32 0.00 0.00 0.00 0.00 175.10 175.90 2i6s s ALA 274 N 1.32 3.65 -0.25 5.51 0.00 0.10 -4.63 121.76 127.45 2i6s s ALA 274 Ca 0.04 -0.38 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 2i6s s ALA 274 Cb -0.14 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.62 2i6s s ALA 274 CO -0.04 0.26 -0.00 0.42 0.00 0.00 0.00 175.76 176.40 2i6s s ILE 275 N -0.15 3.49 -0.04 0.00 -1.09 -0.59 -0.99 121.20 121.84 2i6s s ILE 275 Ca 0.19 -0.64 0.03 0.00 -2.23 0.00 0.00 60.65 58.01 2i6s s ILE 275 Cb -0.14 -2.69 0.00 0.00 -1.58 0.00 0.00 42.46 38.05 2i6s s ILE 275 CO 0.07 0.27 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.29 2i6s s ILE 276 N 1.46 1.16 0.04 2.92 1.01 -0.80 0.02 121.20 127.01 2i6s s ILE 276 Ca 0.04 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.16 2i6s s ILE 276 Cb -0.16 -1.01 -0.04 0.00 0.01 0.00 0.00 42.46 41.27 2i6s s ILE 276 CO -0.01 0.34 -0.01 0.42 0.00 0.00 0.00 174.94 175.68 2i6s s THR 277 N 0.14 4.00 -0.02 2.92 -4.23 -0.35 -1.27 115.64 116.83 2i6s s THR 277 Ca -0.04 -0.82 -0.08 0.00 -1.18 0.00 0.00 61.69 59.57 2i6s s THR 277 Cb -0.11 -2.83 0.01 0.00 1.34 0.00 0.00 72.50 70.91 2i6s s THR 277 CO 0.02 0.26 0.17 0.72 -0.54 0.00 0.00 174.62 175.25 2i6s s PHE 278 N -1.18 -0.06 0.00 3.99 -0.12 -0.59 0.15 117.98 120.17 2i6s s PHE 278 Ca 0.22 0.12 0.00 0.00 -0.05 0.00 0.00 56.93 57.22 2i6s s PHE 278 Cb -0.12 0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.28 2i6s s PHE 278 CO 0.14 -0.24 0.00 0.00 -0.05 0.00 0.00 175.22 175.07 2i6s n ALA 279 N 1.94 0.77 0.13 1.99 0.00 -1.26 -1.61 120.51 122.46 2i6s n ALA 279 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.02 2i6s n ALA 279 Cb 0.57 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.86 2i6s n ALA 279 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2i6s h SER 280 N 0.00 0.72 -4.25 0.00 0.02 -1.51 0.96 113.55 109.48 2i6s h SER 280 Ca 0.00 -0.79 -0.35 0.00 -0.84 0.00 0.00 61.79 59.81 2i6s h SER 280 Cb 0.00 -0.23 -0.18 0.00 0.14 0.00 0.00 62.40 62.13 2i6s h SER 280 CO 0.00 1.62 -0.74 -1.83 -1.14 0.00 0.00 176.83 174.75 2i6s s GLU 281 N -2.61 0.91 0.34 3.45 1.03 -1.26 -4.63 118.70 115.93 2i6s s GLU 281 Ca -0.08 -1.20 -0.26 0.00 0.03 0.00 0.00 54.97 53.45 2i6s s GLU 281 Cb 0.05 -0.65 -0.10 0.00 -0.80 0.00 0.00 34.13 32.64 2i6s s GLU 281 CO 0.92 0.11 0.99 -1.25 -1.33 0.00 0.00 175.26 174.70 2i6s s PRO 282 N -2.83 4.48 -0.20 -4.83 0.04 -1.26 -4.46 135.00 125.93 2i6s s PRO 282 Ca 0.07 1.43 0.02 0.00 0.04 0.00 0.00 61.00 62.56 2i6s s PRO 282 Cb -0.03 -2.78 0.03 0.00 0.04 0.00 0.00 34.50 31.77 2i6s s PRO 282 CO 0.01 0.16 -0.17 0.21 0.04 0.00 0.00 177.00 177.26 2i6s s LYS 283 N -2.10 2.69 -0.38 4.56 2.47 0.40 -4.97 119.74 122.41 2i6s s LYS 283 Ca 0.52 -0.97 -0.22 0.00 -1.56 0.00 0.00 55.97 53.73 2i6s s LYS 283 Cb -0.21 -2.64 0.01 0.00 -1.46 0.00 0.00 37.83 33.53 2i6s s LYS 283 CO 0.27 -0.33 0.73 0.08 0.16 0.00 0.00 175.35 176.25 2i6s s VAL 284 N 1.25 4.78 -0.16 4.02 1.01 -1.26 -1.22 120.40 128.82 2i6s s VAL 284 Ca 0.01 0.66 0.17 0.00 0.00 0.00 0.00 61.98 62.81 2i6s s VAL 284 Cb -0.15 -4.18 -0.25 0.00 0.00 0.00 0.00 36.38 31.80 2i6s s VAL 284 CO -0.10 -0.45 0.24 0.18 0.00 0.00 0.00 175.10 174.96 2i6s n LEU 285 N 6.34 0.22 -3.82 3.92 4.77 0.10 -4.90 117.00 123.63 2i6s n LEU 285 Ca 0.01 0.11 -0.15 0.00 -0.03 0.00 0.00 56.01 55.95 2i6s n LEU 285 Cb 0.48 0.40 -0.16 0.00 -2.33 0.00 0.00 43.42 41.82 2i6s n LEU 285 CO 0.53 0.45 -0.36 -0.32 -1.33 0.00 0.00 177.39 176.36 2i6s s MET 286 N -2.55 0.10 0.05 3.23 0.00 -0.87 -4.90 119.30 114.36 2i6s s MET 286 Ca -0.09 0.09 0.07 0.00 0.00 0.00 0.00 55.69 55.76 2i6s s MET 286 Cb 0.07 -0.27 -0.03 0.00 0.00 0.00 0.00 34.83 34.59 2i6s s MET 286 CO 0.83 -0.11 -0.16 0.45 0.00 0.00 0.00 175.02 176.04 2i6s s SER 287 N 0.75 3.99 0.29 1.11 0.15 -1.26 -1.54 113.70 117.19 2i6s s SER 287 Ca -0.07 -0.40 0.25 0.00 0.70 0.00 0.00 55.95 56.43 2i6s s SER 287 Cb -0.10 -0.69 1.04 0.00 -1.71 0.00 0.00 66.02 64.56 2i6s s SER 287 CO -0.02 0.24 1.74 -0.37 1.20 0.00 0.00 173.24 176.03 2i6s h VAL 288 N 3.79 0.00 0.00 4.45 -1.51 -1.95 -0.99 116.25 120.04 2i6s h VAL 288 Ca -0.48 -0.24 -0.10 0.00 -1.23 0.00 0.00 66.70 64.64 2i6s h VAL 288 Cb 1.16 0.99 -0.01 0.00 -2.13 0.00 0.00 31.29 31.29 2i6s h VAL 288 CO 0.49 0.00 -0.48 -0.07 -1.23 0.00 0.00 177.57 176.28 2i6s h LEU 289 N 0.00 0.00 -9.66 4.19 3.38 -1.95 -3.43 115.31 107.84 2i6s h LEU 289 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 2i6s h LEU 289 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2i6s h LEU 289 CO 0.00 0.48 0.47 0.21 0.09 0.00 0.00 178.44 179.69 2i6s s ASN 290 N -6.70 7.27 0.57 -0.43 3.84 -0.38 -4.94 114.94 114.17 2i6s s ASN 290 Ca -0.01 2.09 0.35 0.00 0.21 0.00 0.00 52.86 55.50 2i6s s ASN 290 Cb 0.12 -2.60 1.61 0.00 -0.55 0.00 0.00 41.25 39.83 2i6s s ASN 290 CO 0.73 -0.21 2.08 0.44 -2.79 0.00 0.00 177.10 177.34 2i6s h ASP 291 N 5.05 0.00 0.80 -4.21 3.32 -1.84 -2.64 116.42 116.90 2i6s h ASP 291 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2i6s h ASP 291 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2i6s h ASP 291 CO 0.72 0.03 0.00 0.59 -1.72 0.00 0.00 179.24 178.86 2i6s n ASN 292 N -3.16 0.72 0.03 6.45 4.13 -1.26 -2.39 115.26 119.78 2i6s n ASN 292 Ca -0.01 0.67 0.06 0.00 1.68 0.00 0.00 54.58 56.99 2i6s n ASN 292 Cb 0.25 -0.82 0.28 0.00 -1.54 0.00 0.00 39.78 37.95 2i6s n ASN 292 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2i6s n SER 293 N -2.29 0.13 -1.33 6.41 3.41 -1.00 -1.01 113.62 117.94 2i6s n SER 293 Ca 0.02 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.28 2i6s n SER 293 Cb 0.25 -0.57 0.32 0.00 -0.26 0.00 0.00 64.21 63.95 2i6s n SER 293 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2i6s n ARG 294 N -1.66 2.87 -4.04 4.33 1.74 -1.00 -1.13 116.66 117.77 2i6s n ARG 294 Ca 0.02 -2.66 -0.32 0.00 -0.77 0.00 0.00 57.85 54.13 2i6s n ARG 294 Cb 0.13 -1.59 -0.15 0.00 -1.02 0.00 0.00 32.46 29.83 2i6s n ARG 294 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2i6s s ASP 295 N -0.99 4.27 0.15 0.55 -1.08 -0.18 -4.99 116.67 114.40 2i6s s ASP 295 Ca 0.48 -1.33 -0.17 0.00 -0.52 0.00 0.00 52.55 51.00 2i6s s ASP 295 Cb 0.26 -1.45 0.06 0.00 -1.46 0.00 0.00 42.92 40.33 2i6s s ASP 295 CO 0.31 -0.20 1.70 -0.03 0.52 0.00 0.00 175.17 177.47 2i6s h MET 296 N 7.82 0.06 -0.20 4.34 1.85 -1.90 -1.60 114.93 125.31 2i6s h MET 296 Ca -0.19 -0.00 0.06 0.00 -0.61 0.00 0.00 59.70 58.95 2i6s h MET 296 Cb 1.05 -0.01 -0.06 0.00 0.43 0.00 0.00 31.60 33.00 2i6s h MET 296 CO 0.45 0.04 -0.22 1.15 -0.40 0.00 0.00 176.91 177.93 2i6s h THR 297 N 0.06 0.43 -0.70 -0.77 2.02 -1.95 -2.12 112.91 109.88 2i6s h THR 297 Ca 0.16 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.33 2i6s h THR 297 Cb 0.23 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2i6s h THR 297 CO -0.29 0.00 0.40 -0.33 0.37 0.00 0.00 175.52 175.66 2i6s h GLU 298 N -0.25 0.97 -0.13 6.66 4.39 -1.65 -1.70 114.58 122.87 2i6s h GLU 298 Ca 0.12 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2i6s h GLU 298 Cb 0.44 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 2i6s h GLU 298 CO -0.34 0.72 0.08 0.28 -1.16 0.00 0.00 179.01 178.59 2i6s h VAL 299 N 0.97 1.06 -0.16 3.13 2.07 -1.08 -2.33 116.25 119.92 2i6s h VAL 299 Ca 0.25 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.51 2i6s h VAL 299 Cb 0.02 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2i6s h VAL 299 CO -0.04 0.06 -0.34 0.40 0.02 0.00 0.00 177.57 177.66 2i6s h ILE 300 N 0.15 1.28 -0.36 4.57 2.04 -1.16 -2.35 117.51 121.68 2i6s h ILE 300 Ca 0.05 -1.38 -0.11 0.00 1.00 0.00 0.00 64.86 64.41 2i6s h ILE 300 Cb 0.02 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 2i6s h ILE 300 CO -0.01 0.42 -0.23 0.77 0.00 0.00 0.00 178.15 179.10 2i6s h SER 301 N 0.28 0.72 0.48 1.72 4.64 -1.20 0.48 113.55 120.66 2i6s h SER 301 Ca 0.03 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2i6s h SER 301 Cb 0.74 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2i6s h SER 301 CO 0.06 0.93 0.00 -1.54 -0.87 0.00 0.00 176.83 175.41 2i6s n SER 302 N -4.11 0.00 -0.09 4.97 3.41 -0.89 -1.58 113.62 115.33 2i6s n SER 302 Ca -0.00 -0.03 -0.09 0.00 -0.26 0.00 0.00 58.87 58.49 2i6s n SER 302 Cb 0.43 -0.30 -0.14 0.00 -0.26 0.00 0.00 64.21 63.94 2i6s n SER 302 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2i6s n LEU 303 N -1.30 0.09 0.10 1.04 7.94 -0.63 -4.13 117.00 120.12 2i6s n LEU 303 Ca 0.11 -0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.96 2i6s n LEU 303 Cb 0.20 0.41 0.09 0.00 0.53 0.00 0.00 43.42 44.65 2i6s n LEU 303 CO 0.19 0.46 0.39 -0.08 -1.11 0.00 0.00 177.39 177.25 2i6s h GLU 304 N 0.00 0.09 -0.01 1.96 4.22 0.07 -3.14 114.58 117.78 2i6s h GLU 304 Ca -0.50 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 58.86 2i6s h GLU 304 Cb 2.12 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.39 2i6s h GLU 304 CO 0.02 0.77 0.00 -1.71 -2.18 0.00 0.00 179.01 175.91 2i6s n ASN 305 N -3.73 0.59 -4.70 1.04 5.15 -0.61 -4.86 115.26 108.13 2i6s n ASN 305 Ca -0.02 -1.20 -0.42 0.00 -0.60 0.00 0.00 54.58 52.34 2i6s n ASN 305 Cb 0.70 -0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.92 2i6s n ASN 305 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2i6s s ALA 306 N -2.00 3.56 -0.08 5.20 0.00 -1.19 -5.02 121.76 122.23 2i6s s ALA 306 Ca 0.44 0.97 0.04 0.00 0.00 0.00 0.00 51.96 53.41 2i6s s ALA 306 Cb 0.21 -3.55 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 2i6s s ALA 306 CO 0.35 -0.72 -0.20 1.21 0.00 0.00 0.00 175.76 176.40 2i6s s ASN 307 N 1.45 3.48 0.31 0.00 3.84 -1.26 -5.02 114.94 117.73 2i6s s ASN 307 Ca 0.63 -0.41 0.03 0.00 0.21 0.00 0.00 52.86 53.33 2i6s s ASN 307 Cb -0.33 -1.06 0.53 0.00 -0.55 0.00 0.00 41.25 39.83 2i6s s ASN 307 CO 0.28 0.24 1.82 0.22 -2.79 0.00 0.00 177.10 176.87 2i6s h TYR 308 N 6.12 0.55 0.00 0.43 3.20 -1.97 -2.82 116.97 122.48 2i6s h TYR 308 Ca -0.32 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.47 2i6s h TYR 308 Cb 1.19 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2i6s h TYR 308 CO 0.46 0.60 0.00 1.63 -1.64 0.00 0.00 178.16 179.21 2i6s n LYS 309 N -4.22 0.08 0.18 1.82 5.02 -1.26 -2.92 118.16 116.85 2i6s n LYS 309 Ca 0.01 0.17 0.13 0.00 -2.02 0.00 0.00 58.31 56.60 2i6s n LYS 309 Cb 0.30 -1.50 0.63 0.00 -0.02 0.00 0.00 35.03 34.44 2i6s n LYS 309 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2i6s h ASP 310 N 0.00 0.00 -0.36 4.39 3.32 -1.93 -2.13 116.42 119.71 2i6s h ASP 310 Ca 0.00 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.83 2i6s h ASP 310 Cb 0.27 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.67 2i6s h ASP 310 CO 0.00 0.00 -0.28 1.41 -1.72 0.00 0.00 179.24 178.65 2i6s n HIS 311 N -2.44 1.20 0.09 4.55 8.25 -1.15 -4.67 115.22 121.03 2i6s n HIS 311 Ca 0.00 -1.77 -0.05 0.00 -0.26 0.00 0.00 57.72 55.64 2i6s n HIS 311 Cb 0.16 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 30.78 2i6s n HIS 311 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 2i6s h GLU 312 N 1.26 0.00 -0.11 -0.41 4.11 -1.59 -3.21 114.58 114.64 2i6s h GLU 312 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.64 2i6s h GLU 312 Cb 1.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2i6s h GLU 312 CO 0.41 0.87 0.00 0.09 0.07 0.00 0.00 179.01 180.45 2i6s n ASN 313 N -3.45 0.91 -3.17 3.06 3.02 -1.26 -4.57 115.26 109.79 2i6s n ASN 313 Ca -0.00 -1.65 0.02 0.00 -0.03 0.00 0.00 54.58 52.92 2i6s n ASN 313 Cb 0.84 -0.07 -0.01 0.00 -0.61 0.00 0.00 39.78 39.93 2i6s n ASN 313 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2i6s s GLY 314 N -1.47 -1.10 0.00 7.41 0.00 -1.21 -5.06 107.32 105.89 2i6s s GLY 314 Ca 0.27 1.19 0.16 0.00 0.00 0.00 0.00 44.72 46.33 2i6s s GLY 314 CO 0.21 3.51 0.94 2.41 0.00 0.00 0.00 173.10 180.17 2i6s n THR 315 N 5.41 0.00 -1.49 0.90 -1.04 -1.26 -3.31 114.28 113.50 2i6s n THR 315 Ca 0.03 -0.45 -0.30 0.00 -2.04 0.00 0.00 64.05 61.29 2i6s n THR 315 Cb 0.53 1.28 0.23 0.00 -1.82 0.00 0.00 70.33 70.54 2i6s n THR 315 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2i6s s GLY 316 N -1.48 1.70 -0.33 3.41 0.00 -1.26 -2.06 107.32 107.30 2i6s s GLY 316 Ca 0.16 -1.20 0.01 0.00 0.00 0.00 0.00 44.72 43.69 2i6s s GLY 316 CO 0.26 -0.31 0.04 -1.59 0.00 0.00 0.00 173.10 171.50 2i6s s THR 317 N -3.47 2.65 -0.89 0.90 2.01 -1.23 -2.83 115.64 112.77 2i6s s THR 317 Ca 0.74 -1.90 -0.01 0.00 0.31 0.00 0.00 61.69 60.83 2i6s s THR 317 Cb -0.05 -2.73 0.22 0.00 0.01 0.00 0.00 72.50 69.95 2i6s s THR 317 CO 0.55 -0.38 0.79 -3.20 -0.69 0.00 0.00 174.62 171.69 2i6s n ASN 318 N 4.45 4.19 0.24 3.53 2.85 0.33 -1.38 115.26 129.47 2i6s n ASN 318 Ca -0.05 -3.15 0.12 0.00 -0.11 0.00 0.00 54.58 51.38 2i6s n ASN 318 Cb 0.42 -1.03 0.52 0.00 1.24 0.00 0.00 39.78 40.93 2i6s n ASN 318 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2i6s h THR 319 N 4.01 0.42 0.17 -0.44 1.35 -1.84 -2.87 112.91 113.73 2i6s h THR 319 Ca 0.16 -0.95 -0.01 0.00 -0.55 0.00 0.00 66.41 65.06 2i6s h THR 319 Cb 0.80 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2i6s h THR 319 CO 0.86 0.16 -0.08 0.22 -0.25 0.00 0.00 175.52 176.43 2i6s h TYR 320 N 0.00 -0.22 -0.48 4.73 3.20 -1.83 -2.12 116.97 120.26 2i6s h TYR 320 Ca -0.00 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.91 2i6s h TYR 320 Cb 0.68 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.99 2i6s h TYR 320 CO 0.00 0.09 0.32 0.00 -1.64 0.00 0.00 178.16 176.93 2i6s h ALA 321 N 0.23 1.87 -0.17 1.82 0.00 -1.84 0.18 119.26 121.34 2i6s h ALA 321 Ca -0.02 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 2i6s h ALA 321 Cb 0.40 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2i6s h ALA 321 CO 0.04 0.06 -0.67 0.00 0.00 0.00 0.00 179.25 178.67 2i6s h ALA 322 N 1.74 0.32 -0.11 0.00 0.00 -1.48 -1.15 119.26 118.58 2i6s h ALA 322 Ca 0.20 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 2i6s h ALA 322 Cb 0.23 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2i6s h ALA 322 CO -0.05 0.62 -0.50 -0.07 0.00 0.00 0.00 179.25 179.25 2i6s h LEU 323 N 0.49 0.31 -1.02 0.00 3.38 -0.95 -2.98 115.31 114.55 2i6s h LEU 323 Ca -0.03 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2i6s h LEU 323 Cb 1.30 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2i6s h LEU 323 CO 0.14 0.76 0.08 -1.13 0.09 0.00 0.00 178.44 178.38 2i6s h ASN 324 N 0.23 0.74 -0.33 -0.43 -0.73 -0.55 -2.00 115.58 112.51 2i6s h ASN 324 Ca 0.01 -0.15 0.07 0.00 1.87 0.00 0.00 56.30 58.11 2i6s h ASN 324 Cb 0.96 -0.19 -0.08 0.00 0.27 0.00 0.00 38.32 39.28 2i6s h ASN 324 CO 0.08 0.76 -0.19 0.28 -0.37 0.00 0.00 177.43 177.99 2i6s h SER 325 N 0.75 -0.62 -0.91 1.15 0.02 -1.05 0.42 113.55 113.31 2i6s h SER 325 Ca 0.16 0.14 0.06 0.00 -0.84 0.00 0.00 61.79 61.30 2i6s h SER 325 Cb 0.34 0.33 -0.06 0.00 0.14 0.00 0.00 62.40 63.15 2i6s h SER 325 CO 0.01 -0.22 0.58 0.58 -1.14 0.00 0.00 176.83 176.63 2i6s h VAL 326 N -0.14 1.07 -0.56 2.27 2.07 -1.41 0.88 116.25 120.43 2i6s h VAL 326 Ca 0.17 -0.37 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 2i6s h VAL 326 Cb 0.40 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 2i6s h VAL 326 CO -0.41 0.19 0.10 0.22 0.02 0.00 0.00 177.57 177.69 2i6s h TYR 327 N 1.07 0.97 0.00 1.57 5.03 -0.61 0.74 116.97 125.75 2i6s h TYR 327 Ca 0.39 -0.13 -0.04 0.00 2.58 0.00 0.00 58.73 61.53 2i6s h TYR 327 Cb 0.14 -0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.15 2i6s h TYR 327 CO -0.02 0.85 -0.17 -0.07 -1.32 0.00 0.00 178.16 177.43 2i6s h LEU 328 N 0.81 0.00 0.09 2.82 3.38 0.50 0.26 115.31 123.17 2i6s h LEU 328 Ca 0.17 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.85 2i6s h LEU 328 Cb 0.40 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.17 2i6s h LEU 328 CO 0.01 0.17 -1.22 -0.03 0.09 0.00 0.00 178.44 177.46 2i6s h MET 329 N 0.00 0.54 -0.40 1.13 4.05 -0.29 -2.68 114.93 117.28 2i6s h MET 329 Ca -0.00 -0.73 -0.08 0.00 -0.28 0.00 0.00 59.70 58.61 2i6s h MET 329 Cb 0.39 0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.43 2i6s h MET 329 CO 0.02 1.32 -0.06 0.52 0.23 0.00 0.00 176.91 178.94 2i6s h MET 330 N 0.23 0.75 -0.92 0.39 2.86 -0.49 -1.49 114.93 116.26 2i6s h MET 330 Ca -0.17 -0.27 -0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2i6s h MET 330 Cb 1.90 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 33.46 2i6s h MET 330 CO 0.23 0.87 0.57 -0.97 1.06 0.00 0.00 176.91 178.66 2i6s h ASN 331 N 0.56 1.09 -0.56 1.22 -1.24 -1.04 -0.83 115.58 114.79 2i6s h ASN 331 Ca 0.11 -0.06 -0.09 0.00 0.71 0.00 0.00 56.30 56.96 2i6s h ASN 331 Cb 0.57 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.32 2i6s h ASN 331 CO 0.03 0.83 -0.00 0.78 -1.29 0.00 0.00 177.43 177.78 2i6s h ASN 332 N 1.26 0.99 0.69 1.15 2.35 -1.35 -3.03 115.58 117.64 2i6s h ASN 332 Ca 0.33 -0.27 -0.14 0.00 -0.55 0.00 0.00 56.30 55.67 2i6s h ASN 332 Cb -0.07 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.01 2i6s h ASN 332 CO -0.06 1.04 -0.66 -0.61 -1.65 0.00 0.00 177.43 175.49 2i6s h GLN 333 N 0.93 0.00 -0.33 0.81 4.15 -0.86 -2.28 115.11 117.52 2i6s h GLN 333 Ca 0.17 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.64 2i6s h GLN 333 Cb 0.54 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.18 2i6s h GLN 333 CO 0.03 0.66 -0.00 0.52 -1.93 0.00 0.00 178.83 178.11 2i6s h MET 334 N 0.00 0.09 -0.85 1.69 2.86 -1.11 -2.55 114.93 115.06 2i6s h MET 334 Ca -0.01 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2i6s h MET 334 Cb 1.18 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.78 2i6s h MET 334 CO 0.09 0.06 0.48 -0.09 1.06 0.00 0.00 176.91 178.51 2i6s h ARG 335 N 0.09 1.18 -0.11 1.72 1.12 -1.32 0.38 114.38 117.44 2i6s h ARG 335 Ca 0.16 -0.13 -0.01 0.00 -1.11 0.00 0.00 59.98 58.89 2i6s h ARG 335 Cb 0.21 -0.24 -0.00 0.00 -0.01 0.00 0.00 29.97 29.93 2i6s h ARG 335 CO -0.27 0.85 0.03 1.25 -3.11 0.00 0.00 179.97 178.73 2i6s h LEU 336 N 1.18 0.16 0.10 3.80 6.46 -1.25 -3.35 115.31 122.41 2i6s h LEU 336 Ca 0.30 -0.20 -0.37 0.00 -0.12 0.00 0.00 57.88 57.49 2i6s h LEU 336 Cb 0.00 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 39.86 2i6s h LEU 336 CO -0.05 0.32 -2.10 0.18 -0.62 0.00 0.00 178.44 176.17 2i6s n LEU 337 N -4.89 2.69 0.00 2.25 4.77 -0.98 -5.09 117.00 115.75 2i6s n LEU 337 Ca -0.06 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2i6s n LEU 337 Cb 0.14 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 2i6s n LEU 337 CO 0.34 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.88 2i6s n GLY 338 N 2.05 3.51 0.06 -0.72 0.00 0.13 -4.80 105.19 105.42 2i6s n GLY 338 Ca -0.35 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 43.97 2i6s n GLY 338 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2i6s h MET 339 N 0.00 0.04 0.00 1.61 4.05 -1.93 -3.25 114.93 115.45 2i6s h MET 339 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 2i6s h MET 339 Cb 0.00 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 2i6s h MET 339 CO 0.00 0.55 0.00 -0.85 0.23 0.00 0.00 176.91 176.84 2i6s n GLU 340 N -4.81 0.98 -3.09 0.39 0.28 -1.26 -4.72 120.64 108.41 2i6s n GLU 340 Ca -0.08 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.55 2i6s n GLU 340 Cb 0.28 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.59 2i6s n GLU 340 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2i6s s THR 341 N -2.00 4.55 0.40 3.84 -4.23 -1.23 -4.95 115.64 112.02 2i6s s THR 341 Ca 0.46 1.34 0.14 0.00 -1.18 0.00 0.00 61.69 62.46 2i6s s THR 341 Cb 0.21 -3.90 0.36 0.00 1.34 0.00 0.00 72.50 70.51 2i6s s THR 341 CO 0.36 0.27 1.87 -0.03 -0.54 0.00 0.00 174.62 176.55 2i6s h MET 342 N 3.61 0.48 0.00 3.99 4.05 -1.90 -2.03 114.93 123.13 2i6s h MET 342 Ca -0.48 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 58.91 2i6s h MET 342 Cb 1.20 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.89 2i6s h MET 342 CO 0.65 0.32 -0.00 0.00 0.23 0.00 0.00 176.91 178.11 2i6s h ALA 343 N 1.62 1.33 0.00 0.39 0.00 -1.92 -2.61 119.26 118.06 2i6s h ALA 343 Ca 0.44 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.10 2i6s h ALA 343 Cb 0.95 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2i6s h ALA 343 CO -0.18 0.00 -1.50 1.87 0.00 0.00 0.00 179.25 179.45 2i6s n TRP 344 N -3.56 0.61 0.57 0.00 -0.00 -0.79 -4.61 117.44 109.66 2i6s n TRP 344 Ca -0.03 0.26 0.09 0.00 -0.00 0.00 0.00 57.50 57.83 2i6s n TRP 344 Cb 0.08 -0.96 0.39 0.00 -0.00 0.00 0.00 31.31 30.82 2i6s n TRP 344 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 2i6s n GLN 345 N -4.41 0.04 0.02 5.87 6.02 -1.07 -1.56 117.38 122.29 2i6s n GLN 345 Ca -0.33 0.24 0.12 0.00 -0.01 0.00 0.00 57.00 57.02 2i6s n GLN 345 Cb 0.66 -1.57 0.32 0.00 1.02 0.00 0.00 30.24 30.67 2i6s n GLN 345 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2i6s n GLU 346 N -1.65 0.08 -2.39 -1.09 0.28 -1.00 -4.85 120.64 110.02 2i6s n GLU 346 Ca 0.04 0.03 -0.43 0.00 -0.16 0.00 0.00 57.16 56.64 2i6s n GLU 346 Cb 0.22 -1.56 -0.02 0.00 1.43 0.00 0.00 31.44 31.50 2i6s n GLU 346 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2i6s s ILE 347 N -3.04 4.21 -0.02 3.84 1.01 -0.60 -2.89 121.20 123.70 2i6s s ILE 347 Ca 0.11 1.45 -0.13 0.00 0.00 0.00 0.00 60.65 62.08 2i6s s ILE 347 Cb 0.17 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.61 2i6s s ILE 347 CO 0.66 -0.16 0.35 -0.13 0.00 0.00 0.00 174.94 175.66 2i6s s ARG 348 N 3.62 3.80 -0.11 2.79 0.52 0.20 -4.94 118.95 124.83 2i6s s ARG 348 Ca 0.56 0.28 0.02 0.00 -0.52 0.00 0.00 55.73 56.07 2i6s s ARG 348 Cb -0.22 -3.21 -0.01 0.00 0.52 0.00 0.00 34.95 32.03 2i6s s ARG 348 CO 0.17 0.71 -0.17 -1.01 0.02 0.00 0.00 175.30 175.01 2i6s s HIS 349 N -1.08 2.71 -0.13 -0.53 3.76 -0.53 -0.65 115.29 118.85 2i6s s HIS 349 Ca 0.22 -0.78 -0.00 0.00 -0.15 0.00 0.00 55.06 54.35 2i6s s HIS 349 Cb -0.16 -1.78 0.03 0.00 1.11 0.00 0.00 32.58 31.78 2i6s s HIS 349 CO 0.11 -0.28 -0.07 0.00 -0.85 0.00 0.00 174.74 173.66 2i6s s ALA 350 N 0.30 1.36 -0.25 -1.40 0.00 -0.30 -1.45 121.76 120.01 2i6s s ALA 350 Ca -0.13 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.16 2i6s s ALA 350 Cb -0.16 -0.97 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2i6s s ALA 350 CO 0.07 -0.52 0.02 0.42 0.00 0.00 0.00 175.76 175.75 2i6s s ILE 351 N 1.70 3.73 -0.20 0.00 1.01 0.27 -0.50 121.20 127.21 2i6s s ILE 351 Ca 0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 2i6s s ILE 351 Cb -0.13 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 2i6s s ILE 351 CO -0.08 0.28 -0.08 -0.63 0.00 0.00 0.00 174.94 174.42 2i6s s ILE 352 N 1.50 3.12 -0.35 2.92 1.01 0.43 -0.09 121.20 129.75 2i6s s ILE 352 Ca 0.04 -0.59 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 2i6s s ILE 352 Cb -0.16 -2.39 0.02 0.00 0.01 0.00 0.00 42.46 39.94 2i6s s ILE 352 CO -0.00 0.46 0.19 -0.76 0.00 0.00 0.00 174.94 174.83 2i6s s LEU 353 N 1.24 4.52 -0.98 2.97 1.43 0.86 0.64 118.68 129.36 2i6s s LEU 353 Ca 0.03 -0.85 -0.19 0.00 -1.03 0.00 0.00 54.13 52.10 2i6s s LEU 353 Cb -0.14 -2.01 0.13 0.00 0.03 0.00 0.00 46.19 44.19 2i6s s LEU 353 CO -0.03 -0.32 1.21 -0.76 0.23 0.00 0.00 176.35 176.67 2i6s s LEU 354 N 1.57 4.87 0.00 1.79 1.43 0.28 0.10 118.68 128.73 2i6s s LEU 354 Ca 0.03 -2.10 0.01 0.00 -1.03 0.00 0.00 54.13 51.03 2i6s s LEU 354 Cb -0.18 -2.42 -0.00 0.00 0.03 0.00 0.00 46.19 43.61 2i6s s LEU 354 CO 0.06 -1.07 0.12 1.07 0.23 0.00 0.00 176.35 176.77 2i6s n THR 355 N 5.55 0.00 -0.03 5.49 5.66 -0.31 -1.01 114.28 129.62 2i6s n THR 355 Ca 0.27 -0.66 0.00 0.00 -3.05 0.00 0.00 64.05 60.61 2i6s n THR 355 Cb 0.48 0.36 0.00 0.00 -1.55 0.00 0.00 70.33 69.63 2i6s n THR 355 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2i6s n ASP 356 N -2.26 0.10 0.00 1.09 3.85 -1.26 -3.35 116.55 114.71 2i6s n ASP 356 Ca 0.01 -0.46 0.00 0.00 -0.71 0.00 0.00 54.79 53.64 2i6s n ASP 356 Cb 0.19 0.64 0.00 0.00 -1.35 0.00 0.00 41.12 40.60 2i6s n ASP 356 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2i6s n GLY 357 N 0.64 0.76 3.78 6.12 0.00 -1.26 -1.85 105.19 113.38 2i6s n GLY 357 Ca 0.00 -1.39 -0.27 0.00 0.00 0.00 0.00 46.02 44.37 2i6s n GLY 357 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i6s n LYS 358 N 0.00 -6.03 -1.85 1.61 5.02 -1.26 -4.92 118.16 110.73 2i6s n LYS 358 Ca 0.00 0.67 -0.41 0.00 -2.02 0.00 0.00 58.31 56.55 2i6s n LYS 358 Cb 0.00 -5.54 -0.01 0.00 -0.02 0.00 0.00 35.03 29.46 2i6s n LYS 358 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2i6s s SER 359 N -3.56 6.42 0.00 4.39 0.15 -1.26 -4.66 113.70 115.17 2i6s s SER 359 Ca 0.49 2.98 0.00 0.00 0.70 0.00 0.00 55.95 60.12 2i6s s SER 359 Cb -0.24 -2.66 0.00 0.00 -1.71 0.00 0.00 66.02 61.41 2i6s s SER 359 CO 0.80 -0.82 0.00 -0.46 1.20 0.00 0.00 173.24 173.96 2i6s n ASN 360 N 0.67 0.00 -3.78 5.45 0.23 -0.48 -5.01 115.26 112.34 2i6s n ASN 360 Ca 0.01 -0.26 -0.10 0.00 -0.53 0.00 0.00 54.58 53.71 2i6s n ASN 360 Cb 0.39 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.04 2i6s n ASN 360 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2i6s s MET 361 N 0.00 1.21 0.00 -3.83 0.23 -1.15 -4.95 119.30 110.81 2i6s s MET 361 Ca 0.00 -0.91 0.00 0.00 -1.03 0.00 0.00 55.69 53.75 2i6s s MET 361 Cb 0.00 0.46 0.00 0.00 -1.53 0.00 0.00 34.83 33.76 2i6s s MET 361 CO 0.00 -0.48 0.00 0.41 -2.03 0.00 0.00 175.02 172.92 2i6s n GLY 362 N -0.26 1.43 2.06 3.16 0.00 -1.26 -4.33 105.19 105.98 2i6s n GLY 362 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2i6s n GLY 362 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i6s n GLY 363 N -2.00 -1.80 3.71 -0.02 0.00 -1.26 -4.81 105.19 99.02 2i6s n GLY 363 Ca 0.00 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 2i6s n GLY 363 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i6s s SER 364 N -4.00 7.34 0.62 1.61 0.15 -1.26 -4.68 113.70 113.49 2i6s s SER 364 Ca 0.00 1.76 0.40 0.00 0.70 0.00 0.00 55.95 58.81 2i6s s SER 364 Cb 0.00 -2.58 2.05 0.00 -1.71 0.00 0.00 66.02 63.79 2i6s s SER 364 CO 0.00 -0.26 2.24 -0.65 1.20 0.00 0.00 173.24 175.77 2i6s h PRO 365 N 6.53 0.00 -0.83 5.44 0.11 -1.92 -2.87 132.00 138.46 2i6s h PRO 365 Ca -0.42 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.71 2i6s h PRO 365 Cb 1.22 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2i6s h PRO 365 CO 0.75 0.01 0.55 -0.22 -0.21 0.00 0.00 178.00 178.88 2i6s h LYS 366 N 0.00 1.05 -0.97 1.05 3.64 -1.93 -2.24 116.57 117.17 2i6s h LYS 366 Ca -0.00 -0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2i6s h LYS 366 Cb 0.18 -0.24 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 2i6s h LYS 366 CO 0.00 0.69 0.63 1.15 -2.27 0.00 0.00 179.45 179.66 2i6s h THR 367 N 1.08 1.07 -0.04 1.00 2.02 -1.92 0.13 112.91 116.25 2i6s h THR 367 Ca 0.32 -0.38 -0.25 0.00 0.77 0.00 0.00 66.41 66.86 2i6s h THR 367 Cb -0.06 -0.15 0.02 0.00 -1.74 0.00 0.00 68.15 66.22 2i6s h THR 367 CO -0.08 0.20 -0.95 0.00 0.37 0.00 0.00 175.52 175.06 2i6s h ALA 368 N 1.48 0.16 -0.67 6.16 0.00 -1.62 -2.48 119.26 122.30 2i6s h ALA 368 Ca 0.43 -0.67 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 2i6s h ALA 368 Cb 0.21 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2i6s h ALA 368 CO -0.17 0.66 0.16 0.28 0.00 0.00 0.00 179.25 180.17 2i6s h VAL 369 N 0.40 1.26 -0.81 0.00 2.07 -0.98 -0.70 116.25 117.48 2i6s h VAL 369 Ca -0.11 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 2i6s h VAL 369 Cb 1.60 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 2i6s h VAL 369 CO 0.19 0.36 0.42 0.44 0.02 0.00 0.00 177.57 179.00 2i6s h ASP 370 N 1.00 1.03 -0.38 0.57 3.32 -0.80 -1.64 116.42 119.53 2i6s h ASP 370 Ca 0.21 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 2i6s h ASP 370 Cb 0.36 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2i6s h ASP 370 CO 0.00 0.85 -0.10 -0.74 -1.72 0.00 0.00 179.24 177.53 2i6s h HIS 371 N 1.14 0.84 -0.57 4.55 2.76 -0.89 -1.42 115.15 121.56 2i6s h HIS 371 Ca 0.28 -0.18 -0.02 0.00 -2.20 0.00 0.00 60.37 58.25 2i6s h HIS 371 Cb 0.07 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 2i6s h HIS 371 CO 0.01 0.89 0.27 0.82 -1.30 0.00 0.00 177.93 178.62 2i6s h ILE 372 N 0.55 1.21 -0.74 6.26 2.04 -1.07 -1.60 117.51 124.17 2i6s h ILE 372 Ca 0.10 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.43 2i6s h ILE 372 Cb 0.62 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 2i6s h ILE 372 CO 0.04 0.24 0.48 0.03 0.00 0.00 0.00 178.15 178.94 2i6s h ARG 373 N 0.78 0.72 0.04 2.37 3.08 -1.09 -1.80 114.38 118.48 2i6s h ARG 373 Ca 0.20 -0.04 -0.25 0.00 0.07 0.00 0.00 59.98 59.95 2i6s h ARG 373 Cb 0.13 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.03 2i6s h ARG 373 CO -0.02 0.48 -1.05 0.93 -1.07 0.00 0.00 179.97 179.24 2i6s h GLU 374 N 0.75 0.42 0.00 0.04 5.08 -0.72 -1.52 114.58 118.63 2i6s h GLU 374 Ca 0.32 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2i6s h GLU 374 Cb 0.30 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2i6s h GLU 374 CO -0.11 1.18 -0.14 1.51 -1.00 0.00 0.00 179.01 180.44 2i6s n ILE 375 N -3.71 0.06 0.45 3.13 3.06 -0.65 -3.41 119.36 118.29 2i6s n ILE 375 Ca -0.08 -0.03 0.05 0.00 -2.50 0.00 0.00 62.75 60.19 2i6s n ILE 375 Cb 0.90 -0.32 0.03 0.00 0.54 0.00 0.00 39.64 40.79 2i6s n ILE 375 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2i6s n LEU 376 N -1.59 1.64 -3.50 9.51 4.77 -0.69 -5.05 117.00 122.08 2i6s n LEU 376 Ca 0.06 -0.91 -0.17 0.00 -0.03 0.00 0.00 56.01 54.97 2i6s n LEU 376 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2i6s n LEU 376 CO 0.30 0.32 -0.04 0.59 -1.33 0.00 0.00 177.39 177.22 2i6s n ASN 377 N 0.27 -5.96 -4.66 -1.43 4.13 -0.62 -4.93 115.26 102.07 2i6s n ASN 377 Ca 0.05 -0.57 -0.40 0.00 1.68 0.00 0.00 54.58 55.34 2i6s n ASN 377 Cb 0.25 -2.99 -0.06 0.00 -1.54 0.00 0.00 39.78 35.44 2i6s n ASN 377 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2i6s s ILE 378 N -2.88 5.02 0.41 2.41 -1.09 -0.94 -4.87 121.20 119.26 2i6s s ILE 378 Ca 0.03 1.18 0.04 0.00 -2.23 0.00 0.00 60.65 59.67 2i6s s ILE 378 Cb -0.01 -3.94 -0.02 0.00 -1.58 0.00 0.00 42.46 36.91 2i6s s ILE 378 CO 0.84 0.11 0.13 0.20 -1.23 0.00 0.00 174.94 174.99 2i6s s ASN 379 N 1.20 2.83 0.55 3.58 -0.87 -1.26 -4.95 114.94 116.02 2i6s s ASN 379 Ca 0.29 -1.68 0.27 0.00 -1.57 0.00 0.00 52.86 50.17 2i6s s ASN 379 Cb -0.16 0.51 1.59 0.00 -0.02 0.00 0.00 41.25 43.17 2i6s s ASN 379 CO 0.10 -0.93 2.15 -0.61 -2.57 0.00 0.00 177.10 175.24 2i6s h GLN 380 N 1.77 0.00 -0.17 -0.60 4.15 -2.01 0.21 115.11 118.46 2i6s h GLN 380 Ca -0.35 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2i6s h GLN 380 Cb 1.27 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.96 2i6s h GLN 380 CO 0.57 0.07 0.00 1.63 -1.93 0.00 0.00 178.83 179.17 2i6s n LYS 381 N -3.80 2.07 -0.29 1.69 5.02 -1.26 -4.27 118.16 117.31 2i6s n LYS 381 Ca -0.02 -1.58 0.02 0.00 -2.02 0.00 0.00 58.31 54.70 2i6s n LYS 381 Cb 0.16 -1.46 0.03 0.00 -0.02 0.00 0.00 35.03 33.74 2i6s n LYS 381 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i6s n ARG 382 N 0.84 0.44 0.31 1.97 1.74 0.13 -4.79 116.66 117.30 2i6s n ARG 382 Ca 0.17 -1.25 0.19 0.00 -0.77 0.00 0.00 57.85 56.19 2i6s n ARG 382 Cb 0.47 -0.73 1.02 0.00 -1.02 0.00 0.00 32.46 32.20 2i6s n ARG 382 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2i6s h ASN 383 N 0.00 0.00 0.33 0.55 2.35 -0.89 -2.34 115.58 115.57 2i6s h ASN 383 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2i6s h ASN 383 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2i6s h ASN 383 CO 0.00 0.02 0.00 0.47 -1.65 0.00 0.00 177.43 176.27 2i6s n ASP 384 N -3.30 0.23 -0.47 5.81 8.00 -1.26 -2.90 116.55 122.66 2i6s n ASP 384 Ca -0.02 0.58 0.11 0.00 0.71 0.00 0.00 54.79 56.16 2i6s n ASP 384 Cb 0.13 -0.62 -0.01 0.00 -0.02 0.00 0.00 41.12 40.60 2i6s n ASP 384 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2i6s n TYR 385 N -1.77 0.00 -3.73 1.24 4.02 -0.88 -4.75 117.16 111.28 2i6s n TYR 385 Ca 0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.76 2i6s n TYR 385 Cb 0.11 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.28 2i6s n TYR 385 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2i6s s LEU 386 N -2.51 0.59 -0.04 7.72 2.96 -1.14 -1.45 118.68 124.81 2i6s s LEU 386 Ca 0.18 0.28 -0.02 0.00 -0.22 0.00 0.00 54.13 54.35 2i6s s LEU 386 Cb 0.18 0.29 0.03 0.00 0.50 0.00 0.00 46.19 47.20 2i6s s LEU 386 CO 0.59 -0.17 0.07 -1.81 -1.32 0.00 0.00 176.35 173.71 2i6s s ASP 387 N 1.39 0.75 -0.17 3.68 1.01 -0.53 -4.96 116.67 117.84 2i6s s ASP 387 Ca -0.07 0.11 -0.00 0.00 0.71 0.00 0.00 52.55 53.30 2i6s s ASP 387 Cb -0.12 -0.06 0.00 0.00 1.01 0.00 0.00 42.92 43.75 2i6s s ASP 387 CO -0.06 -0.21 -0.15 -0.63 0.21 0.00 0.00 175.17 174.34 2i6s s ILE 388 N 1.85 2.62 0.02 0.77 1.01 -1.26 -0.57 121.20 125.64 2i6s s ILE 388 Ca 0.00 -0.77 0.07 0.00 0.00 0.00 0.00 60.65 59.96 2i6s s ILE 388 Cb -0.12 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 2i6s s ILE 388 CO -0.03 0.50 -0.20 -0.31 0.00 0.00 0.00 174.94 174.90 2i6s s TYR 389 N 1.08 2.51 -0.19 3.97 1.51 0.88 -4.46 117.35 122.64 2i6s s TYR 389 Ca -0.00 -0.29 -0.00 0.00 -1.01 0.00 0.00 57.07 55.77 2i6s s TYR 389 Cb -0.14 -1.48 0.05 0.00 -0.11 0.00 0.00 41.96 40.27 2i6s s TYR 389 CO -0.04 0.18 -0.06 0.00 -1.11 0.00 0.00 175.55 174.52 2i6s s ALA 390 N -0.83 1.68 -0.15 3.71 0.00 -0.85 -0.10 121.76 125.21 2i6s s ALA 390 Ca 0.13 -1.02 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 2i6s s ALA 390 Cb -0.10 -1.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.77 2i6s s ALA 390 CO 0.03 -0.89 -0.09 0.42 0.00 0.00 0.00 175.76 175.23 2i6s s ILE 391 N 1.54 3.39 -0.21 0.00 1.01 0.12 -1.83 121.20 125.21 2i6s s ILE 391 Ca -0.01 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 2i6s s ILE 391 Cb -0.16 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2i6s s ILE 391 CO -0.08 0.50 0.29 -0.83 0.00 0.00 0.00 174.94 174.83 2i6s s GLY 392 N 0.50 2.07 -0.17 6.18 0.00 0.12 -1.17 107.32 114.85 2i6s s GLY 392 Ca -0.06 -0.64 -0.01 0.00 0.00 0.00 0.00 44.72 44.00 2i6s s GLY 392 CO 0.04 0.60 -0.01 0.14 0.00 0.00 0.00 173.10 173.86 2i6s s VAL 393 N 1.07 0.83 0.00 1.40 1.01 -1.24 0.96 120.40 124.43 2i6s s VAL 393 Ca 0.14 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2i6s s VAL 393 Cb -0.14 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2i6s s VAL 393 CO 0.06 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.78 2i6s n GLY 394 N 4.96 0.67 0.00 4.51 0.00 -0.86 -4.87 105.19 109.60 2i6s n GLY 394 Ca -0.10 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.15 2i6s n GLY 394 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2i6s n VAL 398 N -3.23 0.00 -2.65 1.61 0.31 -1.26 -5.05 118.33 108.06 2i6s n VAL 398 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 2i6s n VAL 398 Cb 0.48 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.39 2i6s n VAL 398 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2i6s s ASP 399 N 0.00 7.20 -0.06 4.52 1.01 -0.77 -4.97 116.67 123.60 2i6s s ASP 399 Ca 0.00 1.55 -0.14 0.00 0.71 0.00 0.00 52.55 54.67 2i6s s ASP 399 Cb 0.00 -2.55 -0.10 0.00 1.01 0.00 0.00 42.92 41.28 2i6s s ASP 399 CO 0.00 -0.49 0.58 -0.50 0.21 0.00 0.00 175.17 174.97 2i6s h TRP 400 N 7.19 -0.27 0.00 4.23 6.55 -2.01 -3.23 115.95 128.40 2i6s h TRP 400 Ca -0.30 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.53 2i6s h TRP 400 Cb 1.14 0.09 0.00 0.00 -0.86 0.00 0.00 29.16 29.53 2i6s h TRP 400 CO 0.72 -0.01 -0.11 0.54 -1.05 0.00 0.00 178.44 178.54 2i6s n ARG 401 N -4.97 0.27 0.17 0.49 1.74 -1.26 -2.89 116.66 110.21 2i6s n ARG 401 Ca -0.06 0.19 0.12 0.00 -0.77 0.00 0.00 57.85 57.33 2i6s n ARG 401 Cb 0.20 -1.78 0.16 0.00 -1.02 0.00 0.00 32.46 30.01 2i6s n ARG 401 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2i6s h GLU 402 N 0.00 0.00 0.03 5.56 4.81 -1.97 -2.91 114.58 120.11 2i6s h GLU 402 Ca 0.00 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 59.02 2i6s h GLU 402 Cb 0.74 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 2i6s h GLU 402 CO 0.00 0.00 -0.99 -0.07 -0.73 0.00 0.00 179.01 177.22 2i6s h LEU 403 N 0.00 0.15 -1.32 1.64 3.38 -1.54 -3.10 115.31 114.52 2i6s h LEU 403 Ca 0.00 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 2i6s h LEU 403 Cb 0.96 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2i6s h LEU 403 CO 0.00 1.05 -0.23 0.78 0.09 0.00 0.00 178.44 180.13 2i6s h ASN 404 N 0.04 0.00 -0.07 -0.43 2.35 -1.55 -0.39 115.58 115.54 2i6s h ASN 404 Ca -0.04 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2i6s h ASN 404 Cb 1.70 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.06 2i6s h ASN 404 CO 0.14 0.23 0.03 -0.33 -1.65 0.00 0.00 177.43 175.85 2i6s h GLU 405 N 0.00 0.10 -0.33 0.81 4.39 -1.47 -3.23 114.58 114.85 2i6s h GLU 405 Ca -0.00 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 2i6s h GLU 405 Cb 0.65 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2i6s h GLU 405 CO 0.03 0.23 0.02 -0.07 -1.16 0.00 0.00 179.01 178.06 2i6s h LEU 406 N -0.05 0.55 0.00 1.33 3.38 -1.43 -3.48 115.31 115.60 2i6s h LEU 406 Ca 0.02 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2i6s h LEU 406 Cb 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2i6s h LEU 406 CO -0.00 0.71 0.00 0.61 0.09 0.00 0.00 178.44 179.85 2i6s n GLY 407 N -0.39 0.88 3.61 0.83 0.00 -0.17 -4.86 105.19 105.08 2i6s n GLY 407 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2i6s n GLY 407 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2i6s s ARG 414 N 0.02 3.35 -0.29 1.61 3.52 -1.26 -4.81 118.95 121.09 2i6s s ARG 414 Ca 0.00 1.95 0.08 0.00 -0.13 0.00 0.00 55.73 57.63 2i6s s ARG 414 Cb 0.00 -4.28 0.45 0.00 -1.56 0.00 0.00 34.95 29.56 2i6s s ARG 414 CO 0.00 -1.85 1.29 0.72 -0.81 0.00 0.00 175.30 174.65 2i6s n HIS 415 N 10.64 1.70 -3.73 5.12 8.25 -1.26 -4.99 115.22 130.95 2i6s n HIS 415 Ca 0.26 -1.97 -0.15 0.00 -0.26 0.00 0.00 57.72 55.61 2i6s n HIS 415 Cb 0.45 -0.41 -0.15 0.00 1.12 0.00 0.00 29.99 31.00 2i6s n HIS 415 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2i6s s ALA 416 N -3.46 -0.11 -0.00 -1.41 0.00 -1.26 -2.01 121.76 113.51 2i6s s ALA 416 Ca 0.47 0.52 0.03 0.00 0.00 0.00 0.00 51.96 52.98 2i6s s ALA 416 Cb 0.40 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 2i6s s ALA 416 CO -0.00 -0.24 -0.10 -0.06 0.00 0.00 0.00 175.76 175.36 2i6s s PHE 417 N 1.41 0.89 -0.23 0.00 0.40 -0.76 -4.97 117.98 114.72 2i6s s PHE 417 Ca -0.06 -0.18 -0.04 0.00 -0.60 0.00 0.00 56.93 56.05 2i6s s PHE 417 Cb -0.12 -0.57 -0.00 0.00 0.51 0.00 0.00 43.02 42.84 2i6s s PHE 417 CO -0.05 -0.01 -0.03 0.42 0.70 0.00 0.00 175.22 176.24 2i6s s ILE 418 N -0.28 3.35 0.04 0.64 -1.09 -1.26 0.15 121.20 122.76 2i6s s ILE 418 Ca 0.03 -0.59 0.02 0.00 -2.23 0.00 0.00 60.65 57.89 2i6s s ILE 418 Cb -0.04 -2.57 -0.02 0.00 -1.58 0.00 0.00 42.46 38.24 2i6s s ILE 418 CO -0.00 0.36 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.23 2i6s s LEU 419 N 1.46 2.27 -0.00 2.97 1.43 0.27 -4.97 118.68 122.11 2i6s s LEU 419 Ca 0.05 -0.57 -0.00 0.00 -1.03 0.00 0.00 54.13 52.57 2i6s s LEU 419 Cb -0.15 -0.16 -0.00 0.00 0.03 0.00 0.00 46.19 45.91 2i6s s LEU 419 CO -0.03 -0.22 -0.01 1.67 0.23 0.00 0.00 176.35 177.99 2i6s n GLN 420 N 1.39 0.01 -1.58 1.70 7.27 -1.26 -2.02 117.38 122.90 2i6s n GLN 420 Ca -0.22 0.06 -0.31 0.00 0.07 0.00 0.00 57.00 56.60 2i6s n GLN 420 Cb 0.55 -0.58 0.05 0.00 2.41 0.00 0.00 30.24 32.67 2i6s n GLN 420 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2i6s s ASP 421 N -3.95 5.37 0.15 1.69 -1.08 -1.26 -4.13 116.67 113.45 2i6s s ASP 421 Ca -0.01 1.60 -0.06 0.00 -0.52 0.00 0.00 52.55 53.56 2i6s s ASP 421 Cb 0.00 -2.47 -0.02 0.00 -1.46 0.00 0.00 42.92 38.96 2i6s s ASP 421 CO 0.01 -1.45 1.39 0.74 0.52 0.00 0.00 175.17 176.38 2i6s h THR 422 N -0.72 1.33 0.00 1.71 2.02 -1.96 -2.91 112.91 112.38 2i6s h THR 422 Ca -0.44 -2.03 -0.02 0.00 0.77 0.00 0.00 66.41 64.69 2i6s h THR 422 Cb 1.21 2.01 -0.00 0.00 -1.74 0.00 0.00 68.15 69.63 2i6s h THR 422 CO 0.57 0.63 -0.10 0.50 0.37 0.00 0.00 175.52 177.49 2i6s h LYS 423 N 0.40 0.00 -0.23 6.66 3.64 -1.99 0.22 116.57 125.27 2i6s h LYS 423 Ca -0.03 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.18 2i6s h LYS 423 Cb 1.32 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2i6s h LYS 423 CO 0.14 0.10 -0.53 0.00 -2.27 0.00 0.00 179.45 176.88 2i6s h ALA 424 N 1.90 0.62 -0.07 5.00 0.00 -1.90 -2.97 119.26 121.83 2i6s h ALA 424 Ca -0.00 -0.51 -0.18 0.00 0.00 0.00 0.00 54.91 54.22 2i6s h ALA 424 Cb 0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2i6s h ALA 424 CO 0.01 0.68 -0.72 1.25 0.00 0.00 0.00 179.25 180.48 2i6s h LEU 425 N 0.53 0.45 -0.93 0.00 6.46 -1.12 -2.70 115.31 118.00 2i6s h LEU 425 Ca 0.01 -0.29 0.12 0.00 -0.12 0.00 0.00 57.88 57.60 2i6s h LEU 425 Cb 1.10 -0.13 -0.08 0.00 -0.73 0.00 0.00 40.66 40.82 2i6s h LEU 425 CO 0.11 1.03 0.56 -0.74 -0.62 0.00 0.00 178.44 178.77 2i6s h HIS 426 N 0.26 1.00 0.27 1.25 2.76 -0.98 0.26 115.15 119.97 2i6s h HIS 426 Ca -0.03 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 2i6s h HIS 426 Cb 1.29 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.94 2i6s h HIS 426 CO 0.04 0.38 -0.13 1.96 -1.30 0.00 0.00 177.93 178.88 2i6s h GLN 427 N 0.88 -0.35 -0.24 5.26 1.08 -1.39 -3.12 115.11 117.22 2i6s h GLN 427 Ca 0.46 0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.58 2i6s h GLN 427 Cb 0.48 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 2i6s h GLN 427 CO -0.27 -0.12 -0.28 0.28 -0.95 0.00 0.00 178.83 177.49 2i6s h VAL 428 N -0.54 1.27 0.00 -0.54 2.07 -1.07 -1.79 116.25 115.66 2i6s h VAL 428 Ca -0.04 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.13 2i6s h VAL 428 Cb 0.40 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 2i6s h VAL 428 CO 0.06 0.42 -0.12 0.15 0.02 0.00 0.00 177.57 178.10 2i6s h PHE 429 N 0.42 0.00 -0.77 1.57 3.57 -0.59 -1.00 116.94 120.15 2i6s h PHE 429 Ca 0.06 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2i6s h PHE 429 Cb 0.71 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.42 2i6s h PHE 429 CO 0.02 0.12 0.42 0.93 -2.23 0.00 0.00 178.31 177.57 2i6s h GLU 430 N 0.00 1.06 0.00 1.11 4.39 -1.26 -2.66 114.58 117.22 2i6s h GLU 430 Ca -0.00 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2i6s h GLU 430 Cb 0.22 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2i6s h GLU 430 CO 0.02 0.77 0.00 0.72 -1.16 0.00 0.00 179.01 179.36 2i6s n HIS 431 N -4.36 0.74 1.42 4.33 8.25 -0.44 -3.06 115.22 122.10 2i6s n HIS 431 Ca 0.08 0.21 0.15 0.00 -0.26 0.00 0.00 57.72 57.90 2i6s n HIS 431 Cb 0.10 -0.85 0.70 0.00 1.12 0.00 0.00 29.99 31.06 2i6s n HIS 431 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2i6s n MET 432 N -2.10 0.52 -4.66 -0.41 2.81 -0.82 -4.84 117.12 107.61 2i6s n MET 432 Ca 0.06 -0.08 -0.33 0.00 -1.81 0.00 0.00 57.70 55.53 2i6s n MET 432 Cb 0.41 -1.50 -0.12 0.00 -0.71 0.00 0.00 33.22 31.30 2i6s n MET 432 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2i6s s LEU 433 N -2.54 3.03 -0.25 4.03 1.43 -1.17 0.67 118.68 123.87 2i6s s LEU 433 Ca 0.28 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2i6s s LEU 433 Cb 0.20 -1.67 0.01 0.00 0.03 0.00 0.00 46.19 44.76 2i6s s LEU 433 CO 0.47 0.29 -0.00 -0.62 0.23 0.00 0.00 176.35 176.72 2i6s s ASP 434 N -0.39 4.61 -0.00 2.29 2.15 0.30 -4.85 116.67 120.79 2i6s s ASP 434 Ca 0.05 -0.62 0.04 0.00 0.43 0.00 0.00 52.55 52.46 2i6s s ASP 434 Cb -0.12 -1.77 -0.05 0.00 -0.30 0.00 0.00 42.92 40.68 2i6s s ASP 434 CO 0.02 -0.11 0.17 0.52 -0.17 0.00 0.00 175.17 175.61 2i6s n VAL 435 N 4.79 0.00 0.00 1.11 0.31 -1.26 0.35 118.33 123.64 2i6s n VAL 435 Ca -0.16 -0.36 0.23 0.00 -0.01 0.00 0.00 64.34 64.03 2i6s n VAL 435 Cb 0.49 0.93 0.72 0.00 -0.91 0.00 0.00 33.84 35.07 2i6s n VAL 435 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2i6s h SER 436 N 0.00 0.00 -0.49 4.52 4.64 -1.93 0.32 113.55 120.62 2i6s h SER 436 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2i6s h SER 436 Cb 0.11 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.14 2i6s h SER 436 CO 0.00 0.00 0.15 0.29 -0.87 0.00 0.00 176.83 176.40 2i6s n LYS 437 N -3.84 3.08 -3.08 4.77 5.02 -1.26 -4.47 118.16 118.37 2i6s n LYS 437 Ca 0.11 -2.11 -0.35 0.00 -2.02 0.00 0.00 58.31 53.93 2i6s n LYS 437 Cb 0.76 -1.95 -0.02 0.00 -0.02 0.00 0.00 35.03 33.79 2i6s n LYS 437 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2i6s n LEU 438 N 0.09 5.45 0.00 -0.35 7.94 0.11 -4.72 117.00 125.52 2i6s n LEU 438 Ca 0.26 -5.38 0.02 0.00 -1.11 0.00 0.00 56.01 49.80 2i6s n LEU 438 Cb 1.03 -0.96 0.13 0.00 0.53 0.00 0.00 43.42 44.15 2i6s n LEU 438 CO 0.29 1.96 0.39 0.35 -1.11 0.00 0.00 177.39 179.27 2i6s n THR 439 N 0.74 0.00 -0.83 1.96 -2.24 -1.26 -4.72 114.28 107.92 2i6s n THR 439 Ca 0.31 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.78 2i6s n THR 439 Cb 0.35 -0.34 0.15 0.00 -2.10 0.00 0.00 70.33 68.39 2i6s n THR 439 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2i6s s ASP 440 N -1.58 3.25 -0.20 3.42 -1.08 -1.26 -4.57 116.67 114.65 2i6s s ASP 440 Ca 0.07 2.15 0.07 0.00 -0.52 0.00 0.00 52.55 54.31 2i6s s ASP 440 Cb 0.03 -2.56 0.49 0.00 -1.46 0.00 0.00 42.92 39.42 2i6s s ASP 440 CO 0.05 -2.88 1.39 1.07 0.52 0.00 0.00 175.17 175.32 2i6s n THR 441 N -4.02 1.98 -1.74 1.71 5.66 -1.26 -4.82 114.28 111.78 2i6s n THR 441 Ca 0.12 -1.00 -0.40 0.00 -3.05 0.00 0.00 64.05 59.72 2i6s n THR 441 Cb 0.52 -0.47 0.02 0.00 -1.55 0.00 0.00 70.33 68.86 2i6s n THR 441 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2i6s n ILE 442 N 0.07 3.07 -4.03 1.09 3.06 -1.26 -4.82 119.36 116.53 2i6s n ILE 442 Ca 0.25 -0.50 -0.26 0.00 -2.50 0.00 0.00 62.75 59.73 2i6s n ILE 442 Cb 0.99 -1.74 -0.05 0.00 0.54 0.00 0.00 39.64 39.39 2i6s n ILE 442 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2i6s n GLY 444 N -0.39 -0.05 3.54 0.00 0.00 -0.27 -4.60 105.19 103.42 2i6s n GLY 444 Ca -0.08 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 2i6s n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i6s s VAL 445 N -2.62 4.37 0.34 1.61 1.01 -1.26 -1.47 120.40 122.38 2i6s s VAL 445 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.87 2i6s s VAL 445 Cb 0.00 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 2i6s s VAL 445 CO 0.00 0.44 0.26 -0.83 0.00 0.00 0.00 175.10 174.97 2i6s s GLY 446 N 0.71 2.36 -0.16 4.51 0.00 -1.26 -4.75 107.32 108.73 2i6s s GLY 446 Ca 0.02 -1.97 -0.14 0.00 0.00 0.00 0.00 44.72 42.62 2i6s s GLY 446 CO 0.02 -1.51 0.32 0.21 0.00 0.00 0.00 173.10 172.13 2i6s s ASN 447 N -3.40 6.45 0.00 1.64 3.84 -0.79 -4.99 114.94 117.70 2i6s s ASN 447 Ca 0.39 0.53 0.26 0.00 0.21 0.00 0.00 52.86 54.25 2i6s s ASN 447 Cb 0.02 -2.19 0.63 0.00 -0.55 0.00 0.00 41.25 39.16 2i6s s ASN 447 CO 0.26 0.07 1.49 0.23 -2.79 0.00 0.00 177.10 176.37 2i6s n MET 448 N 3.67 1.28 -4.24 0.43 2.81 -1.26 -4.37 117.12 115.43 2i6s n MET 448 Ca -0.11 -0.86 -0.30 0.00 -1.81 0.00 0.00 57.70 54.62 2i6s n MET 448 Cb 0.52 -1.48 -0.09 0.00 -0.71 0.00 0.00 33.22 31.45 2i6s n MET 448 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2i6s s SER 449 N -2.32 4.69 1.25 7.83 1.04 -1.26 -4.92 113.70 120.02 2i6s s SER 449 Ca 0.27 -0.25 -0.19 0.00 0.48 0.00 0.00 55.95 56.27 2i6s s SER 449 Cb 0.20 -1.03 0.30 0.00 0.10 0.00 0.00 66.02 65.59 2i6s s SER 449 CO 0.46 0.20 1.03 0.00 0.98 0.00 0.00 173.24 175.91 2i6s s ALA 450 N -1.20 -0.00 0.00 5.32 0.00 -1.26 -3.35 121.76 121.26 2i6s s ALA 450 Ca 0.22 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2i6s s ALA 450 Cb -0.11 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.02 2i6s s ALA 450 CO 0.14 -3.90 0.00 0.09 0.00 0.00 0.00 175.76 172.08 2i6s n ASN 451 N -5.03 0.00 -4.83 0.00 4.13 -1.26 -4.97 115.26 103.30 2i6s n ASN 451 Ca 0.10 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 56.01 2i6s n ASN 451 Cb 0.59 -0.23 -0.06 0.00 -1.54 0.00 0.00 39.78 38.53 2i6s n ASN 451 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2i6s s ALA 452 N -0.78 3.42 0.78 5.41 0.00 -1.21 -5.06 121.76 124.30 2i6s s ALA 452 Ca 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 51.96 51.92 2i6s s ALA 452 Cb 0.00 -2.77 0.07 0.00 0.00 0.00 0.00 23.12 20.42 2i6s s ALA 452 CO 0.00 0.35 1.19 -1.54 0.00 0.00 0.00 175.76 175.75 2i6s s SER 453 N -1.81 3.91 0.29 0.00 1.04 -1.26 -4.86 113.70 111.01 2i6s s SER 453 Ca 0.45 2.29 0.01 0.00 0.48 0.00 0.00 55.95 59.17 2i6s s SER 453 Cb -0.15 -2.58 0.53 0.00 0.10 0.00 0.00 66.02 63.92 2i6s s SER 453 CO 0.20 -2.45 1.87 0.44 0.98 0.00 0.00 173.24 174.28 2i6s h ASP 454 N -0.72 0.93 -0.07 7.02 3.32 -1.97 -1.80 116.42 123.13 2i6s h ASP 454 Ca -0.46 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.56 2i6s h ASP 454 Cb 1.29 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 2i6s h ASP 454 CO 0.48 0.55 -0.08 -0.61 -1.72 0.00 0.00 179.24 177.86 2i6s h GLN 455 N 1.03 0.34 -0.04 3.56 5.75 -1.88 -1.66 115.11 122.21 2i6s h GLN 455 Ca 0.44 -0.08 -0.15 0.00 -0.15 0.00 0.00 58.65 58.72 2i6s h GLN 455 Cb 0.33 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 2i6s h GLN 455 CO -0.20 0.44 -0.63 0.93 -2.65 0.00 0.00 178.83 176.72 2i6s h GLU 456 N 0.33 0.17 -0.01 1.69 5.08 -1.54 -2.23 114.58 118.06 2i6s h GLU 456 Ca 0.07 -0.12 -0.21 0.00 -1.00 0.00 0.00 59.36 58.09 2i6s h GLU 456 Cb 0.35 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2i6s h GLU 456 CO 0.02 0.75 -0.90 0.00 -1.00 0.00 0.00 179.01 177.88 2i6s h ARG 457 N 0.12 0.37 -2.13 2.33 3.08 -1.09 -2.10 114.38 114.96 2i6s h ARG 457 Ca -0.01 -0.38 -0.58 0.00 0.07 0.00 0.00 59.98 59.07 2i6s h ARG 457 Cb 1.14 0.11 -0.41 0.00 0.08 0.00 0.00 29.97 30.89 2i6s h ARG 457 CO 0.09 1.06 -0.76 2.41 -1.07 0.00 0.00 179.97 181.70 2i6s n THR 458 N -3.74 1.43 0.96 2.04 -1.04 -0.67 -4.33 114.28 108.94 2i6s n THR 458 Ca -0.06 -4.87 0.11 0.00 -2.04 0.00 0.00 64.05 57.19 2i6s n THR 458 Cb 0.81 -1.97 0.54 0.00 -1.82 0.00 0.00 70.33 67.89 2i6s n THR 458 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2i6s n PRO 459 N 0.93 0.21 0.10 -2.82 -0.04 -0.84 -2.12 135.00 130.41 2i6s n PRO 459 Ca 0.27 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.94 2i6s n PRO 459 Cb 0.45 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.58 2i6s n PRO 459 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 2i6s h TRP 460 N 0.00 0.00 -2.88 0.54 0.09 -1.79 -2.47 115.95 109.45 2i6s h TRP 460 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 58.89 58.44 2i6s h TRP 460 Cb 0.27 0.00 0.01 0.00 0.08 0.00 0.00 29.16 29.53 2i6s h TRP 460 CO 0.00 0.00 0.84 -1.58 0.09 0.00 0.00 178.44 177.79 2i6s s HIS 461 N -3.21 2.88 0.17 0.12 2.46 -0.90 -0.69 115.29 116.11 2i6s s HIS 461 Ca 0.06 0.73 0.09 0.00 0.47 0.00 0.00 55.06 56.40 2i6s s HIS 461 Cb 0.11 -3.76 -0.04 0.00 -0.13 0.00 0.00 32.58 28.76 2i6s s HIS 461 CO 0.71 -2.83 -0.18 0.14 -2.47 0.00 0.00 174.74 170.10 2i6s s VAL 462 N 2.00 1.83 -0.13 0.89 -7.23 -0.85 -4.49 120.40 112.41 2i6s s VAL 462 Ca 0.67 -1.94 -0.04 0.00 -1.81 0.00 0.00 61.98 58.86 2i6s s VAL 462 Cb -0.36 -1.86 -0.03 0.00 0.56 0.00 0.00 36.38 34.69 2i6s s VAL 462 CO 0.29 -0.33 0.00 -0.89 -0.31 0.00 0.00 175.10 173.87 2i6s s THR 463 N -2.09 4.29 -0.09 5.32 2.01 -0.71 -1.84 115.64 122.52 2i6s s THR 463 Ca 0.16 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.94 2i6s s THR 463 Cb -0.05 -2.86 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 2i6s s THR 463 CO 0.07 0.53 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.80 2i6s s ILE 464 N -0.12 3.39 -0.18 1.82 1.01 0.17 0.18 121.20 127.46 2i6s s ILE 464 Ca 0.04 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 60.12 2i6s s ILE 464 Cb -0.13 -2.39 0.03 0.00 0.01 0.00 0.00 42.46 39.98 2i6s s ILE 464 CO 0.02 0.56 -0.15 -0.54 0.00 0.00 0.00 174.94 174.84 2i6s s LYS 465 N -0.33 2.42 0.24 2.79 1.02 0.06 -1.30 119.74 124.63 2i6s s LYS 465 Ca 0.04 -0.77 -0.00 0.00 0.02 0.00 0.00 55.97 55.26 2i6s s LYS 465 Cb -0.13 -2.38 0.05 0.00 -0.52 0.00 0.00 37.83 34.85 2i6s s LYS 465 CO 0.02 -0.30 0.33 -0.35 -0.92 0.00 0.00 175.35 174.13 2i6s n PRO 466 N 4.68 0.34 -1.70 -1.68 -0.04 -1.26 -0.28 135.00 135.06 2i6s n PRO 466 Ca -0.17 -0.87 -0.42 0.00 -0.04 0.00 0.00 63.50 62.00 2i6s n PRO 466 Cb 0.48 -0.23 -0.02 0.00 -0.04 0.00 0.00 33.50 33.69 2i6s n PRO 466 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2i6s n LYS 467 N -1.62 2.40 0.00 0.54 4.81 -1.26 -3.76 118.16 119.27 2i6s n LYS 467 Ca 0.05 -2.46 0.00 0.00 -0.87 0.00 0.00 58.31 55.03 2i6s n LYS 467 Cb 0.19 -3.24 0.00 0.00 0.02 0.00 0.00 35.03 32.00 2i6s n LYS 467 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2i6s n SER 468 N 7.47 0.00 0.00 3.14 2.88 -1.26 -4.83 113.62 121.02 2i6s n SER 468 Ca 0.50 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 2i6s n SER 468 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 2i6s n SER 468 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i6s n GLN 469 N -0.75 0.00 -1.55 -1.46 1.13 -1.25 -4.97 117.38 108.53 2i6s n GLN 469 Ca 0.00 0.00 -0.47 0.00 -1.94 0.00 0.00 57.00 54.59 2i6s n GLN 469 Cb 0.00 -0.61 -0.05 0.00 0.11 0.00 0.00 30.24 29.69 2i6s n GLN 469 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 2i6s n GLU 470 N -0.64 1.65 -2.39 -1.09 2.13 -1.26 -4.95 120.64 114.09 2i6s n GLU 470 Ca 0.00 0.48 -0.34 0.00 0.66 0.00 0.00 57.16 57.96 2i6s n GLU 470 Cb 0.00 -2.86 -0.02 0.00 0.27 0.00 0.00 31.44 28.83 2i6s n GLU 470 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2i6s s THR 471 N 7.39 3.70 0.17 6.31 -4.23 -1.26 -4.29 115.64 123.43 2i6s s THR 471 Ca 1.03 1.00 -0.05 0.00 -1.18 0.00 0.00 61.69 62.49 2i6s s THR 471 Cb -0.58 -3.41 -0.03 0.00 1.34 0.00 0.00 72.50 69.82 2i6s s THR 471 CO 0.43 -0.29 0.19 0.00 -0.54 0.00 0.00 174.62 174.41 2i6s s ARG 473 N -4.04 2.01 0.11 0.00 1.81 -0.51 0.43 118.95 118.77 2i6s s ARG 473 Ca 0.24 -2.10 -0.09 0.00 -1.72 0.00 0.00 55.73 52.06 2i6s s ARG 473 Cb 0.05 -1.67 0.03 0.00 -0.45 0.00 0.00 34.95 32.91 2i6s s ARG 473 CO 0.04 -0.09 0.46 0.41 -0.68 0.00 0.00 175.30 175.43 2i6s n GLY 474 N -1.03 1.10 2.81 -3.53 0.00 -0.77 -3.05 105.19 100.72 2i6s n GLY 474 Ca -0.06 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 2i6s n GLY 474 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i6s s ALA 475 N -1.49 0.07 0.11 4.61 0.00 -0.28 -2.01 121.76 122.77 2i6s s ALA 475 Ca 0.10 0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.94 2i6s s ALA 475 Cb -0.02 -0.17 -0.09 0.00 0.00 0.00 0.00 23.12 22.85 2i6s s ALA 475 CO 0.03 -0.07 1.67 -0.51 0.00 0.00 0.00 175.76 176.89 2i6s s LEU 476 N 0.69 4.37 0.00 0.00 1.43 0.13 -0.04 118.68 125.26 2i6s s LEU 476 Ca -0.06 2.60 0.07 0.00 -1.03 0.00 0.00 54.13 55.71 2i6s s LEU 476 Cb -0.08 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.53 2i6s s LEU 476 CO -0.02 -0.90 0.41 2.30 0.23 0.00 0.00 176.35 178.37 2i6s n ILE 477 N 4.50 0.00 -2.07 -0.59 -5.35 -0.52 -0.67 119.36 114.65 2i6s n ILE 477 Ca 0.16 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.24 2i6s n ILE 477 Cb 0.39 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 2i6s n ILE 477 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2i6s n SER 478 N -0.68 0.00 0.19 7.28 3.41 -1.19 -4.74 113.62 117.89 2i6s n SER 478 Ca 0.02 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.76 2i6s n SER 478 Cb 0.12 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.43 2i6s n SER 478 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2i6s h ASP 479 N 0.00 0.00 0.00 4.04 3.04 -1.94 -3.36 116.42 118.20 2i6s h ASP 479 Ca 0.00 0.00 -0.08 0.00 -3.24 0.00 0.00 57.03 53.71 2i6s h ASP 479 Cb 0.00 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 38.14 2i6s h ASP 479 CO 0.00 0.00 -0.55 0.00 -2.04 0.00 0.00 179.24 176.65 2i6s n GLN 480 N -2.77 0.00 -4.98 4.15 10.64 -1.26 0.35 117.38 123.51 2i6s n GLN 480 Ca 0.04 -1.15 -0.29 0.00 -1.83 0.00 0.00 57.00 53.77 2i6s n GLN 480 Cb 0.43 -0.05 -0.17 0.00 -0.86 0.00 0.00 30.24 29.60 2i6s n GLN 480 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 2i6s s TRP 481 N 0.00 2.05 -0.05 2.61 0.52 -1.26 -0.92 118.94 121.90 2i6s s TRP 481 Ca 0.11 -0.72 0.05 0.00 0.02 0.00 0.00 56.10 55.56 2i6s s TRP 481 Cb 0.13 -1.39 -0.01 0.00 -1.15 0.00 0.00 33.47 31.05 2i6s s TRP 481 CO -0.06 -0.28 -0.22 0.14 0.02 0.00 0.00 176.95 176.56 2i6s s VAL 482 N 0.24 1.79 -0.17 4.03 -7.23 -0.68 -1.44 120.40 116.94 2i6s s VAL 482 Ca -0.11 -0.92 -0.14 0.00 -1.81 0.00 0.00 61.98 59.00 2i6s s VAL 482 Cb -0.15 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.22 2i6s s VAL 482 CO 0.05 0.50 0.32 -0.22 -0.31 0.00 0.00 175.10 175.44 2i6s s LEU 483 N -0.08 4.22 0.00 1.32 2.96 0.94 -1.78 118.68 126.26 2i6s s LEU 483 Ca -0.04 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.38 2i6s s LEU 483 Cb -0.13 -2.41 -0.00 0.00 0.50 0.00 0.00 46.19 44.15 2i6s s LEU 483 CO 0.03 0.06 0.23 1.07 -1.32 0.00 0.00 176.35 176.42 2i6s n THR 484 N 3.76 0.00 -3.42 3.68 5.66 -0.59 -1.12 114.28 122.24 2i6s n THR 484 Ca -0.11 -1.01 -0.38 0.00 -3.05 0.00 0.00 64.05 59.50 2i6s n THR 484 Cb 0.52 0.59 -0.06 0.00 -1.55 0.00 0.00 70.33 69.83 2i6s n THR 484 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2i6s s ALA 485 N -2.32 3.64 0.37 1.79 0.00 -1.26 -1.22 121.76 122.76 2i6s s ALA 485 Ca 0.17 -0.16 0.12 0.00 0.00 0.00 0.00 51.96 52.09 2i6s s ALA 485 Cb -0.00 -2.48 0.70 0.00 0.00 0.00 0.00 23.12 21.34 2i6s s ALA 485 CO 0.12 0.39 1.81 0.00 0.00 0.00 0.00 175.76 178.09 2i6s h ALA 486 N 4.97 1.36 0.00 0.00 0.00 -1.75 -2.77 119.26 121.07 2i6s h ALA 486 Ca -0.50 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.06 2i6s h ALA 486 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2i6s h ALA 486 CO 0.64 0.48 0.00 -2.39 0.00 0.00 0.00 179.25 177.98 2i6s n HIS 487 N -4.08 0.00 0.39 0.00 1.44 -1.26 -2.09 115.22 109.61 2i6s n HIS 487 Ca -0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.82 2i6s n HIS 487 Cb 0.42 -0.08 0.30 0.00 0.12 0.00 0.00 29.99 30.74 2i6s n HIS 487 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2i6s n PHE 489 N -2.74 3.20 -1.75 0.00 3.01 -0.89 -4.75 117.46 113.53 2i6s n PHE 489 Ca 0.04 -2.80 -0.38 0.00 1.01 0.00 0.00 57.45 55.33 2i6s n PHE 489 Cb 0.47 -0.41 -0.02 0.00 -0.01 0.00 0.00 39.48 39.51 2i6s n PHE 489 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2i6s n ARG 490 N -0.56 4.10 0.00 -1.08 1.74 -1.26 -3.62 116.66 115.98 2i6s n ARG 490 Ca 0.44 -2.97 0.00 0.00 -0.77 0.00 0.00 57.85 54.55 2i6s n ARG 490 Cb 0.65 -2.60 0.00 0.00 -1.02 0.00 0.00 32.46 29.48 2i6s n ARG 490 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2i6s n ASP 491 N 2.11 0.00 0.00 0.55 -0.08 -1.26 -5.11 116.55 112.77 2i6s n ASP 491 Ca 0.65 -0.96 0.00 0.00 -1.51 0.00 0.00 54.79 52.97 2i6s n ASP 491 Cb 0.29 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.75 2i6s n ASP 491 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2i6s n GLY 492 N 0.00 3.59 0.99 0.27 0.00 -1.24 -4.94 105.19 103.87 2i6s n GLY 492 Ca 0.00 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 44.34 2i6s n GLY 492 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2i6s n ASN 493 N 0.00 3.01 -4.57 1.61 3.02 -1.26 -4.88 115.26 112.20 2i6s n ASN 493 Ca 0.00 -1.94 -0.40 0.00 -0.03 0.00 0.00 54.58 52.21 2i6s n ASN 493 Cb 0.00 -0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.01 2i6s n ASN 493 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2i6s s ASP 494 N -1.72 5.31 0.03 6.41 3.68 -1.26 -4.84 116.67 124.28 2i6s s ASP 494 Ca 0.34 0.89 0.27 0.00 2.13 0.00 0.00 52.55 56.18 2i6s s ASP 494 Cb 0.21 -2.52 0.86 0.00 -1.45 0.00 0.00 42.92 40.02 2i6s s ASP 494 CO 0.31 -2.24 1.68 0.00 0.13 0.00 0.00 175.17 175.05 2i6s n HIS 495 N 12.53 0.14 0.87 -5.34 1.44 -1.26 -3.89 115.22 119.71 2i6s n HIS 495 Ca 0.25 0.04 0.06 0.00 -2.01 0.00 0.00 57.72 56.06 2i6s n HIS 495 Cb 0.50 -0.47 0.33 0.00 0.12 0.00 0.00 29.99 30.47 2i6s n HIS 495 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2i6s n SER 496 N -1.63 0.00 -0.21 4.39 3.41 -1.26 -0.74 113.62 117.58 2i6s n SER 496 Ca 0.06 -0.53 0.03 0.00 -0.26 0.00 0.00 58.87 58.17 2i6s n SER 496 Cb 0.36 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.33 2i6s n SER 496 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2i6s n LEU 497 N -0.90 1.47 -4.86 1.04 7.94 -1.25 -5.02 117.00 115.41 2i6s n LEU 497 Ca 0.08 -1.05 -0.34 0.00 -1.11 0.00 0.00 56.01 53.60 2i6s n LEU 497 Cb 0.04 -0.00 -0.05 0.00 0.53 0.00 0.00 43.42 43.93 2i6s n LEU 497 CO 0.06 0.32 0.16 0.26 -1.11 0.00 0.00 177.39 177.08 2i6s s TRP 498 N -0.45 3.55 0.02 1.96 0.51 0.08 -4.32 118.94 120.29 2i6s s TRP 498 Ca 0.06 0.88 0.07 0.00 -2.12 0.00 0.00 56.10 55.00 2i6s s TRP 498 Cb 0.04 -2.24 -0.02 0.00 -0.81 0.00 0.00 33.47 30.44 2i6s s TRP 498 CO 0.06 0.42 -0.22 1.03 -0.51 0.00 0.00 176.95 177.74 2i6s s ARG 499 N -2.19 1.59 -0.13 4.98 1.81 0.62 -4.34 118.95 121.29 2i6s s ARG 499 Ca 0.39 -0.91 -0.00 0.00 -1.72 0.00 0.00 55.73 53.48 2i6s s ARG 499 Cb -0.14 -1.66 -0.01 0.00 -0.45 0.00 0.00 34.95 32.69 2i6s s ARG 499 CO 0.20 0.44 -0.13 0.08 -0.68 0.00 0.00 175.30 175.21 2i6s s VAL 500 N -0.70 3.06 -0.33 3.52 1.01 -0.07 -0.76 120.40 126.13 2i6s s VAL 500 Ca 0.09 -0.65 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 2i6s s VAL 500 Cb -0.09 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 34.02 2i6s s VAL 500 CO 0.01 0.52 0.13 0.21 0.00 0.00 0.00 175.10 175.97 2i6s s ASN 501 N 0.41 5.38 0.12 3.32 2.47 0.13 0.11 114.94 126.87 2i6s s ASN 501 Ca -0.10 -0.86 0.05 0.00 0.42 0.00 0.00 52.86 52.37 2i6s s ASN 501 Cb -0.16 -1.93 -0.04 0.00 -1.45 0.00 0.00 41.25 37.67 2i6s s ASN 501 CO 0.05 -0.27 0.08 -0.69 -3.72 0.00 0.00 177.10 172.55 2i6s s VAL 502 N 1.50 4.33 0.49 -5.21 1.01 0.13 -1.74 120.40 120.92 2i6s s VAL 502 Ca 0.02 -1.00 -0.22 0.00 0.00 0.00 0.00 61.98 60.77 2i6s s VAL 502 Cb -0.18 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 2i6s s VAL 502 CO 0.04 0.01 1.23 -0.83 0.00 0.00 0.00 175.10 175.55 2i6s s GLY 503 N -2.71 2.81 -0.00 4.51 0.00 -1.26 -1.01 107.32 109.66 2i6s s GLY 503 Ca 0.29 1.07 0.01 0.00 0.00 0.00 0.00 44.72 46.09 2i6s s GLY 503 CO 0.21 1.54 -0.02 -0.35 0.00 0.00 0.00 173.10 174.49 2i6s s ASP 504 N -1.24 0.29 0.34 1.64 2.15 -1.26 -4.35 116.67 114.24 2i6s s ASP 504 Ca 0.67 -0.04 0.14 0.00 0.43 0.00 0.00 52.55 53.75 2i6s s ASP 504 Cb -0.33 -0.05 0.59 0.00 -0.30 0.00 0.00 42.92 42.84 2i6s s ASP 504 CO 0.39 0.02 1.73 -0.65 -0.17 0.00 0.00 175.17 176.48 2i6s h PRO 505 N 6.21 0.00 0.03 4.34 0.11 -1.96 -3.32 132.00 137.41 2i6s h PRO 505 Ca -0.28 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.52 2i6s h PRO 505 Cb 1.19 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2i6s h PRO 505 CO 0.50 0.46 -1.76 1.63 -0.21 0.00 0.00 178.00 178.63 2i6s n LYS 506 N -3.82 0.63 -2.36 1.05 4.76 -1.26 -4.97 118.16 112.19 2i6s n LYS 506 Ca -0.01 0.41 -0.35 0.00 -2.87 0.00 0.00 58.31 55.49 2i6s n LYS 506 Cb 0.51 -1.68 -0.01 0.00 -1.84 0.00 0.00 35.03 32.01 2i6s n LYS 506 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2i6s s SER 507 N -6.99 5.96 0.04 4.39 0.01 -1.25 -4.97 113.70 110.90 2i6s s SER 507 Ca -0.29 2.10 -0.10 0.00 1.31 0.00 0.00 55.95 58.97 2i6s s SER 507 Cb 0.08 -2.58 -0.32 0.00 0.21 0.00 0.00 66.02 63.41 2i6s s SER 507 CO 0.62 -1.05 1.03 -0.61 0.41 0.00 0.00 173.24 173.64 2i6s h GLN 508 N 1.38 0.40 -0.00 12.44 4.15 -1.93 -3.38 115.11 128.17 2i6s h GLN 508 Ca -0.50 -0.68 0.00 0.00 0.77 0.00 0.00 58.65 58.24 2i6s h GLN 508 Cb 1.25 0.25 0.00 0.00 0.21 0.00 0.00 27.48 29.19 2i6s h GLN 508 CO 0.58 1.32 -0.65 0.91 -1.93 0.00 0.00 178.83 179.06 2i6s n TRP 509 N -3.61 0.00 0.00 3.99 8.01 -1.26 -5.00 117.44 119.57 2i6s n TRP 509 Ca -0.14 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.05 2i6s n TRP 509 Cb 1.07 -0.15 0.00 0.00 -2.01 0.00 0.00 31.31 30.22 2i6s n TRP 509 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2i6s n GLY 510 N 1.48 -2.04 3.73 6.99 0.00 -1.26 -4.87 105.19 109.22 2i6s n GLY 510 Ca 0.06 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 2i6s n GLY 510 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i6s s LYS 511 N -3.57 4.41 -0.14 1.61 -0.14 -0.18 -4.78 119.74 116.96 2i6s s LYS 511 Ca 0.00 1.97 -0.07 0.00 -1.36 0.00 0.00 55.97 56.51 2i6s s LYS 511 Cb 0.00 -3.23 -0.04 0.00 -1.68 0.00 0.00 37.83 32.87 2i6s s LYS 511 CO 0.00 -0.23 0.11 -1.83 -0.76 0.00 0.00 175.35 172.64 2i6s s GLU 512 N 0.17 3.61 0.06 1.68 -1.05 -1.26 0.20 118.70 122.11 2i6s s GLU 512 Ca 0.57 -0.22 0.08 0.00 -0.15 0.00 0.00 54.97 55.25 2i6s s GLU 512 Cb -0.35 -3.19 -0.03 0.00 -0.44 0.00 0.00 34.13 30.13 2i6s s GLU 512 CO 0.35 0.59 -0.21 -0.06 0.95 0.00 0.00 175.26 176.89 2i6s s PHE 513 N -0.51 2.46 0.51 4.83 0.40 0.29 -4.95 117.98 121.00 2i6s s PHE 513 Ca 0.12 -0.32 -0.00 0.00 -0.60 0.00 0.00 56.93 56.13 2i6s s PHE 513 Cb -0.12 -1.40 0.01 0.00 0.51 0.00 0.00 43.02 42.02 2i6s s PHE 513 CO 0.02 0.24 0.74 -0.51 0.70 0.00 0.00 175.22 176.41 2i6s s LEU 514 N -1.54 3.45 -0.15 -0.37 1.43 -1.26 -0.89 118.68 119.34 2i6s s LEU 514 Ca 0.14 0.23 -0.05 0.00 -1.03 0.00 0.00 54.13 53.43 2i6s s LEU 514 Cb -0.10 -3.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.98 2i6s s LEU 514 CO 0.05 -0.92 0.00 -0.63 0.23 0.00 0.00 176.35 175.08 2i6s s ILE 515 N -2.70 4.28 -0.05 -0.59 1.09 -1.26 -0.93 121.20 121.05 2i6s s ILE 515 Ca 0.52 -0.23 -0.21 0.00 -1.10 0.00 0.00 60.65 59.64 2i6s s ILE 515 Cb -0.10 -2.88 -0.32 0.00 -1.06 0.00 0.00 42.46 38.10 2i6s s ILE 515 CO 0.39 0.51 0.88 -0.08 -0.10 0.00 0.00 174.94 176.53 2i6s h GLU 516 N 6.39 0.32 -2.63 2.79 4.81 -0.22 -3.44 114.58 122.59 2i6s h GLU 516 Ca -0.37 -0.54 -0.05 0.00 -0.13 0.00 0.00 59.36 58.27 2i6s h GLU 516 Cb 1.18 0.20 -0.16 0.00 0.63 0.00 0.00 28.75 30.61 2i6s h GLU 516 CO 0.64 1.26 0.13 -1.59 -0.73 0.00 0.00 179.01 178.72 2i6s s LYS 517 N -2.45 1.12 0.10 1.92 -2.85 -1.15 -5.03 119.74 111.40 2i6s s LYS 517 Ca -0.14 -0.17 0.08 0.00 -1.00 0.00 0.00 55.97 54.74 2i6s s LYS 517 Cb 0.01 0.52 -0.04 0.00 -2.06 0.00 0.00 37.83 36.26 2i6s s LYS 517 CO 0.84 -0.42 -0.18 0.00 0.10 0.00 0.00 175.35 175.69 2i6s s ALA 518 N -2.52 2.66 -0.41 0.59 0.00 -1.26 -0.81 121.76 120.02 2i6s s ALA 518 Ca -0.05 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 50.62 2i6s s ALA 518 Cb -0.01 -0.68 0.12 0.00 0.00 0.00 0.00 23.12 22.56 2i6s s ALA 518 CO -0.02 0.59 0.18 0.08 0.00 0.00 0.00 175.76 176.59 2i6s s VAL 519 N -1.08 1.66 -0.06 0.00 1.01 0.17 -4.99 120.40 117.11 2i6s s VAL 519 Ca 0.17 -2.41 -0.20 0.00 0.00 0.00 0.00 61.98 59.54 2i6s s VAL 519 Cb -0.11 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 2i6s s VAL 519 CO 0.09 -0.78 0.58 -0.63 0.00 0.00 0.00 175.10 174.36 2i6s s ILE 520 N 0.61 5.04 0.11 2.22 1.01 -1.26 -0.20 121.20 128.72 2i6s s ILE 520 Ca 0.15 1.19 -0.35 0.00 0.00 0.00 0.00 60.65 61.64 2i6s s ILE 520 Cb -0.22 -3.92 -0.17 0.00 0.01 0.00 0.00 42.46 38.16 2i6s s ILE 520 CO -0.07 0.35 1.13 -0.24 0.00 0.00 0.00 174.94 176.11 2i6s n SER 521 N 3.27 0.84 0.27 3.58 2.88 -0.78 -4.84 113.62 118.84 2i6s n SER 521 Ca -0.06 1.14 0.17 0.00 -1.33 0.00 0.00 58.87 58.80 2i6s n SER 521 Cb 0.51 -1.11 0.73 0.00 -0.75 0.00 0.00 64.21 63.60 2i6s n SER 521 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2i6s h PRO 522 N 3.39 0.00 0.00 -1.46 0.13 -1.91 -3.19 132.00 128.96 2i6s h PRO 522 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2i6s h PRO 522 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2i6s h PRO 522 CO 0.70 0.00 -0.57 0.41 -0.23 0.00 0.00 178.00 178.31 2i6s n GLY 523 N -0.11 -1.38 3.74 1.56 0.00 -1.26 -4.90 105.19 102.84 2i6s n GLY 523 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2i6s n GLY 523 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2i6s s PHE 524 N -3.12 3.39 -0.32 1.61 5.36 -1.21 -4.74 117.98 118.94 2i6s s PHE 524 Ca 0.08 1.40 -0.03 0.00 -0.96 0.00 0.00 56.93 57.41 2i6s s PHE 524 Cb 0.15 -3.47 0.19 0.00 -0.34 0.00 0.00 43.02 39.55 2i6s s PHE 524 CO 0.71 -1.33 0.87 0.34 -1.46 0.00 0.00 175.22 174.35 2i6s s ASP 525 N 0.08 -0.87 0.24 6.13 -1.08 -1.26 -5.06 116.67 114.84 2i6s s ASP 525 Ca 0.53 -0.10 -0.06 0.00 -0.52 0.00 0.00 52.55 52.40 2i6s s ASP 525 Cb -0.34 1.38 0.42 0.00 -1.46 0.00 0.00 42.92 42.92 2i6s s ASP 525 CO 0.38 -0.14 1.70 0.58 0.52 0.00 0.00 175.17 178.21 2i6s h VAL 526 N 4.70 0.58 -0.57 1.11 2.07 -1.94 -1.46 116.25 120.74 2i6s h VAL 526 Ca -0.04 -0.11 -0.11 0.00 0.82 0.00 0.00 66.70 67.27 2i6s h VAL 526 Cb 1.19 0.24 -0.07 0.00 -1.52 0.00 0.00 31.29 31.14 2i6s h VAL 526 CO 0.00 0.06 0.14 0.49 0.02 0.00 0.00 177.57 178.28 2i6s n PHE 527 N -5.11 1.96 0.16 1.57 3.01 -1.26 -0.87 117.46 116.92 2i6s n PHE 527 Ca 0.13 -0.87 0.02 0.00 1.01 0.00 0.00 57.45 57.75 2i6s n PHE 527 Cb 0.41 -0.55 0.38 0.00 -0.01 0.00 0.00 39.48 39.72 2i6s n PHE 527 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2i6s h ALA 528 N 3.05 1.45 -0.54 4.37 0.00 -1.59 -2.64 119.26 123.37 2i6s h ALA 528 Ca 0.14 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2i6s h ALA 528 Cb 1.96 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.63 2i6s h ALA 528 CO 0.55 0.39 0.09 1.63 0.00 0.00 0.00 179.25 181.91 2i6s n LYS 529 N -4.19 3.76 -0.31 0.00 4.01 -1.26 -4.68 118.16 115.48 2i6s n LYS 529 Ca -0.02 -3.06 -0.05 0.00 -0.51 0.00 0.00 58.31 54.68 2i6s n LYS 529 Cb 0.34 -2.11 0.08 0.00 -0.51 0.00 0.00 35.03 32.82 2i6s n LYS 529 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 2i6s h LYS 530 N 2.74 1.20 0.00 1.97 3.64 -1.22 -2.20 116.57 122.69 2i6s h LYS 530 Ca 0.11 -0.16 -0.05 0.00 -1.27 0.00 0.00 60.65 59.28 2i6s h LYS 530 Cb 1.95 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 33.54 2i6s h LYS 530 CO 0.50 0.90 -0.25 -0.91 -2.27 0.00 0.00 179.45 177.43 2i6s h ASN 531 N 1.19 0.00 0.66 4.20 4.21 -1.83 -2.00 115.58 122.02 2i6s h ASN 531 Ca 0.29 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.80 2i6s h ASN 531 Cb 0.08 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.28 2i6s h ASN 531 CO -0.04 0.25 0.00 0.00 -1.29 0.00 0.00 177.43 176.35 2i6s n GLN 532 N -3.59 0.30 0.00 0.81 3.00 -0.91 -4.89 117.38 112.09 2i6s n GLN 532 Ca -0.01 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2i6s n GLN 532 Cb 0.39 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.13 2i6s n GLN 532 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2i6s n GLY 533 N 1.25 1.82 3.62 1.08 0.00 -0.75 -4.73 105.19 107.47 2i6s n GLY 533 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 2i6s n GLY 533 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2i6s s ILE 534 N -2.01 3.67 0.12 -0.61 1.01 -0.88 -4.39 121.20 118.12 2i6s s ILE 534 Ca 0.00 0.72 -0.06 0.00 0.00 0.00 0.00 60.65 61.31 2i6s s ILE 534 Cb 0.00 -3.77 -0.19 0.00 0.01 0.00 0.00 42.46 38.51 2i6s s ILE 534 CO 0.00 -0.41 1.29 -0.07 0.00 0.00 0.00 174.94 175.75 2i6s h LEU 535 N 12.37 0.60 -7.65 2.97 3.38 -1.78 -2.85 115.31 122.35 2i6s h LEU 535 Ca -0.33 -0.47 -0.54 0.00 0.09 0.00 0.00 57.88 56.63 2i6s h LEU 535 Cb 1.15 -0.18 -0.37 0.00 0.09 0.00 0.00 40.66 41.34 2i6s h LEU 535 CO 1.02 1.27 -0.80 -1.61 0.09 0.00 0.00 178.44 178.42 2i6s s GLU 536 N -3.30 1.47 -0.11 1.13 2.02 -1.26 -4.42 118.70 114.24 2i6s s GLU 536 Ca -0.06 -0.39 0.02 0.00 0.02 0.00 0.00 54.97 54.55 2i6s s GLU 536 Cb 0.09 -1.81 0.02 0.00 0.10 0.00 0.00 34.13 32.52 2i6s s GLU 536 CO 0.88 -0.36 -0.14 0.12 0.02 0.00 0.00 175.26 175.78 2i6s s PHE 537 N 1.67 1.91 -0.30 1.61 5.36 -0.05 -5.04 117.98 123.14 2i6s s PHE 537 Ca 0.03 -0.90 0.10 0.00 -0.96 0.00 0.00 56.93 55.20 2i6s s PHE 537 Cb -0.14 -1.39 0.55 0.00 -0.34 0.00 0.00 43.02 41.70 2i6s s PHE 537 CO -0.08 -0.47 1.55 0.66 -1.46 0.00 0.00 175.22 175.42 2i6s n TYR 538 N 4.25 1.46 -1.79 10.12 4.01 -1.26 -3.76 117.16 130.18 2i6s n TYR 538 Ca -0.19 -1.47 -0.40 0.00 -0.16 0.00 0.00 57.90 55.69 2i6s n TYR 538 Cb 0.51 -0.54 0.02 0.00 -0.31 0.00 0.00 39.34 39.02 2i6s n TYR 538 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2i6s s GLY 539 N -2.12 2.92 -1.43 2.72 0.00 -1.26 -2.85 107.32 105.30 2i6s s GLY 539 Ca 0.47 1.48 -0.08 0.00 0.00 0.00 0.00 44.72 46.58 2i6s s GLY 539 CO 0.04 2.09 0.65 1.22 0.00 0.00 0.00 173.10 177.11 2i6s n ASP 540 N -0.17 -4.91 -4.31 1.64 10.43 -1.26 -4.07 116.55 113.90 2i6s n ASP 540 Ca 0.05 -0.43 -0.43 0.00 2.57 0.00 0.00 54.79 56.55 2i6s n ASP 540 Cb 0.42 -3.98 0.00 0.00 1.84 0.00 0.00 41.12 39.40 2i6s n ASP 540 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2i6s n ASP 541 N -2.51 4.62 -3.71 -2.24 2.03 -1.13 -4.04 116.55 109.57 2i6s n ASP 541 Ca -0.04 -2.90 -0.14 0.00 0.52 0.00 0.00 54.79 52.24 2i6s n ASP 541 Cb 0.57 -1.72 -0.09 0.00 -0.72 0.00 0.00 41.12 39.16 2i6s n ASP 541 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2i6s s ILE 542 N 3.83 0.02 -0.05 5.18 2.07 -1.26 -3.97 121.20 127.02 2i6s s ILE 542 Ca 0.52 -0.18 -0.19 0.00 -1.41 0.00 0.00 60.65 59.39 2i6s s ILE 542 Cb 0.07 -0.66 0.04 0.00 0.13 0.00 0.00 42.46 42.03 2i6s s ILE 542 CO 0.03 -0.10 0.42 0.00 -1.91 0.00 0.00 174.94 173.37 2i6s s ALA 543 N -0.54 -1.06 -0.09 1.50 0.00 -0.36 -1.87 121.76 119.34 2i6s s ALA 543 Ca -0.07 0.72 0.03 0.00 0.00 0.00 0.00 51.96 52.64 2i6s s ALA 543 Cb -0.03 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2i6s s ALA 543 CO 0.03 -0.28 -0.16 -0.51 0.00 0.00 0.00 175.76 174.84 2i6s s LEU 544 N -1.00 1.80 -0.18 0.00 1.43 0.72 -1.54 118.68 119.91 2i6s s LEU 544 Ca -0.10 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 52.56 2i6s s LEU 544 Cb -0.04 -1.06 -0.01 0.00 0.03 0.00 0.00 46.19 45.11 2i6s s LEU 544 CO 0.05 0.07 -0.07 -0.76 0.23 0.00 0.00 176.35 175.86 2i6s s LEU 545 N 0.64 2.88 -0.23 1.79 1.43 -0.74 0.46 118.68 124.92 2i6s s LEU 545 Ca -0.14 -0.33 -0.18 0.00 -1.03 0.00 0.00 54.13 52.45 2i6s s LEU 545 Cb -0.16 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2i6s s LEU 545 CO 0.04 0.08 0.52 -0.75 0.23 0.00 0.00 176.35 176.47 2i6s s LYS 546 N 0.90 4.13 0.65 1.70 2.20 0.01 -1.69 119.74 127.64 2i6s s LYS 546 Ca -0.02 0.38 -0.13 0.00 -0.36 0.00 0.00 55.97 55.84 2i6s s LYS 546 Cb -0.15 -3.61 -0.01 0.00 -1.51 0.00 0.00 37.83 32.55 2i6s s LYS 546 CO 0.01 -0.26 1.06 -0.51 -0.36 0.00 0.00 175.35 175.29 2i6s s LEU 547 N 1.99 3.30 0.44 5.43 1.43 -0.09 0.41 118.68 131.59 2i6s s LEU 547 Ca 0.23 1.69 0.26 0.00 -1.03 0.00 0.00 54.13 55.28 2i6s s LEU 547 Cb -0.15 -4.51 0.63 0.00 0.03 0.00 0.00 46.19 42.18 2i6s s LEU 547 CO 0.09 -1.30 1.71 0.00 0.23 0.00 0.00 176.35 177.09 2i6s h ALA 548 N -0.20 1.00 -2.77 4.21 0.00 -1.32 -3.37 119.26 116.81 2i6s h ALA 548 Ca -0.45 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 2i6s h ALA 548 Cb 1.21 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.81 2i6s h ALA 548 CO 0.57 0.00 -0.70 -0.65 0.00 0.00 0.00 179.25 178.47 2i6s s GLN 549 N -3.31 0.43 0.45 0.00 -1.52 -1.26 -4.95 119.66 109.50 2i6s s GLN 549 Ca 0.06 -0.82 -0.25 0.00 -1.95 0.00 0.00 55.36 52.40 2i6s s GLN 549 Cb 0.07 0.08 -0.08 0.00 -0.22 0.00 0.00 33.01 32.86 2i6s s GLN 549 CO 0.63 -0.05 1.36 0.15 -0.25 0.00 0.00 175.29 177.12 2i6s s LYS 550 N -2.22 3.73 -0.10 2.91 3.01 -1.26 -4.79 119.74 121.01 2i6s s LYS 550 Ca -0.08 2.26 -0.23 0.00 -1.01 0.00 0.00 55.97 56.91 2i6s s LYS 550 Cb -0.05 -2.63 -0.03 0.00 -1.01 0.00 0.00 37.83 34.11 2i6s s LYS 550 CO -0.03 -0.73 0.71 0.08 0.51 0.00 0.00 175.35 175.89 2i6s s VAL 551 N -1.26 5.02 -0.18 3.17 1.01 0.16 -5.01 120.40 123.31 2i6s s VAL 551 Ca 0.61 1.44 -0.29 0.00 0.00 0.00 0.00 61.98 63.73 2i6s s VAL 551 Cb -0.40 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 2i6s s VAL 551 CO 0.51 0.19 1.76 -0.54 0.00 0.00 0.00 175.10 177.02 2i6s s LYS 552 N 1.18 3.76 0.17 2.72 1.02 -1.26 -4.87 119.74 122.47 2i6s s LYS 552 Ca 0.36 1.88 -0.31 0.00 0.02 0.00 0.00 55.97 57.92 2i6s s LYS 552 Cb -0.17 -4.10 -0.10 0.00 -0.52 0.00 0.00 37.83 32.94 2i6s s LYS 552 CO 0.16 -1.35 1.55 -1.64 -0.92 0.00 0.00 175.35 173.16 2i6s s MET 553 N 4.86 4.22 0.04 1.68 -1.94 -1.26 -4.69 119.30 122.22 2i6s s MET 553 Ca 0.78 2.35 -0.01 0.00 -1.71 0.00 0.00 55.69 57.11 2i6s s MET 553 Cb -0.29 -3.15 0.00 0.00 2.01 0.00 0.00 34.83 33.40 2i6s s MET 553 CO 0.32 -0.59 0.07 -1.13 -0.01 0.00 0.00 175.02 173.68 2i6s n SER 554 N 3.81 -0.21 0.11 3.03 3.41 -0.79 -4.58 113.62 118.40 2i6s n SER 554 Ca 0.13 -1.19 0.10 0.00 -0.26 0.00 0.00 58.87 57.65 2i6s n SER 554 Cb 0.39 0.36 0.45 0.00 -0.26 0.00 0.00 64.21 65.15 2i6s n SER 554 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2i6s n THR 555 N -0.06 1.02 0.09 6.66 -2.24 -1.26 -3.15 114.28 115.34 2i6s n THR 555 Ca -0.01 0.41 0.03 0.00 -2.27 0.00 0.00 64.05 62.22 2i6s n THR 555 Cb 0.07 -1.34 -0.05 0.00 -2.10 0.00 0.00 70.33 66.91 2i6s n THR 555 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2i6s n HIS 556 N -2.08 0.00 -3.48 4.78 -0.00 -1.26 -4.38 115.22 108.80 2i6s n HIS 556 Ca 0.01 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.48 2i6s n HIS 556 Cb 0.14 -0.11 -0.13 0.00 -0.00 0.00 0.00 29.99 29.89 2i6s n HIS 556 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2i6s s ALA 557 N -2.22 0.25 0.09 -1.41 0.00 -1.19 -4.24 121.76 113.04 2i6s s ALA 557 Ca -0.01 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.11 2i6s s ALA 557 Cb 0.05 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 2i6s s ALA 557 CO 0.28 -1.71 -0.09 1.03 0.00 0.00 0.00 175.76 175.27 2i6s s ARG 558 N 2.11 0.80 0.56 0.00 0.52 -0.93 -1.88 118.95 120.14 2i6s s ARG 558 Ca 0.10 -1.13 -0.18 0.00 -0.52 0.00 0.00 55.73 53.99 2i6s s ARG 558 Cb -0.16 -0.46 -0.05 0.00 0.52 0.00 0.00 34.95 34.81 2i6s s ARG 558 CO -0.33 0.06 1.11 -1.25 0.02 0.00 0.00 175.30 174.92 2i6s s PRO 559 N -2.78 3.30 0.26 3.54 0.04 -1.26 -2.74 135.00 135.37 2i6s s PRO 559 Ca 0.04 1.52 -0.12 0.00 0.04 0.00 0.00 61.00 62.48 2i6s s PRO 559 Cb -0.03 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.43 2i6s s PRO 559 CO -0.01 -0.87 0.62 -1.50 0.04 0.00 0.00 177.00 175.29 2i6s s ILE 560 N -1.94 4.83 0.06 0.56 2.07 0.15 -1.11 121.20 125.81 2i6s s ILE 560 Ca 0.70 0.68 -0.31 0.00 -1.41 0.00 0.00 60.65 60.32 2i6s s ILE 560 Cb -0.22 -3.62 -0.08 0.00 0.13 0.00 0.00 42.46 38.67 2i6s s ILE 560 CO 0.29 -0.10 1.54 0.00 -1.91 0.00 0.00 174.94 174.76 2i6s s LEU 562 N 2.26 4.19 0.76 0.00 2.96 -1.26 -1.57 118.68 126.02 2i6s s LEU 562 Ca 0.69 0.30 -0.14 0.00 -0.22 0.00 0.00 54.13 54.77 2i6s s LEU 562 Cb -0.37 -2.21 0.06 0.00 0.50 0.00 0.00 46.19 44.16 2i6s s LEU 562 CO 0.30 0.11 1.17 -2.84 -1.32 0.00 0.00 176.35 173.77 2i6s s PRO 563 N 0.63 2.04 -0.41 0.98 0.02 -1.26 -3.45 135.00 133.55 2i6s s PRO 563 Ca 0.11 1.60 0.00 0.00 0.02 0.00 0.00 61.00 62.73 2i6s s PRO 563 Cb -0.12 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.56 2i6s s PRO 563 CO 0.02 -1.88 0.00 0.00 -0.33 0.00 0.00 177.00 174.81 2i6s s THR 565 N -2.09 3.30 0.42 0.00 -4.23 -1.22 -0.53 115.64 111.28 2i6s s THR 565 Ca 0.00 -1.91 0.13 0.00 -1.18 0.00 0.00 61.69 58.73 2i6s s THR 565 Cb 0.00 -2.84 0.16 0.00 1.34 0.00 0.00 72.50 71.17 2i6s s THR 565 CO 0.00 -0.34 1.95 0.24 -0.54 0.00 0.00 174.62 175.93 2i6s h MET 566 N 1.85 0.06 0.28 3.99 2.86 -0.82 -1.12 114.93 122.04 2i6s h MET 566 Ca -0.44 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.18 2i6s h MET 566 Cb 1.25 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.90 2i6s h MET 566 CO 0.61 0.26 -0.17 0.93 1.06 0.00 0.00 176.91 179.60 2i6s h GLU 567 N 0.05 -0.41 0.00 1.72 3.07 -1.90 -2.02 114.58 115.08 2i6s h GLU 567 Ca 0.01 0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.84 2i6s h GLU 567 Cb 0.38 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 2i6s h GLU 567 CO 0.03 -0.28 -0.28 0.00 -1.40 0.00 0.00 179.01 177.08 2i6s h ALA 568 N 0.28 1.19 -0.02 3.43 0.00 -1.69 -2.78 119.26 119.67 2i6s h ALA 568 Ca -0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2i6s h ALA 568 Cb 0.35 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2i6s h ALA 568 CO 0.04 0.36 -0.00 -0.97 0.00 0.00 0.00 179.25 178.67 2i6s h ASN 569 N 0.00 0.03 -0.55 0.00 -1.24 -0.91 -1.73 115.58 111.18 2i6s h ASN 569 Ca -0.00 -0.34 -0.03 0.00 0.71 0.00 0.00 56.30 56.63 2i6s h ASN 569 Cb 0.65 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.66 2i6s h ASN 569 CO 0.04 0.37 0.23 -0.07 -1.29 0.00 0.00 177.43 176.70 2i6s h LEU 570 N -0.31 0.79 -1.65 0.34 3.38 -1.35 -1.86 115.31 114.66 2i6s h LEU 570 Ca 0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2i6s h LEU 570 Cb 0.35 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2i6s h LEU 570 CO 0.00 0.72 0.18 0.00 0.09 0.00 0.00 178.44 179.43 2i6s h ALA 571 N 1.40 1.74 -0.05 1.53 0.00 -1.37 -1.85 119.26 120.66 2i6s h ALA 571 Ca 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2i6s h ALA 571 Cb 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2i6s h ALA 571 CO -0.02 0.23 0.00 1.28 0.00 0.00 0.00 179.25 180.74 2i6s n LEU 572 N -4.47 1.32 -2.72 0.00 4.77 -0.66 -4.91 117.00 110.33 2i6s n LEU 572 Ca 0.02 -0.48 -0.17 0.00 -0.03 0.00 0.00 56.01 55.34 2i6s n LEU 572 Cb 0.09 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2i6s n LEU 572 CO 0.35 0.24 -0.13 0.54 -1.33 0.00 0.00 177.39 177.07 2i6s n ARG 573 N 0.05 -2.80 -1.61 3.23 3.00 -0.69 -4.97 116.66 112.87 2i6s n ARG 573 Ca 0.18 0.68 -0.30 0.00 -0.01 0.00 0.00 57.85 58.41 2i6s n ARG 573 Cb 0.31 -5.35 0.09 0.00 0.00 0.00 0.00 32.46 27.51 2i6s n ARG 573 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2i6s s ARG 574 N -5.34 2.04 0.86 5.56 1.81 -0.85 -5.04 118.95 118.00 2i6s s ARG 574 Ca 0.13 0.54 -0.12 0.00 -1.72 0.00 0.00 55.73 54.56 2i6s s ARG 574 Cb -0.06 -1.92 0.11 0.00 -0.45 0.00 0.00 34.95 32.62 2i6s s ARG 574 CO 0.16 -1.63 1.11 -2.14 -0.68 0.00 0.00 175.30 172.12 2i6s s PRO 575 N -5.22 1.53 0.23 3.54 0.02 -1.26 -4.82 135.00 129.02 2i6s s PRO 575 Ca 0.61 0.57 0.04 0.00 0.02 0.00 0.00 61.00 62.24 2i6s s PRO 575 Cb -0.14 -1.86 0.24 0.00 0.02 0.00 0.00 34.50 32.76 2i6s s PRO 575 CO 0.53 -1.99 1.55 0.37 -0.33 0.00 0.00 177.00 177.14 2i6s h GLN 576 N -1.36 0.24 -1.77 5.54 4.15 -1.98 -3.26 115.11 116.68 2i6s h GLN 576 Ca -0.49 -0.17 -0.19 0.00 0.77 0.00 0.00 58.65 58.57 2i6s h GLN 576 Cb 1.29 0.03 -0.08 0.00 0.21 0.00 0.00 27.48 28.93 2i6s h GLN 576 CO 0.59 0.78 0.20 0.41 -1.93 0.00 0.00 178.83 178.88 2i6s n GLY 577 N 0.28 3.39 3.84 2.39 0.00 -1.26 -4.93 105.19 108.90 2i6s n GLY 577 Ca -0.02 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 2i6s n GLY 577 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i6s s SER 578 N 1.04 6.86 0.36 1.61 0.01 -1.23 -5.10 113.70 117.26 2i6s s SER 578 Ca 0.21 1.09 0.08 0.00 1.31 0.00 0.00 55.95 58.63 2i6s s SER 578 Cb 0.15 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 64.05 2i6s s SER 578 CO -0.01 0.16 0.22 0.42 0.41 0.00 0.00 173.24 174.43 2i6s s THR 579 N -1.37 2.93 0.47 1.44 -4.23 -1.26 -4.44 115.64 109.18 2i6s s THR 579 Ca 0.35 -1.58 0.14 0.00 -1.18 0.00 0.00 61.69 59.42 2i6s s THR 579 Cb -0.16 -3.02 0.30 0.00 1.34 0.00 0.00 72.50 70.97 2i6s s THR 579 CO 0.19 -0.12 2.05 0.00 -0.54 0.00 0.00 174.62 176.20 2i6s h ARG 581 N 0.27 0.87 -0.66 0.00 3.08 -1.82 -2.05 114.38 114.07 2i6s h ARG 581 Ca 0.16 -0.22 0.06 0.00 0.07 0.00 0.00 59.98 60.05 2i6s h ARG 581 Cb 0.29 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.18 2i6s h ARG 581 CO -0.03 0.83 0.37 -0.44 -1.07 0.00 0.00 179.97 179.63 2i6s h ASP 582 N 0.77 0.55 -0.50 7.04 3.32 -1.63 -2.49 116.42 123.48 2i6s h ASP 582 Ca 0.17 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 2i6s h ASP 582 Cb 0.36 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2i6s h ASP 582 CO 0.00 0.36 0.11 0.45 -1.72 0.00 0.00 179.24 178.44 2i6s h HIS 583 N 0.69 0.85 -0.56 4.55 3.86 -1.16 -1.85 115.15 121.53 2i6s h HIS 583 Ca 0.29 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 2i6s h HIS 583 Cb 0.17 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 2i6s h HIS 583 CO -0.08 0.77 0.36 1.49 0.86 0.00 0.00 177.93 181.33 2i6s h GLU 584 N 0.70 0.71 -0.31 2.45 4.81 -1.21 -0.87 114.58 120.86 2i6s h GLU 584 Ca 0.16 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 2i6s h GLU 584 Cb 0.35 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 2i6s h GLU 584 CO 0.00 0.47 -0.14 -0.91 -0.73 0.00 0.00 179.01 177.70 2i6s h ASN 585 N 0.73 0.53 0.00 1.04 -0.26 -1.31 -0.59 115.58 115.73 2i6s h ASN 585 Ca 0.21 -0.15 -0.00 0.00 -0.56 0.00 0.00 56.30 55.81 2i6s h ASN 585 Cb -0.05 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.07 2i6s h ASN 585 CO -0.06 0.70 -0.00 -0.08 -1.06 0.00 0.00 177.43 176.92 2i6s h GLU 586 N 0.50 -0.00 0.04 0.81 4.81 -1.02 -3.33 114.58 116.38 2i6s h GLU 586 Ca 0.09 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2i6s h GLU 586 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2i6s h GLU 586 CO 0.03 0.59 -0.02 -0.07 -0.73 0.00 0.00 179.01 178.81 2i6s h LEU 587 N -0.60 -0.05 -7.92 1.64 3.38 -1.16 -3.37 115.31 107.23 2i6s h LEU 587 Ca -0.00 -0.60 -0.74 0.00 0.09 0.00 0.00 57.88 56.64 2i6s h LEU 587 Cb 0.60 0.01 -0.21 0.00 0.09 0.00 0.00 40.66 41.14 2i6s h LEU 587 CO 0.00 0.70 0.48 -0.76 0.09 0.00 0.00 178.44 178.95 2i6s s LEU 588 N -8.57 5.84 -0.10 1.67 1.43 -0.23 -4.83 118.68 113.90 2i6s s LEU 588 Ca -0.13 -2.32 0.07 0.00 -1.03 0.00 0.00 54.13 50.72 2i6s s LEU 588 Cb -0.01 -2.31 -0.11 0.00 0.03 0.00 0.00 46.19 43.79 2i6s s LEU 588 CO 0.50 -0.84 0.01 -0.46 0.23 0.00 0.00 176.35 175.79 2i6s n ASN 589 N 5.37 2.71 -5.00 2.29 6.94 -1.25 -4.40 115.26 121.92 2i6s n ASN 589 Ca 0.18 -0.01 -0.19 0.00 -0.02 0.00 0.00 54.58 54.55 2i6s n ASN 589 Cb 0.48 0.61 0.04 0.00 -2.36 0.00 0.00 39.78 38.55 2i6s n ASN 589 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2i6s s LYS 590 N -2.23 2.51 0.33 -3.83 1.02 -1.26 -5.02 119.74 111.25 2i6s s LYS 590 Ca -0.06 -1.39 0.19 0.00 0.02 0.00 0.00 55.97 54.74 2i6s s LYS 590 Cb 0.03 -2.67 0.17 0.00 -0.52 0.00 0.00 37.83 34.84 2i6s s LYS 590 CO 0.37 -0.63 1.44 1.96 -0.92 0.00 0.00 175.35 177.57 2i6s h GLN 591 N 0.33 0.00 -4.04 1.68 4.20 -1.91 -3.42 115.11 111.96 2i6s h GLN 591 Ca -0.35 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 57.78 2i6s h GLN 591 Cb 1.28 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.68 2i6s h GLN 591 CO 0.43 0.21 -0.78 -1.54 -0.67 0.00 0.00 178.83 176.49 2i6s s SER 592 N -6.20 3.49 -0.22 1.46 1.04 -1.26 0.25 113.70 112.27 2i6s s SER 592 Ca 0.04 -1.04 -0.05 0.00 0.48 0.00 0.00 55.95 55.38 2i6s s SER 592 Cb 0.07 -0.95 -0.02 0.00 0.10 0.00 0.00 66.02 65.21 2i6s s SER 592 CO 0.72 -0.26 0.00 -0.69 0.98 0.00 0.00 173.24 173.99 2i6s s VAL 593 N 1.57 3.85 -0.21 5.02 1.01 0.24 -4.91 120.40 126.97 2i6s s VAL 593 Ca -0.04 -0.34 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 2i6s s VAL 593 Cb -0.18 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 2i6s s VAL 593 CO -0.07 0.41 1.69 -2.16 0.00 0.00 0.00 175.10 174.96 2i6s s PRO 594 N 1.29 3.75 0.00 2.72 0.04 -1.26 -0.04 135.00 141.50 2i6s s PRO 594 Ca 0.04 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2i6s s PRO 594 Cb -0.15 -4.07 0.00 0.00 0.04 0.00 0.00 34.50 30.32 2i6s s PRO 594 CO 0.01 -1.36 0.00 0.00 0.04 0.00 0.00 177.00 175.69 2i6s n ALA 595 N 8.70 0.00 -2.22 8.56 0.00 0.68 -4.84 120.51 131.38 2i6s n ALA 595 Ca 0.20 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.53 2i6s n ALA 595 Cb 0.45 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 2i6s n ALA 595 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2i6s s HIS 596 N -0.63 0.91 0.12 0.00 3.76 -0.48 -1.87 115.29 117.09 2i6s s HIS 596 Ca 0.00 -1.24 -0.13 0.00 -0.15 0.00 0.00 55.06 53.54 2i6s s HIS 596 Cb 0.00 -0.46 0.02 0.00 1.11 0.00 0.00 32.58 33.25 2i6s s HIS 596 CO 0.00 -0.57 0.33 -0.59 -0.85 0.00 0.00 174.74 173.06 2i6s s PHE 597 N -4.07 -0.04 -0.12 1.40 -0.71 -0.98 -2.34 117.98 111.12 2i6s s PHE 597 Ca 0.28 -0.32 -0.09 0.00 -1.04 0.00 0.00 56.93 55.76 2i6s s PHE 597 Cb 0.07 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 2i6s s PHE 597 CO 0.05 -0.66 0.18 0.08 -1.34 0.00 0.00 175.22 173.53 2i6s s VAL 598 N -3.84 5.41 0.72 -2.49 1.01 -1.26 -1.05 120.40 118.90 2i6s s VAL 598 Ca 0.05 0.31 -0.07 0.00 0.00 0.00 0.00 61.98 62.27 2i6s s VAL 598 Cb 0.03 -3.47 0.07 0.00 0.00 0.00 0.00 36.38 33.00 2i6s s VAL 598 CO -0.10 0.56 1.04 0.00 0.00 0.00 0.00 175.10 176.60 2i6s s ALA 599 N -0.66 3.10 0.23 5.51 0.00 -0.89 -4.89 121.76 124.16 2i6s s ALA 599 Ca 0.15 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 51.12 2i6s s ALA 599 Cb -0.12 -2.62 0.32 0.00 0.00 0.00 0.00 23.12 20.69 2i6s s ALA 599 CO 0.04 -1.37 1.82 -0.07 0.00 0.00 0.00 175.76 176.18 2i6s h LEU 600 N -0.67 0.66 -1.37 0.00 3.38 -1.93 0.15 115.31 115.54 2i6s h LEU 600 Ca -0.44 0.03 0.46 0.00 0.09 0.00 0.00 57.88 58.02 2i6s h LEU 600 Cb 1.31 -0.10 -0.14 0.00 0.09 0.00 0.00 40.66 41.83 2i6s h LEU 600 CO 0.60 0.41 0.85 -1.13 0.09 0.00 0.00 178.44 179.26 2i6s h ASN 601 N 0.79 0.22 0.00 -0.43 -0.73 -2.03 -3.45 115.58 109.95 2i6s h ASN 601 Ca 0.35 0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.68 2i6s h ASN 601 Cb 0.25 0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.00 2i6s h ASN 601 CO -0.21 -0.25 0.00 0.61 -0.37 0.00 0.00 177.43 177.22 2i6s n GLY 602 N -1.50 3.22 3.87 1.57 0.00 0.53 -5.07 105.19 107.81 2i6s n GLY 602 Ca 0.39 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 2i6s n GLY 602 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2i6s s SER 603 N -1.08 6.29 -0.04 1.61 1.04 -1.26 -4.60 113.70 115.66 2i6s s SER 603 Ca 0.00 1.41 -0.26 0.00 0.48 0.00 0.00 55.95 57.59 2i6s s SER 603 Cb 0.00 -2.46 -0.04 0.00 0.10 0.00 0.00 66.02 63.62 2i6s s SER 603 CO 0.00 -0.81 0.79 -0.75 0.98 0.00 0.00 173.24 173.45 2i6s s LYS 604 N -4.99 4.48 0.20 4.02 2.20 -1.26 -2.10 119.74 122.29 2i6s s LYS 604 Ca 0.55 1.06 0.09 0.00 -0.36 0.00 0.00 55.97 57.32 2i6s s LYS 604 Cb -0.11 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 2i6s s LYS 604 CO 0.50 0.04 -0.07 -0.51 -0.36 0.00 0.00 175.35 174.94 2i6s s LEU 605 N 0.84 3.03 -0.12 5.43 1.43 -0.22 -4.98 118.68 124.09 2i6s s LEU 605 Ca 0.42 -0.59 -0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2i6s s LEU 605 Cb -0.19 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 2i6s s LEU 605 CO 0.22 0.08 -0.00 0.20 0.23 0.00 0.00 176.35 177.07 2i6s s ASN 606 N -3.00 5.15 0.07 2.29 0.01 -1.26 -2.31 114.94 115.88 2i6s s ASN 606 Ca 0.26 0.06 -0.01 0.00 -0.71 0.00 0.00 52.86 52.46 2i6s s ASN 606 Cb -0.08 -1.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.93 2i6s s ASN 606 CO 0.16 0.30 -0.01 0.27 -1.51 0.00 0.00 177.10 176.31 2i6s s ILE 607 N -0.39 0.20 -0.32 0.60 -4.36 -0.78 -2.72 121.20 113.42 2i6s s ILE 607 Ca 0.07 -1.83 0.02 0.00 -0.26 0.00 0.00 60.65 58.66 2i6s s ILE 607 Cb -0.12 -1.63 0.08 0.00 1.25 0.00 0.00 42.46 42.04 2i6s s ILE 607 CO 0.02 -0.89 0.01 0.20 0.24 0.00 0.00 174.94 174.53 2i6s s ASN 608 N -2.95 4.73 0.09 4.36 0.01 -1.26 -0.23 114.94 119.69 2i6s s ASN 608 Ca 0.11 -1.83 -0.31 0.00 -0.71 0.00 0.00 52.86 50.11 2i6s s ASN 608 Cb 0.08 -1.63 -0.08 0.00 0.41 0.00 0.00 41.25 40.02 2i6s s ASN 608 CO -0.08 -0.33 1.54 -0.76 -1.51 0.00 0.00 177.10 175.96 2i6s s LEU 609 N 1.02 4.36 -0.34 0.60 1.43 0.95 -4.33 118.68 122.36 2i6s s LEU 609 Ca 0.03 2.43 -0.12 0.00 -1.03 0.00 0.00 54.13 55.44 2i6s s LEU 609 Cb -0.20 -3.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.44 2i6s s LEU 609 CO -0.06 -0.80 0.21 -0.54 0.23 0.00 0.00 176.35 175.39 2i6s s LYS 610 N 1.90 3.31 0.54 1.70 -0.14 0.85 -0.59 119.74 127.32 2i6s s LYS 610 Ca 0.69 -0.76 0.06 0.00 -1.36 0.00 0.00 55.97 54.61 2i6s s LYS 610 Cb -0.39 -3.72 0.04 0.00 -1.68 0.00 0.00 37.83 32.09 2i6s s LYS 610 CO 0.31 -0.49 0.46 -1.64 -0.76 0.00 0.00 175.35 173.23 2i6s s MET 611 N 1.66 2.27 4.80 1.68 -1.94 0.14 -3.76 119.30 124.14 2i6s s MET 611 Ca 0.05 -1.95 0.00 0.00 -1.71 0.00 0.00 55.69 52.08 2i6s s MET 611 Cb -0.18 -2.19 0.00 0.00 2.01 0.00 0.00 34.83 34.47 2i6s s MET 611 CO 0.08 -0.64 0.00 0.41 -0.01 0.00 0.00 175.02 174.86 2i6s n GLY 612 N -1.83 3.25 0.22 -0.03 0.00 -1.26 -1.55 105.19 103.99 2i6s n GLY 612 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.14 2i6s n GLY 612 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2i6s h VAL 613 N 0.00 0.36 0.00 1.61 2.07 -1.95 -2.86 116.25 115.49 2i6s h VAL 613 Ca 0.00 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.29 2i6s h VAL 613 Cb 0.00 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2i6s h VAL 613 CO 0.00 0.17 -0.22 -0.33 0.02 0.00 0.00 177.57 177.22 2i6s h GLU 614 N 0.00 0.00 -0.55 1.57 5.08 -1.58 -3.26 114.58 115.83 2i6s h GLU 614 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2i6s h GLU 614 Cb 0.89 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 2i6s h GLU 614 CO 0.02 0.22 0.28 2.35 -1.00 0.00 0.00 179.01 180.88 2i6s h TRP 615 N 0.00 0.78 -0.37 4.33 7.01 -1.21 -1.35 115.95 125.14 2i6s h TRP 615 Ca -0.00 -0.03 -0.07 0.00 2.11 0.00 0.00 58.89 60.90 2i6s h TRP 615 Cb 0.87 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.67 2i6s h TRP 615 CO 0.00 0.60 -0.04 1.79 -2.79 0.00 0.00 178.44 177.99 2i6s h THR 616 N 0.74 1.27 0.00 2.65 1.35 -1.72 0.44 112.91 117.64 2i6s h THR 616 Ca 0.19 -1.08 -0.02 0.00 -0.55 0.00 0.00 66.41 64.95 2i6s h THR 616 Cb 0.10 1.23 -0.00 0.00 -1.73 0.00 0.00 68.15 67.75 2i6s h THR 616 CO -0.03 0.36 -0.09 0.77 -0.25 0.00 0.00 175.52 176.28 2i6s h SER 617 N 0.48 0.00 -0.07 5.36 4.64 -1.68 0.37 113.55 122.65 2i6s h SER 617 Ca 0.10 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.30 2i6s h SER 617 Cb 0.53 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.63 2i6s h SER 617 CO 0.03 0.09 -0.40 0.00 -0.87 0.00 0.00 176.83 175.68 2i6s h ALA 619 N 0.43 0.50 -0.15 0.00 0.00 0.28 -3.32 119.26 117.00 2i6s h ALA 619 Ca -0.03 -0.72 0.04 0.00 0.00 0.00 0.00 54.91 54.21 2i6s h ALA 619 Cb 1.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2i6s h ALA 619 CO 0.08 0.90 0.14 1.49 0.00 0.00 0.00 179.25 181.86 2i6s h GLU 620 N 0.13 0.00 0.00 0.00 4.22 -0.41 -2.24 114.58 116.28 2i6s h GLU 620 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.39 2i6s h GLU 620 Cb 1.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2i6s h GLU 620 CO 0.14 0.00 0.00 -0.24 -2.18 0.00 0.00 179.01 176.73 2i6s h VAL 621 N 0.00 0.00 0.00 0.32 3.04 -1.75 -1.46 116.25 116.40 2i6s h VAL 621 Ca 0.07 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 2i6s h VAL 621 Cb 0.34 0.93 0.00 0.00 -2.01 0.00 0.00 31.29 30.56 2i6s h VAL 621 CO -0.00 0.00 0.00 0.55 -1.01 0.00 0.00 177.57 177.11 2i6s n VAL 622 N -2.55 1.27 1.19 1.51 3.14 -0.84 -2.39 118.33 119.66 2i6s n VAL 622 Ca -0.00 0.59 0.12 0.00 -2.96 0.00 0.00 64.34 62.09 2i6s n VAL 622 Cb 0.16 -1.57 0.62 0.00 -1.06 0.00 0.00 33.84 31.99 2i6s n VAL 622 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2i6s n SER 623 N -2.01 0.00 -0.01 6.55 2.88 -0.55 -2.93 113.62 117.54 2i6s n SER 623 Ca -0.00 -0.15 0.07 0.00 -1.33 0.00 0.00 58.87 57.45 2i6s n SER 623 Cb 0.05 -0.25 -0.14 0.00 -0.75 0.00 0.00 64.21 63.12 2i6s n SER 623 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i6s n GLN 624 N -1.25 0.66 -2.38 -1.46 6.02 -1.00 -4.89 117.38 113.08 2i6s n GLN 624 Ca 0.12 -0.11 -0.43 0.00 -0.01 0.00 0.00 57.00 56.58 2i6s n GLN 624 Cb 0.18 -1.57 -0.02 0.00 1.02 0.00 0.00 30.24 29.84 2i6s n GLN 624 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2i6s s GLU 625 N -3.31 4.25 0.00 -1.09 2.56 -1.15 -4.87 118.70 115.08 2i6s s GLU 625 Ca -0.07 1.72 0.00 0.00 0.00 0.00 0.00 54.97 56.62 2i6s s GLU 625 Cb 0.12 -3.74 0.00 0.00 2.00 0.00 0.00 34.13 32.51 2i6s s GLU 625 CO 0.88 -0.67 0.74 1.63 -0.56 0.00 0.00 175.26 177.28 2i6s n LYS 626 N 6.36 1.42 0.08 4.30 5.02 -1.26 -3.73 118.16 130.35 2i6s n LYS 626 Ca 0.14 -1.01 -0.12 0.00 -2.02 0.00 0.00 58.31 55.30 2i6s n LYS 626 Cb 0.45 -0.87 -0.13 0.00 -0.02 0.00 0.00 35.03 34.45 2i6s n LYS 626 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2i6s h THR 627 N 0.63 1.55 0.02 -0.18 2.02 -1.99 -3.38 112.91 111.59 2i6s h THR 627 Ca 0.00 -3.19 -0.38 0.00 0.77 0.00 0.00 66.41 63.61 2i6s h THR 627 Cb 0.49 2.88 -0.06 0.00 -1.74 0.00 0.00 68.15 69.72 2i6s h THR 627 CO 0.00 0.91 -2.34 0.23 0.37 0.00 0.00 175.52 174.69 2i6s n MET 628 N -3.44 0.67 -3.76 6.66 2.81 -1.26 -4.87 117.12 113.94 2i6s n MET 628 Ca -0.06 0.15 -0.30 0.00 -1.81 0.00 0.00 57.70 55.68 2i6s n MET 628 Cb 0.99 -1.57 -0.14 0.00 -0.71 0.00 0.00 33.22 31.80 2i6s n MET 628 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 2i6s s PHE 629 N -2.52 2.11 -0.06 2.03 0.08 -1.24 -2.82 117.98 115.55 2i6s s PHE 629 Ca -0.27 -2.28 -0.11 0.00 0.12 0.00 0.00 56.93 54.39 2i6s s PHE 629 Cb 0.08 -1.97 -0.07 0.00 -0.57 0.00 0.00 43.02 40.49 2i6s s PHE 629 CO 0.68 -0.83 0.46 -1.35 -0.10 0.00 0.00 175.22 174.08 2i6s h PRO 630 N 7.27 -0.31 -1.64 0.24 0.11 -1.77 -3.36 132.00 132.54 2i6s h PRO 630 Ca -0.06 0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.45 2i6s h PRO 630 Cb 0.97 0.07 -0.24 0.00 0.11 0.00 0.00 31.00 31.91 2i6s h PRO 630 CO 0.49 -0.14 0.77 0.09 -0.21 0.00 0.00 178.00 179.00 2i6s n ASN 631 N -4.99 7.20 -4.66 -2.05 3.02 -1.26 -4.96 115.26 107.57 2i6s n ASN 631 Ca -0.05 -3.57 -0.40 0.00 -0.03 0.00 0.00 54.58 50.52 2i6s n ASN 631 Cb 0.16 -1.08 -0.06 0.00 -0.61 0.00 0.00 39.78 38.19 2i6s n ASN 631 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2i6s s LEU 632 N -3.26 4.14 -0.04 3.41 2.96 -1.26 -4.88 118.68 119.75 2i6s s LEU 632 Ca 0.54 0.89 0.01 0.00 -0.22 0.00 0.00 54.13 55.35 2i6s s LEU 632 Cb 0.42 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 2i6s s LEU 632 CO -0.20 -0.31 -0.02 0.41 -1.32 0.00 0.00 176.35 174.91 2i6s n THR 633 N 4.76 0.23 -3.63 3.68 -1.04 -1.26 -4.99 114.28 112.03 2i6s n THR 633 Ca -0.00 -0.11 -0.39 0.00 -2.04 0.00 0.00 64.05 61.51 2i6s n THR 633 Cb 0.49 -0.75 -0.11 0.00 -1.82 0.00 0.00 70.33 68.14 2i6s n THR 633 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2i6s s ASP 634 N -4.01 5.65 0.36 8.00 -1.08 -1.26 -4.96 116.67 119.36 2i6s s ASP 634 Ca -0.04 -0.60 0.08 0.00 -0.52 0.00 0.00 52.55 51.47 2i6s s ASP 634 Cb 0.01 -2.02 0.67 0.00 -1.46 0.00 0.00 42.92 40.12 2i6s s ASP 634 CO 0.11 -0.24 1.86 0.58 0.52 0.00 0.00 175.17 178.00 2i6s h VAL 635 N 5.68 1.21 0.00 1.11 2.07 -1.94 -2.74 116.25 121.64 2i6s h VAL 635 Ca -0.31 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2i6s h VAL 635 Cb 1.14 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2i6s h VAL 635 CO 0.63 0.30 0.00 -2.11 0.02 0.00 0.00 177.57 176.41 2i6s n ARG 636 N -4.21 0.14 0.01 1.57 1.85 -1.26 -1.83 116.66 112.92 2i6s n ARG 636 Ca -0.01 0.58 -0.11 0.00 -1.00 0.00 0.00 57.85 57.31 2i6s n ARG 636 Cb 0.32 -1.91 0.02 0.00 -1.05 0.00 0.00 32.46 29.83 2i6s n ARG 636 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2i6s h GLU 637 N 0.00 0.58 0.00 2.89 4.39 -1.92 -3.37 114.58 117.16 2i6s h GLU 637 Ca 0.00 -0.41 -0.38 0.00 0.34 0.00 0.00 59.36 58.90 2i6s h GLU 637 Cb 0.09 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.73 2i6s h GLU 637 CO 0.00 1.03 -2.44 1.33 -1.16 0.00 0.00 179.01 177.77 2i6s n VAL 638 N -3.92 1.47 -3.97 3.13 0.24 -0.88 -4.88 118.33 109.53 2i6s n VAL 638 Ca -0.04 -0.65 -0.34 0.00 -2.04 0.00 0.00 64.34 61.26 2i6s n VAL 638 Cb 0.66 -1.16 -0.14 0.00 -1.47 0.00 0.00 33.84 31.73 2i6s n VAL 638 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2i6s s VAL 639 N -2.51 2.78 0.43 3.34 1.01 -0.76 -4.76 120.40 119.92 2i6s s VAL 639 Ca -0.28 -1.21 0.07 0.00 0.00 0.00 0.00 61.98 60.57 2i6s s VAL 639 Cb 0.08 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2i6s s VAL 639 CO 0.67 0.09 0.22 0.42 0.00 0.00 0.00 175.10 176.50 2i6s s THR 640 N 1.27 2.28 -1.23 3.92 -4.23 -1.26 -4.14 115.64 112.26 2i6s s THR 640 Ca -0.02 -1.64 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 2i6s s THR 640 Cb -0.18 -2.91 0.00 0.00 1.34 0.00 0.00 72.50 70.75 2i6s s THR 640 CO -0.04 0.00 0.88 -0.90 -0.54 0.00 0.00 174.62 174.02 2i6s n ASP 641 N -1.32 0.00 0.24 3.99 5.68 -1.26 -0.54 116.55 123.33 2i6s n ASP 641 Ca -0.01 0.38 0.16 0.00 -0.50 0.00 0.00 54.79 54.82 2i6s n ASP 641 Cb 0.64 -0.38 0.72 0.00 -1.14 0.00 0.00 41.12 40.96 2i6s n ASP 641 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2i6s h GLN 642 N 0.00 0.00 -5.96 0.11 4.15 -1.94 -3.43 115.11 108.04 2i6s h GLN 642 Ca 0.00 0.00 -0.68 0.00 0.77 0.00 0.00 58.65 58.74 2i6s h GLN 642 Cb 0.01 0.00 -0.16 0.00 0.21 0.00 0.00 27.48 27.54 2i6s h GLN 642 CO 0.00 0.00 -0.63 -0.06 -1.93 0.00 0.00 178.83 176.21 2i6s s PHE 643 N -3.64 3.13 0.46 3.99 0.08 0.29 -0.17 117.98 122.12 2i6s s PHE 643 Ca 0.01 0.16 -0.16 0.00 0.12 0.00 0.00 56.93 57.06 2i6s s PHE 643 Cb 0.09 -1.79 -0.08 0.00 -0.57 0.00 0.00 43.02 40.67 2i6s s PHE 643 CO 0.44 0.43 0.91 -0.51 -0.10 0.00 0.00 175.22 176.39 2i6s s LEU 644 N -0.81 3.76 -0.10 -0.37 1.43 0.29 -4.82 118.68 118.05 2i6s s LEU 644 Ca 0.12 1.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.72 2i6s s LEU 644 Cb -0.11 -4.36 0.01 0.00 0.03 0.00 0.00 46.19 41.75 2i6s s LEU 644 CO 0.02 -0.48 -0.21 0.00 0.23 0.00 0.00 176.35 175.92 2i6s s SER 646 N 0.54 1.24 0.00 0.00 1.04 -0.12 -0.10 113.70 116.29 2i6s s SER 646 Ca -0.15 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 54.67 2i6s s SER 646 Cb -0.17 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.54 2i6s s SER 646 CO 0.05 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.73 2i6s n GLY 647 N -0.57 0.94 3.84 7.32 0.00 -1.26 0.10 105.19 115.55 2i6s n GLY 647 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 2i6s n GLY 647 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i6s s THR 648 N -2.00 4.36 0.00 2.61 -4.23 -1.26 -4.51 115.64 110.61 2i6s s THR 648 Ca 0.00 0.87 0.00 0.00 -1.18 0.00 0.00 61.69 61.38 2i6s s THR 648 Cb 0.00 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 70.20 2i6s s THR 648 CO 0.00 -0.90 0.00 0.00 -0.54 0.00 0.00 174.62 173.18 2i6s n GLN 649 N -2.56 0.00 -0.87 3.99 6.02 -1.26 -2.00 117.38 120.68 2i6s n GLN 649 Ca 0.07 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.10 2i6s n GLN 649 Cb 0.54 0.00 0.36 0.00 1.02 0.00 0.00 30.24 32.16 2i6s n GLN 649 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2i6s n GLU 650 N 10.95 4.35 -2.00 -1.09 -0.58 -1.26 -4.98 120.64 126.02 2i6s n GLU 650 Ca 0.00 -3.12 -0.37 0.00 -0.42 0.00 0.00 57.16 53.26 2i6s n GLU 650 Cb 0.00 -2.20 0.03 0.00 -0.57 0.00 0.00 31.44 28.70 2i6s n GLU 650 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2i6s s ASP 651 N -1.02 5.38 0.13 1.62 -0.00 -0.85 -5.01 116.67 116.91 2i6s s ASP 651 Ca 0.53 2.46 -0.25 0.00 -0.00 0.00 0.00 52.55 55.30 2i6s s ASP 651 Cb 0.41 -2.61 -0.07 0.00 -0.00 0.00 0.00 42.92 40.65 2i6s s ASP 651 CO 0.14 -1.47 0.76 -1.61 -0.00 0.00 0.00 175.17 172.99 2i6s s GLU 652 N -3.11 4.53 -0.14 8.23 0.41 -1.10 -4.90 118.70 122.61 2i6s s GLU 652 Ca 0.74 1.11 -0.10 0.00 -0.41 0.00 0.00 54.97 56.30 2i6s s GLU 652 Cb -0.32 -3.29 -0.05 0.00 -1.78 0.00 0.00 34.13 28.69 2i6s s GLU 652 CO 0.37 0.50 0.20 -1.12 -0.49 0.00 0.00 175.26 174.72 2i6s s SER 653 N -0.87 6.38 0.49 -0.19 0.01 -1.26 -4.80 113.70 113.46 2i6s s SER 653 Ca 0.36 0.45 -0.23 0.00 1.31 0.00 0.00 55.95 57.84 2i6s s SER 653 Cb -0.22 -2.12 -0.06 0.00 0.21 0.00 0.00 66.02 63.82 2i6s s SER 653 CO 0.25 0.26 1.26 -2.84 0.41 0.00 0.00 173.24 172.58 2i6s s PRO 654 N -0.24 3.53 0.59 12.44 0.02 -1.26 -4.64 135.00 145.44 2i6s s PRO 654 Ca 0.14 2.01 -0.03 0.00 0.02 0.00 0.00 61.00 63.14 2i6s s PRO 654 Cb -0.12 -2.39 0.03 0.00 0.02 0.00 0.00 34.50 32.04 2i6s s PRO 654 CO 0.03 -0.81 0.87 0.00 -0.33 0.00 0.00 177.00 176.76 2i6s h LYS 656 N -0.15 1.04 0.00 0.00 1.63 -1.97 -0.58 116.57 116.54 2i6s h LYS 656 Ca -0.44 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 59.29 2i6s h LYS 656 Cb 1.28 -0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 32.68 2i6s h LYS 656 CO 0.58 0.69 -0.03 0.78 -3.45 0.00 0.00 179.45 178.01 2i6s h GLY 657 N 1.07 0.00 0.53 5.01 0.00 -1.96 -2.27 103.07 105.46 2i6s h GLY 657 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 2i6s h GLY 657 CO -0.11 0.00 -0.39 1.18 0.00 0.00 0.00 176.54 177.22 2i6s n GLU 658 N -3.36 0.45 -2.04 4.80 1.02 -0.25 -3.63 120.64 117.62 2i6s n GLU 658 Ca -0.02 -0.27 -0.34 0.00 -0.02 0.00 0.00 57.16 56.50 2i6s n GLU 658 Cb 0.16 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.11 2i6s n GLU 658 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2i6s s SER 659 N -2.74 5.45 0.00 1.62 1.04 -0.86 -2.44 113.70 115.78 2i6s s SER 659 Ca 0.18 2.11 0.00 0.00 0.48 0.00 0.00 55.95 58.72 2i6s s SER 659 Cb 0.18 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.73 2i6s s SER 659 CO 0.61 -1.40 0.00 0.61 0.98 0.00 0.00 173.24 174.04 2i6s n GLY 660 N -0.11 2.89 3.54 7.32 0.00 -0.18 -1.42 105.19 117.24 2i6s n GLY 660 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2i6s n GLY 660 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i6s n GLY 661 N -0.43 -1.23 3.80 -0.02 0.00 -1.02 -3.78 105.19 102.50 2i6s n GLY 661 Ca 0.00 -0.82 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 2i6s n GLY 661 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i6s s ALA 662 N -2.51 3.33 -0.34 4.61 0.00 -1.26 -1.76 121.76 123.82 2i6s s ALA 662 Ca 0.64 0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.83 2i6s s ALA 662 Cb -0.22 -2.99 0.01 0.00 0.00 0.00 0.00 23.12 19.92 2i6s s ALA 662 CO 0.62 0.26 0.18 0.08 0.00 0.00 0.00 175.76 176.90 2i6s s VAL 663 N -1.53 4.57 0.14 0.00 1.01 -0.89 -4.36 120.40 119.34 2i6s s VAL 663 Ca 0.45 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.84 2i6s s VAL 663 Cb -0.18 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2i6s s VAL 663 CO 0.23 -0.09 -0.13 0.72 0.00 0.00 0.00 175.10 175.83 2i6s s PHE 664 N 1.58 1.40 0.22 5.22 -0.71 -0.99 -0.48 117.98 124.23 2i6s s PHE 664 Ca 0.03 -0.62 0.10 0.00 -1.04 0.00 0.00 56.93 55.40 2i6s s PHE 664 Cb -0.18 -0.71 -0.04 0.00 -1.21 0.00 0.00 43.02 40.88 2i6s s PHE 664 CO 0.06 0.16 -0.08 -0.51 -1.34 0.00 0.00 175.22 173.51 2i6s s LEU 665 N -2.78 2.98 -0.21 -1.99 1.43 0.78 -1.39 118.68 117.50 2i6s s LEU 665 Ca 0.13 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.52 2i6s s LEU 665 Cb -0.02 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 2i6s s LEU 665 CO 0.03 0.06 -0.02 -0.70 0.23 0.00 0.00 176.35 175.94 2i6s s GLU 666 N -3.19 3.47 -0.06 1.70 2.12 -1.26 -1.31 118.70 120.17 2i6s s GLU 666 Ca 0.28 -0.59 0.02 0.00 0.36 0.00 0.00 54.97 55.04 2i6s s GLU 666 Cb -0.07 -3.04 0.02 0.00 0.26 0.00 0.00 34.13 31.29 2i6s s GLU 666 CO 0.17 -0.12 -0.09 1.03 -0.54 0.00 0.00 175.26 175.71 2i6s s ARG 667 N 1.31 1.35 -0.82 4.30 1.81 -0.11 -4.84 118.95 121.94 2i6s s ARG 667 Ca 0.04 -0.28 -0.23 0.00 -1.72 0.00 0.00 55.73 53.54 2i6s s ARG 667 Cb -0.14 -1.19 0.03 0.00 -0.45 0.00 0.00 34.95 33.20 2i6s s ARG 667 CO -0.01 -0.03 0.43 2.89 -0.68 0.00 0.00 175.30 177.90 2i6s n ARG 668 N 3.96 -0.50 -1.04 3.54 0.00 -1.26 -0.61 116.66 120.75 2i6s n ARG 668 Ca -0.23 -0.13 -0.01 0.00 -0.00 0.00 0.00 57.85 57.47 2i6s n ARG 668 Cb 0.51 -1.35 -0.01 0.00 -0.00 0.00 0.00 32.46 31.62 2i6s n ARG 668 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2i6s n PHE 669 N -3.70 0.00 -4.34 2.89 3.72 -1.26 -4.87 117.46 109.90 2i6s n PHE 669 Ca -0.08 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.04 2i6s n PHE 669 Cb 0.38 -1.51 -0.11 0.00 -0.94 0.00 0.00 39.48 37.29 2i6s n PHE 669 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2i6s s ARG 670 N -1.57 1.76 -0.10 -1.08 1.81 0.22 -4.64 118.95 115.35 2i6s s ARG 670 Ca 0.00 -1.31 0.01 0.00 -1.72 0.00 0.00 55.73 52.71 2i6s s ARG 670 Cb 0.00 -2.04 -0.02 0.00 -0.45 0.00 0.00 34.95 32.44 2i6s s ARG 670 CO 0.00 0.44 -0.13 -0.06 -0.68 0.00 0.00 175.30 174.87 2i6s s PHE 671 N -1.45 2.78 -0.07 -0.53 0.08 -0.54 -0.94 117.98 117.31 2i6s s PHE 671 Ca 0.20 -0.44 0.00 0.00 0.12 0.00 0.00 56.93 56.81 2i6s s PHE 671 Cb -0.09 -1.77 0.02 0.00 -0.57 0.00 0.00 43.02 40.61 2i6s s PHE 671 CO 0.11 -0.05 -0.05 -0.06 -0.10 0.00 0.00 175.22 175.07 2i6s s PHE 672 N -0.06 1.02 -0.47 0.36 0.40 -0.42 -2.49 117.98 116.31 2i6s s PHE 672 Ca -0.02 -0.38 -0.26 0.00 -0.60 0.00 0.00 56.93 55.66 2i6s s PHE 672 Cb -0.14 -0.91 0.03 0.00 0.51 0.00 0.00 43.02 42.51 2i6s s PHE 672 CO 0.04 -0.33 0.96 -1.14 0.70 0.00 0.00 175.22 175.44 2i6s s GLN 673 N 1.41 3.54 0.12 0.44 0.74 -0.61 -0.15 119.66 125.15 2i6s s GLN 673 Ca -0.02 0.19 0.22 0.00 0.05 0.00 0.00 55.36 55.80 2i6s s GLN 673 Cb -0.13 -3.93 -0.12 0.00 1.10 0.00 0.00 33.01 29.92 2i6s s GLN 673 CO -0.03 -1.26 0.84 1.33 -0.55 0.00 0.00 175.29 175.61 2i6s n VAL 674 N 6.48 0.41 -3.82 1.34 0.24 0.37 -4.33 118.33 119.01 2i6s n VAL 674 Ca 0.07 -0.53 -0.07 0.00 -2.04 0.00 0.00 64.34 61.76 2i6s n VAL 674 Cb 0.49 -0.22 -0.02 0.00 -1.47 0.00 0.00 33.84 32.62 2i6s n VAL 674 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i6s n GLY 675 N 1.21 2.72 3.12 7.63 0.00 -0.56 -1.97 105.19 117.33 2i6s n GLY 675 Ca -0.02 -1.51 -0.01 0.00 0.00 0.00 0.00 46.02 44.49 2i6s n GLY 675 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i6s s LEU 676 N 0.00 -1.12 -0.07 0.99 0.20 -1.00 -2.09 118.68 115.59 2i6s s LEU 676 Ca 0.14 0.74 -0.36 0.00 0.69 0.00 0.00 54.13 55.35 2i6s s LEU 676 Cb -0.00 1.83 -0.13 0.00 -0.43 0.00 0.00 46.19 47.46 2i6s s LEU 676 CO 0.10 -0.27 1.75 0.52 -0.29 0.00 0.00 176.35 178.16 2i6s n VAL 677 N 5.41 0.36 0.00 1.68 0.31 -0.72 -0.60 118.33 124.77 2i6s n VAL 677 Ca -0.03 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2i6s n VAL 677 Cb 0.51 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 31.85 2i6s n VAL 677 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2i6s n SER 678 N 5.41 0.00 -3.55 4.52 2.88 -1.18 -1.01 113.62 120.69 2i6s n SER 678 Ca 0.22 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.54 2i6s n SER 678 Cb 0.25 -0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.62 2i6s n SER 678 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2i6s n TRP 679 N -1.28 -0.32 -3.80 0.66 4.27 -1.02 -4.84 117.44 111.10 2i6s n TRP 679 Ca 0.00 -2.70 -0.02 0.00 -3.89 0.00 0.00 57.50 50.89 2i6s n TRP 679 Cb 0.00 0.14 0.00 0.00 -1.36 0.00 0.00 31.31 30.09 2i6s n TRP 679 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 2i6s s GLY 680 N -3.41 -0.11 0.05 -1.67 0.00 -1.26 -1.11 107.32 99.80 2i6s s GLY 680 Ca 0.30 0.02 0.21 0.00 0.00 0.00 0.00 44.72 45.25 2i6s s GLY 680 CO 0.21 1.37 0.68 1.04 0.00 0.00 0.00 173.10 176.40 2i6s n LEU 681 N -0.60 0.38 -3.79 0.66 4.77 0.71 -4.91 117.00 114.23 2i6s n LEU 681 Ca -0.05 0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 2i6s n LEU 681 Cb 0.60 0.02 -0.14 0.00 -2.33 0.00 0.00 43.42 41.57 2i6s n LEU 681 CO 0.16 -0.02 -0.28 -0.47 -1.33 0.00 0.00 177.39 175.46 2i6s s TYR 682 N -3.34 -0.09 -0.30 -1.77 5.04 -1.26 -4.88 117.35 110.75 2i6s s TYR 682 Ca -0.05 0.29 -0.08 0.00 -2.44 0.00 0.00 57.07 54.78 2i6s s TYR 682 Cb 0.11 -0.07 -0.00 0.00 0.35 0.00 0.00 41.96 42.35 2i6s s TYR 682 CO 0.85 -0.10 0.12 1.21 -1.34 0.00 0.00 175.55 176.29 2i6s s ASN 683 N 0.68 5.35 0.44 4.32 3.04 -1.26 -4.83 114.94 122.67 2i6s s ASN 683 Ca -0.05 -0.54 0.13 0.00 0.04 0.00 0.00 52.86 52.44 2i6s s ASN 683 Cb -0.07 -1.95 0.98 0.00 -1.54 0.00 0.00 41.25 38.67 2i6s s ASN 683 CO -0.03 -0.17 2.00 -0.65 -3.04 0.00 0.00 177.10 175.21 2i6s h PRO 684 N 8.30 0.08 -0.00 0.43 0.11 -1.81 -2.56 132.00 136.54 2i6s h PRO 684 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2i6s h PRO 684 Cb 1.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2i6s h PRO 684 CO 0.61 0.21 -0.16 0.00 -0.21 0.00 0.00 178.00 178.45 2i6s n LEU 686 N -1.04 2.76 0.27 0.00 7.94 -0.96 -4.38 117.00 121.59 2i6s n LEU 686 Ca 0.12 -1.39 -0.17 0.00 -1.11 0.00 0.00 56.01 53.46 2i6s n LEU 686 Cb 0.30 -0.51 -0.09 0.00 0.53 0.00 0.00 43.42 43.65 2i6s n LEU 686 CO 0.26 0.47 0.57 1.23 -1.11 0.00 0.00 177.39 178.81 2i6s h GLY 687 N 4.09 -1.09 0.00 -3.96 0.00 -1.79 -3.48 103.07 96.85 2i6s h GLY 687 Ca 0.02 0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.87 2i6s h GLY 687 CO 0.04 -0.35 -0.64 -1.26 0.00 0.00 0.00 176.54 174.33 2i6s n SER 688 N -5.53 1.27 0.00 0.19 2.88 -1.26 -5.12 113.62 106.05 2i6s n SER 688 Ca -0.11 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.43 2i6s n SER 688 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2i6s n SER 688 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i6s n ALA 689 N -2.49 0.00 -0.05 -1.46 0.00 -1.26 -4.09 120.51 111.17 2i6s n ALA 689 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2i6s n ALA 689 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.76 2i6s n ALA 689 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2i6s n ASP 690 N 3.14 1.23 -3.49 0.00 9.92 -1.26 -5.17 116.55 120.92 2i6s n ASP 690 Ca 0.00 0.41 -0.14 0.00 -0.53 0.00 0.00 54.79 54.53 2i6s n ASP 690 Cb 0.00 -0.72 0.01 0.00 -0.64 0.00 0.00 41.12 39.77 2i6s n ASP 690 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2i6s n LYS 695 N -3.82 0.00 -3.58 -1.24 5.02 -1.26 -5.17 118.16 108.12 2i6s n LYS 695 Ca -0.06 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.94 2i6s n LYS 695 Cb 0.23 -0.91 -0.15 0.00 -0.02 0.00 0.00 35.03 34.18 2i6s n LYS 695 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2i6s s ARG 696 N -1.81 0.27 -0.08 1.97 0.52 -1.26 -4.25 118.95 114.31 2i6s s ARG 696 Ca 0.13 -0.57 -0.05 0.00 -0.52 0.00 0.00 55.73 54.72 2i6s s ARG 696 Cb 0.04 -1.36 -0.04 0.00 0.52 0.00 0.00 34.95 34.11 2i6s s ARG 696 CO 0.24 -0.98 0.13 0.00 0.02 0.00 0.00 175.30 174.71 2i6s s ALA 697 N 2.03 3.82 0.00 2.13 0.00 -0.93 -4.99 121.76 123.81 2i6s s ALA 697 Ca 0.08 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.34 2i6s s ALA 697 Cb -0.16 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.09 2i6s s ALA 697 CO -0.32 0.66 0.00 -0.35 0.00 0.00 0.00 175.76 175.74 2i6s n PRO 698 N 1.66 0.00 -0.74 0.00 -0.05 -1.26 -4.34 135.00 130.27 2i6s n PRO 698 Ca -0.17 0.20 0.00 0.00 -0.05 0.00 0.00 63.50 63.48 2i6s n PRO 698 Cb 0.54 -0.69 0.00 0.00 -0.05 0.00 0.00 33.50 33.30 2i6s n PRO 698 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 175.50 173.32 2i6s n ARG 699 N -2.28 -2.11 -0.18 0.54 0.63 -1.26 -4.96 116.66 107.03 2i6s n ARG 699 Ca 0.00 1.55 0.05 0.00 -0.92 0.00 0.00 57.85 58.53 2i6s n ARG 699 Cb 0.00 -1.73 0.07 0.00 0.45 0.00 0.00 32.46 31.25 2i6s n ARG 699 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2i6s n SER 700 N -0.59 1.44 -0.04 6.15 3.41 -1.26 -4.51 113.62 118.21 2i6s n SER 700 Ca 0.00 -2.47 0.03 0.00 -0.26 0.00 0.00 58.87 56.17 2i6s n SER 700 Cb 0.00 -0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 63.65 2i6s n SER 700 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2i6s n LYS 701 N -0.79 4.18 -2.12 4.33 2.85 -1.26 -4.98 118.16 120.38 2i6s n LYS 701 Ca 0.08 -0.13 -0.40 0.00 -1.05 0.00 0.00 58.31 56.81 2i6s n LYS 701 Cb 0.60 -0.85 -0.02 0.00 -0.65 0.00 0.00 35.03 34.11 2i6s n LYS 701 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 2i6s s VAL 702 N -1.47 2.74 -0.38 0.58 -7.23 -1.26 -5.02 120.40 108.35 2i6s s VAL 702 Ca 0.03 0.71 -0.15 0.00 -1.81 0.00 0.00 61.98 60.77 2i6s s VAL 702 Cb 0.05 -3.44 0.00 0.00 0.56 0.00 0.00 36.38 33.56 2i6s s VAL 702 CO 0.24 0.14 0.31 -2.16 -0.31 0.00 0.00 175.10 173.32 2i6s s PRO 703 N -1.97 3.22 0.47 4.82 0.04 -1.26 -4.54 135.00 135.77 2i6s s PRO 703 Ca 0.52 -0.79 0.05 0.00 0.04 0.00 0.00 61.00 60.82 2i6s s PRO 703 Cb -0.38 -3.90 -0.02 0.00 0.04 0.00 0.00 34.50 30.23 2i6s s PRO 703 CO 0.50 -0.64 0.16 -1.25 0.04 0.00 0.00 177.00 175.80 2i6s s PRO 704 N 1.80 2.19 0.23 0.56 0.04 -1.26 -4.61 135.00 133.95 2i6s s PRO 704 Ca 0.07 -2.08 -0.30 0.00 0.04 0.00 0.00 61.00 58.74 2i6s s PRO 704 Cb -0.18 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 2i6s s PRO 704 CO 0.11 -0.29 1.21 -1.25 0.04 0.00 0.00 177.00 176.82 2i6s s PRO 705 N -3.96 4.49 -0.16 0.56 0.04 -1.26 -4.70 135.00 130.02 2i6s s PRO 705 Ca 0.29 1.93 -0.29 0.00 0.04 0.00 0.00 61.00 62.97 2i6s s PRO 705 Cb 0.03 -3.20 0.11 0.00 0.04 0.00 0.00 34.50 31.48 2i6s s PRO 705 CO 0.16 -0.05 0.91 0.50 0.04 0.00 0.00 177.00 178.56 2i6s s ARG 706 N -0.72 0.71 -0.02 4.56 3.52 -1.26 -4.60 118.95 121.14 2i6s s ARG 706 Ca 0.51 0.31 0.02 0.00 -0.13 0.00 0.00 55.73 56.44 2i6s s ARG 706 Cb -0.34 0.33 -0.00 0.00 -1.56 0.00 0.00 34.95 33.38 2i6s s ARG 706 CO 0.40 -0.19 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.10 2i6s s ASP 707 N -0.80 1.08 -0.12 -2.12 1.01 0.11 -0.21 116.67 115.63 2i6s s ASP 707 Ca -0.03 -0.17 0.01 0.00 0.71 0.00 0.00 52.55 53.07 2i6s s ASP 707 Cb -0.01 -0.22 0.02 0.00 1.01 0.00 0.00 42.92 43.72 2i6s s ASP 707 CO 0.02 0.08 -0.14 -0.36 0.21 0.00 0.00 175.17 174.98 2i6s s PHE 708 N 0.02 1.93 0.06 4.23 0.08 -0.27 -0.94 117.98 123.10 2i6s s PHE 708 Ca -0.00 -0.96 0.06 0.00 0.12 0.00 0.00 56.93 56.15 2i6s s PHE 708 Cb -0.06 -1.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.93 2i6s s PHE 708 CO 0.00 -0.52 -0.10 -1.01 -0.10 0.00 0.00 175.22 173.49 2i6s s HIS 709 N 1.20 2.76 0.11 0.36 3.76 -0.39 -2.43 115.29 120.65 2i6s s HIS 709 Ca -0.02 -0.14 -0.31 0.00 -0.15 0.00 0.00 55.06 54.44 2i6s s HIS 709 Cb -0.14 -1.49 -0.08 0.00 1.11 0.00 0.00 32.58 31.98 2i6s s HIS 709 CO -0.05 0.38 1.51 0.42 -0.85 0.00 0.00 174.74 176.15 2i6s s ILE 710 N -1.11 3.07 -0.51 0.60 -1.09 0.23 0.11 121.20 122.50 2i6s s ILE 710 Ca 0.19 0.69 -0.25 0.00 -2.23 0.00 0.00 60.65 59.06 2i6s s ILE 710 Cb -0.11 -3.45 0.03 0.00 -1.58 0.00 0.00 42.46 37.36 2i6s s ILE 710 CO 0.11 0.03 0.94 0.21 -1.23 0.00 0.00 174.94 175.00 2i6s s ASN 711 N 1.50 6.41 0.56 3.58 3.84 0.76 -2.38 114.94 129.21 2i6s s ASN 711 Ca 0.68 -0.14 0.25 0.00 0.21 0.00 0.00 52.86 53.86 2i6s s ASN 711 Cb -0.39 -2.45 1.58 0.00 -0.55 0.00 0.00 41.25 39.44 2i6s s ASN 711 CO 0.31 -1.16 2.17 -0.07 -2.79 0.00 0.00 177.10 175.55 2i6s h LEU 712 N 10.84 0.00 -0.98 3.21 3.38 -1.71 0.04 115.31 130.09 2i6s h LEU 712 Ca -0.25 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 2i6s h LEU 712 Cb 1.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2i6s h LEU 712 CO 1.06 0.00 0.05 -0.26 0.09 0.00 0.00 178.44 179.39 2i6s h PHE 713 N 0.00 0.83 0.00 1.13 0.04 -1.91 -2.08 116.94 114.94 2i6s h PHE 713 Ca 0.04 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2i6s h PHE 713 Cb 0.19 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.10 2i6s h PHE 713 CO 0.00 0.74 0.00 0.54 -0.60 0.00 0.00 178.31 178.99 2i6s n ARG 714 N -4.24 0.93 -0.21 1.51 5.12 -0.00 -3.74 116.66 116.03 2i6s n ARG 714 Ca 0.03 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 56.01 2i6s n ARG 714 Cb 0.27 -1.20 0.09 0.00 -1.16 0.00 0.00 32.46 30.46 2i6s n ARG 714 CO 0.00 0.00 0.00 -0.12 -1.93 0.00 0.00 177.63 175.58 2i6s n MET 715 N -0.70 0.90 -0.04 5.56 1.56 -0.79 -4.87 117.12 118.74 2i6s n MET 715 Ca 0.09 -2.00 -0.15 0.00 -0.27 0.00 0.00 57.70 55.37 2i6s n MET 715 Cb 0.04 -1.15 -0.08 0.00 2.15 0.00 0.00 33.22 34.18 2i6s n MET 715 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 2i6s h GLN 716 N 0.00 0.42 -0.59 2.12 1.08 -1.64 -2.63 115.11 113.87 2i6s h GLN 716 Ca 0.00 -0.31 0.08 0.00 -1.45 0.00 0.00 58.65 56.97 2i6s h GLN 716 Cb 1.11 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.56 2i6s h GLN 716 CO 0.00 0.93 0.39 -1.35 -0.95 0.00 0.00 178.83 177.85 2i6s h PRO 717 N -0.01 0.48 0.18 1.46 0.11 -1.91 0.46 132.00 132.77 2i6s h PRO 717 Ca -0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 2i6s h PRO 717 Cb 0.97 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2i6s h PRO 717 CO 0.07 0.32 -0.09 2.35 -0.21 0.00 0.00 178.00 180.44 2i6s h TRP 718 N 0.49 -0.23 -0.61 0.65 7.01 -1.94 -1.97 115.95 119.36 2i6s h TRP 718 Ca 0.26 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.38 2i6s h TRP 718 Cb 0.39 0.08 -0.10 0.00 -2.10 0.00 0.00 29.16 27.42 2i6s h TRP 718 CO -0.00 0.18 0.02 -0.07 -2.79 0.00 0.00 178.44 175.77 2i6s h LEU 719 N -0.89 -0.24 -0.09 0.65 3.38 -1.14 -0.28 115.31 116.69 2i6s h LEU 719 Ca -0.03 0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.13 2i6s h LEU 719 Cb 0.51 0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 2i6s h LEU 719 CO 0.04 -0.10 -0.18 0.03 0.09 0.00 0.00 178.44 178.32 2i6s h ARG 720 N 0.13 -0.23 -1.31 1.13 3.08 -1.00 0.25 114.38 116.42 2i6s h ARG 720 Ca 0.32 0.02 0.38 0.00 0.07 0.00 0.00 59.98 60.76 2i6s h ARG 720 Cb 0.51 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.55 2i6s h ARG 720 CO -0.51 -0.16 0.93 0.37 -1.07 0.00 0.00 179.97 179.53 2i6s h GLN 721 N -0.24 0.05 0.00 0.04 4.15 -0.24 -2.24 115.11 116.63 2i6s h GLN 721 Ca 0.08 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.50 2i6s h GLN 721 Cb 0.36 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2i6s h GLN 721 CO -0.23 0.03 -0.42 0.72 -1.93 0.00 0.00 178.83 177.00 2i6s n HIS 722 N -4.23 0.00 -0.06 3.99 8.25 -1.02 -4.68 115.22 117.47 2i6s n HIS 722 Ca 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 2i6s n HIS 722 Cb 1.34 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 32.44 2i6s n HIS 722 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2i6s n LEU 723 N -1.22 2.00 0.31 2.41 4.77 0.04 -4.75 117.00 120.57 2i6s n LEU 723 Ca 0.00 -2.04 0.19 0.00 -0.03 0.00 0.00 56.01 54.13 2i6s n LEU 723 Cb 0.04 -0.02 0.98 0.00 -2.33 0.00 0.00 43.42 42.09 2i6s n LEU 723 CO 0.05 0.51 1.10 1.23 -1.33 0.00 0.00 177.39 178.94 2i6s h GLY 724 N 0.00 0.00 1.27 -0.72 0.00 -1.61 0.19 103.07 102.20 2i6s h GLY 724 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 2i6s h GLY 724 CO 0.00 0.00 -1.05 -0.55 0.00 0.00 0.00 176.54 174.94 2i6s h ASP 725 N 0.00 0.00 0.05 0.19 5.19 -1.88 -3.41 116.42 116.57 2i6s h ASP 725 Ca -0.00 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.14 2i6s h ASP 725 Cb 0.19 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 2i6s h ASP 725 CO 0.00 0.42 -1.46 0.58 -3.12 0.00 0.00 179.24 175.66 2i6s h VAL 726 N 0.00 0.86 -4.04 -1.35 2.07 -1.09 -3.47 116.25 109.24 2i6s h VAL 726 Ca -0.09 -2.26 -0.67 0.00 0.82 0.00 0.00 66.70 64.50 2i6s h VAL 726 Cb 1.40 2.39 -0.23 0.00 -1.52 0.00 0.00 31.29 33.32 2i6s h VAL 726 CO 0.04 0.53 -0.87 -0.76 0.02 0.00 0.00 177.57 176.54 2i6s s LEU 727 N -7.60 2.27 -0.58 2.57 1.43 0.30 -5.07 118.68 112.00 2i6s s LEU 727 Ca -0.26 -0.69 -0.22 0.00 -1.03 0.00 0.00 54.13 51.93 2i6s s LEU 727 Cb 0.06 -1.20 0.06 0.00 0.03 0.00 0.00 46.19 45.14 2i6s s LEU 727 CO 0.67 0.19 0.87 0.20 0.23 0.00 0.00 176.35 178.51 2i6s s ASN 728 N -1.77 6.26 0.50 2.29 0.02 -1.26 -4.49 114.94 116.49 2i6s s ASN 728 Ca 0.12 -0.72 -0.17 0.00 -1.02 0.00 0.00 52.86 51.07 2i6s s ASN 728 Cb -0.10 -2.39 -0.08 0.00 0.02 0.00 0.00 41.25 38.69 2i6s s ASN 728 CO 0.05 -1.22 0.98 -0.36 0.02 0.00 0.00 177.10 176.57 2i6s s PHE 729 N 3.66 3.40 0.31 2.20 0.08 -1.26 -0.13 117.98 126.23 2i6s s PHE 729 Ca 0.24 1.50 0.00 0.00 0.12 0.00 0.00 56.93 58.79 2i6s s PHE 729 Cb -0.16 -2.82 -0.04 0.00 -0.57 0.00 0.00 43.02 39.44 2i6s s PHE 729 CO 0.14 -0.36 0.50 -0.51 -0.10 0.00 0.00 175.22 174.89 2i6s s LEU 730 N -3.91 4.08 0.19 -0.37 1.43 0.31 -4.73 118.68 115.68 2i6s s LEU 730 Ca 0.60 0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 53.83 2i6s s LEU 730 Cb -0.10 -3.26 -0.17 0.00 0.03 0.00 0.00 46.19 42.69 2i6s s LEU 730 CO 0.28 -0.22 0.63 -2.65 0.23 0.00 0.00 176.35 174.62 2i6s n PRO 731 N -1.48 0.15 0.00 1.29 -0.02 -1.26 -4.62 135.00 129.06 2i6s n PRO 731 Ca -0.05 0.05 0.03 0.00 -2.02 0.00 0.00 63.50 61.51 2i6s n PRO 731 Cb 0.56 -1.14 0.16 0.00 -0.02 0.00 0.00 33.50 33.05 2i6s n PRO 731 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76