#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3brd n GLN 196 N 0.00 -1.02 -2.03 7.34 7.27 -1.26 -4.85 117.38 122.83 3brd n GLN 196 Ca 0.00 0.26 -0.41 0.00 0.07 0.00 0.00 57.00 56.91 3brd n GLN 196 Cb 0.00 -4.05 -0.02 0.00 2.41 0.00 0.00 30.24 28.57 3brd n GLN 196 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 3brd s SER 197 N -2.02 6.67 0.31 1.69 0.01 -1.26 -3.02 113.70 116.08 3brd s SER 197 Ca 0.00 2.63 -0.29 0.00 1.31 0.00 0.00 55.95 59.60 3brd s SER 197 Cb 0.00 -2.62 -0.11 0.00 0.21 0.00 0.00 66.02 63.50 3brd s SER 197 CO 0.00 -0.69 1.54 -0.22 0.41 0.00 0.00 173.24 174.27 3brd s LEU 198 N -0.22 4.35 0.09 2.44 2.96 -1.26 -4.97 118.68 122.06 3brd s LEU 198 Ca 0.60 2.93 0.03 0.00 -0.22 0.00 0.00 54.13 57.46 3brd s LEU 198 Cb -0.41 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.59 3brd s LEU 198 CO 0.42 -0.86 0.14 0.42 -1.32 0.00 0.00 176.35 175.15 3brd s THR 199 N -0.33 4.81 0.19 3.68 -4.23 -1.26 -5.00 115.64 113.50 3brd s THR 199 Ca 0.60 -0.72 -0.12 0.00 -1.18 0.00 0.00 61.69 60.27 3brd s THR 199 Cb -0.46 -3.36 0.11 0.00 1.34 0.00 0.00 72.50 70.12 3brd s THR 199 CO 0.51 0.07 1.74 0.28 -0.54 0.00 0.00 174.62 176.69 3brd h SER 200 N 2.99 0.17 -0.88 3.99 0.02 -1.95 0.16 113.55 118.04 3brd h SER 200 Ca -0.47 0.07 0.08 0.00 -0.84 0.00 0.00 61.79 60.63 3brd h SER 200 Cb 1.17 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 63.70 3brd h SER 200 CO 0.68 0.12 0.54 0.44 -1.14 0.00 0.00 176.83 177.47 3brd h ASP 201 N 0.36 0.82 -0.15 3.07 3.45 -1.96 0.16 116.42 122.16 3brd h ASP 201 Ca 0.26 0.03 -0.13 0.00 0.43 0.00 0.00 57.03 57.62 3brd h ASP 201 Cb 0.30 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 3brd h ASP 201 CO -0.27 0.49 -0.42 -0.09 -1.57 0.00 0.00 179.24 177.38 3brd h ARG 202 N 0.94 0.56 -0.96 3.56 9.65 -1.83 -1.57 114.38 124.72 3brd h ARG 202 Ca 0.41 -0.40 0.10 0.00 -1.10 0.00 0.00 59.98 58.99 3brd h ARG 202 Cb 0.28 0.06 -0.08 0.00 -1.39 0.00 0.00 29.97 28.85 3brd h ARG 202 CO -0.21 1.01 0.60 1.98 2.80 0.00 0.00 179.97 186.15 3brd h MET 203 N 0.19 0.97 -0.31 0.20 4.05 -0.47 -0.38 114.93 119.19 3brd h MET 203 Ca -0.01 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.27 3brd h MET 203 Cb 1.04 -0.22 -0.01 0.00 -0.80 0.00 0.00 31.60 31.61 3brd h MET 203 CO 0.09 0.64 -0.11 0.82 0.23 0.00 0.00 176.91 178.58 3brd h ILE 204 N 1.00 1.29 -0.52 1.77 2.04 -0.54 -0.37 117.51 122.17 3brd h ILE 204 Ca 0.45 -1.19 0.04 0.00 1.00 0.00 0.00 64.86 65.17 3brd h ILE 204 Cb 0.37 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 3brd h ILE 204 CO -0.23 0.38 0.27 -0.78 0.00 0.00 0.00 178.15 177.79 3brd h ASP 205 N 0.40 0.40 0.32 1.72 3.58 -1.01 -1.43 116.42 120.40 3brd h ASP 205 Ca 0.07 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 3brd h ASP 205 Cb 0.62 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.61 3brd h ASP 205 CO 0.04 0.28 -0.20 0.15 -2.88 0.00 0.00 179.24 176.63 3brd h PHE 206 N 0.53 -0.51 0.00 0.28 3.57 -0.84 -2.74 116.94 117.23 3brd h PHE 206 Ca 0.23 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 3brd h PHE 206 Cb 0.12 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 3brd h PHE 206 CO -0.09 -0.31 -0.17 -0.07 -2.23 0.00 0.00 178.31 175.44 3brd h LEU 207 N -0.49 0.00 -0.07 0.59 3.38 -0.95 -1.31 115.31 116.46 3brd h LEU 207 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3brd h LEU 207 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3brd h LEU 207 CO 0.03 0.17 0.00 -1.54 0.09 0.00 0.00 178.44 177.19 3brd n SER 208 N -4.28 0.31 -2.74 -0.43 3.41 -0.55 -4.31 113.62 105.03 3brd n SER 208 Ca -0.02 0.54 -0.00 0.00 -0.26 0.00 0.00 58.87 59.12 3brd n SER 208 Cb 0.24 -0.62 0.06 0.00 -0.26 0.00 0.00 64.21 63.63 3brd n SER 208 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3brd n ASN 209 N -1.80 1.03 -0.36 4.04 3.02 -0.57 -4.95 115.26 115.66 3brd n ASN 209 Ca 0.06 -2.05 0.05 0.00 -0.03 0.00 0.00 54.58 52.60 3brd n ASN 209 Cb 0.33 -0.27 0.21 0.00 -0.61 0.00 0.00 39.78 39.43 3brd n ASN 209 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 3brd h LYS 210 N 2.26 1.06 0.00 3.52 1.57 -1.55 -2.48 116.57 120.94 3brd h LYS 210 Ca -0.20 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 3brd h LYS 210 Cb 1.30 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3brd h LYS 210 CO 0.11 0.70 0.00 0.39 -0.57 0.00 0.00 179.45 180.08 3brd n GLU 211 N -4.55 0.15 0.00 3.15 -0.58 -1.26 -0.05 120.64 117.50 3brd n GLU 211 Ca 0.17 0.47 0.07 0.00 -0.42 0.00 0.00 57.16 57.46 3brd n GLU 211 Cb 0.26 -1.85 -0.01 0.00 -0.57 0.00 0.00 31.44 29.27 3brd n GLU 211 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 3brd n LYS 212 N -2.15 1.82 -0.06 3.49 2.85 -0.94 -3.94 118.16 119.24 3brd n LYS 212 Ca 0.01 -0.65 -0.08 0.00 -1.05 0.00 0.00 58.31 56.54 3brd n LYS 212 Cb 0.16 -1.24 -0.05 0.00 -0.65 0.00 0.00 35.03 33.25 3brd n LYS 212 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3brd n TYR 213 N -0.34 0.00 -2.54 5.58 4.02 -0.58 -3.58 117.16 119.72 3brd n TYR 213 Ca 0.06 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.53 3brd n TYR 213 Cb 0.30 -0.44 -0.03 0.00 -0.02 0.00 0.00 39.34 39.16 3brd n TYR 213 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 3brd s GLU 214 N -2.23 4.44 -0.16 -0.72 2.12 0.93 -4.19 118.70 118.88 3brd s GLU 214 Ca -0.16 1.60 -0.17 0.00 0.36 0.00 0.00 54.97 56.60 3brd s GLU 214 Cb 0.04 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.93 3brd s GLU 214 CO 0.26 -0.27 0.44 0.00 -0.54 0.00 0.00 175.26 175.15 3brd s VAL 216 N 1.00 3.05 -0.15 0.00 1.01 -0.81 -0.94 120.40 123.55 3brd s VAL 216 Ca 0.23 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 3brd s VAL 216 Cb -0.15 -2.22 0.04 0.00 0.00 0.00 0.00 36.38 34.05 3brd s VAL 216 CO 0.09 0.57 -0.05 -0.63 0.00 0.00 0.00 175.10 175.08 3brd s ILE 217 N -0.40 1.06 -0.17 2.22 1.01 -0.12 -1.25 121.20 123.54 3brd s ILE 217 Ca 0.05 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.17 3brd s ILE 217 Cb -0.12 -1.21 0.02 0.00 0.01 0.00 0.00 42.46 41.15 3brd s ILE 217 CO 0.02 0.17 -0.19 -0.44 0.00 0.00 0.00 174.94 174.50 3brd s SER 218 N 1.66 3.22 -0.22 3.58 0.01 -0.36 -0.82 113.70 120.78 3brd s SER 218 Ca 0.02 -0.62 -0.07 0.00 1.31 0.00 0.00 55.95 56.59 3brd s SER 218 Cb -0.15 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.56 3brd s SER 218 CO -0.08 0.02 0.06 -0.63 0.41 0.00 0.00 173.24 173.03 3brd s ILE 219 N 1.18 4.48 0.04 1.44 1.01 0.11 -1.26 121.20 128.20 3brd s ILE 219 Ca 0.02 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.62 3brd s ILE 219 Cb -0.14 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 3brd s ILE 219 CO -0.10 0.39 -0.19 -0.36 0.00 0.00 0.00 174.94 174.68 3brd s PHE 220 N 1.11 2.54 -0.07 3.97 0.40 -0.05 -0.59 117.98 125.29 3brd s PHE 220 Ca 0.04 -0.27 -0.31 0.00 -0.60 0.00 0.00 56.93 55.79 3brd s PHE 220 Cb -0.14 -1.45 0.12 0.00 0.51 0.00 0.00 43.02 42.05 3brd s PHE 220 CO 0.03 0.25 1.13 -3.38 0.70 0.00 0.00 175.22 173.95 3brd s HIS 221 N -0.92 -0.15 0.63 0.36 -3.43 -1.02 -1.46 115.29 109.30 3brd s HIS 221 Ca 0.14 0.04 -0.14 0.00 -0.80 0.00 0.00 55.06 54.31 3brd s HIS 221 Cb -0.10 0.54 -0.02 0.00 -1.43 0.00 0.00 32.58 31.57 3brd s HIS 221 CO 0.05 -0.37 1.06 0.00 -2.00 0.00 0.00 174.74 173.48 3brd s ALA 222 N -2.68 2.72 -0.64 -1.38 0.00 -1.26 0.49 121.76 119.01 3brd s ALA 222 Ca 0.10 0.26 0.25 0.00 0.00 0.00 0.00 51.96 52.57 3brd s ALA 222 Cb 0.00 -3.21 0.45 0.00 0.00 0.00 0.00 23.12 20.36 3brd s ALA 222 CO -0.05 -0.97 1.43 0.87 0.00 0.00 0.00 175.76 177.05 3brd h LYS 223 N -0.02 0.00 -5.28 0.00 1.57 -1.38 -3.44 116.57 108.02 3brd h LYS 223 Ca -0.46 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 57.93 3brd h LYS 223 Cb 1.22 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.33 3brd h LYS 223 CO 0.57 0.00 -0.76 0.14 -0.57 0.00 0.00 179.45 178.83 3brd s VAL 224 N -3.16 1.15 -0.04 0.50 -7.23 -1.26 -0.83 120.40 109.53 3brd s VAL 224 Ca 0.07 -1.52 0.02 0.00 -1.81 0.00 0.00 61.98 58.74 3brd s VAL 224 Cb 0.13 -1.29 0.01 0.00 0.56 0.00 0.00 36.38 35.79 3brd s VAL 224 CO 0.69 -0.36 -0.07 0.00 -0.31 0.00 0.00 175.10 175.05 3brd s ALA 225 N -1.82 0.77 0.09 1.32 0.00 -0.28 -4.88 121.76 116.96 3brd s ALA 225 Ca 0.03 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 3brd s ALA 225 Cb -0.07 -0.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.61 3brd s ALA 225 CO 0.02 0.05 1.12 -1.14 0.00 0.00 0.00 175.76 175.82 3brd s GLN 226 N 0.63 4.51 0.75 0.00 0.74 -1.26 -0.50 119.66 124.53 3brd s GLN 226 Ca -0.09 1.69 -0.11 0.00 0.05 0.00 0.00 55.36 56.89 3brd s GLN 226 Cb -0.12 -3.34 0.04 0.00 1.10 0.00 0.00 33.01 30.68 3brd s GLN 226 CO 0.01 -0.10 1.08 -1.59 -0.55 0.00 0.00 175.29 174.14 3brd s LYS 227 N 0.57 2.46 -0.10 1.67 -2.85 -0.09 -4.69 119.74 116.70 3brd s LYS 227 Ca 0.54 0.74 0.01 0.00 -1.00 0.00 0.00 55.97 56.27 3brd s LYS 227 Cb -0.28 -1.95 -0.02 0.00 -2.06 0.00 0.00 37.83 33.52 3brd s LYS 227 CO 0.31 -1.38 -0.13 -1.12 0.10 0.00 0.00 175.35 173.12 3brd s SER 228 N -3.89 4.03 0.05 0.03 0.01 -0.21 -4.87 113.70 108.85 3brd s SER 228 Ca 0.60 -0.28 0.01 0.00 1.31 0.00 0.00 55.95 57.58 3brd s SER 228 Cb -0.14 -1.35 -0.04 0.00 0.21 0.00 0.00 66.02 64.70 3brd s SER 228 CO 0.54 0.23 0.15 -0.31 0.41 0.00 0.00 173.24 174.26 3brd s TYR 229 N -0.02 3.39 0.00 2.43 1.51 -1.26 -0.12 117.35 123.27 3brd s TYR 229 Ca -0.03 0.20 0.00 0.00 -1.01 0.00 0.00 57.07 56.22 3brd s TYR 229 Cb -0.14 -1.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.99 3brd s TYR 229 CO 0.04 0.57 0.00 0.41 -1.11 0.00 0.00 175.55 175.46 3brd n GLY 230 N 0.50 2.07 0.15 0.71 0.00 -1.26 -2.37 105.19 105.00 3brd n GLY 230 Ca -0.08 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.58 3brd n GLY 230 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3brd n ASN 231 N 3.68 0.86 -4.71 1.61 3.02 -1.26 -4.91 115.26 113.54 3brd n ASN 231 Ca 0.00 -0.67 -0.30 0.00 -0.03 0.00 0.00 54.58 53.57 3brd n ASN 231 Cb 0.00 0.22 0.14 0.00 -0.61 0.00 0.00 39.78 39.53 3brd n ASN 231 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3brd s GLU 232 N -2.71 1.37 -0.19 3.52 -1.05 -1.00 -5.04 118.70 113.61 3brd s GLU 232 Ca 0.19 1.00 -0.01 0.00 -0.15 0.00 0.00 54.97 55.99 3brd s GLU 232 Cb 0.18 -1.81 0.05 0.00 -0.44 0.00 0.00 34.13 32.12 3brd s GLU 232 CO 0.60 -2.21 -0.03 0.15 0.95 0.00 0.00 175.26 174.72 3brd s LYS 233 N -4.87 1.28 -0.44 -4.83 1.02 -1.26 -4.67 119.74 105.97 3brd s LYS 233 Ca 0.63 -0.61 -0.11 0.00 0.02 0.00 0.00 55.97 55.91 3brd s LYS 233 Cb -0.19 -2.17 0.08 0.00 -0.52 0.00 0.00 37.83 35.04 3brd s LYS 233 CO 0.57 -0.53 0.31 1.03 -0.92 0.00 0.00 175.35 175.81 3brd s ARG 234 N 1.63 2.67 0.36 1.68 0.52 -1.26 -5.07 118.95 119.48 3brd s ARG 234 Ca -0.01 -1.49 -0.27 0.00 -0.52 0.00 0.00 55.73 53.44 3brd s ARG 234 Cb -0.17 -3.89 -0.09 0.00 0.52 0.00 0.00 34.95 31.32 3brd s ARG 234 CO -0.07 -1.01 1.22 -0.06 0.02 0.00 0.00 175.30 175.40 3brd s PHE 235 N 1.47 3.12 0.16 -0.53 2.99 -1.26 -4.50 117.98 119.43 3brd s PHE 235 Ca 0.04 1.51 -0.32 0.00 0.00 0.00 0.00 56.93 58.16 3brd s PHE 235 Cb -0.24 -3.51 -0.10 0.00 0.00 0.00 0.00 43.02 39.17 3brd s PHE 235 CO 0.03 -1.47 1.60 -0.06 -0.00 0.00 0.00 175.22 175.31 3brd s PHE 236 N -1.26 2.99 -0.03 0.36 2.99 0.94 -4.98 117.98 118.99 3brd s PHE 236 Ca 0.52 0.56 0.00 0.00 0.00 0.00 0.00 56.93 58.01 3brd s PHE 236 Cb -0.35 -3.96 0.03 0.00 0.00 0.00 0.00 43.02 38.73 3brd s PHE 236 CO 0.45 -3.59 -0.00 0.00 -0.00 0.00 0.00 175.22 172.08 3brd s PRO 238 N 1.06 1.24 0.09 0.00 0.04 -1.26 -4.86 135.00 131.31 3brd s PRO 238 Ca -0.09 1.56 -0.31 0.00 0.04 0.00 0.00 61.00 62.19 3brd s PRO 238 Cb -0.14 -1.75 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 3brd s PRO 238 CO -0.02 -2.47 1.35 -1.25 0.04 0.00 0.00 177.00 174.66 3brd s PRO 239 N -4.58 4.34 0.21 0.56 0.04 -1.24 -4.59 135.00 129.74 3brd s PRO 239 Ca 0.67 2.00 -0.32 0.00 0.04 0.00 0.00 61.00 63.39 3brd s PRO 239 Cb -0.23 -3.31 -0.15 0.00 0.04 0.00 0.00 34.50 30.85 3brd s PRO 239 CO 0.56 -0.42 1.23 -2.30 0.04 0.00 0.00 177.00 176.12 3brd n PRO 240 N 4.13 1.48 -4.15 0.56 -0.02 -1.24 -4.66 135.00 131.10 3brd n PRO 240 Ca 0.11 0.53 -0.10 0.00 -2.02 0.00 0.00 63.50 62.02 3brd n PRO 240 Cb 0.43 -2.07 -0.10 0.00 -0.02 0.00 0.00 33.50 31.75 3brd n PRO 240 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3brd s ILE 242 N -3.84 0.95 -0.20 0.00 1.01 0.21 -0.87 121.20 118.46 3brd s ILE 242 Ca 0.16 -0.30 -0.08 0.00 0.00 0.00 0.00 60.65 60.43 3brd s ILE 242 Cb 0.07 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 3brd s ILE 242 CO -0.03 0.34 0.07 -0.31 0.00 0.00 0.00 174.94 175.01 3brd s TYR 243 N 1.25 3.21 -0.34 3.97 1.51 -0.39 -1.26 117.35 125.30 3brd s TYR 243 Ca -0.04 -0.02 -0.12 0.00 -1.01 0.00 0.00 57.07 55.88 3brd s TYR 243 Cb -0.14 -2.13 -0.01 0.00 -0.11 0.00 0.00 41.96 39.57 3brd s TYR 243 CO -0.03 0.03 0.23 -0.51 -1.11 0.00 0.00 175.55 174.16 3brd s LEU 244 N 0.72 4.49 0.00 -1.29 1.43 -0.09 -1.22 118.68 122.72 3brd s LEU 244 Ca 0.04 -0.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.74 3brd s LEU 244 Cb -0.13 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.95 3brd s LEU 244 CO 0.02 -0.24 -0.24 -0.63 0.23 0.00 0.00 176.35 175.49 3brd s ILE 245 N 1.70 2.27 0.00 -0.59 1.01 -0.38 -0.25 121.20 124.96 3brd s ILE 245 Ca 0.06 -1.15 0.00 0.00 0.00 0.00 0.00 60.65 59.55 3brd s ILE 245 Cb -0.17 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.45 3brd s ILE 245 CO 0.10 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.14 3brd n GLY 246 N 2.14 3.17 0.30 6.18 0.00 0.15 -1.92 105.19 115.22 3brd n GLY 246 Ca -0.16 -1.60 0.20 0.00 0.00 0.00 0.00 46.02 44.45 3brd n GLY 246 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3brd h GLN 247 N 0.00 0.00 -0.50 1.61 4.20 -1.81 -2.66 115.11 115.95 3brd h GLN 247 Ca 0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 3brd h GLN 247 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 3brd h GLN 247 CO 0.00 0.00 0.36 0.78 -0.67 0.00 0.00 178.83 179.30 3brd h GLY 248 N 0.79 0.10 1.30 3.46 0.00 -1.72 -1.86 103.07 105.15 3brd h GLY 248 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.25 3brd h GLY 248 CO 0.00 0.01 0.12 1.49 0.00 0.00 0.00 176.54 178.16 3brd h TRP 249 N 0.06 0.90 -0.33 5.60 4.06 -1.76 -0.45 115.95 124.04 3brd h TRP 249 Ca 0.24 -0.09 -0.15 0.00 2.06 0.00 0.00 58.89 60.95 3brd h TRP 249 Cb 0.87 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 28.76 3brd h TRP 249 CO -0.00 0.76 -0.40 -0.22 -3.56 0.00 0.00 178.44 175.02 3brd h LYS 250 N 0.83 0.79 -0.49 0.49 1.63 -1.54 -1.06 116.57 117.23 3brd h LYS 250 Ca 0.18 -0.41 -0.02 0.00 -0.85 0.00 0.00 60.65 59.55 3brd h LYS 250 Cb 0.33 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.95 3brd h LYS 250 CO 0.00 1.04 0.24 1.25 -3.45 0.00 0.00 179.45 178.53 3brd h LEU 251 N 0.64 0.64 -0.52 5.20 5.85 -1.23 -0.13 115.31 125.76 3brd h LEU 251 Ca 0.05 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3brd h LEU 251 Cb 0.96 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 3brd h LEU 251 CO 0.09 0.58 0.30 0.50 -0.34 0.00 0.00 178.44 179.57 3brd h LYS 252 N 0.65 0.71 -0.63 1.25 3.64 -0.93 -0.58 116.57 120.68 3brd h LYS 252 Ca 0.17 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 3brd h LYS 252 Cb 0.11 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 3brd h LYS 252 CO -0.02 0.54 0.40 -0.22 -2.27 0.00 0.00 179.45 177.87 3brd h LYS 253 N 0.69 0.77 -0.42 1.90 3.64 -1.06 -1.91 116.57 120.18 3brd h LYS 253 Ca 0.18 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 3brd h LYS 253 Cb 0.02 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 3brd h LYS 253 CO -0.03 0.51 0.20 -0.44 -2.27 0.00 0.00 179.45 177.41 3brd h ASP 254 N 0.79 0.27 -0.92 4.20 3.32 -0.17 0.54 116.42 124.46 3brd h ASP 254 Ca 0.25 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3brd h ASP 254 Cb -0.01 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 3brd h ASP 254 CO -0.09 0.20 0.58 0.03 -1.72 0.00 0.00 179.24 178.24 3brd h ARG 255 N 0.40 1.22 -0.07 3.56 3.08 -1.01 0.26 114.38 121.82 3brd h ARG 255 Ca 0.18 -0.09 -0.16 0.00 0.07 0.00 0.00 59.98 59.98 3brd h ARG 255 Cb 0.11 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 3brd h ARG 255 CO -0.14 0.83 -0.65 0.28 -1.07 0.00 0.00 179.97 179.22 3brd h VAL 256 N 1.25 1.39 -0.11 2.04 2.07 -0.72 -1.62 116.25 120.55 3brd h VAL 256 Ca 0.33 -2.06 -0.05 0.00 0.82 0.00 0.00 66.70 65.75 3brd h VAL 256 Cb -0.11 2.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.71 3brd h VAL 256 CO -0.07 0.61 -0.13 0.00 0.02 0.00 0.00 177.57 178.00 3brd h ALA 257 N 1.11 0.17 0.00 1.67 0.00 0.44 -2.17 119.26 120.49 3brd h ALA 257 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3brd h ALA 257 Cb 1.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3brd h ALA 257 CO 0.10 0.04 0.00 1.96 0.00 0.00 0.00 179.25 181.36 3brd h GLN 258 N -0.11 0.00 -0.01 0.00 7.50 -0.44 -2.76 115.11 119.28 3brd h GLN 258 Ca 0.02 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.17 3brd h GLN 258 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.20 3brd h GLN 258 CO 0.03 0.00 -0.46 1.28 -1.50 0.00 0.00 178.83 178.18 3brd n LEU 259 N -2.42 1.56 0.03 1.46 4.32 -0.62 -3.89 117.00 117.45 3brd n LEU 259 Ca 0.03 -0.71 -0.06 0.00 -0.02 0.00 0.00 56.01 55.25 3brd n LEU 259 Cb 0.30 0.00 0.13 0.00 -1.62 0.00 0.00 43.42 42.23 3brd n LEU 259 CO 0.24 0.31 0.57 0.22 -1.22 0.00 0.00 177.39 177.50 3brd h TYR 260 N 1.60 0.53 0.00 -1.77 3.20 -1.08 -2.40 116.97 117.04 3brd h TYR 260 Ca 0.00 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.71 3brd h TYR 260 Cb 0.57 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.73 3brd h TYR 260 CO 0.00 0.82 -0.84 1.57 -1.64 0.00 0.00 178.16 178.07 3brd h LYS 261 N 0.35 0.00 0.00 1.82 2.10 -1.70 -3.33 116.57 115.81 3brd h LYS 261 Ca 0.02 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.67 3brd h LYS 261 Cb 0.95 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.28 3brd h LYS 261 CO 0.08 0.00 -0.00 1.15 -2.00 0.00 0.00 179.45 178.68 3brd h THR 262 N 0.00 1.61 0.00 0.07 2.02 -1.67 -3.53 112.91 111.41 3brd h THR 262 Ca 0.00 -2.16 -0.12 0.00 0.77 0.00 0.00 66.41 64.90 3brd h THR 262 Cb 0.89 3.02 -0.02 0.00 -1.74 0.00 0.00 68.15 70.31 3brd h THR 262 CO 0.00 0.54 -0.68 0.25 0.37 0.00 0.00 175.52 176.00 3brd h LEU 263 N -0.97 0.00 0.00 2.58 6.46 -1.55 -3.52 115.31 118.31 3brd h LEU 263 Ca -0.00 -0.62 -0.04 0.00 -0.12 0.00 0.00 57.88 57.11 3brd h LEU 263 Cb 0.88 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.81 3brd h LEU 263 CO 0.00 1.20 -1.11 0.00 -0.62 0.00 0.00 178.44 177.91 3brd n GLN 281 N -4.53 0.53 -0.60 1.25 10.64 -1.26 -5.03 117.38 118.38 3brd n GLN 281 Ca -0.20 0.22 0.09 0.00 -1.83 0.00 0.00 57.00 55.28 3brd n GLN 281 Cb 0.54 -1.44 0.35 0.00 -0.86 0.00 0.00 30.24 28.83 3brd n GLN 281 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3brd n GLN 282 N -4.45 3.66 -0.07 2.61 1.13 -1.26 -3.98 117.38 115.02 3brd n GLN 282 Ca -0.17 -2.79 0.02 0.00 -1.94 0.00 0.00 57.00 52.11 3brd n GLN 282 Cb 0.54 -1.88 0.05 0.00 0.11 0.00 0.00 30.24 29.06 3brd n GLN 282 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3brd n ALA 283 N 1.12 2.51 -0.46 -1.58 0.00 -1.26 -2.61 120.51 118.23 3brd n ALA 283 Ca 0.25 -0.21 0.07 0.00 0.00 0.00 0.00 53.44 53.55 3brd n ALA 283 Cb 0.87 -0.99 0.19 0.00 0.00 0.00 0.00 19.45 19.51 3brd n ALA 283 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3brd n THR 284 N -0.13 1.45 -2.88 0.00 5.66 -1.26 -2.86 114.28 114.27 3brd n THR 284 Ca 0.04 -1.31 -0.38 0.00 -3.05 0.00 0.00 64.05 59.35 3brd n THR 284 Cb 0.14 0.24 -0.06 0.00 -1.55 0.00 0.00 70.33 69.09 3brd n THR 284 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 3brd s GLU 285 N -1.64 4.61 0.15 1.09 2.12 -1.07 -4.84 118.70 119.11 3brd s GLU 285 Ca 0.30 1.26 -0.30 0.00 0.36 0.00 0.00 54.97 56.58 3brd s GLU 285 Cb 0.20 -3.08 -0.07 0.00 0.26 0.00 0.00 34.13 31.44 3brd s GLU 285 CO 0.13 0.45 1.09 -0.51 -0.54 0.00 0.00 175.26 175.88 3brd s LEU 286 N -1.54 4.47 -0.07 2.70 2.01 -1.26 0.59 118.68 125.58 3brd s LEU 286 Ca 0.42 2.03 0.03 0.00 0.01 0.00 0.00 54.13 56.62 3brd s LEU 286 Cb -0.22 -3.60 0.01 0.00 0.01 0.00 0.00 46.19 42.39 3brd s LEU 286 CO 0.26 -0.23 -0.15 -0.69 1.01 0.00 0.00 176.35 176.55 3brd s VAL 287 N -0.03 1.37 0.07 -1.59 1.01 0.56 -4.84 120.40 116.97 3brd s VAL 287 Ca 0.50 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.89 3brd s VAL 287 Cb -0.28 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 3brd s VAL 287 CO 0.33 0.41 -0.10 0.00 0.00 0.00 0.00 175.10 175.74 3brd s ALA 288 N 0.55 0.95 0.08 5.51 0.00 -1.26 0.61 121.76 128.20 3brd s ALA 288 Ca -0.15 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.80 3brd s ALA 288 Cb -0.16 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 3brd s ALA 288 CO 0.05 -0.00 -0.07 0.71 0.00 0.00 0.00 175.76 176.44 3brd s TYR 289 N -1.96 0.85 -0.05 0.00 1.51 -0.09 -1.54 117.35 116.06 3brd s TYR 289 Ca -0.00 -0.79 -0.07 0.00 -1.01 0.00 0.00 57.07 55.19 3brd s TYR 289 Cb -0.06 -0.49 0.01 0.00 -0.11 0.00 0.00 41.96 41.31 3brd s TYR 289 CO 0.00 -0.12 0.18 -1.50 -1.11 0.00 0.00 175.55 172.99 3brd s ILE 290 N -2.99 0.02 0.35 2.71 2.07 -0.04 -0.76 121.20 122.56 3brd s ILE 290 Ca 0.06 -0.19 -0.05 0.00 -1.41 0.00 0.00 60.65 59.06 3brd s ILE 290 Cb 0.01 -0.32 0.01 0.00 0.13 0.00 0.00 42.46 42.29 3brd s ILE 290 CO -0.03 -0.10 0.53 -0.83 -1.91 0.00 0.00 174.94 172.59 3brd s GLY 291 N -0.31 1.28 -0.38 1.50 0.00 -1.05 -0.52 107.32 107.84 3brd s GLY 291 Ca -0.04 -1.37 0.06 0.00 0.00 0.00 0.00 44.72 43.37 3brd s GLY 291 CO 0.01 -0.87 1.59 0.29 0.00 0.00 0.00 173.10 174.11 3brd n ILE 292 N -0.55 2.83 -1.80 0.90 -5.35 -1.26 -1.70 119.36 112.42 3brd n ILE 292 Ca -0.01 -2.88 -0.20 0.00 -0.27 0.00 0.00 62.75 59.39 3brd n ILE 292 Cb 0.61 -0.60 -0.07 0.00 -1.74 0.00 0.00 39.64 37.85 3brd n ILE 292 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3brd n GLY 293 N -1.04 1.29 3.41 3.28 0.00 -1.26 -4.67 105.19 106.20 3brd n GLY 293 Ca 0.44 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.13 3brd n GLY 293 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3brd s SER 294 N -2.55 3.95 0.00 1.61 0.15 -1.26 -5.01 113.70 110.60 3brd s SER 294 Ca 0.00 -0.29 0.15 0.00 0.70 0.00 0.00 55.95 56.52 3brd s SER 294 Cb 0.00 -1.25 0.92 0.00 -1.71 0.00 0.00 66.02 63.97 3brd s SER 294 CO 0.00 0.24 1.51 0.47 1.20 0.00 0.00 173.24 176.66 3brd n ASP 295 N 2.99 0.00 -0.05 5.45 10.43 -1.26 -2.16 116.55 131.95 3brd n ASP 295 Ca -0.18 -1.29 0.02 0.00 2.57 0.00 0.00 54.79 55.92 3brd n ASP 295 Cb 0.52 0.00 0.03 0.00 1.84 0.00 0.00 41.12 43.52 3brd n ASP 295 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 3brd n THR 296 N -0.77 0.96 -5.06 -3.53 -2.24 -1.26 -5.03 114.28 97.34 3brd n THR 296 Ca 0.12 -1.05 -0.32 0.00 -2.27 0.00 0.00 64.05 60.53 3brd n THR 296 Cb 0.05 0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 68.54 3brd n THR 296 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3brd s SER 297 N -1.26 3.48 0.16 3.42 0.15 -0.92 -5.10 113.70 113.63 3brd s SER 297 Ca 0.07 -0.42 -0.30 0.00 0.70 0.00 0.00 55.95 56.00 3brd s SER 297 Cb 0.06 -1.17 -0.08 0.00 -1.71 0.00 0.00 66.02 63.13 3brd s SER 297 CO 0.01 0.22 1.20 -0.70 1.20 0.00 0.00 173.24 175.17 3brd s GLU 298 N -0.01 4.48 0.25 5.44 2.12 -1.26 -4.81 118.70 124.91 3brd s GLU 298 Ca -0.06 1.85 -0.30 0.00 0.36 0.00 0.00 54.97 56.82 3brd s GLU 298 Cb -0.15 -3.26 -0.09 0.00 0.26 0.00 0.00 34.13 30.89 3brd s GLU 298 CO 0.05 -0.12 1.19 1.03 -0.54 0.00 0.00 175.26 176.87 3brd s ARG 299 N 0.03 4.52 0.00 4.30 0.52 -1.26 -4.76 118.95 122.29 3brd s ARG 299 Ca 0.54 1.93 0.06 0.00 -0.52 0.00 0.00 55.73 57.74 3brd s ARG 299 Cb -0.32 -3.18 -0.03 0.00 0.52 0.00 0.00 34.95 31.94 3brd s ARG 299 CO 0.35 -0.00 -0.18 -0.65 0.02 0.00 0.00 175.30 174.84 3brd s GLN 300 N -0.99 2.23 0.19 3.54 -0.21 0.32 -4.91 119.66 119.83 3brd s GLN 300 Ca 0.49 -0.88 -0.30 0.00 0.02 0.00 0.00 55.36 54.70 3brd s GLN 300 Cb -0.34 -2.24 -0.08 0.00 1.00 0.00 0.00 33.01 31.36 3brd s GLN 300 CO 0.42 0.57 1.12 -1.14 -2.12 0.00 0.00 175.29 174.13 3brd s GLN 301 N -1.10 4.58 0.41 2.91 0.74 -1.26 -0.86 119.66 125.08 3brd s GLN 301 Ca 0.13 1.75 -0.10 0.00 0.05 0.00 0.00 55.36 57.19 3brd s GLN 301 Cb -0.10 -3.26 -0.06 0.00 1.10 0.00 0.00 33.01 30.68 3brd s GLN 301 CO 0.03 0.06 0.78 -0.51 -0.55 0.00 0.00 175.29 175.09 3brd s LEU 302 N -0.45 3.81 -0.07 3.68 1.43 -0.59 -4.92 118.68 121.57 3brd s LEU 302 Ca 0.49 1.13 -0.21 0.00 -1.03 0.00 0.00 54.13 54.52 3brd s LEU 302 Cb -0.30 -4.02 -0.16 0.00 0.03 0.00 0.00 46.19 41.73 3brd s LEU 302 CO 0.36 -0.42 0.80 -2.24 0.23 0.00 0.00 176.35 175.08 3brd h ASP 303 N 1.17 -0.12 -3.65 2.29 -0.00 -1.90 -3.44 116.42 110.77 3brd h ASP 303 Ca -0.47 -0.45 0.00 0.00 -0.00 0.00 0.00 57.03 56.11 3brd h ASP 303 Cb 1.19 0.03 0.00 0.00 -0.00 0.00 0.00 39.33 40.55 3brd h ASP 303 CO 0.64 0.51 -0.69 0.49 -0.00 0.00 0.00 179.24 180.18 3brd n PHE 304 N -4.84 -3.41 0.00 4.15 3.01 -1.26 -5.04 117.46 110.06 3brd n PHE 304 Ca -0.07 1.80 0.00 0.00 1.01 0.00 0.00 57.45 60.18 3brd n PHE 304 Cb 0.28 -2.77 0.00 0.00 -0.01 0.00 0.00 39.48 36.98 3brd n PHE 304 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 3brd n PRO 319 N -0.23 0.00 0.00 -1.08 -0.04 -1.26 -4.85 135.00 127.54 3brd n PRO 319 Ca 0.00 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 3brd n PRO 319 Cb 0.00 0.00 0.58 0.00 -0.04 0.00 0.00 33.50 34.04 3brd n PRO 319 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3brd n ASN 320 N 0.00 0.00 -4.60 3.54 6.94 -1.26 -4.73 115.26 115.16 3brd n ASN 320 Ca 0.00 -0.53 -0.43 0.00 -0.02 0.00 0.00 54.58 53.60 3brd n ASN 320 Cb 0.00 -0.04 -0.03 0.00 -2.36 0.00 0.00 39.78 37.35 3brd n ASN 320 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3brd s ILE 321 N -2.09 3.39 -0.11 1.53 1.01 -1.26 0.29 121.20 123.97 3brd s ILE 321 Ca 0.28 0.39 -0.28 0.00 0.00 0.00 0.00 60.65 61.05 3brd s ILE 321 Cb 0.14 -3.55 -0.25 0.00 0.01 0.00 0.00 42.46 38.81 3brd s ILE 321 CO 0.24 -0.36 0.90 0.22 0.00 0.00 0.00 174.94 175.93 3brd h TYR 322 N 13.39 0.02 -3.26 3.97 3.20 -0.89 -3.48 116.97 129.93 3brd h TYR 322 Ca -0.34 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.50 3brd h TYR 322 Cb 1.18 -0.00 -0.10 0.00 1.54 0.00 0.00 36.73 39.35 3brd h TYR 322 CO 0.96 0.89 0.06 0.34 -1.64 0.00 0.00 178.16 178.77 3brd s ASP 323 N -6.12 -0.28 -0.11 -2.11 3.68 -0.91 -5.01 116.67 105.81 3brd s ASP 323 Ca -0.18 -0.48 -0.07 0.00 2.13 0.00 0.00 52.55 53.95 3brd s ASP 323 Cb -0.02 0.60 0.04 0.00 -1.45 0.00 0.00 42.92 42.10 3brd s ASP 323 CO 0.69 -1.09 0.27 -0.47 0.13 0.00 0.00 175.17 174.70 3brd s TYR 324 N -3.88 -0.35 0.04 -5.34 5.04 -1.26 -0.91 117.35 110.69 3brd s TYR 324 Ca 0.09 0.83 -0.00 0.00 -2.44 0.00 0.00 57.07 55.55 3brd s TYR 324 Cb -0.02 0.09 -0.03 0.00 0.35 0.00 0.00 41.96 42.35 3brd s TYR 324 CO -0.02 -0.22 -0.04 0.00 -1.34 0.00 0.00 175.55 173.93 3brd s ALA 326 N -2.81 0.49 -0.44 0.00 0.00 -1.26 -0.62 121.76 117.12 3brd s ALA 326 Ca -0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.29 3brd s ALA 326 Cb -0.00 -0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.21 3brd s ALA 326 CO -0.06 0.02 0.30 0.00 0.00 0.00 0.00 175.76 176.03 3brd s ALA 327 N -0.92 3.35 -0.90 0.00 0.00 0.61 -4.02 121.76 119.89 3brd s ALA 327 Ca -0.06 -2.29 0.24 0.00 0.00 0.00 0.00 51.96 49.85 3brd s ALA 327 Cb -0.07 -2.75 0.28 0.00 0.00 0.00 0.00 23.12 20.58 3brd s ALA 327 CO 0.00 -1.75 1.24 1.63 0.00 0.00 0.00 175.76 176.88 3brd n LYS 328 N 4.94 0.07 -2.12 0.00 5.02 -1.26 -3.69 118.16 121.12 3brd n LYS 328 Ca -0.10 0.01 -0.11 0.00 -2.02 0.00 0.00 58.31 56.09 3brd n LYS 328 Cb 0.42 -1.53 0.05 0.00 -0.02 0.00 0.00 35.03 33.95 3brd n LYS 328 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3brd n THR 329 N -1.63 1.92 -3.24 -0.18 -2.24 -1.26 -4.75 114.28 102.90 3brd n THR 329 Ca 0.04 -3.49 -0.36 0.00 -2.27 0.00 0.00 64.05 57.98 3brd n THR 329 Cb 0.36 -0.11 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 3brd n THR 329 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3brd s LEU 330 N -3.41 4.34 0.19 3.22 1.43 -1.26 -4.95 118.68 118.24 3brd s LEU 330 Ca 0.41 1.24 -0.16 0.00 -1.03 0.00 0.00 54.13 54.59 3brd s LEU 330 Cb 0.38 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 43.21 3brd s LEU 330 CO -0.01 0.07 0.49 -0.72 0.23 0.00 0.00 176.35 176.41 3brd s TYR 331 N -1.48 -0.04 -0.07 0.29 -0.85 -1.26 -0.04 117.35 113.89 3brd s TYR 331 Ca 0.40 -0.31 0.01 0.00 -0.52 0.00 0.00 57.07 56.65 3brd s TYR 331 Cb -0.16 0.32 0.02 0.00 0.38 0.00 0.00 41.96 42.52 3brd s TYR 331 CO 0.20 -0.89 -0.08 -1.50 -1.52 0.00 0.00 175.55 171.76 3brd s ILE 332 N -3.89 0.89 0.58 -3.49 2.07 -1.26 -5.03 121.20 111.07 3brd s ILE 332 Ca 0.10 -0.29 -0.13 0.00 -1.41 0.00 0.00 60.65 58.92 3brd s ILE 332 Cb -0.00 -0.87 -0.06 0.00 0.13 0.00 0.00 42.46 41.66 3brd s ILE 332 CO -0.02 0.31 1.01 -0.44 -1.91 0.00 0.00 174.94 173.89 3brd s SER 333 N 1.05 6.38 0.45 4.50 0.01 -1.26 -1.04 113.70 123.79 3brd s SER 333 Ca -0.08 1.49 0.31 0.00 1.31 0.00 0.00 55.95 58.97 3brd s SER 333 Cb -0.14 -2.49 1.50 0.00 0.21 0.00 0.00 66.02 65.10 3brd s SER 333 CO -0.01 -0.76 1.93 -2.24 0.41 0.00 0.00 173.24 172.58 3brd h ASP 334 N 0.19 0.00 0.98 2.44 2.03 -0.88 -2.45 116.42 118.73 3brd h ASP 334 Ca -0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.85 3brd h ASP 334 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 3brd h ASP 334 CO 0.62 0.00 0.00 0.77 -1.03 0.00 0.00 179.24 179.60 3brd h SER 335 N 0.00 0.00 -3.37 4.15 4.64 -1.93 -3.39 113.55 113.65 3brd h SER 335 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 3brd h SER 335 Cb 0.21 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.19 3brd h SER 335 CO 0.00 0.00 0.62 -0.62 -0.87 0.00 0.00 176.83 175.96 3brd s ASP 336 N -5.60 6.41 0.00 4.97 -1.08 -0.92 -4.94 116.67 115.50 3brd s ASP 336 Ca 0.01 -0.13 0.12 0.00 -0.52 0.00 0.00 52.55 52.03 3brd s ASP 336 Cb 0.09 -2.45 0.40 0.00 -1.46 0.00 0.00 42.92 39.50 3brd s ASP 336 CO 0.53 -1.19 1.31 0.29 0.52 0.00 0.00 175.17 176.63 3brd n LYS 337 N 7.47 1.61 -2.72 4.34 4.76 -1.26 -4.92 118.16 127.43 3brd n LYS 337 Ca 0.04 -0.93 -0.39 0.00 -2.87 0.00 0.00 58.31 54.15 3brd n LYS 337 Cb 0.48 -1.25 -0.06 0.00 -1.84 0.00 0.00 35.03 32.36 3brd n LYS 337 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3brd s ARG 338 N -1.69 4.76 0.22 1.97 0.52 -1.26 -4.96 118.95 118.51 3brd s ARG 338 Ca 0.22 1.49 0.03 0.00 -0.52 0.00 0.00 55.73 56.95 3brd s ARG 338 Cb 0.11 -3.15 0.20 0.00 0.52 0.00 0.00 34.95 32.63 3brd s ARG 338 CO 0.16 0.42 1.53 0.87 0.02 0.00 0.00 175.30 178.29 3brd h LYS 339 N 3.86 0.29 -5.23 3.54 6.56 -1.95 -3.45 116.57 120.19 3brd h LYS 339 Ca -0.46 -0.21 -0.39 0.00 -1.06 0.00 0.00 60.65 58.54 3brd h LYS 339 Cb 1.20 0.03 -0.20 0.00 -0.57 0.00 0.00 32.23 32.69 3brd h LYS 339 CO 0.67 0.83 -0.76 0.71 -2.06 0.00 0.00 179.45 178.83 3brd s TYR 340 N -3.74 1.18 0.26 -1.35 1.51 -1.26 -1.41 117.35 112.54 3brd s TYR 340 Ca -0.05 -0.52 -0.05 0.00 -1.01 0.00 0.00 57.07 55.44 3brd s TYR 340 Cb 0.12 -0.65 -0.01 0.00 -0.11 0.00 0.00 41.96 41.30 3brd s TYR 340 CO 0.81 0.05 0.36 -0.59 -1.11 0.00 0.00 175.55 175.07 3brd s PHE 341 N -1.65 0.86 0.29 2.71 -0.12 -0.26 -4.95 117.98 114.86 3brd s PHE 341 Ca 0.01 -1.12 0.03 0.00 -0.05 0.00 0.00 56.93 55.80 3brd s PHE 341 Cb -0.08 -0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.12 3brd s PHE 341 CO 0.02 -0.92 0.16 0.16 -0.05 0.00 0.00 175.22 174.59 3brd s ASP 342 N -3.14 1.42 -0.07 1.98 3.84 -1.26 0.19 116.67 119.63 3brd s ASP 342 Ca 0.31 -1.54 -0.01 0.00 -0.00 0.00 0.00 52.55 51.31 3brd s ASP 342 Cb 0.02 0.37 -0.03 0.00 -1.38 0.00 0.00 42.92 41.89 3brd s ASP 342 CO 0.14 -0.87 0.01 -0.76 -0.00 0.00 0.00 175.17 173.68 3brd s LEU 343 N -3.36 3.61 -0.24 2.11 1.43 -1.26 -3.98 118.68 116.98 3brd s LEU 343 Ca 0.36 0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.56 3brd s LEU 343 Cb 0.05 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.40 3brd s LEU 343 CO 0.17 0.36 -0.05 0.21 0.23 0.00 0.00 176.35 177.27 3brd s ASN 344 N -1.06 4.35 -0.25 2.29 2.47 -0.69 -1.10 114.94 120.96 3brd s ASN 344 Ca 0.15 -0.75 -0.10 0.00 0.42 0.00 0.00 52.86 52.59 3brd s ASN 344 Cb -0.11 -1.69 -0.04 0.00 -1.45 0.00 0.00 41.25 37.95 3brd s ASN 344 CO 0.04 -0.11 0.14 0.00 -3.72 0.00 0.00 177.10 173.45 3brd s ALA 345 N 1.37 3.46 -0.14 1.71 0.00 -0.56 -2.51 121.76 125.09 3brd s ALA 345 Ca 0.02 -0.98 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 3brd s ALA 345 Cb -0.16 -2.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.67 3brd s ALA 345 CO -0.04 -0.32 -0.08 -1.14 0.00 0.00 0.00 175.76 174.18 3brd s GLN 346 N 1.30 3.51 -0.04 0.00 0.74 0.06 -0.91 119.66 124.32 3brd s GLN 346 Ca 0.06 -0.60 0.05 0.00 0.05 0.00 0.00 55.36 54.93 3brd s GLN 346 Cb -0.14 -2.77 -0.02 0.00 1.10 0.00 0.00 33.01 31.17 3brd s GLN 346 CO 0.06 0.24 -0.19 -0.06 -0.55 0.00 0.00 175.29 174.79 3brd s PHE 347 N 0.31 2.56 0.05 1.67 0.40 -0.00 -0.92 117.98 122.06 3brd s PHE 347 Ca -0.07 -0.28 -0.00 0.00 -0.60 0.00 0.00 56.93 55.98 3brd s PHE 347 Cb -0.15 -1.58 -0.04 0.00 0.51 0.00 0.00 43.02 41.76 3brd s PHE 347 CO 0.04 0.09 -0.04 -0.06 0.70 0.00 0.00 175.22 175.96 3brd s PHE 348 N -0.66 0.54 0.16 0.36 0.40 0.20 -0.65 117.98 118.32 3brd s PHE 348 Ca 0.10 -0.97 -0.11 0.00 -0.60 0.00 0.00 56.93 55.36 3brd s PHE 348 Cb -0.10 -0.38 -0.07 0.00 0.51 0.00 0.00 43.02 42.98 3brd s PHE 348 CO 0.00 -0.32 0.50 0.71 0.70 0.00 0.00 175.22 176.81 3brd s TYR 349 N -3.52 3.53 0.53 0.36 4.12 0.75 -0.32 117.35 122.80 3brd s TYR 349 Ca 0.04 0.88 0.16 0.00 0.02 0.00 0.00 57.07 58.17 3brd s TYR 349 Cb 0.05 -2.24 0.85 0.00 -1.52 0.00 0.00 41.96 39.09 3brd s TYR 349 CO -0.08 0.40 1.44 0.78 0.02 0.00 0.00 175.55 178.11 3brd h GLY 350 N 3.18 0.00 1.59 0.71 0.00 0.05 0.23 103.07 108.83 3brd h GLY 350 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3brd h GLY 350 CO 0.68 0.00 -0.20 0.00 0.00 0.00 0.00 176.54 177.01 3brd n GLY 352 N 1.50 2.50 3.68 0.00 0.00 0.82 -5.08 105.19 108.61 3brd n GLY 352 Ca 0.06 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.61 3brd n GLY 352 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3brd n MET 353 N -0.82 2.19 -3.18 1.61 0.00 -1.24 -4.78 117.12 110.90 3brd n MET 353 Ca 0.00 0.80 -0.39 0.00 -0.00 0.00 0.00 57.70 58.11 3brd n MET 353 Cb 0.00 -2.63 -0.05 0.00 0.00 0.00 0.00 33.22 30.54 3brd n MET 353 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 3brd s GLU 354 N 3.27 4.38 -0.16 2.12 2.12 -1.26 -0.18 118.70 129.00 3brd s GLU 354 Ca 0.89 0.68 -0.14 0.00 0.36 0.00 0.00 54.97 56.76 3brd s GLU 354 Cb -0.68 -3.43 -0.10 0.00 0.26 0.00 0.00 34.13 30.17 3brd s GLU 354 CO 0.48 0.13 0.06 0.82 -0.54 0.00 0.00 175.26 176.21 3brd h ILE 355 N 4.69 0.47 0.00 -3.70 2.04 -1.23 -3.38 117.51 116.39 3brd h ILE 355 Ca -0.41 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 63.92 3brd h ILE 355 Cb 1.19 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 3brd h ILE 355 CO 0.75 0.16 0.00 0.61 0.00 0.00 0.00 178.15 179.67 3brd n GLY 356 N 1.57 -2.48 3.53 5.37 0.00 -1.01 -0.73 105.19 111.44 3brd n GLY 356 Ca -0.16 -1.37 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 3brd n GLY 356 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3brd s GLY 357 N 0.00 1.68 -0.05 -0.02 0.00 -1.26 -0.82 107.32 106.85 3brd s GLY 357 Ca 0.00 -0.87 0.02 0.00 0.00 0.00 0.00 44.72 43.86 3brd s GLY 357 CO 0.00 -0.44 -0.07 -1.36 0.00 0.00 0.00 173.10 171.22 3brd s PHE 358 N -0.34 0.97 0.09 1.90 0.40 -0.09 -4.76 117.98 116.15 3brd s PHE 358 Ca 0.05 -0.30 -0.04 0.00 -0.60 0.00 0.00 56.93 56.04 3brd s PHE 358 Cb -0.12 -0.78 -0.05 0.00 0.51 0.00 0.00 43.02 42.58 3brd s PHE 358 CO 0.02 -0.21 0.30 0.14 0.70 0.00 0.00 175.22 176.18 3brd s VAL 359 N 0.78 5.26 1.05 -0.44 -7.23 -1.26 -1.50 120.40 117.06 3brd s VAL 359 Ca -0.12 -0.07 -0.17 0.00 -1.81 0.00 0.00 61.98 59.81 3brd s VAL 359 Cb -0.15 -3.61 0.23 0.00 0.56 0.00 0.00 36.38 33.41 3brd s VAL 359 CO 0.01 0.14 1.23 -0.94 -0.31 0.00 0.00 175.10 175.23 3brd s SER 360 N -2.30 2.31 1.13 4.85 1.04 -0.26 -4.83 113.70 115.63 3brd s SER 360 Ca 0.36 0.46 -0.17 0.00 0.48 0.00 0.00 55.95 57.09 3brd s SER 360 Cb -0.13 -0.62 0.25 0.00 0.10 0.00 0.00 66.02 65.63 3brd s SER 360 CO 0.24 -3.25 1.11 -1.10 0.98 0.00 0.00 173.24 171.22 3brd s GLN 361 N -5.66 -0.62 0.38 4.02 -1.52 -1.26 -4.71 119.66 110.28 3brd s GLN 361 Ca 0.72 0.12 -0.25 0.00 -1.95 0.00 0.00 55.36 54.00 3brd s GLN 361 Cb -0.07 -1.65 -0.09 0.00 -0.22 0.00 0.00 33.01 30.98 3brd s GLN 361 CO 0.54 -3.35 1.05 0.50 -0.25 0.00 0.00 175.29 173.78 3brd s ARG 362 N -5.26 4.25 -0.09 2.91 6.06 -1.26 -4.52 118.95 121.05 3brd s ARG 362 Ca 0.69 1.55 0.03 0.00 -2.50 0.00 0.00 55.73 55.50 3brd s ARG 362 Cb -0.13 -2.65 0.01 0.00 0.06 0.00 0.00 34.95 32.24 3brd s ARG 362 CO 0.56 -0.07 -0.19 0.42 -2.50 0.00 0.00 175.30 173.52 3brd s ILE 363 N -1.58 1.66 -0.07 4.11 1.01 0.13 -4.82 121.20 121.63 3brd s ILE 363 Ca 0.55 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 60.23 3brd s ILE 363 Cb -0.23 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.73 3brd s ILE 363 CO 0.29 0.47 0.51 -0.75 0.00 0.00 0.00 174.94 175.47 3brd s LYS 364 N 0.49 4.29 -0.07 2.79 2.20 -0.01 -1.11 119.74 128.32 3brd s LYS 364 Ca -0.17 0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 55.68 3brd s LYS 364 Cb -0.17 -3.39 -0.02 0.00 -1.51 0.00 0.00 37.83 32.74 3brd s LYS 364 CO 0.07 0.26 1.00 0.08 -0.36 0.00 0.00 175.35 176.40 3brd s VAL 365 N 0.25 4.80 0.19 4.02 1.01 -0.50 -1.12 120.40 129.04 3brd s VAL 365 Ca 0.28 2.04 0.10 0.00 0.00 0.00 0.00 61.98 64.40 3brd s VAL 365 Cb -0.16 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 3brd s VAL 365 CO 0.13 0.05 -0.18 0.27 0.00 0.00 0.00 175.10 175.37 3brd s ILE 366 N 1.71 2.71 0.11 2.22 -4.36 0.35 -4.91 121.20 119.03 3brd s ILE 366 Ca 0.50 -1.89 -0.00 0.00 -0.26 0.00 0.00 60.65 58.99 3brd s ILE 366 Cb -0.19 -2.32 -0.23 0.00 1.25 0.00 0.00 42.46 40.96 3brd s ILE 366 CO 0.21 -0.13 1.24 0.77 0.24 0.00 0.00 174.94 177.27 3brd h SER 367 N 3.04 0.30 -4.28 4.36 4.64 -1.93 -0.22 113.55 119.46 3brd h SER 367 Ca -0.46 -0.30 0.24 0.00 -0.47 0.00 0.00 61.79 60.80 3brd h SER 367 Cb 1.21 -0.10 -0.18 0.00 -0.31 0.00 0.00 62.40 63.02 3brd h SER 367 CO 0.51 1.19 0.77 -0.54 -0.87 0.00 0.00 176.83 177.89 3brd s LYS 368 N -2.84 0.36 0.39 4.77 1.02 -1.26 -4.63 119.74 117.55 3brd s LYS 368 Ca -0.03 -0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.57 3brd s LYS 368 Cb 0.09 0.17 -0.11 0.00 -0.52 0.00 0.00 37.83 37.45 3brd s LYS 368 CO 0.86 -0.16 1.18 -2.30 -0.92 0.00 0.00 175.35 174.01 3brd n PRO 369 N -0.10 1.78 -2.26 -1.68 -0.02 -1.26 -4.96 135.00 126.50 3brd n PRO 369 Ca -0.01 0.63 -0.38 0.00 -2.02 0.00 0.00 63.50 61.72 3brd n PRO 369 Cb 0.59 -2.23 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 3brd n PRO 369 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3brd s SER 370 N -0.53 6.47 -0.51 2.55 0.15 -1.26 -4.99 113.70 115.57 3brd s SER 370 Ca 0.60 2.39 0.06 0.00 0.70 0.00 0.00 55.95 59.70 3brd s SER 370 Cb -0.56 -2.62 0.36 0.00 -1.71 0.00 0.00 66.02 61.50 3brd s SER 370 CO 0.59 -0.72 0.96 2.29 1.20 0.00 0.00 173.24 177.56 3brd n LYS 371 N 0.05 2.94 -2.62 5.44 2.85 -1.26 -5.01 118.16 120.55 3brd n LYS 371 Ca 0.04 -4.55 -0.31 0.00 -1.05 0.00 0.00 58.31 52.45 3brd n LYS 371 Cb 0.46 -2.14 -0.02 0.00 -0.65 0.00 0.00 35.03 32.68 3brd n LYS 371 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3brd s LYS 372 N -3.36 3.78 0.00 -1.58 2.36 -1.26 -5.26 119.74 114.42 3brd s LYS 372 Ca 0.47 0.59 0.11 0.00 -2.55 0.00 0.00 55.97 54.59 3brd s LYS 372 Cb 0.32 -2.29 0.18 0.00 -1.05 0.00 0.00 37.83 34.99 3brd s LYS 372 CO -0.14 -0.17 1.02 1.63 1.55 0.00 0.00 175.35 179.24 3brd n LYS 373 N -1.61 1.53 0.00 4.03 4.76 -1.26 -4.94 118.16 120.67 3brd n LYS 373 Ca 0.04 -1.53 0.00 0.00 -2.87 0.00 0.00 58.31 53.95 3brd n LYS 373 Cb 0.54 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 32.50 3brd n LYS 373 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 3brd n THR 379 N 0.55 0.00 -3.47 -0.18 5.66 -1.26 -4.58 114.28 111.00 3brd n THR 379 Ca 0.08 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.66 3brd n THR 379 Cb 0.33 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.01 3brd n THR 379 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 3brd s ASP 380 N 0.00 6.11 0.24 1.09 -4.77 -1.26 -4.94 116.67 113.14 3brd s ASP 380 Ca 0.00 -0.70 0.16 0.00 -3.30 0.00 0.00 52.55 48.71 3brd s ASP 380 Cb 0.00 -2.16 0.04 0.00 -1.09 0.00 0.00 42.92 39.71 3brd s ASP 380 CO 0.00 -0.39 1.30 0.00 0.70 0.00 0.00 175.17 176.78 3brd h LYS 382 N 0.00 0.00 0.00 0.00 2.10 -1.92 -0.93 116.57 115.82 3brd h LYS 382 Ca -0.04 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.39 3brd h LYS 382 Cb 1.38 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.67 3brd h LYS 382 CO 0.05 0.00 -1.83 0.66 -2.00 0.00 0.00 179.45 176.33 3brd n TYR 383 N -3.81 0.00 -0.03 0.07 4.02 -1.26 -4.84 117.16 111.31 3brd n TYR 383 Ca -0.03 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.72 3brd n TYR 383 Cb 0.08 -0.59 -0.14 0.00 -0.02 0.00 0.00 39.34 38.67 3brd n TYR 383 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3brd n LEU 384 N -2.57 1.59 -5.00 7.72 4.77 -1.09 -4.82 117.00 117.60 3brd n LEU 384 Ca -0.21 0.24 -0.21 0.00 -0.03 0.00 0.00 56.01 55.80 3brd n LEU 384 Cb 0.87 -0.35 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 3brd n LEU 384 CO 0.23 0.62 0.39 0.00 -1.33 0.00 0.00 177.39 177.30 3brd s ILE 386 N -2.80 1.98 0.24 0.00 1.01 -1.23 -4.83 121.20 115.56 3brd s ILE 386 Ca 0.61 -1.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.25 3brd s ILE 386 Cb -0.07 -2.24 -0.09 0.00 0.01 0.00 0.00 42.46 40.06 3brd s ILE 386 CO 0.40 -0.24 0.93 0.00 0.00 0.00 0.00 174.94 176.02 3brd s ALA 387 N 1.14 3.34 0.19 9.38 0.00 -1.26 -0.19 121.76 134.36 3brd s ALA 387 Ca -0.02 0.59 -0.33 0.00 0.00 0.00 0.00 51.96 52.20 3brd s ALA 387 Cb -0.19 -3.18 -0.13 0.00 0.00 0.00 0.00 23.12 19.61 3brd s ALA 387 CO -0.07 0.22 1.56 0.45 0.00 0.00 0.00 175.76 177.91 3brd n SER 388 N 1.42 3.16 0.00 0.00 2.88 0.11 -2.23 113.62 118.97 3brd n SER 388 Ca -0.02 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.62 3brd n SER 388 Cb 0.47 -1.45 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 3brd n SER 388 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3brd n GLY 389 N 3.15 0.52 4.00 0.46 0.00 0.18 -4.63 105.19 108.87 3brd n GLY 389 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 3brd n GLY 389 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3brd s THR 390 N -2.10 2.54 0.03 2.61 -4.23 -0.95 -4.78 115.64 108.76 3brd s THR 390 Ca 0.00 -0.82 -0.00 0.00 -1.18 0.00 0.00 61.69 59.69 3brd s THR 390 Cb 0.00 -2.72 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 3brd s THR 390 CO 0.00 0.00 0.16 -0.54 -0.54 0.00 0.00 174.62 173.70 3brd s LYS 391 N -4.70 3.28 0.03 3.99 1.02 -1.26 -1.43 119.74 120.66 3brd s LYS 391 Ca 0.59 -0.46 -0.02 0.00 0.02 0.00 0.00 55.97 56.11 3brd s LYS 391 Cb -0.08 -2.97 -0.02 0.00 -0.52 0.00 0.00 37.83 34.24 3brd s LYS 391 CO 0.38 0.63 0.00 0.14 -0.92 0.00 0.00 175.35 175.58 3brd s VAL 392 N -1.39 0.13 0.04 3.17 -7.23 0.09 -1.76 120.40 113.46 3brd s VAL 392 Ca 0.30 -1.07 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 3brd s VAL 392 Cb -0.13 -0.57 -0.04 0.00 0.56 0.00 0.00 36.38 36.20 3brd s VAL 392 CO 0.22 -0.59 0.06 0.00 -0.31 0.00 0.00 175.10 174.48 3brd s ALA 393 N -2.02 3.49 -0.10 1.32 0.00 -0.14 -0.93 121.76 123.38 3brd s ALA 393 Ca -0.11 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.89 3brd s ALA 393 Cb -0.06 -1.43 0.02 0.00 0.00 0.00 0.00 23.12 21.65 3brd s ALA 393 CO -0.03 0.71 -0.12 -0.51 0.00 0.00 0.00 175.76 175.81 3brd s LEU 394 N -2.03 1.55 0.13 0.00 1.43 -1.26 -2.21 118.68 116.28 3brd s LEU 394 Ca 0.25 -0.37 0.07 0.00 -1.03 0.00 0.00 54.13 53.06 3brd s LEU 394 Cb -0.12 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.09 3brd s LEU 394 CO 0.17 -0.03 -0.18 0.72 0.23 0.00 0.00 176.35 177.27 3brd s PHE 395 N 1.16 1.66 -0.12 0.29 -0.12 -0.30 -1.33 117.98 119.22 3brd s PHE 395 Ca -0.04 -0.47 -0.02 0.00 -0.05 0.00 0.00 56.93 56.35 3brd s PHE 395 Cb -0.14 -0.87 -0.03 0.00 -0.63 0.00 0.00 43.02 41.35 3brd s PHE 395 CO -0.03 0.22 -0.05 1.21 -0.05 0.00 0.00 175.22 176.52 3brd s ASN 396 N -2.27 4.73 -0.01 1.98 2.47 0.68 -0.38 114.94 122.13 3brd s ASN 396 Ca 0.09 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.29 3brd s ASN 396 Cb -0.07 -1.55 0.01 0.00 -1.45 0.00 0.00 41.25 38.18 3brd s ASN 396 CO 0.05 0.25 0.00 -0.60 -3.72 0.00 0.00 177.10 173.08 3brd s ARG 397 N -0.11 0.09 -0.17 0.43 3.52 -1.26 -0.95 118.95 120.50 3brd s ARG 397 Ca 0.02 0.05 -0.08 0.00 -0.13 0.00 0.00 55.73 55.59 3brd s ARG 397 Cb -0.13 -0.20 -0.04 0.00 -1.56 0.00 0.00 34.95 33.01 3brd s ARG 397 CO 0.03 -0.06 0.11 -0.51 -0.81 0.00 0.00 175.30 174.05 3brd s LEU 398 N 0.48 4.11 -1.50 -0.88 1.02 -1.26 -4.70 118.68 115.95 3brd s LEU 398 Ca -0.04 0.25 -0.04 0.00 0.02 0.00 0.00 54.13 54.32 3brd s LEU 398 Cb -0.06 -2.03 0.04 0.00 0.02 0.00 0.00 46.19 44.15 3brd s LEU 398 CO -0.01 0.25 0.09 0.54 0.02 0.00 0.00 176.35 177.25 3brd n ARG 399 N 3.01 -0.91 -2.56 1.70 5.12 -1.26 -1.71 116.66 120.05 3brd n ARG 399 Ca -0.17 0.09 -0.21 0.00 -1.93 0.00 0.00 57.85 55.62 3brd n ARG 399 Cb 0.53 -3.51 0.00 0.00 -1.16 0.00 0.00 32.46 28.32 3brd n ARG 399 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 3brd n SER 400 N -2.60 -6.00 -4.29 0.55 7.64 -1.26 -4.97 113.62 102.69 3brd n SER 400 Ca -0.24 -0.09 -0.37 0.00 1.01 0.00 0.00 58.87 59.18 3brd n SER 400 Cb 0.61 -4.95 -0.13 0.00 -1.01 0.00 0.00 64.21 58.73 3brd n SER 400 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3brd s GLN 401 N -5.22 2.75 0.25 1.43 -1.52 -0.69 -4.99 119.66 111.66 3brd s GLN 401 Ca 0.08 -1.09 -0.04 0.00 -1.95 0.00 0.00 55.36 52.37 3brd s GLN 401 Cb -0.04 -3.42 0.45 0.00 -0.22 0.00 0.00 33.01 29.79 3brd s GLN 401 CO 0.10 -0.60 1.76 0.00 -0.25 0.00 0.00 175.29 176.30 3brd h THR 402 N 6.09 0.75 -0.06 -0.19 1.03 -1.93 -1.55 112.91 117.04 3brd h THR 402 Ca -0.26 -0.20 0.02 0.00 -0.01 0.00 0.00 66.41 65.97 3brd h THR 402 Cb 1.09 0.12 -0.00 0.00 -1.07 0.00 0.00 68.15 68.30 3brd h THR 402 CO 0.60 0.10 0.07 1.62 -0.01 0.00 0.00 175.52 177.91 3brd h VAL 403 N 0.57 0.54 -0.00 0.00 3.04 -1.96 -2.12 116.25 116.31 3brd h VAL 403 Ca 0.42 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.11 3brd h VAL 403 Cb 0.56 0.94 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 3brd h VAL 403 CO -0.34 0.00 -0.08 -1.54 -1.01 0.00 0.00 177.57 174.60 3brd n SER 404 N -3.88 0.40 -4.68 3.17 3.41 -0.58 -4.93 113.62 106.53 3brd n SER 404 Ca -0.01 -0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 57.59 3brd n SER 404 Cb 0.17 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 3brd n SER 404 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3brd s THR 405 N -2.43 3.31 -0.01 6.66 2.01 -0.80 -4.54 115.64 119.84 3brd s THR 405 Ca 0.31 0.69 0.05 0.00 0.31 0.00 0.00 61.69 63.05 3brd s THR 405 Cb 0.20 -3.44 -0.01 0.00 0.01 0.00 0.00 72.50 69.26 3brd s THR 405 CO 0.46 -0.01 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.08 3brd s ARG 406 N 2.77 1.31 -0.15 4.92 1.81 -0.13 -4.57 118.95 124.92 3brd s ARG 406 Ca 0.71 -0.61 -0.02 0.00 -1.72 0.00 0.00 55.73 54.10 3brd s ARG 406 Cb -0.36 -1.28 -0.02 0.00 -0.45 0.00 0.00 34.95 32.84 3brd s ARG 406 CO 0.30 0.35 -0.09 0.71 -0.68 0.00 0.00 175.30 175.89 3brd s TYR 407 N -0.42 2.89 0.19 -0.53 1.51 0.13 -0.23 117.35 120.89 3brd s TYR 407 Ca 0.06 -0.56 -0.33 0.00 -1.01 0.00 0.00 57.07 55.23 3brd s TYR 407 Cb -0.06 -1.90 -0.14 0.00 -0.11 0.00 0.00 41.96 39.75 3brd s TYR 407 CO -0.00 -0.18 1.53 -0.11 -1.11 0.00 0.00 175.55 175.67 3brd n LEU 408 N 3.63 3.14 -3.67 -1.29 7.94 -0.44 -1.28 117.00 125.03 3brd n LEU 408 Ca -0.18 1.10 -0.13 0.00 -1.11 0.00 0.00 56.01 55.70 3brd n LEU 408 Cb 0.52 -1.43 -0.08 0.00 0.53 0.00 0.00 43.42 42.96 3brd n LEU 408 CO 0.31 -0.33 0.28 -2.28 -1.11 0.00 0.00 177.39 174.26 3brd s HIS 409 N 0.60 -0.71 -0.16 1.96 5.65 -0.08 -1.09 115.29 121.46 3brd s HIS 409 Ca 0.75 1.66 -0.10 0.00 0.25 0.00 0.00 55.06 57.62 3brd s HIS 409 Cb -0.66 0.28 -0.05 0.00 -1.18 0.00 0.00 32.58 30.97 3brd s HIS 409 CO 0.41 -0.35 0.18 0.14 -0.65 0.00 0.00 174.74 174.48 3brd s VAL 410 N 0.58 5.39 -0.10 0.89 -7.23 -1.26 -0.39 120.40 118.28 3brd s VAL 410 Ca -0.02 0.31 -0.05 0.00 -1.81 0.00 0.00 61.98 60.41 3brd s VAL 410 Cb -0.05 -3.50 0.04 0.00 0.56 0.00 0.00 36.38 33.44 3brd s VAL 410 CO -0.03 0.49 0.23 -0.70 -0.31 0.00 0.00 175.10 174.77 3brd s GLU 411 N -0.07 0.19 -1.20 4.82 2.12 -0.78 -4.90 118.70 118.88 3brd s GLU 411 Ca 0.13 0.49 -0.01 0.00 0.36 0.00 0.00 54.97 55.94 3brd s GLU 411 Cb -0.12 -0.12 0.00 0.00 0.26 0.00 0.00 34.13 34.15 3brd s GLU 411 CO 0.02 -0.16 0.09 0.41 -0.54 0.00 0.00 175.26 175.08 3brd n GLY 412 N 4.18 -0.21 2.27 -1.50 0.00 -1.26 -2.91 105.19 105.76 3brd n GLY 412 Ca -0.25 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 3brd n GLY 412 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3brd n ASN 413 N -0.84 -4.10 -3.97 1.61 4.13 -1.26 -5.01 115.26 105.82 3brd n ASN 413 Ca -0.15 0.22 -0.09 0.00 1.68 0.00 0.00 54.58 56.24 3brd n ASN 413 Cb 0.62 -2.51 -0.11 0.00 -1.54 0.00 0.00 39.78 36.24 3brd n ASN 413 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3brd s ALA 414 N -2.37 0.06 0.25 5.41 0.00 -1.15 -5.11 121.76 118.86 3brd s ALA 414 Ca 0.00 -0.55 -0.29 0.00 0.00 0.00 0.00 51.96 51.12 3brd s ALA 414 Cb 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 23.12 23.18 3brd s ALA 414 CO 0.00 -0.18 0.94 -0.06 0.00 0.00 0.00 175.76 176.46 3brd s PHE 415 N -1.59 3.94 0.14 0.00 0.40 -1.26 -1.86 117.98 117.74 3brd s PHE 415 Ca -0.14 1.89 -0.02 0.00 -0.60 0.00 0.00 56.93 58.06 3brd s PHE 415 Cb -0.09 -2.97 0.01 0.00 0.51 0.00 0.00 43.02 40.49 3brd s PHE 415 CO -0.01 0.42 0.21 -2.39 0.70 0.00 0.00 175.22 174.14 3brd n HIS 416 N 1.33 -0.95 -4.68 0.36 1.44 0.48 -4.39 115.22 108.81 3brd n HIS 416 Ca -0.01 -0.85 -0.25 0.00 -2.01 0.00 0.00 57.72 54.59 3brd n HIS 416 Cb 0.48 0.24 -0.17 0.00 0.12 0.00 0.00 29.99 30.66 3brd n HIS 416 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3brd s ALA 417 N -1.91 1.38 0.14 1.59 0.00 -0.82 -0.91 121.76 121.24 3brd s ALA 417 Ca 0.10 -0.50 0.08 0.00 0.00 0.00 0.00 51.96 51.64 3brd s ALA 417 Cb -0.01 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 3brd s ALA 417 CO 0.07 0.15 -0.19 0.45 0.00 0.00 0.00 175.76 176.24 3brd s SER 418 N 0.54 2.61 0.00 0.00 0.15 -0.40 -4.62 113.70 111.98 3brd s SER 418 Ca -0.14 -0.79 0.22 0.00 0.70 0.00 0.00 55.95 55.94 3brd s SER 418 Cb -0.15 -0.15 0.11 0.00 -1.71 0.00 0.00 66.02 64.12 3brd s SER 418 CO 0.04 0.00 1.15 -1.54 1.20 0.00 0.00 173.24 174.09 3brd n SER 419 N 0.61 2.54 0.00 5.45 3.41 -1.26 0.22 113.62 124.59 3brd n SER 419 Ca -0.16 -1.77 0.00 0.00 -0.26 0.00 0.00 58.87 56.68 3brd n SER 419 Cb 0.56 0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 3brd n SER 419 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3brd n THR 420 N 0.78 0.00 -4.38 6.66 -2.24 -1.26 -4.95 114.28 108.89 3brd n THR 420 Ca 0.12 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.64 3brd n THR 420 Cb 0.52 -0.87 -0.12 0.00 -2.10 0.00 0.00 70.33 67.76 3brd n THR 420 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3brd s LYS 421 N -1.98 1.39 -0.03 -0.78 1.02 -1.26 -4.95 119.74 113.15 3brd s LYS 421 Ca 0.00 -1.43 -0.03 0.00 0.02 0.00 0.00 55.97 54.53 3brd s LYS 421 Cb 0.00 -1.66 0.01 0.00 -0.52 0.00 0.00 37.83 35.66 3brd s LYS 421 CO 0.00 0.36 0.09 1.67 -0.92 0.00 0.00 175.35 176.55 3brd s TRP 422 N -1.64 -0.07 0.22 3.18 1.48 -1.26 -4.40 118.94 116.45 3brd s TRP 422 Ca 0.17 0.16 -0.19 0.00 -1.06 0.00 0.00 56.10 55.19 3brd s TRP 422 Cb -0.08 0.01 -0.08 0.00 -1.16 0.00 0.00 33.47 32.16 3brd s TRP 422 CO 0.08 -0.07 0.70 0.20 -4.06 0.00 0.00 176.95 173.80 3brd s GLY 423 N -0.15 2.57 -0.27 3.67 0.00 -0.25 -4.96 107.32 107.93 3brd s GLY 423 Ca -0.02 0.12 -0.10 0.00 0.00 0.00 0.00 44.72 44.71 3brd s GLY 423 CO 0.00 0.45 0.17 0.00 0.00 0.00 0.00 173.10 173.73 3brd s ALA 424 N -1.56 3.49 -0.10 3.20 0.00 -1.26 -4.42 121.76 121.12 3brd s ALA 424 Ca 0.43 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.32 3brd s ALA 424 Cb -0.16 -2.41 -0.02 0.00 0.00 0.00 0.00 23.12 20.53 3brd s ALA 424 CO 0.20 -0.51 -0.11 -0.06 0.00 0.00 0.00 175.76 175.28 3brd s PHE 425 N 1.67 2.82 0.01 0.00 0.40 -0.10 -2.31 117.98 120.48 3brd s PHE 425 Ca 0.07 -0.34 -0.30 0.00 -0.60 0.00 0.00 56.93 55.75 3brd s PHE 425 Cb -0.16 -1.77 -0.05 0.00 0.51 0.00 0.00 43.02 41.55 3brd s PHE 425 CO 0.09 0.02 1.30 0.99 0.70 0.00 0.00 175.22 178.33 3brd s THR 426 N -0.17 3.88 -0.27 0.64 2.01 0.34 -0.73 115.64 121.34 3brd s THR 426 Ca 0.00 1.28 -0.08 0.00 0.31 0.00 0.00 61.69 63.21 3brd s THR 426 Cb -0.13 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 3brd s THR 426 CO 0.03 0.03 0.08 -0.51 -0.69 0.00 0.00 174.62 173.57 3brd s ILE 427 N 1.92 4.28 -0.02 1.82 2.07 -0.52 -0.78 121.20 129.97 3brd s ILE 427 Ca 0.61 -0.31 0.06 0.00 -1.41 0.00 0.00 60.65 59.60 3brd s ILE 427 Cb -0.30 -3.07 -0.03 0.00 0.13 0.00 0.00 42.46 39.20 3brd s ILE 427 CO 0.26 0.25 -0.19 -1.00 -1.91 0.00 0.00 174.94 172.36 3brd s HIS 428 N 1.59 2.56 -0.40 3.50 3.76 0.06 -0.64 115.29 125.73 3brd s HIS 428 Ca 0.05 -0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 54.41 3brd s HIS 428 Cb -0.16 -1.56 0.01 0.00 1.11 0.00 0.00 32.58 31.98 3brd s HIS 428 CO 0.04 0.13 1.44 -0.51 -0.85 0.00 0.00 174.74 174.99 3brd s LEU 429 N -0.84 3.60 0.46 0.89 2.01 -1.26 -0.35 118.68 123.19 3brd s LEU 429 Ca 0.12 0.90 -0.25 0.00 0.01 0.00 0.00 54.13 54.90 3brd s LEU 429 Cb -0.10 -3.54 -0.08 0.00 0.01 0.00 0.00 46.19 42.48 3brd s LEU 429 CO 0.01 -1.43 1.42 0.12 1.01 0.00 0.00 176.35 177.48 3brd s PHE 430 N 5.48 2.44 0.00 0.29 5.36 -0.94 -1.33 117.98 129.28 3brd s PHE 430 Ca 0.63 1.27 0.00 0.00 -0.96 0.00 0.00 56.93 57.87 3brd s PHE 430 Cb -0.15 -3.91 0.00 0.00 -0.34 0.00 0.00 43.02 38.62 3brd s PHE 430 CO 0.32 -2.94 0.00 -3.47 -1.46 0.00 0.00 175.22 167.67 3brd n ASP 431 N -0.26 0.00 0.00 6.13 2.03 0.36 -4.75 116.55 120.06 3brd n ASP 431 Ca 0.05 0.29 0.00 0.00 0.52 0.00 0.00 54.79 55.65 3brd n ASP 431 Cb 0.42 -0.45 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 3brd n ASP 431 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3brd n ASP 432 N -2.04 0.00 -0.43 1.67 8.00 -1.26 -5.08 116.55 117.40 3brd n ASP 432 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3brd n ASP 432 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 3brd n ASP 432 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3brd n GLN 437 N -0.45 0.00 -3.86 -1.24 6.02 -1.26 -5.07 117.38 111.52 3brd n GLN 437 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.76 3brd n GLN 437 Cb 0.00 -0.14 -0.04 0.00 1.02 0.00 0.00 30.24 31.07 3brd n GLN 437 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3brd n GLU 438 N 0.36 1.06 -3.57 -1.09 2.13 -1.26 -5.16 120.64 113.12 3brd n GLU 438 Ca 0.00 -2.70 -0.11 0.00 0.66 0.00 0.00 57.16 55.01 3brd n GLU 438 Cb 0.00 0.66 -0.04 0.00 0.27 0.00 0.00 31.44 32.33 3brd n GLU 438 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 3brd s THR 439 N -2.30 0.05 0.10 6.31 -4.23 -1.26 -5.05 115.64 109.26 3brd s THR 439 Ca 0.03 -0.41 -0.06 0.00 -1.18 0.00 0.00 61.69 60.08 3brd s THR 439 Cb -0.00 -1.13 -0.22 0.00 1.34 0.00 0.00 72.50 72.48 3brd s THR 439 CO 0.02 -0.21 1.23 0.44 -0.54 0.00 0.00 174.62 175.56 3brd h ASP 440 N 2.25 0.57 -3.61 3.99 5.19 -2.04 -3.43 116.42 119.34 3brd h ASP 440 Ca -0.34 -0.50 -0.62 0.00 -0.62 0.00 0.00 57.03 54.95 3brd h ASP 440 Cb 1.27 -0.18 -0.15 0.00 0.18 0.00 0.00 39.33 40.46 3brd h ASP 440 CO 0.44 1.33 -0.50 0.54 -3.12 0.00 0.00 179.24 177.93 3brd s ASN 441 N -7.16 6.12 0.02 6.45 2.20 -1.26 -5.10 114.94 116.22 3brd s ASN 441 Ca -0.06 0.11 0.00 0.00 -0.94 0.00 0.00 52.86 51.98 3brd s ASN 441 Cb 0.08 -2.11 -0.02 0.00 -2.00 0.00 0.00 41.25 37.20 3brd s ASN 441 CO 0.88 0.05 -0.03 0.72 -2.94 0.00 0.00 177.10 175.78 3brd s PHE 442 N 1.12 0.29 0.21 1.54 -0.71 -1.26 -5.16 117.98 114.01 3brd s PHE 442 Ca 0.08 -0.52 -0.13 0.00 -1.04 0.00 0.00 56.93 55.31 3brd s PHE 442 Cb -0.14 -0.21 -0.07 0.00 -1.21 0.00 0.00 43.02 41.39 3brd s PHE 442 CO 0.05 -0.18 0.59 0.00 -1.34 0.00 0.00 175.22 174.34 3brd s ALA 443 N -1.44 3.52 0.23 1.99 0.00 -1.26 -5.01 121.76 119.79 3brd s ALA 443 Ca -0.15 -0.14 0.05 0.00 0.00 0.00 0.00 51.96 51.71 3brd s ALA 443 Cb -0.10 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 3brd s ALA 443 CO -0.01 0.45 -0.04 0.14 0.00 0.00 0.00 175.76 176.30 3brd s VAL 444 N -1.68 1.26 0.07 0.00 -7.23 -1.26 -0.49 120.40 111.07 3brd s VAL 444 Ca 0.44 -2.07 0.07 0.00 -1.81 0.00 0.00 61.98 58.61 3brd s VAL 444 Cb -0.13 -2.27 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 3brd s VAL 444 CO 0.20 -0.41 -0.18 -0.13 -0.31 0.00 0.00 175.10 174.27 3brd s ARG 445 N -3.79 1.06 0.58 4.82 0.52 -0.44 -4.82 118.95 116.87 3brd s ARG 445 Ca 0.26 -0.98 -0.09 0.00 -0.52 0.00 0.00 55.73 54.40 3brd s ARG 445 Cb 0.04 -1.19 -0.04 0.00 0.52 0.00 0.00 34.95 34.29 3brd s ARG 445 CO 0.08 0.28 0.95 -0.51 0.02 0.00 0.00 175.30 176.12 3brd s ASP 446 N -1.55 6.19 0.00 0.23 -0.00 -1.26 -4.14 116.67 116.14 3brd s ASP 446 Ca 0.04 1.23 0.00 0.00 -0.00 0.00 0.00 52.55 53.81 3brd s ASP 446 Cb -0.09 -2.36 0.00 0.00 -0.00 0.00 0.00 42.92 40.47 3brd s ASP 446 CO 0.03 -0.80 0.00 0.61 -0.00 0.00 0.00 175.17 175.01 3brd n GLY 447 N -2.59 3.01 3.80 0.21 0.00 -1.26 -4.93 105.19 103.42 3brd n GLY 447 Ca 0.04 -1.87 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 3brd n GLY 447 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3brd s PHE 448 N -2.00 3.63 -0.15 1.61 0.40 -1.26 0.09 117.98 120.29 3brd s PHE 448 Ca 0.00 1.63 -0.26 0.00 -0.60 0.00 0.00 56.93 57.69 3brd s PHE 448 Cb 0.00 -2.81 -0.01 0.00 0.51 0.00 0.00 43.02 40.70 3brd s PHE 448 CO 0.00 0.21 0.88 0.08 0.70 0.00 0.00 175.22 177.09 3brd s VAL 449 N -1.66 4.85 0.26 -0.44 1.01 0.73 -4.86 120.40 120.29 3brd s VAL 449 Ca 0.49 1.75 0.07 0.00 0.00 0.00 0.00 61.98 64.30 3brd s VAL 449 Cb -0.17 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 3brd s VAL 449 CO 0.22 0.02 0.17 -0.31 0.00 0.00 0.00 175.10 175.20 3brd s TYR 450 N 2.09 3.04 0.34 5.22 1.51 -1.26 -1.13 117.35 127.16 3brd s TYR 450 Ca 0.41 -0.14 -0.29 0.00 -1.01 0.00 0.00 57.07 56.05 3brd s TYR 450 Cb -0.17 -1.39 -0.11 0.00 -0.11 0.00 0.00 41.96 40.18 3brd s TYR 450 CO 0.14 0.52 1.42 0.71 -1.11 0.00 0.00 175.55 177.23 3brd s TYR 451 N -2.17 2.81 0.00 2.71 1.51 -0.92 -1.92 117.35 119.38 3brd s TYR 451 Ca 0.33 1.22 0.00 0.00 -1.01 0.00 0.00 57.07 57.61 3brd s TYR 451 Cb -0.07 -3.88 0.00 0.00 -0.11 0.00 0.00 41.96 37.90 3brd s TYR 451 CO 0.24 -2.58 0.00 0.41 -1.11 0.00 0.00 175.55 172.51 3brd n GLY 452 N 0.89 0.80 3.75 0.71 0.00 0.31 -4.06 105.19 107.58 3brd n GLY 452 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3brd n GLY 452 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3brd s SER 453 N -2.98 7.54 -0.08 1.61 0.01 -0.81 -4.80 113.70 114.19 3brd s SER 453 Ca 0.00 1.83 -0.28 0.00 1.31 0.00 0.00 55.95 58.81 3brd s SER 453 Cb 0.00 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.63 3brd s SER 453 CO 0.00 0.08 0.93 -0.69 0.41 0.00 0.00 173.24 173.97 3brd s VAL 454 N -0.72 4.86 0.00 3.43 1.01 -1.26 -1.59 120.40 126.13 3brd s VAL 454 Ca 0.42 1.90 0.02 0.00 0.00 0.00 0.00 61.98 64.32 3brd s VAL 454 Cb -0.24 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 31.88 3brd s VAL 454 CO 0.30 0.08 -0.07 0.54 0.00 0.00 0.00 175.10 175.95 3brd s VAL 455 N 1.61 0.56 -0.21 2.92 0.11 -0.15 -2.21 120.40 123.02 3brd s VAL 455 Ca 0.46 -0.41 -0.04 0.00 -2.93 0.00 0.00 61.98 59.06 3brd s VAL 455 Cb -0.19 -0.49 -0.02 0.00 -1.53 0.00 0.00 36.38 34.16 3brd s VAL 455 CO 0.20 0.08 -0.02 -0.54 -3.33 0.00 0.00 175.10 171.49 3brd s LYS 456 N -0.37 3.51 -0.25 1.54 -0.14 0.52 -2.02 119.74 122.54 3brd s LYS 456 Ca 0.01 -0.57 -0.11 0.00 -1.36 0.00 0.00 55.97 53.94 3brd s LYS 456 Cb -0.04 -3.04 -0.05 0.00 -1.68 0.00 0.00 37.83 33.02 3brd s LYS 456 CO -0.00 -0.08 0.17 -0.51 -0.76 0.00 0.00 175.35 174.17 3brd s LEU 457 N 1.21 4.09 -0.12 3.17 1.43 -1.26 -0.76 118.68 126.45 3brd s LEU 457 Ca 0.03 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 3brd s LEU 457 Cb -0.14 -2.12 0.02 0.00 0.03 0.00 0.00 46.19 43.98 3brd s LEU 457 CO 0.00 0.03 -0.14 -0.69 0.23 0.00 0.00 176.35 175.79 3brd s VAL 458 N 1.23 1.43 0.10 -1.59 1.01 0.04 -2.04 120.40 120.58 3brd s VAL 458 Ca 0.08 -0.58 -0.31 0.00 0.00 0.00 0.00 61.98 61.17 3brd s VAL 458 Cb -0.14 -1.34 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 3brd s VAL 458 CO 0.06 0.43 1.77 -0.62 0.00 0.00 0.00 175.10 176.74 3brd s ASP 459 N 1.22 6.49 0.50 3.32 3.68 0.51 -0.51 116.67 131.88 3brd s ASP 459 Ca -0.02 2.65 0.26 0.00 2.13 0.00 0.00 52.55 57.57 3brd s ASP 459 Cb -0.14 -2.56 1.29 0.00 -1.45 0.00 0.00 42.92 40.06 3brd s ASP 459 CO -0.05 -0.96 2.00 0.77 0.13 0.00 0.00 175.17 177.05 3brd h SER 460 N 8.61 0.00 0.00 -0.34 4.64 -1.79 0.35 113.55 125.02 3brd h SER 460 Ca -0.45 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.69 3brd h SER 460 Cb 1.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 3brd h SER 460 CO 0.94 0.15 -1.01 0.58 -0.87 0.00 0.00 176.83 176.62 3brd h VAL 461 N 0.00 1.01 -0.01 0.95 2.07 -1.89 -3.40 116.25 114.99 3brd h VAL 461 Ca -0.00 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.37 3brd h VAL 461 Cb 0.46 2.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 3brd h VAL 461 CO 0.02 0.34 -0.59 0.35 0.02 0.00 0.00 177.57 177.71 3brd n THR 462 N -4.47 0.00 -1.10 2.57 -2.24 -1.24 -4.98 114.28 102.82 3brd n THR 462 Ca -0.27 -0.11 -0.06 0.00 -2.27 0.00 0.00 64.05 61.34 3brd n THR 462 Cb 0.63 0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 69.67 3brd n THR 462 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3brd n GLY 463 N 1.44 0.54 3.78 3.38 0.00 0.11 -4.99 105.19 109.45 3brd n GLY 463 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 3brd n GLY 463 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3brd s ILE 464 N -1.41 3.93 0.27 -0.61 -1.09 -1.26 -4.72 121.20 116.31 3brd s ILE 464 Ca 0.00 1.63 0.12 0.00 -2.23 0.00 0.00 60.65 60.17 3brd s ILE 464 Cb 0.00 -3.92 -0.05 0.00 -1.58 0.00 0.00 42.46 36.91 3brd s ILE 464 CO 0.00 0.16 -0.17 0.00 -1.23 0.00 0.00 174.94 173.69 3brd s ALA 465 N -1.53 2.79 0.56 9.38 0.00 -1.26 -0.37 121.76 131.32 3brd s ALA 465 Ca 0.51 -1.81 -0.07 0.00 0.00 0.00 0.00 51.96 50.59 3brd s ALA 465 Cb -0.22 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 3brd s ALA 465 CO 0.28 0.30 0.89 -0.51 0.00 0.00 0.00 175.76 176.72 3brd s LEU 466 N -3.42 3.38 1.14 0.00 1.43 -0.87 -5.02 118.68 115.33 3brd s LEU 466 Ca 0.29 0.97 -0.13 0.00 -1.03 0.00 0.00 54.13 54.24 3brd s LEU 466 Cb -0.06 -3.90 0.27 0.00 0.03 0.00 0.00 46.19 42.54 3brd s LEU 466 CO 0.15 -0.83 1.04 -2.16 0.23 0.00 0.00 176.35 174.78 3brd s PRO 467 N -4.94 -0.74 0.25 1.29 0.04 -1.26 -4.60 135.00 125.04 3brd s PRO 467 Ca 0.51 0.75 -0.31 0.00 0.04 0.00 0.00 61.00 62.00 3brd s PRO 467 Cb -0.11 -1.58 -0.13 0.00 0.04 0.00 0.00 34.50 32.72 3brd s PRO 467 CO 0.47 -3.58 1.44 0.54 0.04 0.00 0.00 177.00 175.91 3brd n ARG 468 N -4.80 2.16 -4.33 4.56 1.74 -1.26 -4.75 116.66 109.97 3brd n ARG 468 Ca 0.03 0.77 -0.18 0.00 -0.77 0.00 0.00 57.85 57.70 3brd n ARG 468 Cb 0.55 -2.45 -0.14 0.00 -1.02 0.00 0.00 32.46 29.40 3brd n ARG 468 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3brd s LEU 469 N -0.05 2.07 -0.25 0.55 1.43 -0.85 -3.81 118.68 117.76 3brd s LEU 469 Ca 0.67 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 53.40 3brd s LEU 469 Cb -0.62 -0.46 -0.05 0.00 0.03 0.00 0.00 46.19 45.09 3brd s LEU 469 CO 0.50 0.06 0.20 -0.60 0.23 0.00 0.00 176.35 176.74 3brd s ARG 470 N -0.53 4.03 0.12 1.70 3.52 0.11 -0.98 118.95 126.92 3brd s ARG 470 Ca 0.02 -0.24 -0.30 0.00 -0.13 0.00 0.00 55.73 55.08 3brd s ARG 470 Cb -0.05 -3.59 -0.06 0.00 -1.56 0.00 0.00 34.95 29.69 3brd s ARG 470 CO 0.00 -0.04 1.08 -1.50 -0.81 0.00 0.00 175.30 174.02 3brd s ILE 471 N 1.36 4.16 0.03 4.11 2.07 -0.62 -0.97 121.20 131.35 3brd s ILE 471 Ca 0.09 1.74 0.04 0.00 -1.41 0.00 0.00 60.65 61.10 3brd s ILE 471 Cb -0.15 -4.11 -0.02 0.00 0.13 0.00 0.00 42.46 38.32 3brd s ILE 471 CO 0.07 0.24 -0.12 -0.13 -1.91 0.00 0.00 174.94 173.09 3brd s ARG 472 N 0.18 0.82 0.25 3.50 1.81 -0.13 0.11 118.95 125.49 3brd s ARG 472 Ca 0.51 -0.62 -0.30 0.00 -1.72 0.00 0.00 55.73 53.60 3brd s ARG 472 Cb -0.27 -0.79 -0.09 0.00 -0.45 0.00 0.00 34.95 33.35 3brd s ARG 472 CO 0.32 0.20 0.95 0.21 -0.68 0.00 0.00 175.30 176.30 3brd s LYS 473 N -0.91 4.82 0.07 3.54 2.47 -1.26 -0.79 119.74 127.68 3brd s LYS 473 Ca 0.01 1.50 0.10 0.00 -1.56 0.00 0.00 55.97 56.01 3brd s LYS 473 Cb -0.07 -3.24 -0.03 0.00 -1.46 0.00 0.00 37.83 33.03 3brd s LYS 473 CO 0.01 0.48 -0.26 0.14 0.16 0.00 0.00 175.35 175.88 3brd s VAL 474 N -1.21 2.12 -0.14 4.02 -7.23 -1.10 -1.17 120.40 115.68 3brd s VAL 474 Ca 0.42 -1.47 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 3brd s VAL 474 Cb -0.26 -1.84 0.04 0.00 0.56 0.00 0.00 36.38 34.88 3brd s VAL 474 CO 0.32 0.28 -0.05 -0.62 -0.31 0.00 0.00 175.10 174.72 3brd s ASP 475 N -1.45 2.52 -1.25 4.85 -1.08 -0.20 -4.74 116.67 115.32 3brd s ASP 475 Ca 0.12 -0.51 -0.07 0.00 -0.52 0.00 0.00 52.55 51.57 3brd s ASP 475 Cb -0.10 -0.82 -0.01 0.00 -1.46 0.00 0.00 42.92 40.53 3brd s ASP 475 CO 0.03 -0.17 0.69 0.29 0.52 0.00 0.00 175.17 176.52 3brd n LYS 476 N 4.93 -3.19 -1.07 4.34 5.02 -1.26 -0.92 118.16 126.01 3brd n LYS 476 Ca -0.11 0.54 -0.03 0.00 -2.02 0.00 0.00 58.31 56.69 3brd n LYS 476 Cb 0.49 -4.76 -0.01 0.00 -0.02 0.00 0.00 35.03 30.72 3brd n LYS 476 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3brd n GLN 477 N -4.19 -0.84 -5.23 1.97 3.00 -1.26 -5.03 117.38 105.80 3brd n GLN 477 Ca -0.22 0.39 -0.31 0.00 -0.01 0.00 0.00 57.00 56.85 3brd n GLN 477 Cb 0.65 -4.13 -0.16 0.00 0.00 0.00 0.00 30.24 26.60 3brd n GLN 477 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 3brd s GLN 478 N -1.41 2.23 -0.23 -1.09 -0.21 -0.10 -1.47 119.66 117.38 3brd s GLN 478 Ca 0.00 -0.88 -0.20 0.00 0.02 0.00 0.00 55.36 54.29 3brd s GLN 478 Cb 0.00 -2.02 -0.02 0.00 1.00 0.00 0.00 33.01 31.97 3brd s GLN 478 CO 0.00 0.46 0.62 0.08 -2.12 0.00 0.00 175.29 174.33 3brd s VAL 479 N -0.37 5.00 -0.36 1.09 1.01 -0.72 -1.03 120.40 125.01 3brd s VAL 479 Ca 0.03 1.14 -0.17 0.00 0.00 0.00 0.00 61.98 62.98 3brd s VAL 479 Cb -0.11 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.33 3brd s VAL 479 CO 0.01 0.06 0.45 0.27 0.00 0.00 0.00 175.10 175.89 3brd s ILE 480 N 2.26 5.08 -2.62 2.22 -4.36 -0.32 -2.46 121.20 121.00 3brd s ILE 480 Ca 0.27 0.09 0.22 0.00 -0.26 0.00 0.00 60.65 60.96 3brd s ILE 480 Cb -0.16 -3.94 0.15 0.00 1.25 0.00 0.00 42.46 39.77 3brd s ILE 480 CO 0.09 -0.23 1.17 0.18 0.24 0.00 0.00 174.94 176.39 3brd n LEU 481 N 5.60 2.70 -4.51 0.37 4.77 0.23 -4.26 117.00 121.91 3brd n LEU 481 Ca -0.07 -0.97 -0.49 0.00 -0.03 0.00 0.00 56.01 54.46 3brd n LEU 481 Cb 0.49 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 3brd n LEU 481 CO 0.44 0.46 0.43 0.47 -1.33 0.00 0.00 177.39 177.86 3brd n ASP 482 N 1.07 0.32 -2.07 -1.43 9.92 -1.22 -4.81 116.55 118.32 3brd n ASP 482 Ca 0.12 1.15 -0.02 0.00 -0.53 0.00 0.00 54.79 55.51 3brd n ASP 482 Cb 0.53 -1.11 -0.03 0.00 -0.64 0.00 0.00 41.12 39.87 3brd n ASP 482 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3brd n ALA 483 N 0.70 2.66 0.00 2.24 0.00 -1.26 -2.53 120.51 122.32 3brd n ALA 483 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3brd n ALA 483 Cb 0.24 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.74 3brd n ALA 483 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3brd n SER 484 N 2.32 0.00 0.24 0.00 3.41 -1.26 -4.85 113.62 113.48 3brd n SER 484 Ca 0.08 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.80 3brd n SER 484 Cb 0.25 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.74 3brd n SER 484 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3brd h SER 486 N 0.00 0.00 0.71 0.00 0.02 -1.72 -0.37 113.55 112.19 3brd h SER 486 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 3brd h SER 486 Cb 0.66 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.19 3brd h SER 486 CO 0.02 0.02 -0.12 -0.33 -1.14 0.00 0.00 176.83 175.29 3brd h GLU 487 N 0.00 0.00 -5.55 3.45 5.08 -1.68 -3.42 114.58 112.46 3brd h GLU 487 Ca -0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 3brd h GLU 487 Cb 0.10 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.25 3brd h GLU 487 CO 0.00 0.12 -0.14 -2.00 -1.00 0.00 0.00 179.01 175.99 3brd s GLU 488 N -3.85 4.23 0.37 2.33 2.12 -0.15 -5.03 118.70 118.72 3brd s GLU 488 Ca -0.01 0.33 -0.25 0.00 0.36 0.00 0.00 54.97 55.40 3brd s GLU 488 Cb 0.11 -3.51 -0.09 0.00 0.26 0.00 0.00 34.13 30.90 3brd s GLU 488 CO 0.58 0.01 1.01 -1.25 -0.54 0.00 0.00 175.26 175.06 3brd s PRO 489 N 1.14 4.34 0.26 4.30 0.05 -1.26 -2.16 135.00 141.67 3brd s PRO 489 Ca 0.22 1.43 -0.30 0.00 0.05 0.00 0.00 61.00 62.41 3brd s PRO 489 Cb -0.15 -2.64 -0.10 0.00 0.05 0.00 0.00 34.50 31.67 3brd s PRO 489 CO 0.09 0.03 1.36 0.08 0.05 0.00 0.00 177.00 178.61 3brd s VAL 490 N -1.66 2.85 0.32 -0.36 1.01 -0.28 -4.86 120.40 117.42 3brd s VAL 490 Ca 0.55 0.75 0.03 0.00 0.00 0.00 0.00 61.98 63.31 3brd s VAL 490 Cb -0.20 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 3brd s VAL 490 CO 0.26 0.14 0.07 -0.55 0.00 0.00 0.00 175.10 175.01 3brd s SER 491 N 0.07 2.21 0.23 3.32 0.15 -1.26 -3.57 113.70 114.85 3brd s SER 491 Ca 0.55 -1.40 -0.31 0.00 0.70 0.00 0.00 55.95 55.49 3brd s SER 491 Cb -0.39 0.00 -0.10 0.00 -1.71 0.00 0.00 66.02 63.81 3brd s SER 491 CO 0.45 -0.65 1.54 -1.10 1.20 0.00 0.00 173.24 174.67 3brd s GLN 492 N -3.90 4.21 -1.26 5.44 -1.52 -1.10 -2.73 119.66 118.79 3brd s GLN 492 Ca 0.36 2.41 0.00 0.00 -1.95 0.00 0.00 55.36 56.18 3brd s GLN 492 Cb 0.08 -3.10 0.00 0.00 -0.22 0.00 0.00 33.01 29.77 3brd s GLN 492 CO 0.15 -0.55 0.00 1.28 -0.25 0.00 0.00 175.29 175.92 3brd n LEU 493 N 2.93 -1.38 -4.84 2.90 4.77 0.73 -4.51 117.00 117.60 3brd n LEU 493 Ca 0.10 0.12 -0.33 0.00 -0.03 0.00 0.00 56.01 55.86 3brd n LEU 493 Cb 0.39 -2.06 -0.06 0.00 -2.33 0.00 0.00 43.42 39.35 3brd n LEU 493 CO 0.62 -0.35 0.43 -1.00 -1.33 0.00 0.00 177.39 175.76 3brd s HIS 494 N -2.61 3.42 -0.03 -1.77 3.76 -1.11 -4.83 115.29 112.13 3brd s HIS 494 Ca 0.00 1.27 -0.18 0.00 -0.15 0.00 0.00 55.06 56.00 3brd s HIS 494 Cb 0.00 -2.57 -0.05 0.00 1.11 0.00 0.00 32.58 31.07 3brd s HIS 494 CO 0.00 0.13 0.49 0.21 -0.85 0.00 0.00 174.74 174.72 3brd s LYS 495 N -2.82 4.18 0.27 1.40 2.20 -1.26 -1.85 119.74 121.86 3brd s LYS 495 Ca 0.53 0.53 -0.04 0.00 -0.36 0.00 0.00 55.97 56.64 3brd s LYS 495 Cb -0.11 -3.32 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 3brd s LYS 495 CO 0.18 0.44 0.33 0.00 -0.36 0.00 0.00 175.35 175.94 3brd s ALA 497 N -3.75 1.33 -0.22 0.00 0.00 0.03 -0.47 121.76 118.68 3brd s ALA 497 Ca 0.33 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 50.81 3brd s ALA 497 Cb 0.02 0.16 0.05 0.00 0.00 0.00 0.00 23.12 23.35 3brd s ALA 497 CO 0.15 -0.17 -0.07 -0.06 0.00 0.00 0.00 175.76 175.62 3brd s PHE 498 N -3.45 2.38 -0.01 0.00 0.40 -1.26 -0.96 117.98 115.08 3brd s PHE 498 Ca 0.17 -1.67 -0.11 0.00 -0.60 0.00 0.00 56.93 54.71 3brd s PHE 498 Cb 0.04 -1.59 -0.05 0.00 0.51 0.00 0.00 43.02 41.93 3brd s PHE 498 CO -0.00 -0.76 0.33 1.14 0.70 0.00 0.00 175.22 176.64 3brd s GLN 499 N 1.40 3.75 0.30 0.44 -2.07 -0.14 -1.56 119.66 121.77 3brd s GLN 499 Ca -0.04 0.20 -0.30 0.00 -1.82 0.00 0.00 55.36 53.40 3brd s GLN 499 Cb -0.18 -3.16 -0.11 0.00 -1.09 0.00 0.00 33.01 28.48 3brd s GLN 499 CO -0.07 0.68 1.50 -1.64 -1.32 0.00 0.00 175.29 174.44 3brd s MET 500 N -1.30 4.19 0.34 9.60 -1.94 -0.65 0.07 119.30 129.60 3brd s MET 500 Ca 0.24 2.45 0.09 0.00 -1.71 0.00 0.00 55.69 56.77 3brd s MET 500 Cb -0.15 -3.05 0.60 0.00 2.01 0.00 0.00 34.83 34.24 3brd s MET 500 CO 0.13 -0.51 1.78 0.82 -0.01 0.00 0.00 175.02 177.23 3brd h ILE 501 N 3.34 1.28 -0.09 2.53 1.08 -1.92 -3.22 117.51 120.51 3brd h ILE 501 Ca -0.47 -1.32 -0.07 0.00 -0.39 0.00 0.00 64.86 62.60 3brd h ILE 501 Cb 1.22 1.61 0.00 0.00 -3.07 0.00 0.00 36.82 36.58 3brd h ILE 501 CO 0.75 0.39 -0.23 -2.24 -0.69 0.00 0.00 178.15 176.13 3brd h ASP 502 N 0.14 0.36 -3.44 1.72 2.03 -1.92 -3.43 116.42 111.87 3brd h ASP 502 Ca 0.02 -0.59 -0.59 0.00 -0.73 0.00 0.00 57.03 55.14 3brd h ASP 502 Cb 0.69 -0.10 -0.38 0.00 -0.83 0.00 0.00 39.33 38.71 3brd h ASP 502 CO 0.05 0.88 -0.80 0.21 -1.03 0.00 0.00 179.24 178.56 3brd s ASN 503 N -6.25 3.29 0.60 4.15 3.04 -1.22 -5.01 114.94 113.55 3brd s ASN 503 Ca -0.14 -0.88 0.38 0.00 0.04 0.00 0.00 52.86 52.25 3brd s ASN 503 Cb 0.04 -1.08 1.80 0.00 -1.54 0.00 0.00 41.25 40.48 3brd s ASN 503 CO 0.76 -0.19 2.15 -0.33 -3.04 0.00 0.00 177.10 176.45 3brd h GLU 504 N 8.03 0.00 -0.01 0.43 5.08 -1.84 -2.28 114.58 123.98 3brd h GLU 504 Ca -0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3brd h GLU 504 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 3brd h GLU 504 CO 0.43 0.01 -0.04 1.28 -1.00 0.00 0.00 179.01 179.69 3brd n LEU 505 N -3.13 1.44 -4.62 1.33 4.77 -1.26 -4.88 117.00 110.65 3brd n LEU 505 Ca -0.01 -0.47 -0.34 0.00 -0.03 0.00 0.00 56.01 55.16 3brd n LEU 505 Cb 0.21 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.17 3brd n LEU 505 CO 0.25 0.24 -0.30 -0.69 -1.33 0.00 0.00 177.39 175.56 3brd s VAL 506 N -2.08 4.33 0.10 4.08 1.01 -0.86 0.13 120.40 127.11 3brd s VAL 506 Ca 0.36 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.17 3brd s VAL 506 Cb 0.21 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 3brd s VAL 506 CO 0.36 0.54 -0.13 -0.31 0.00 0.00 0.00 175.10 175.56 3brd s TYR 507 N -0.22 1.25 0.10 5.22 1.51 -0.29 -1.63 117.35 123.28 3brd s TYR 507 Ca 0.06 -0.56 -0.31 0.00 -1.01 0.00 0.00 57.07 55.25 3brd s TYR 507 Cb -0.12 -0.67 -0.07 0.00 -0.11 0.00 0.00 41.96 40.99 3brd s TYR 507 CO 0.02 0.08 1.23 -1.17 -1.11 0.00 0.00 175.55 174.60 3brd s LEU 508 N -2.24 4.39 -0.02 -1.29 2.96 -0.60 -1.44 118.68 120.42 3brd s LEU 508 Ca 0.05 2.12 -0.13 0.00 -0.22 0.00 0.00 54.13 55.95 3brd s LEU 508 Cb -0.06 -3.59 0.02 0.00 0.50 0.00 0.00 46.19 43.07 3brd s LEU 508 CO 0.02 -0.48 0.27 0.00 -1.32 0.00 0.00 176.35 174.84 3brd s LEU 510 N -1.14 3.27 -0.20 0.00 2.96 -0.16 -0.21 118.68 123.19 3brd s LEU 510 Ca -0.12 -0.18 -0.01 0.00 -0.22 0.00 0.00 54.13 53.60 3brd s LEU 510 Cb -0.05 -1.82 0.06 0.00 0.50 0.00 0.00 46.19 44.87 3brd s LEU 510 CO 0.03 0.09 -0.02 -0.55 -1.32 0.00 0.00 176.35 174.58 3brd s SER 511 N 0.86 3.29 -1.33 3.68 0.15 -0.03 -4.73 113.70 115.59 3brd s SER 511 Ca 0.01 -0.94 -0.11 0.00 0.70 0.00 0.00 55.95 55.61 3brd s SER 511 Cb -0.14 -0.91 0.01 0.00 -1.71 0.00 0.00 66.02 63.26 3brd s SER 511 CO 0.02 -0.25 0.49 1.41 1.20 0.00 0.00 173.24 176.11 3brd n HIS 512 N 4.85 -1.60 -0.95 3.44 8.25 -1.26 -0.91 115.22 127.03 3brd n HIS 512 Ca -0.11 0.53 0.00 0.00 -0.26 0.00 0.00 57.72 57.89 3brd n HIS 512 Cb 0.46 -3.35 0.00 0.00 1.12 0.00 0.00 29.99 28.22 3brd n HIS 512 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3brd n ASP 513 N -2.75 -4.06 -4.66 0.41 10.43 -1.26 -4.99 116.55 109.66 3brd n ASP 513 Ca -0.23 0.00 -0.35 0.00 2.57 0.00 0.00 54.79 56.79 3brd n ASP 513 Cb 0.64 -2.24 -0.09 0.00 1.84 0.00 0.00 41.12 41.27 3brd n ASP 513 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 3brd s LYS 514 N -1.15 3.69 -0.18 -1.24 2.20 -0.09 -1.94 119.74 121.02 3brd s LYS 514 Ca 0.00 -0.35 -0.20 0.00 -0.36 0.00 0.00 55.97 55.07 3brd s LYS 514 Cb 0.00 -3.10 -0.03 0.00 -1.51 0.00 0.00 37.83 33.19 3brd s LYS 514 CO 0.00 0.42 0.57 0.42 -0.36 0.00 0.00 175.35 176.40 3brd s ILE 515 N -0.06 5.07 0.20 5.43 -1.09 -1.26 -0.85 121.20 128.63 3brd s ILE 515 Ca 0.06 1.08 0.02 0.00 -2.23 0.00 0.00 60.65 59.59 3brd s ILE 515 Cb -0.12 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.81 3brd s ILE 515 CO 0.01 0.17 0.00 0.27 -1.23 0.00 0.00 174.94 174.16 3brd s ILE 516 N 1.59 0.81 -0.24 2.92 -4.36 0.70 -4.98 121.20 117.65 3brd s ILE 516 Ca 0.27 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.45 3brd s ILE 516 Cb -0.16 -2.21 -0.02 0.00 1.25 0.00 0.00 42.46 41.32 3brd s ILE 516 CO 0.11 -0.41 0.66 -1.10 0.24 0.00 0.00 174.94 174.44 3brd s GLN 517 N -3.90 4.14 -0.08 0.37 -0.21 -1.26 -0.97 119.66 117.75 3brd s GLN 517 Ca 0.26 0.63 0.04 0.00 0.02 0.00 0.00 55.36 56.31 3brd s GLN 517 Cb 0.06 -3.63 0.00 0.00 1.00 0.00 0.00 33.01 30.44 3brd s GLN 517 CO 0.06 -0.40 -0.20 -1.58 -2.12 0.00 0.00 175.29 171.05 3brd s HIS 518 N 2.45 2.18 -0.11 0.91 5.65 -0.52 -4.94 115.29 120.91 3brd s HIS 518 Ca 0.28 -0.85 -0.25 0.00 0.25 0.00 0.00 55.06 54.49 3brd s HIS 518 Cb -0.16 -1.49 -0.03 0.00 -1.18 0.00 0.00 32.58 29.73 3brd s HIS 518 CO 0.09 -0.36 0.79 -1.14 -0.65 0.00 0.00 174.74 173.47 3brd s GLN 519 N 0.40 4.38 0.87 2.88 0.74 -1.26 -1.14 119.66 126.54 3brd s GLN 519 Ca -0.16 1.00 -0.12 0.00 0.05 0.00 0.00 55.36 56.12 3brd s GLN 519 Cb -0.17 -3.51 0.12 0.00 1.10 0.00 0.00 33.01 30.55 3brd s GLN 519 CO 0.07 -0.13 1.15 0.00 -0.55 0.00 0.00 175.29 175.82 3brd s ALA 520 N 1.46 2.05 -0.20 1.58 0.00 0.36 -4.98 121.76 122.02 3brd s ALA 520 Ca 0.39 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 51.79 3brd s ALA 520 Cb -0.18 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 3brd s ALA 520 CO 0.17 -2.08 -0.06 0.99 0.00 0.00 0.00 175.76 174.78 3brd s THR 521 N -3.35 3.32 -0.01 0.00 2.01 0.03 -4.93 115.64 112.70 3brd s THR 521 Ca 0.63 -0.52 -0.32 0.00 0.31 0.00 0.00 61.69 61.79 3brd s THR 521 Cb -0.14 -2.49 -0.11 0.00 0.01 0.00 0.00 72.50 69.77 3brd s THR 521 CO 0.52 0.44 1.90 0.00 -0.69 0.00 0.00 174.62 176.79 3brd n ALA 522 N 4.54 1.26 -0.17 7.40 0.00 -1.26 -0.24 120.51 132.04 3brd n ALA 522 Ca -0.18 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3brd n ALA 522 Cb 0.51 -2.56 0.00 0.00 0.00 0.00 0.00 19.45 17.40 3brd n ALA 522 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3brd n ILE 523 N 5.16 0.00 -2.90 0.00 2.08 -0.98 -4.85 119.36 117.87 3brd n ILE 523 Ca 0.21 0.60 0.00 0.00 0.56 0.00 0.00 62.75 64.12 3brd n ILE 523 Cb 0.34 -1.46 0.00 0.00 -0.75 0.00 0.00 39.64 37.77 3brd n ILE 523 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 3brd n ASN 524 N -1.75 0.00 0.19 4.38 0.23 -1.01 -5.02 115.26 112.28 3brd n ASN 524 Ca 0.00 -0.06 0.05 0.00 -0.53 0.00 0.00 54.58 54.05 3brd n ASN 524 Cb 0.00 0.00 0.33 0.00 -2.08 0.00 0.00 39.78 38.03 3brd n ASN 524 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3brd h GLU 525 N 0.00 0.00 -0.01 -3.83 3.07 -2.02 -3.15 114.58 108.63 3brd h GLU 525 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3brd h GLU 525 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3brd h GLU 525 CO 0.00 0.38 -0.32 0.72 -1.40 0.00 0.00 179.01 178.40 3brd n HIS 526 N -3.58 0.00 -3.68 4.33 8.25 -1.26 -4.84 115.22 114.44 3brd n HIS 526 Ca -0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 3brd n HIS 526 Cb 0.50 -0.07 -0.08 0.00 1.12 0.00 0.00 29.99 31.46 3brd n HIS 526 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3brd s ARG 527 N -2.47 0.68 0.02 -0.41 0.52 -1.19 -0.60 118.95 115.50 3brd s ARG 527 Ca 0.23 0.56 0.06 0.00 -0.52 0.00 0.00 55.73 56.06 3brd s ARG 527 Cb 0.19 0.33 -0.02 0.00 0.52 0.00 0.00 34.95 35.96 3brd s ARG 527 CO 0.53 -0.12 -0.18 -1.01 0.02 0.00 0.00 175.30 174.54 3brd s HIS 528 N -0.11 1.62 -0.23 -0.53 3.76 -1.03 -2.33 115.29 116.45 3brd s HIS 528 Ca -0.03 -0.34 -0.17 0.00 -0.15 0.00 0.00 55.06 54.37 3brd s HIS 528 Cb -0.03 -1.00 -0.03 0.00 1.11 0.00 0.00 32.58 32.62 3brd s HIS 528 CO 0.02 0.03 0.47 -1.14 -0.85 0.00 0.00 174.74 173.28 3brd s GLN 529 N -0.84 4.11 0.00 1.40 2.00 0.66 -1.76 119.66 125.23 3brd s GLN 529 Ca 0.06 0.28 0.00 0.00 -2.00 0.00 0.00 55.36 53.70 3brd s GLN 529 Cb -0.08 -3.61 0.00 0.00 0.80 0.00 0.00 33.01 30.13 3brd s GLN 529 CO 0.01 -0.22 0.00 0.44 -0.50 0.00 0.00 175.29 175.01 3brd n ILE 530 N 4.83 0.00 -4.23 -2.34 -5.35 -0.54 -0.79 119.36 110.93 3brd n ILE 530 Ca -0.06 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.28 3brd n ILE 530 Cb 0.50 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.31 3brd n ILE 530 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3brd s ASN 531 N 1.00 0.65 0.00 7.28 2.20 -1.26 -4.86 114.94 119.95 3brd s ASN 531 Ca 0.00 -1.49 0.03 0.00 -0.94 0.00 0.00 52.86 50.46 3brd s ASN 531 Cb 0.00 0.41 0.13 0.00 -2.00 0.00 0.00 41.25 39.79 3brd s ASN 531 CO 0.00 -0.89 0.89 -0.90 -2.94 0.00 0.00 177.10 173.26 3brd n ASP 532 N -0.63 0.00 0.19 3.54 5.68 -1.26 -1.72 116.55 122.35 3brd n ASP 532 Ca 0.03 0.25 0.09 0.00 -0.50 0.00 0.00 54.79 54.66 3brd n ASP 532 Cb 0.65 -0.29 0.12 0.00 -1.14 0.00 0.00 41.12 40.46 3brd n ASP 532 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3brd h GLY 533 N 0.43 0.00 -2.21 6.12 0.00 -1.95 -3.22 103.07 102.24 3brd h GLY 533 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3brd h GLY 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 3brd n ALA 534 N -2.15 2.42 -3.11 3.60 0.00 -0.70 -0.99 120.51 119.59 3brd n ALA 534 Ca 0.03 -1.02 -0.35 0.00 0.00 0.00 0.00 53.44 52.10 3brd n ALA 534 Cb 0.60 -0.94 -0.13 0.00 0.00 0.00 0.00 19.45 18.99 3brd n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3brd s ALA 535 N -1.34 3.02 -0.01 0.00 0.00 -1.22 -4.43 121.76 117.79 3brd s ALA 535 Ca 0.41 -0.99 0.07 0.00 0.00 0.00 0.00 51.96 51.45 3brd s ALA 535 Cb 0.22 -1.75 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 3brd s ALA 535 CO 0.30 -0.14 -0.22 -1.58 0.00 0.00 0.00 175.76 174.13 3brd s TRP 536 N 0.98 1.95 0.00 0.00 0.52 0.38 -4.61 118.94 118.16 3brd s TRP 536 Ca 0.01 -0.37 -0.18 0.00 0.02 0.00 0.00 56.10 55.59 3brd s TRP 536 Cb -0.14 -1.25 -0.06 0.00 -1.15 0.00 0.00 33.47 30.87 3brd s TRP 536 CO 0.02 -0.02 0.50 0.99 0.02 0.00 0.00 176.95 178.46 3brd s THR 537 N -0.54 4.94 -0.04 2.01 2.01 0.48 0.51 115.64 125.01 3brd s THR 537 Ca 0.08 1.05 0.04 0.00 0.31 0.00 0.00 61.69 63.17 3brd s THR 537 Cb -0.08 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.57 3brd s THR 537 CO -0.01 0.50 -0.14 -0.51 -0.69 0.00 0.00 174.62 173.77 3brd s ILE 538 N -0.65 3.06 -0.11 1.82 2.07 -0.77 -1.15 121.20 125.47 3brd s ILE 538 Ca 0.27 -0.77 -0.15 0.00 -1.41 0.00 0.00 60.65 58.59 3brd s ILE 538 Cb -0.18 -2.21 0.04 0.00 0.13 0.00 0.00 42.46 40.24 3brd s ILE 538 CO 0.15 0.56 0.39 -0.51 -1.91 0.00 0.00 174.94 173.62 3brd s ILE 539 N -0.76 0.02 0.30 2.00 2.07 -0.94 -0.19 121.20 123.69 3brd s ILE 539 Ca 0.12 -0.13 -0.29 0.00 -1.41 0.00 0.00 60.65 58.94 3brd s ILE 539 Cb -0.11 -0.60 -0.10 0.00 0.13 0.00 0.00 42.46 41.79 3brd s ILE 539 CO 0.01 -0.07 1.18 -0.44 -1.91 0.00 0.00 174.94 173.71 3brd s SER 540 N -0.29 7.09 0.28 4.50 0.01 -1.26 -0.96 113.70 123.06 3brd s SER 540 Ca -0.04 2.42 0.10 0.00 1.31 0.00 0.00 55.95 59.74 3brd s SER 540 Cb -0.03 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 3brd s SER 540 CO 0.02 -0.29 -0.16 0.42 0.41 0.00 0.00 173.24 173.64 3brd s THR 541 N -1.13 2.23 0.36 1.44 -4.23 -0.72 -1.01 115.64 112.58 3brd s THR 541 Ca 0.46 -2.32 0.05 0.00 -1.18 0.00 0.00 61.69 58.71 3brd s THR 541 Cb -0.35 -2.32 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 3brd s THR 541 CO 0.45 -0.40 0.21 -0.62 -0.54 0.00 0.00 174.62 173.72 3brd s ASP 542 N -3.48 2.10 -0.18 3.99 -1.08 0.18 -4.62 116.67 113.58 3brd s ASP 542 Ca 0.29 -1.71 -0.11 0.00 -0.52 0.00 0.00 52.55 50.50 3brd s ASP 542 Cb -0.02 0.54 0.06 0.00 -1.46 0.00 0.00 42.92 42.04 3brd s ASP 542 CO 0.13 -1.00 0.45 -0.75 0.52 0.00 0.00 175.17 174.52 3brd s LYS 543 N -3.59 0.44 -0.17 4.34 2.20 -1.26 -2.43 119.74 119.27 3brd s LYS 543 Ca 0.33 0.82 -0.00 0.00 -0.36 0.00 0.00 55.97 56.76 3brd s LYS 543 Cb 0.03 0.02 -0.00 0.00 -1.51 0.00 0.00 37.83 36.36 3brd s LYS 543 CO 0.21 -0.15 -0.14 0.00 -0.36 0.00 0.00 175.35 174.92 3brd s ALA 544 N 1.32 2.54 -0.04 3.13 0.00 0.24 -4.77 121.76 124.18 3brd s ALA 544 Ca -0.09 -1.08 0.05 0.00 0.00 0.00 0.00 51.96 50.85 3brd s ALA 544 Cb -0.08 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.73 3brd s ALA 544 CO -0.12 -0.12 -0.21 -2.00 0.00 0.00 0.00 175.76 173.31 3brd s GLU 545 N 0.96 1.99 0.00 0.00 2.12 -1.26 0.04 118.70 122.54 3brd s GLU 545 Ca -0.02 -0.74 0.04 0.00 0.36 0.00 0.00 54.97 54.61 3brd s GLU 545 Cb -0.15 -1.76 -0.01 0.00 0.26 0.00 0.00 34.13 32.47 3brd s GLU 545 CO -0.02 0.34 -0.11 0.71 -0.54 0.00 0.00 175.26 175.64 3brd s TYR 546 N -0.17 1.00 -0.02 5.30 1.51 0.00 -5.00 117.35 119.98 3brd s TYR 546 Ca -0.00 -0.22 0.04 0.00 -1.01 0.00 0.00 57.07 55.88 3brd s TYR 546 Cb -0.11 -0.64 -0.01 0.00 -0.11 0.00 0.00 41.96 41.10 3brd s TYR 546 CO 0.02 -0.01 -0.13 1.03 -1.11 0.00 0.00 175.55 175.34 3brd s ARG 547 N -0.42 1.22 0.08 -0.62 0.52 -1.26 -0.95 118.95 117.52 3brd s ARG 547 Ca 0.03 -0.48 -0.15 0.00 -0.52 0.00 0.00 55.73 54.62 3brd s ARG 547 Cb -0.05 -1.14 0.02 0.00 0.52 0.00 0.00 34.95 34.31 3brd s ARG 547 CO -0.00 0.25 0.34 -0.59 0.02 0.00 0.00 175.30 175.31 3brd s PHE 548 N -0.14 -0.13 -0.06 -0.53 -0.12 -0.12 -4.25 117.98 112.63 3brd s PHE 548 Ca 0.02 -0.09 -0.03 0.00 -0.05 0.00 0.00 56.93 56.78 3brd s PHE 548 Cb -0.07 0.15 0.04 0.00 -0.63 0.00 0.00 43.02 42.50 3brd s PHE 548 CO 0.00 -0.59 0.14 0.12 -0.05 0.00 0.00 175.22 174.84 3brd s PHE 549 N -3.15 -0.15 -1.18 3.49 5.36 -0.55 0.32 117.98 122.10 3brd s PHE 549 Ca -0.01 0.47 -0.17 0.00 -0.96 0.00 0.00 56.93 56.26 3brd s PHE 549 Cb 0.01 -0.11 0.11 0.00 -0.34 0.00 0.00 43.02 42.69 3brd s PHE 549 CO -0.07 -0.17 1.51 -1.21 -1.46 0.00 0.00 175.22 173.82 3brd s GLU 550 N 1.27 3.93 0.47 10.12 2.02 -1.26 -1.05 118.70 134.21 3brd s GLU 550 Ca -0.08 -2.08 0.17 0.00 0.02 0.00 0.00 54.97 53.00 3brd s GLU 550 Cb -0.12 -5.26 1.14 0.00 0.10 0.00 0.00 34.13 29.99 3brd s GLU 550 CO -0.06 -2.01 2.04 0.00 0.02 0.00 0.00 175.26 175.25 3brd h ALA 551 N 7.86 1.68 -0.58 5.21 0.00 -1.77 -2.42 119.26 129.23 3brd h ALA 551 Ca 0.33 -0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.81 3brd h ALA 551 Cb 0.91 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.50 3brd h ALA 551 CO 1.33 0.17 0.17 -1.33 0.00 0.00 0.00 179.25 179.60 3brd n MET 552 N -4.24 1.98 0.00 0.00 2.81 -1.25 -5.03 117.12 111.38 3brd n MET 552 Ca -0.02 -3.14 0.00 0.00 -1.81 0.00 0.00 57.70 52.72 3brd n MET 552 Cb 0.21 -1.95 0.00 0.00 -0.71 0.00 0.00 33.22 30.78 3brd n MET 552 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3brd n GLY 553 N -1.13 0.78 3.64 3.03 0.00 -0.91 -4.91 105.19 105.69 3brd n GLY 553 Ca 0.43 -1.88 -0.46 0.00 0.00 0.00 0.00 46.02 44.11 3brd n GLY 553 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3brd n GLN 554 N 1.09 1.79 -4.05 1.61 7.27 -1.26 -4.81 117.38 119.03 3brd n GLN 554 Ca 0.00 0.64 -0.25 0.00 0.07 0.00 0.00 57.00 57.46 3brd n GLN 554 Cb 0.00 -2.26 -0.04 0.00 2.41 0.00 0.00 30.24 30.35 3brd n GLN 554 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 3brd s VAL 555 N -0.05 4.74 0.12 1.69 -7.23 -1.26 -5.04 120.40 113.38 3brd s VAL 555 Ca 0.70 -1.04 0.08 0.00 -1.81 0.00 0.00 61.98 59.91 3brd s VAL 555 Cb -0.71 -3.47 -0.19 0.00 0.56 0.00 0.00 36.38 32.58 3brd s VAL 555 CO 0.50 -0.17 1.31 0.00 -0.31 0.00 0.00 175.10 176.43 3brd h ALA 556 N 2.07 0.41 -2.52 1.32 0.00 -1.96 -3.46 119.26 115.12 3brd h ALA 556 Ca -0.48 -0.87 -0.53 0.00 0.00 0.00 0.00 54.91 53.02 3brd h ALA 556 Cb 1.21 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3brd h ALA 556 CO 0.64 1.19 -0.43 -0.80 0.00 0.00 0.00 179.25 179.85 3brd s ASN 557 N -6.71 6.35 0.29 0.00 0.01 -1.26 -5.01 114.94 108.60 3brd s ASN 557 Ca 0.01 0.22 -0.28 0.00 -0.71 0.00 0.00 52.86 52.10 3brd s ASN 557 Cb 0.10 -1.93 -0.14 0.00 0.41 0.00 0.00 41.25 39.69 3brd s ASN 557 CO 0.81 0.02 0.98 -2.65 -1.51 0.00 0.00 177.10 174.75 3brd n PRO 558 N -0.64 1.27 0.30 -0.60 -0.02 -1.26 -4.88 135.00 129.17 3brd n PRO 558 Ca -0.07 0.44 0.18 0.00 -2.02 0.00 0.00 63.50 62.04 3brd n PRO 558 Cb 0.54 -1.79 0.95 0.00 -0.02 0.00 0.00 33.50 33.18 3brd n PRO 558 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 3brd h ILE 559 N 1.91 0.24 -2.67 4.25 5.03 -1.19 -3.44 117.51 121.64 3brd h ILE 559 Ca -0.39 -0.23 -0.47 0.00 -0.12 0.00 0.00 64.86 63.65 3brd h ILE 559 Cb 1.35 1.18 0.01 0.00 -3.03 0.00 0.00 36.82 36.32 3brd h ILE 559 CO 0.60 0.03 -0.23 -0.94 -0.68 0.00 0.00 178.15 176.93 3brd s SER 560 N -5.68 6.27 0.07 1.72 1.04 -1.25 -4.24 113.70 111.64 3brd s SER 560 Ca -0.03 0.36 -0.31 0.00 0.48 0.00 0.00 55.95 56.45 3brd s SER 560 Cb 0.13 -1.96 -0.08 0.00 0.10 0.00 0.00 66.02 64.21 3brd s SER 560 CO 0.50 -0.28 1.61 -2.16 0.98 0.00 0.00 173.24 173.89 3brd s PRO 561 N -4.27 4.21 -0.22 4.02 0.04 -1.26 -4.93 135.00 132.59 3brd s PRO 561 Ca 0.39 2.29 -0.29 0.00 0.04 0.00 0.00 61.00 63.43 3brd s PRO 561 Cb -0.09 -3.54 -0.00 0.00 0.04 0.00 0.00 34.50 30.90 3brd s PRO 561 CO 0.35 -0.70 1.17 0.00 0.04 0.00 0.00 177.00 177.86 3brd s PRO 563 N 3.50 3.21 -0.08 0.00 0.04 -1.26 -4.84 135.00 135.57 3brd s PRO 563 Ca 0.50 1.88 0.04 0.00 0.04 0.00 0.00 61.00 63.46 3brd s PRO 563 Cb -0.18 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.26 3brd s PRO 563 CO 0.13 -1.03 -0.19 0.08 0.04 0.00 0.00 177.00 176.02 3brd s VAL 564 N -1.53 1.68 -0.30 -0.36 1.01 0.14 -4.99 120.40 116.03 3brd s VAL 564 Ca 0.73 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.81 3brd s VAL 564 Cb -0.32 -1.46 -0.00 0.00 0.00 0.00 0.00 36.38 34.60 3brd s VAL 564 CO 0.36 0.48 0.12 -0.69 0.00 0.00 0.00 175.10 175.37 3brd s VAL 565 N 0.33 4.35 -0.03 2.92 1.01 -1.26 -0.61 120.40 127.10 3brd s VAL 565 Ca -0.13 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3brd s VAL 565 Cb -0.16 -3.23 -0.27 0.00 0.00 0.00 0.00 36.38 32.72 3brd s VAL 565 CO 0.06 0.07 0.71 1.23 0.00 0.00 0.00 175.10 177.17 3brd h GLY 566 N 8.31 0.28 -3.04 4.51 0.00 -0.21 -3.48 103.07 109.44 3brd h GLY 566 Ca -0.32 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.29 3brd h GLY 566 CO 0.61 0.63 0.25 -1.35 0.00 0.00 0.00 176.54 176.69 3brd s SER 567 N -6.94 -0.53 -0.14 0.19 1.04 -0.75 -5.00 113.70 101.57 3brd s SER 567 Ca -0.12 -0.01 -0.02 0.00 0.48 0.00 0.00 55.95 56.29 3brd s SER 567 Cb 0.07 0.57 -0.02 0.00 0.10 0.00 0.00 66.02 66.73 3brd s SER 567 CO 0.83 -0.92 -0.08 -0.76 0.98 0.00 0.00 173.24 173.29 3brd s LEU 568 N -2.71 3.01 -0.29 2.42 1.43 -1.26 -0.27 118.68 121.00 3brd s LEU 568 Ca 0.02 -0.21 -0.01 0.00 -1.03 0.00 0.00 54.13 52.90 3brd s LEU 568 Cb -0.01 -1.70 0.05 0.00 0.03 0.00 0.00 46.19 44.56 3brd s LEU 568 CO -0.12 0.18 -0.02 -0.70 0.23 0.00 0.00 176.35 175.92 3brd s GLU 569 N 0.27 2.40 0.02 1.70 2.12 0.34 -4.97 118.70 120.59 3brd s GLU 569 Ca -0.06 -1.27 -0.01 0.00 0.36 0.00 0.00 54.97 53.99 3brd s GLU 569 Cb -0.15 -3.12 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3brd s GLU 569 CO 0.04 -0.60 0.17 0.14 -0.54 0.00 0.00 175.26 174.47 3brd s VAL 570 N 1.23 5.28 0.03 3.70 -7.23 -1.26 -0.60 120.40 121.54 3brd s VAL 570 Ca -0.06 -0.32 -0.00 0.00 -1.81 0.00 0.00 61.98 59.79 3brd s VAL 570 Cb -0.20 -3.51 -0.03 0.00 0.56 0.00 0.00 36.38 33.21 3brd s VAL 570 CO -0.02 0.24 -0.03 -0.62 -0.31 0.00 0.00 175.10 174.36 3brd s ASP 571 N -2.17 0.35 0.13 4.85 2.15 -0.63 -5.00 116.67 116.34 3brd s ASP 571 Ca 0.30 -0.63 0.00 0.00 0.43 0.00 0.00 52.55 52.65 3brd s ASP 571 Cb -0.13 0.12 0.00 0.00 -0.30 0.00 0.00 42.92 42.61 3brd s ASP 571 CO 0.22 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.46 3brd n GLY 572 N 1.20 -2.17 3.22 2.66 0.00 -1.26 -1.53 105.19 107.30 3brd n GLY 572 Ca -0.21 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.24 3brd n GLY 572 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3brd s HIS 573 N -2.40 1.31 0.00 1.61 3.76 -1.26 -4.50 115.29 113.81 3brd s HIS 573 Ca 0.00 -0.55 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 3brd s HIS 573 Cb 0.00 -0.70 0.00 0.00 1.11 0.00 0.00 32.58 32.99 3brd s HIS 573 CO 0.00 0.10 0.00 0.41 -0.85 0.00 0.00 174.74 174.40 3brd n GLY 574 N 0.73 0.98 0.02 -2.22 0.00 -1.26 -2.89 105.19 100.55 3brd n GLY 574 Ca -0.17 -0.69 0.15 0.00 0.00 0.00 0.00 46.02 45.31 3brd n GLY 574 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3brd n GLU 575 N 12.45 0.75 0.13 1.61 4.71 -1.26 -2.87 120.64 136.16 3brd n GLU 575 Ca 0.00 -0.04 0.09 0.00 -0.01 0.00 0.00 57.16 57.20 3brd n GLU 575 Cb 0.00 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 28.97 3brd n GLU 575 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3brd h ALA 576 N 3.74 0.68 -2.67 0.62 0.00 -1.90 -3.48 119.26 116.24 3brd h ALA 576 Ca 0.00 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.21 3brd h ALA 576 Cb 0.16 0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.03 3brd h ALA 576 CO 0.00 0.20 0.80 -1.54 0.00 0.00 0.00 179.25 178.71 3brd s SER 577 N -5.77 6.65 0.19 0.00 1.04 -1.14 -4.77 113.70 109.90 3brd s SER 577 Ca 0.02 2.60 0.00 0.00 0.48 0.00 0.00 55.95 59.05 3brd s SER 577 Cb 0.08 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 3brd s SER 577 CO 0.76 -0.74 0.07 -0.13 0.98 0.00 0.00 173.24 174.17 3brd s ARG 578 N 0.39 1.15 -0.02 4.02 1.81 -0.58 -2.38 118.95 123.34 3brd s ARG 578 Ca 0.64 -1.59 0.01 0.00 -1.72 0.00 0.00 55.73 53.07 3brd s ARG 578 Cb -0.42 0.00 0.02 0.00 -0.45 0.00 0.00 34.95 34.10 3brd s ARG 578 CO 0.37 -0.27 -0.03 0.54 -0.68 0.00 0.00 175.30 175.24 3brd s VAL 579 N -3.91 0.32 -0.24 3.52 0.11 -0.03 -1.61 120.40 118.56 3brd s VAL 579 Ca 0.31 -0.05 -0.11 0.00 -2.93 0.00 0.00 61.98 59.20 3brd s VAL 579 Cb 0.07 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.52 3brd s VAL 579 CO 0.08 0.15 0.16 -0.70 -3.33 0.00 0.00 175.10 171.46 3brd s GLU 580 N 0.64 4.06 -0.13 1.54 2.12 0.23 -1.78 118.70 125.37 3brd s GLU 580 Ca -0.07 -0.28 -0.18 0.00 0.36 0.00 0.00 54.97 54.80 3brd s GLU 580 Cb -0.10 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 3brd s GLU 580 CO -0.01 0.04 0.47 -0.51 -0.54 0.00 0.00 175.26 174.72 3brd s LEU 581 N 1.12 4.25 -0.11 2.70 1.43 0.66 -0.50 118.68 128.22 3brd s LEU 581 Ca 0.07 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 53.92 3brd s LEU 581 Cb -0.14 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.37 3brd s LEU 581 CO 0.05 -0.03 0.00 -1.00 0.23 0.00 0.00 176.35 175.61 3brd s HIS 582 N 0.79 3.15 -0.34 0.29 3.76 0.62 -2.40 115.29 121.17 3brd s HIS 582 Ca 0.25 0.07 0.00 0.00 -0.15 0.00 0.00 55.06 55.24 3brd s HIS 582 Cb -0.15 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.67 3brd s HIS 582 CO 0.10 0.32 0.00 0.41 -0.85 0.00 0.00 174.74 174.72 3brd n GLY 583 N 2.63 -0.89 3.28 -2.22 0.00 -1.00 0.58 105.19 107.58 3brd n GLY 583 Ca -0.18 -0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 3brd n GLY 583 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3brd s ARG 584 N -0.46 0.65 -0.91 1.61 3.52 0.22 -4.30 118.95 119.29 3brd s ARG 584 Ca 0.00 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 3brd s ARG 584 Cb 0.00 0.30 0.00 0.00 -1.56 0.00 0.00 34.95 33.69 3brd s ARG 584 CO 0.00 -0.16 0.00 -0.25 -0.81 0.00 0.00 175.30 174.08 3brd n ASP 585 N 1.71 -3.54 -4.78 -2.12 8.00 -0.64 -0.69 116.55 114.49 3brd n ASP 585 Ca -0.19 0.03 -0.34 0.00 0.71 0.00 0.00 54.79 55.01 3brd n ASP 585 Cb 0.56 -2.65 0.02 0.00 -0.02 0.00 0.00 41.12 39.03 3brd n ASP 585 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3brd s PHE 586 N -2.49 2.72 0.06 1.24 2.99 -0.17 -4.21 117.98 118.13 3brd s PHE 586 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 56.93 58.47 3brd s PHE 586 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 43.02 39.81 3brd s PHE 586 CO 0.00 -1.50 -0.04 0.15 -0.00 0.00 0.00 175.22 173.82 3brd s LYS 587 N -3.81 0.64 0.00 0.44 -0.14 -1.26 -4.42 119.74 111.20 3brd s LYS 587 Ca 0.68 -1.17 0.10 0.00 -1.36 0.00 0.00 55.97 54.23 3brd s LYS 587 Cb -0.20 0.05 0.63 0.00 -1.68 0.00 0.00 37.83 36.62 3brd s LYS 587 CO 0.35 -0.07 1.11 -2.30 -0.76 0.00 0.00 175.35 173.69 3brd n PRO 588 N 0.29 0.60 -0.36 -1.68 -0.02 -1.26 -3.13 135.00 129.44 3brd n PRO 588 Ca -0.15 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.42 3brd n PRO 588 Cb 0.60 -1.27 0.26 0.00 -0.02 0.00 0.00 33.50 33.07 3brd n PRO 588 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3brd n ASN 589 N -0.77 3.34 -4.70 2.55 0.23 -1.26 -4.94 115.26 109.71 3brd n ASN 589 Ca 0.08 -2.12 -0.31 0.00 -0.53 0.00 0.00 54.58 51.70 3brd n ASN 589 Cb 0.04 -0.43 -0.08 0.00 -2.08 0.00 0.00 39.78 37.23 3brd n ASN 589 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3brd s LEU 590 N -1.19 3.54 -0.03 -4.53 1.43 -1.18 -1.93 118.68 114.78 3brd s LEU 590 Ca 0.39 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 3brd s LEU 590 Cb 0.22 -2.20 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3brd s LEU 590 CO 0.24 0.20 -0.08 -0.75 0.23 0.00 0.00 176.35 176.19 3brd s LYS 591 N -2.14 0.90 0.15 1.70 2.20 0.79 -4.89 119.74 118.46 3brd s LYS 591 Ca 0.25 -0.27 -0.29 0.00 -0.36 0.00 0.00 55.97 55.30 3brd s LYS 591 Cb -0.12 -0.85 -0.07 0.00 -1.51 0.00 0.00 37.83 35.28 3brd s LYS 591 CO 0.17 0.09 0.92 0.14 -0.36 0.00 0.00 175.35 176.31 3brd s VAL 592 N 0.26 4.36 -0.16 4.02 -7.23 -1.26 -1.04 120.40 119.36 3brd s VAL 592 Ca -0.04 2.01 -0.01 0.00 -1.81 0.00 0.00 61.98 62.13 3brd s VAL 592 Cb -0.09 -4.29 -0.01 0.00 0.56 0.00 0.00 36.38 32.55 3brd s VAL 592 CO 0.00 0.40 -0.10 0.26 -0.31 0.00 0.00 175.10 175.35 3brd s TRP 593 N -0.49 2.86 -0.51 2.82 0.52 -0.05 -1.71 118.94 122.38 3brd s TRP 593 Ca 0.43 -0.74 -0.21 0.00 0.02 0.00 0.00 56.10 55.60 3brd s TRP 593 Cb -0.24 -1.92 0.05 0.00 -1.15 0.00 0.00 33.47 30.21 3brd s TRP 593 CO 0.30 -0.31 0.71 -0.06 0.02 0.00 0.00 176.95 177.60 3brd s PHE 594 N 0.69 2.99 0.00 -1.98 0.40 -0.76 -1.49 117.98 117.82 3brd s PHE 594 Ca -0.05 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 55.96 3brd s PHE 594 Cb -0.15 -3.64 0.00 0.00 0.51 0.00 0.00 43.02 39.74 3brd s PHE 594 CO 0.02 -1.09 0.00 0.41 0.70 0.00 0.00 175.22 175.26 3brd n GLY 595 N 5.13 3.91 1.91 4.36 0.00 -0.50 -1.65 105.19 118.36 3brd n GLY 595 Ca -0.04 0.16 0.04 0.00 0.00 0.00 0.00 46.02 46.19 3brd n GLY 595 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3brd n ALA 596 N 12.26 4.02 -3.66 4.61 0.00 -1.26 -4.85 120.51 131.63 3brd n ALA 596 Ca 0.00 -1.97 -0.35 0.00 0.00 0.00 0.00 53.44 51.12 3brd n ALA 596 Cb 0.00 -1.15 -0.13 0.00 0.00 0.00 0.00 19.45 18.17 3brd n ALA 596 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3brd s THR 597 N -2.79 3.09 0.46 0.00 2.01 -0.66 -4.64 115.64 113.11 3brd s THR 597 Ca 0.54 -1.56 -0.22 0.00 0.31 0.00 0.00 61.69 60.76 3brd s THR 597 Cb 0.42 -2.88 -0.08 0.00 0.01 0.00 0.00 72.50 69.97 3brd s THR 597 CO 0.15 -0.27 1.10 -2.16 -0.69 0.00 0.00 174.62 172.75 3brd s PRO 598 N 1.22 3.84 -0.02 4.92 0.04 -1.26 -1.83 135.00 141.91 3brd s PRO 598 Ca -0.01 1.58 0.01 0.00 0.04 0.00 0.00 61.00 62.62 3brd s PRO 598 Cb -0.20 -2.33 0.02 0.00 0.04 0.00 0.00 34.50 32.02 3brd s PRO 598 CO -0.02 -0.44 -0.02 0.08 0.04 0.00 0.00 177.00 176.64 3brd s VAL 599 N -1.70 0.29 -0.04 -0.36 1.01 -0.70 -4.94 120.40 113.96 3brd s VAL 599 Ca 0.64 -0.04 -0.39 0.00 0.00 0.00 0.00 61.98 62.19 3brd s VAL 599 Cb -0.23 -0.32 -0.18 0.00 0.00 0.00 0.00 36.38 35.65 3brd s VAL 599 CO 0.28 0.14 1.36 -1.84 0.00 0.00 0.00 175.10 175.04 3brd n GLU 600 N 3.71 0.77 -4.47 2.72 0.00 -1.26 -4.16 120.64 117.94 3brd n GLU 600 Ca -0.22 0.28 -0.27 0.00 0.00 0.00 0.00 57.16 56.95 3brd n GLU 600 Cb 0.53 -1.88 -0.17 0.00 0.00 0.00 0.00 31.44 29.93 3brd n GLU 600 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 3brd s THR 601 N 1.05 1.39 -0.25 3.84 2.01 -1.26 -4.38 115.64 118.03 3brd s THR 601 Ca 0.90 -0.58 -0.18 0.00 0.31 0.00 0.00 61.69 62.13 3brd s THR 601 Cb -1.10 -1.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.12 3brd s THR 601 CO 0.55 0.42 0.54 -0.89 -0.69 0.00 0.00 174.62 174.55 3brd s THR 602 N 0.94 5.06 -0.38 -0.82 2.01 0.14 -4.94 115.64 117.65 3brd s THR 602 Ca -0.08 0.94 -0.27 0.00 0.31 0.00 0.00 61.69 62.59 3brd s THR 602 Cb -0.15 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.53 3brd s THR 602 CO -0.00 0.09 1.01 0.12 -0.69 0.00 0.00 174.62 175.14 3brd s PHE 603 N 2.24 3.04 -0.23 4.92 5.36 -1.26 -0.75 117.98 131.30 3brd s PHE 603 Ca 0.23 0.86 -0.10 0.00 -0.96 0.00 0.00 56.93 56.96 3brd s PHE 603 Cb -0.16 -3.83 -0.17 0.00 -0.34 0.00 0.00 43.02 38.52 3brd s PHE 603 CO 0.09 -0.91 -0.07 0.54 -1.46 0.00 0.00 175.22 173.41 3brd n ARG 604 N 7.02 0.63 -2.90 10.12 1.74 -0.63 -5.01 116.66 127.64 3brd n ARG 604 Ca 0.09 0.29 -0.06 0.00 -0.77 0.00 0.00 57.85 57.41 3brd n ARG 604 Cb 0.48 -1.59 0.02 0.00 -1.02 0.00 0.00 32.46 30.35 3brd n ARG 604 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3brd n SER 605 N -3.86 -1.52 0.00 0.55 3.41 -1.01 -4.97 113.62 106.22 3brd n SER 605 Ca -0.44 -2.03 0.11 0.00 -0.26 0.00 0.00 58.87 56.25 3brd n SER 605 Cb 0.91 2.53 0.60 0.00 -0.26 0.00 0.00 64.21 67.99 3brd n SER 605 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3brd n GLU 606 N -0.37 0.39 -0.01 4.33 1.02 -1.26 -2.83 120.64 121.90 3brd n GLU 606 Ca -0.06 0.06 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 3brd n GLU 606 Cb 0.40 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.33 3brd n GLU 606 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3brd n GLU 607 N -1.24 2.66 -3.64 3.49 0.00 -1.26 -1.00 120.64 119.65 3brd n GLU 607 Ca 0.12 -1.47 -0.14 0.00 0.00 0.00 0.00 57.16 55.68 3brd n GLU 607 Cb 0.17 -1.02 -0.13 0.00 0.00 0.00 0.00 31.44 30.45 3brd n GLU 607 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3brd s SER 608 N -0.92 0.40 0.14 -1.84 0.15 -1.13 -2.37 113.70 108.13 3brd s SER 608 Ca 0.02 0.54 0.10 0.00 0.70 0.00 0.00 55.95 57.31 3brd s SER 608 Cb 0.01 0.71 -0.04 0.00 -1.71 0.00 0.00 66.02 64.99 3brd s SER 608 CO 0.01 -0.25 -0.20 -0.76 1.20 0.00 0.00 173.24 173.24 3brd s LEU 609 N 2.42 2.59 -0.02 3.45 1.43 -1.01 -1.60 118.68 125.95 3brd s LEU 609 Ca 0.02 -0.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 3brd s LEU 609 Cb -0.12 -1.42 0.00 0.00 0.03 0.00 0.00 46.19 44.68 3brd s LEU 609 CO -0.09 0.16 -0.07 -2.28 0.23 0.00 0.00 176.35 174.30 3brd s HIS 610 N -1.25 0.70 0.26 0.29 2.46 0.07 -0.25 115.29 117.57 3brd s HIS 610 Ca 0.18 -0.15 -0.14 0.00 0.47 0.00 0.00 55.06 55.42 3brd s HIS 610 Cb -0.10 -0.50 0.00 0.00 -0.13 0.00 0.00 32.58 31.85 3brd s HIS 610 CO 0.10 -0.06 0.52 0.00 -2.47 0.00 0.00 174.74 172.83 3brd s SER 612 N -3.01 6.79 -0.26 0.00 1.04 -1.26 -0.86 113.70 116.14 3brd s SER 612 Ca 0.21 1.19 -0.27 0.00 0.48 0.00 0.00 55.95 57.56 3brd s SER 612 Cb -0.02 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.77 3brd s SER 612 CO 0.09 -0.10 0.93 -0.63 0.98 0.00 0.00 173.24 174.51 3brd s ILE 613 N -1.81 4.72 0.64 -1.02 1.01 -1.00 -4.82 121.20 118.91 3brd s ILE 613 Ca 0.49 1.68 -0.16 0.00 0.00 0.00 0.00 60.65 62.66 3brd s ILE 613 Cb -0.12 -4.24 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 3brd s ILE 613 CO 0.19 -0.21 1.12 -2.16 0.00 0.00 0.00 174.94 173.88 3brd s PRO 614 N 3.12 2.89 0.43 2.79 0.04 -1.26 -4.92 135.00 138.08 3brd s PRO 614 Ca 0.39 1.47 -0.25 0.00 0.04 0.00 0.00 61.00 62.65 3brd s PRO 614 Cb -0.14 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 3brd s PRO 614 CO 0.09 -1.19 1.34 -2.14 0.04 0.00 0.00 177.00 175.13 3brd s PRO 615 N -3.89 3.82 0.33 0.56 0.02 -1.26 -4.83 135.00 129.74 3brd s PRO 615 Ca 0.69 2.22 0.11 0.00 0.02 0.00 0.00 61.00 64.04 3brd s PRO 615 Cb -0.22 -2.67 1.00 0.00 0.02 0.00 0.00 34.50 32.62 3brd s PRO 615 CO 0.38 -0.64 1.65 -0.39 -0.33 0.00 0.00 177.00 177.67 3brd h VAL 616 N 2.31 0.28 -0.09 3.83 -1.51 -1.96 -0.93 116.25 118.18 3brd h VAL 616 Ca -0.50 -0.09 -0.03 0.00 -1.23 0.00 0.00 66.70 64.85 3brd h VAL 616 Cb 1.26 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.39 3brd h VAL 616 CO 0.62 0.05 -0.07 0.28 -1.23 0.00 0.00 177.57 177.21 3brd h SER 617 N 0.27 0.12 0.92 4.19 0.02 -1.90 -0.15 113.55 117.01 3brd h SER 617 Ca 0.69 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.63 3brd h SER 617 Cb 1.55 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 64.06 3brd h SER 617 CO -0.64 0.21 -1.04 0.00 -1.14 0.00 0.00 176.83 174.22 3brd n GLN 618 N -4.38 0.58 0.06 3.45 10.64 -0.37 -4.32 117.38 123.03 3brd n GLN 618 Ca -0.01 0.10 -0.19 0.00 -1.83 0.00 0.00 57.00 55.07 3brd n GLN 618 Cb 0.19 -1.80 -0.14 0.00 -0.86 0.00 0.00 30.24 27.63 3brd n GLN 618 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.06 174.99 3brd h VAL 619 N 0.00 1.03 -3.36 -0.39 3.04 -1.04 -3.43 116.25 112.10 3brd h VAL 619 Ca 0.00 -2.66 -0.66 0.00 -1.01 0.00 0.00 66.70 62.36 3brd h VAL 619 Cb 0.98 2.73 -0.30 0.00 -2.01 0.00 0.00 31.29 32.68 3brd h VAL 619 CO 0.00 0.82 -0.76 -0.60 -1.01 0.00 0.00 177.57 176.02 3brd s ARG 620 N -2.60 3.14 0.13 4.17 3.52 -0.17 -4.78 118.95 122.36 3brd s ARG 620 Ca -0.12 -0.77 0.01 0.00 -0.13 0.00 0.00 55.73 54.71 3brd s ARG 620 Cb 0.06 -2.91 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 3brd s ARG 620 CO 0.85 -0.26 0.03 0.27 -0.81 0.00 0.00 175.30 175.37 3brd n ASN 621 N 4.72 1.62 0.25 -2.12 0.23 -1.26 -4.56 115.26 114.14 3brd n ASN 621 Ca -0.18 -1.66 0.10 0.00 -0.53 0.00 0.00 54.58 52.32 3brd n ASN 621 Cb 0.50 0.22 0.66 0.00 -2.08 0.00 0.00 39.78 39.08 3brd n ASN 621 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3brd h GLU 622 N 0.00 0.00 -0.13 -3.83 4.11 -1.98 0.22 114.58 112.96 3brd h GLU 622 Ca -0.11 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.13 3brd h GLU 622 Cb 0.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 3brd h GLU 622 CO 0.18 0.14 -0.70 1.96 0.07 0.00 0.00 179.01 180.66 3brd h GLN 623 N 0.00 0.56 -0.01 1.06 7.50 -2.01 -3.38 115.11 118.84 3brd h GLN 623 Ca -0.00 -0.43 0.00 0.00 0.50 0.00 0.00 58.65 58.72 3brd h GLN 623 Cb 0.33 0.08 0.00 0.00 0.05 0.00 0.00 27.48 27.94 3brd h GLN 623 CO 0.02 1.06 -0.36 0.25 -1.50 0.00 0.00 178.83 178.29 3brd n THR 624 N -3.90 0.00 -0.26 -0.54 -2.24 -0.69 -4.64 114.28 102.01 3brd n THR 624 Ca -0.05 -0.32 0.06 0.00 -2.27 0.00 0.00 64.05 61.47 3brd n THR 624 Cb 0.69 1.14 0.20 0.00 -2.10 0.00 0.00 70.33 70.27 3brd n THR 624 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3brd h HIS 625 N 1.37 0.42 -0.06 4.78 6.17 -0.80 0.29 115.15 127.31 3brd h HIS 625 Ca 0.00 0.04 0.02 0.00 0.71 0.00 0.00 60.37 61.14 3brd h HIS 625 Cb 0.47 -0.07 -0.00 0.00 2.52 0.00 0.00 27.41 30.33 3brd h HIS 625 CO 0.00 -0.02 0.04 0.11 0.71 0.00 0.00 177.93 178.78 3brd h TRP 626 N 0.36 0.00 0.00 5.26 5.08 -1.85 -2.95 115.95 121.84 3brd h TRP 626 Ca 0.43 0.00 -0.25 0.00 1.08 0.00 0.00 58.89 60.15 3brd h TRP 626 Cb 0.71 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.83 3brd h TRP 626 CO -0.21 0.00 -1.73 0.00 -1.28 0.00 0.00 178.44 175.22 3brd n MET 627 N -4.40 0.64 -0.25 0.12 0.00 0.06 -4.41 117.12 108.89 3brd n MET 627 Ca -0.02 0.21 0.07 0.00 0.00 0.00 0.00 57.70 57.96 3brd n MET 627 Cb 0.15 -1.75 0.19 0.00 0.00 0.00 0.00 33.22 31.81 3brd n MET 627 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 3brd n PHE 628 N -2.92 0.62 -4.10 3.17 3.72 -1.05 -4.95 117.46 111.95 3brd n PHE 628 Ca -0.17 -0.58 -0.34 0.00 -0.05 0.00 0.00 57.45 56.31 3brd n PHE 628 Cb 0.98 -0.09 -0.14 0.00 -0.94 0.00 0.00 39.48 39.29 3brd n PHE 628 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3brd s THR 629 N -1.40 3.07 -0.12 4.37 2.01 -1.12 -1.13 115.64 121.31 3brd s THR 629 Ca 0.29 -0.61 -0.29 0.00 0.31 0.00 0.00 61.69 61.39 3brd s THR 629 Cb 0.18 -2.36 -0.02 0.00 0.01 0.00 0.00 72.50 70.30 3brd s THR 629 CO 0.15 0.46 1.26 0.21 -0.69 0.00 0.00 174.62 176.02 3brd s ASN 630 N 1.24 6.96 0.33 3.53 2.47 -0.07 -4.91 114.94 124.49 3brd s ASN 630 Ca 0.03 1.76 0.17 0.00 0.42 0.00 0.00 52.86 55.24 3brd s ASN 630 Cb -0.14 -2.54 0.42 0.00 -1.45 0.00 0.00 41.25 37.53 3brd s ASN 630 CO -0.04 -0.71 1.61 0.03 -3.72 0.00 0.00 177.10 174.27 3brd h ARG 631 N 8.00 0.00 0.08 0.43 3.08 -1.95 -1.25 114.38 122.78 3brd h ARG 631 Ca -0.29 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.75 3brd h ARG 631 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3brd h ARG 631 CO 0.94 0.44 -0.04 1.15 -1.07 0.00 0.00 179.97 181.39 3brd h THR 632 N 0.00 1.12 0.00 2.04 2.02 -1.98 -3.40 112.91 112.71 3brd h THR 632 Ca -0.00 -1.43 0.00 0.00 0.77 0.00 0.00 66.41 65.75 3brd h THR 632 Cb 1.12 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 69.47 3brd h THR 632 CO 0.06 0.31 -1.65 0.35 0.37 0.00 0.00 175.52 174.96 3brd n THR 633 N -4.82 0.00 -0.70 3.16 -2.24 -1.25 -5.00 114.28 103.43 3brd n THR 633 Ca -0.08 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3brd n THR 633 Cb 0.30 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 3brd n THR 633 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3brd n GLY 634 N 1.37 1.41 3.75 3.38 0.00 -0.47 -5.04 105.19 109.58 3brd n GLY 634 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3brd n GLY 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3brd s ASP 635 N -3.21 4.86 -0.29 1.61 1.01 -1.26 -4.61 116.67 114.79 3brd s ASP 635 Ca 0.00 2.28 -0.19 0.00 0.71 0.00 0.00 52.55 55.35 3brd s ASP 635 Cb 0.00 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 3brd s ASP 635 CO 0.00 -1.81 0.55 -0.69 0.21 0.00 0.00 175.17 173.43 3brd s VAL 636 N -1.90 5.02 -0.11 -1.27 1.01 -1.26 -0.89 120.40 120.99 3brd s VAL 636 Ca 0.74 0.81 0.02 0.00 0.00 0.00 0.00 61.98 63.55 3brd s VAL 636 Cb -0.27 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.22 3brd s VAL 636 CO 0.39 -0.02 -0.16 -1.61 0.00 0.00 0.00 175.10 173.70 3brd s GLU 637 N 2.42 2.27 -0.01 2.72 2.02 -0.28 -0.88 118.70 126.95 3brd s GLU 637 Ca 0.22 -0.58 0.06 0.00 0.02 0.00 0.00 54.97 54.69 3brd s GLU 637 Cb -0.15 -1.94 -0.01 0.00 0.10 0.00 0.00 34.13 32.12 3brd s GLU 637 CO 0.10 -0.08 -0.18 0.14 0.02 0.00 0.00 175.26 175.27 3brd s VAL 638 N 1.02 1.41 0.38 2.63 -7.23 -0.40 -4.41 120.40 113.80 3brd s VAL 638 Ca -0.06 -0.79 -0.24 0.00 -1.81 0.00 0.00 61.98 59.09 3brd s VAL 638 Cb -0.15 -1.18 -0.10 0.00 0.56 0.00 0.00 36.38 35.52 3brd s VAL 638 CO -0.02 0.38 0.98 -2.16 -0.31 0.00 0.00 175.10 173.97 3brd s PRO 639 N -0.47 4.33 -0.22 4.82 0.04 -1.26 -0.70 135.00 141.54 3brd s PRO 639 Ca 0.07 1.35 -0.13 0.00 0.04 0.00 0.00 61.00 62.32 3brd s PRO 639 Cb -0.07 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.88 3brd s PRO 639 CO -0.01 0.04 0.29 0.42 0.04 0.00 0.00 177.00 177.79 3brd s ILE 640 N -1.77 5.26 0.20 0.56 -1.09 -0.58 -1.41 121.20 122.38 3brd s ILE 640 Ca 0.56 0.47 0.11 0.00 -2.23 0.00 0.00 60.65 59.56 3brd s ILE 640 Cb -0.17 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 3brd s ILE 640 CO 0.22 0.28 -0.24 -0.44 -1.23 0.00 0.00 174.94 173.54 3brd s SER 641 N 1.11 3.41 -0.15 3.58 0.01 -0.55 -1.99 113.70 119.12 3brd s SER 641 Ca 0.14 -0.88 -0.03 0.00 1.31 0.00 0.00 55.95 56.49 3brd s SER 641 Cb -0.14 -0.25 -0.02 0.00 0.21 0.00 0.00 66.02 65.81 3brd s SER 641 CO 0.07 0.11 -0.05 -0.76 0.41 0.00 0.00 173.24 173.01 3brd s LEU 642 N -2.72 3.15 -0.09 2.44 1.43 -0.52 -0.87 118.68 121.49 3brd s LEU 642 Ca 0.21 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 3brd s LEU 642 Cb -0.08 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.40 3brd s LEU 642 CO 0.10 0.17 -0.16 -0.69 0.23 0.00 0.00 176.35 176.00 3brd s VAL 643 N 0.37 1.44 0.52 -1.59 1.01 -0.20 -0.21 120.40 121.73 3brd s VAL 643 Ca -0.05 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 3brd s VAL 643 Cb -0.14 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.89 3brd s VAL 643 CO 0.03 0.42 0.89 -0.60 0.00 0.00 0.00 175.10 175.85 3brd s ARG 644 N 0.71 3.66 0.24 2.72 3.52 0.34 -0.15 118.95 129.99 3brd s ARG 644 Ca -0.13 0.53 0.24 0.00 -0.13 0.00 0.00 55.73 56.24 3brd s ARG 644 Cb -0.16 -2.25 0.94 0.00 -1.56 0.00 0.00 34.95 31.92 3brd s ARG 644 CO 0.03 -0.31 1.72 -0.40 -0.81 0.00 0.00 175.30 175.54 3brd n ASP 645 N -2.16 0.68 -1.32 -2.12 3.85 -0.81 -0.35 116.55 114.31 3brd n ASP 645 Ca 0.03 0.64 0.08 0.00 -0.71 0.00 0.00 54.79 54.84 3brd n ASP 645 Cb 0.54 -0.80 0.30 0.00 -1.35 0.00 0.00 41.12 39.81 3brd n ASP 645 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3brd n ASP 646 N -2.22 3.87 0.00 -1.12 5.68 -1.26 -4.12 116.55 117.38 3brd n ASP 646 Ca 0.03 -2.27 0.00 0.00 -0.50 0.00 0.00 54.79 52.05 3brd n ASP 646 Cb 0.27 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 3brd n ASP 646 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3brd n GLY 647 N 1.15 0.49 3.67 6.12 0.00 0.53 -4.71 105.19 112.43 3brd n GLY 647 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3brd n GLY 647 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3brd s VAL 648 N -2.18 3.92 -0.17 1.61 1.01 -1.25 -2.12 120.40 121.21 3brd s VAL 648 Ca 0.00 1.19 -0.12 0.00 0.00 0.00 0.00 61.98 63.05 3brd s VAL 648 Cb 0.00 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 3brd s VAL 648 CO 0.00 -0.06 0.21 -0.69 0.00 0.00 0.00 175.10 174.56 3brd s VAL 649 N 3.18 5.36 -0.37 2.92 1.01 -0.21 -0.50 120.40 131.79 3brd s VAL 649 Ca 0.63 0.37 -0.00 0.00 0.00 0.00 0.00 61.98 62.97 3brd s VAL 649 Cb -0.28 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.65 3brd s VAL 649 CO 0.23 0.43 0.11 -0.31 0.00 0.00 0.00 175.10 175.56 3brd s TYR 650 N 0.30 3.58 0.22 5.22 1.51 0.71 -1.49 117.35 127.41 3brd s TYR 650 Ca 0.13 -2.51 -0.32 0.00 -1.01 0.00 0.00 57.07 53.36 3brd s TYR 650 Cb -0.12 -2.91 -0.12 0.00 -0.11 0.00 0.00 41.96 38.70 3brd s TYR 650 CO 0.01 -0.94 1.70 -1.12 -1.11 0.00 0.00 175.55 174.09 3brd s SER 651 N 1.43 6.38 0.36 2.29 0.01 -1.26 -1.44 113.70 121.47 3brd s SER 651 Ca 0.06 2.88 0.19 0.00 1.31 0.00 0.00 55.95 60.39 3brd s SER 651 Cb -0.21 -2.61 0.41 0.00 0.21 0.00 0.00 66.02 63.82 3brd s SER 651 CO -0.05 -0.96 1.60 0.77 0.41 0.00 0.00 173.24 175.01 3brd h SER 652 N 6.47 0.00 0.00 2.44 4.64 -1.76 -3.46 113.55 121.88 3brd h SER 652 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3brd h SER 652 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3brd h SER 652 CO 0.93 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.83 3brd n GLY 653 N 0.83 1.65 3.72 -0.77 0.00 -1.26 -4.63 105.19 104.73 3brd n GLY 653 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3brd n GLY 653 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3brd s LEU 654 N 0.00 3.61 -0.10 0.99 1.02 -1.26 -5.05 118.68 117.89 3brd s LEU 654 Ca 0.00 -0.08 0.04 0.00 0.02 0.00 0.00 54.13 54.11 3brd s LEU 654 Cb 0.00 -2.27 -0.00 0.00 0.02 0.00 0.00 46.19 43.94 3brd s LEU 654 CO 0.00 0.19 -0.23 -0.89 0.02 0.00 0.00 176.35 175.44 3brd s THR 655 N -1.30 2.15 -0.13 5.49 2.01 -1.26 -1.53 115.64 121.08 3brd s THR 655 Ca 0.26 -0.99 -0.20 0.00 0.31 0.00 0.00 61.69 61.07 3brd s THR 655 Cb -0.12 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.53 3brd s THR 655 CO 0.18 0.56 0.56 0.12 -0.69 0.00 0.00 174.62 175.35 3brd s PHE 656 N 0.31 3.49 -0.15 4.92 5.36 0.13 -4.92 117.98 127.12 3brd s PHE 656 Ca -0.17 0.96 -0.03 0.00 -0.96 0.00 0.00 56.93 56.73 3brd s PHE 656 Cb -0.18 -2.66 -0.03 0.00 -0.34 0.00 0.00 43.02 39.81 3brd s PHE 656 CO 0.08 0.06 -0.04 0.45 -1.46 0.00 0.00 175.22 174.32 3brd s SER 657 N 0.82 4.81 0.37 6.13 0.15 -1.26 -1.28 113.70 123.44 3brd s SER 657 Ca 0.29 -0.11 0.27 0.00 0.70 0.00 0.00 55.95 57.11 3brd s SER 657 Cb -0.16 -1.73 1.13 0.00 -1.71 0.00 0.00 66.02 63.56 3brd s SER 657 CO 0.12 0.19 1.82 1.88 1.20 0.00 0.00 173.24 178.45 3brd h TYR 658 N 6.52 0.00 0.00 3.44 -1.99 -1.40 -2.23 116.97 121.31 3brd h TYR 658 Ca -0.33 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.40 3brd h TYR 658 Cb 1.19 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.92 3brd h TYR 658 CO 0.54 0.00 -0.00 -0.22 -0.00 0.00 0.00 178.16 178.48 3brd h LYS 659 N 0.00 0.00 0.00 4.88 1.63 -1.94 -3.37 116.57 117.76 3brd h LYS 659 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 3brd h LYS 659 Cb 0.42 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.05 3brd h LYS 659 CO 0.00 0.00 0.00 0.43 -3.45 0.00 0.00 179.45 176.43 3brd n SER 660 N -3.08 -0.82 0.00 4.20 7.64 -0.84 -5.19 113.62 115.52 3brd n SER 660 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 3brd n SER 660 Cb 0.16 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 3brd n SER 660 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21