#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g42 h MET 221 N 0.00 0.00 -4.61 -0.52 2.86 -2.00 -3.24 114.93 107.42 3g42 h MET 221 Ca 0.00 0.00 -0.71 0.00 -2.06 0.00 0.00 59.70 56.93 3g42 h MET 221 Cb 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.56 3g42 h MET 221 CO 0.00 0.06 2.32 1.63 1.06 0.00 0.00 176.91 181.98 3g42 n LYS 222 N -3.58 3.20 -0.05 1.72 5.02 -1.26 -3.33 118.16 119.89 3g42 n LYS 222 Ca -0.02 -3.21 0.06 0.00 -2.02 0.00 0.00 58.31 53.12 3g42 n LYS 222 Cb 0.17 -3.24 0.09 0.00 -0.02 0.00 0.00 35.03 32.03 3g42 n LYS 222 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3g42 n ASN 223 N 6.30 2.21 -4.09 4.39 2.04 -0.76 -4.54 115.26 120.81 3g42 n ASN 223 Ca 0.46 -2.68 -0.28 0.00 -0.44 0.00 0.00 54.58 51.64 3g42 n ASN 223 Cb 0.41 -0.27 -0.17 0.00 -2.53 0.00 0.00 39.78 37.22 3g42 n ASN 223 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 3g42 s THR 224 N -2.18 1.48 -0.42 5.53 2.01 0.65 -1.57 115.64 121.13 3g42 s THR 224 Ca 0.20 -0.67 -0.19 0.00 0.31 0.00 0.00 61.69 61.34 3g42 s THR 224 Cb 0.18 -1.32 0.02 0.00 0.01 0.00 0.00 72.50 71.38 3g42 s THR 224 CO 0.02 0.43 0.55 0.00 -0.69 0.00 0.00 174.62 174.94 3g42 s LYS 226 N 2.53 4.62 0.07 0.00 -0.14 -1.26 -2.45 119.74 123.10 3g42 s LYS 226 Ca 0.18 1.59 0.05 0.00 -1.36 0.00 0.00 55.97 56.44 3g42 s LYS 226 Cb -0.15 -3.34 -0.04 0.00 -1.68 0.00 0.00 37.83 32.62 3g42 s LYS 226 CO 0.16 0.09 -0.07 -0.51 -0.76 0.00 0.00 175.35 174.27 3g42 s LEU 227 N 0.03 3.18 -0.27 3.17 1.43 0.23 -2.01 118.68 124.43 3g42 s LEU 227 Ca 0.50 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 53.26 3g42 s LEU 227 Cb -0.26 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 3g42 s LEU 227 CO 0.32 0.21 0.08 -0.22 0.23 0.00 0.00 176.35 176.96 3g42 s LEU 228 N -1.99 3.65 -0.17 1.79 2.96 0.27 0.24 118.68 125.43 3g42 s LEU 228 Ca 0.21 -0.44 -0.03 0.00 -0.22 0.00 0.00 54.13 53.65 3g42 s LEU 228 Cb -0.11 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 3g42 s LEU 228 CO 0.13 -0.11 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.30 3g42 s VAL 229 N 1.57 3.63 -0.08 1.68 1.01 -0.21 -0.37 120.40 127.63 3g42 s VAL 229 Ca 0.05 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.63 3g42 s VAL 229 Cb -0.16 -2.60 -0.00 0.00 0.00 0.00 0.00 36.38 33.62 3g42 s VAL 229 CO 0.03 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.70 3g42 s VAL 230 N 0.63 1.86 -0.21 2.92 1.01 -0.36 0.00 120.40 126.25 3g42 s VAL 230 Ca -0.03 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 3g42 s VAL 230 Cb -0.15 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.63 3g42 s VAL 230 CO 0.02 0.52 -0.08 0.00 0.00 0.00 0.00 175.10 175.56 3g42 s ALA 231 N 0.21 2.69 0.98 5.51 0.00 -0.15 -0.18 121.76 130.81 3g42 s ALA 231 Ca -0.12 -1.19 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 3g42 s ALA 231 Cb -0.16 -1.57 0.20 0.00 0.00 0.00 0.00 23.12 21.59 3g42 s ALA 231 CO 0.06 -0.42 1.27 0.16 0.00 0.00 0.00 175.76 176.83 3g42 s ASP 232 N 1.43 2.99 0.53 0.00 3.84 -0.99 -0.49 116.67 123.97 3g42 s ASP 232 Ca 0.05 0.40 0.22 0.00 -0.00 0.00 0.00 52.55 53.22 3g42 s ASP 232 Cb -0.14 -0.53 1.45 0.00 -1.38 0.00 0.00 42.92 42.32 3g42 s ASP 232 CO -0.06 -2.82 2.15 1.12 -0.00 0.00 0.00 175.17 175.55 3g42 h HIS 233 N -1.70 0.00 -0.06 2.11 2.07 -1.75 -0.56 115.15 115.26 3g42 h HIS 233 Ca -0.45 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.06 3g42 h HIS 233 Cb 1.26 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.23 3g42 h HIS 233 CO -1.07 0.05 -0.01 0.00 -3.07 0.00 0.00 177.93 173.83 3g42 h ARG 234 N 0.00 0.12 -0.43 5.12 3.08 -1.91 -1.82 114.38 118.53 3g42 h ARG 234 Ca -0.00 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 3g42 h ARG 234 Cb 0.11 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 3g42 h ARG 234 CO 0.01 0.42 0.08 0.35 -1.07 0.00 0.00 179.97 179.76 3g42 h PHE 235 N -0.20 0.75 -0.16 3.04 3.04 -1.69 -1.05 116.94 120.65 3g42 h PHE 235 Ca 0.02 -0.10 0.05 0.00 3.98 0.00 0.00 57.97 61.91 3g42 h PHE 235 Cb 0.38 -0.21 -0.05 0.00 2.56 0.00 0.00 35.95 38.63 3g42 h PHE 235 CO 0.04 0.71 -0.14 -0.92 -2.02 0.00 0.00 178.31 175.99 3g42 h TYR 236 N 0.56 -0.35 0.10 0.41 3.20 -1.08 0.21 116.97 120.03 3g42 h TYR 236 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 3g42 h TYR 236 Cb 0.36 0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.81 3g42 h TYR 236 CO 0.02 -0.21 -0.05 -0.09 -1.64 0.00 0.00 178.16 176.20 3g42 h ARG 237 N -0.15 -0.13 0.00 1.82 2.43 -1.26 -0.83 114.38 116.25 3g42 h ARG 237 Ca 0.10 0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 3g42 h ARG 237 Cb 0.31 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3g42 h ARG 237 CO -0.26 0.24 -1.04 1.88 -1.51 0.00 0.00 179.97 179.29 3g42 h TYR 238 N -0.53 0.00 0.00 2.20 -1.99 -1.15 -2.44 116.97 113.06 3g42 h TYR 238 Ca -0.01 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.44 3g42 h TYR 238 Cb 0.43 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.11 3g42 h TYR 238 CO 0.05 0.61 -2.06 -1.33 -0.00 0.00 0.00 178.16 175.43 3g42 n MET 239 N -3.07 0.85 0.00 4.88 2.81 0.67 -4.52 117.12 118.75 3g42 n MET 239 Ca -0.05 0.07 0.12 0.00 -1.81 0.00 0.00 57.70 56.04 3g42 n MET 239 Cb 0.82 -1.38 0.26 0.00 -0.71 0.00 0.00 33.22 32.21 3g42 n MET 239 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g42 n GLY 240 N 2.42 -0.37 3.92 3.03 0.00 -0.68 -4.81 105.19 108.70 3g42 n GLY 240 Ca -0.30 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 3g42 n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g42 n ARG 241 N -0.41 -5.51 -1.06 1.61 1.74 -0.54 -1.28 116.66 111.21 3g42 n ARG 241 Ca 0.11 0.59 -0.02 0.00 -0.77 0.00 0.00 57.85 57.77 3g42 n ARG 241 Cb 0.39 -5.49 -0.01 0.00 -1.02 0.00 0.00 32.46 26.33 3g42 n ARG 241 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g42 n GLY 242 N -1.69 0.43 3.41 -0.13 0.00 -0.43 -4.96 105.19 101.82 3g42 n GLY 242 Ca 0.05 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3g42 n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g42 s GLU 243 N -1.39 3.51 0.08 1.61 2.02 -0.41 -5.01 118.70 119.11 3g42 s GLU 243 Ca 0.00 -0.60 -0.21 0.00 0.02 0.00 0.00 54.97 54.18 3g42 s GLU 243 Cb 0.00 -2.85 -0.11 0.00 0.10 0.00 0.00 34.13 31.27 3g42 s GLU 243 CO 0.00 0.13 1.59 1.49 0.02 0.00 0.00 175.26 178.49 3g42 h GLU 244 N 7.04 0.23 -0.20 1.61 4.81 -1.94 -1.65 114.58 124.48 3g42 h GLU 244 Ca -0.32 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 58.89 3g42 h GLU 244 Cb 1.19 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3g42 h GLU 244 CO 0.60 0.35 0.03 0.66 -0.73 0.00 0.00 179.01 179.91 3g42 h SER 245 N 0.07 -0.02 -0.81 1.04 4.64 -1.95 0.52 113.55 117.04 3g42 h SER 245 Ca 0.05 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3g42 h SER 245 Cb 0.21 0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 62.31 3g42 h SER 245 CO -0.00 0.02 0.48 0.74 -0.87 0.00 0.00 176.83 177.20 3g42 h THR 246 N 0.10 1.23 -0.05 2.95 2.02 -1.81 0.18 112.91 117.54 3g42 h THR 246 Ca 0.09 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 3g42 h THR 246 Cb 0.10 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.61 3g42 h THR 246 CO -0.13 0.24 -0.00 0.74 0.37 0.00 0.00 175.52 176.74 3g42 h THR 247 N 1.11 1.27 -0.03 3.16 2.02 -1.00 -2.66 112.91 116.78 3g42 h THR 247 Ca 0.29 -0.82 0.00 0.00 0.77 0.00 0.00 66.41 66.66 3g42 h THR 247 Cb -0.03 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 68.10 3g42 h THR 247 CO -0.05 0.22 0.00 0.74 0.37 0.00 0.00 175.52 176.80 3g42 h THR 248 N -0.23 0.98 -0.65 3.16 2.02 -0.64 -2.51 112.91 115.05 3g42 h THR 248 Ca 0.01 -0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.23 3g42 h THR 248 Cb 0.36 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 3g42 h THR 248 CO 0.00 0.00 0.39 0.78 0.37 0.00 0.00 175.52 177.07 3g42 h ASN 249 N 0.01 0.63 -0.39 4.18 2.35 -0.68 0.55 115.58 122.23 3g42 h ASN 249 Ca 0.01 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.78 3g42 h ASN 249 Cb 0.01 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 3g42 h ASN 249 CO -0.02 0.43 0.26 0.22 -1.65 0.00 0.00 177.43 176.66 3g42 h TYR 250 N 0.76 0.48 -0.39 1.19 3.20 -1.38 0.42 116.97 121.26 3g42 h TYR 250 Ca 0.27 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.05 3g42 h TYR 250 Cb 0.06 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 3g42 h TYR 250 CO -0.06 0.30 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.55 3g42 h LEU 251 N 0.52 0.81 -0.49 2.82 3.38 -1.00 0.12 115.31 121.46 3g42 h LEU 251 Ca 0.14 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3g42 h LEU 251 Cb -0.05 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3g42 h LEU 251 CO -0.03 1.01 0.20 0.40 0.09 0.00 0.00 178.44 180.11 3g42 h ILE 252 N 0.59 1.21 -0.57 1.22 2.04 -0.74 -0.91 117.51 120.35 3g42 h ILE 252 Ca 0.09 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 3g42 h ILE 252 Cb 0.69 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 3g42 h ILE 252 CO 0.05 0.24 0.18 -0.33 0.00 0.00 0.00 178.15 178.29 3g42 h GLU 253 N 0.65 0.88 -0.12 2.37 5.08 -0.78 -1.76 114.58 120.90 3g42 h GLU 253 Ca 0.16 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3g42 h GLU 253 Cb 0.19 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3g42 h GLU 253 CO -0.01 0.79 0.06 1.25 -1.00 0.00 0.00 179.01 180.10 3g42 h LEU 254 N 0.79 0.16 -1.08 1.33 6.46 -0.71 -1.28 115.31 120.98 3g42 h LEU 254 Ca 0.18 -0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 3g42 h LEU 254 Cb 0.28 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 3g42 h LEU 254 CO -0.01 0.24 0.41 0.40 -0.62 0.00 0.00 178.44 178.86 3g42 h ILE 255 N 0.07 1.23 -0.49 4.05 1.08 -1.11 -1.05 117.51 121.29 3g42 h ILE 255 Ca 0.04 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 3g42 h ILE 255 Cb 0.12 0.21 -0.02 0.00 -3.07 0.00 0.00 36.82 34.06 3g42 h ILE 255 CO -0.01 0.25 0.31 -0.78 -0.69 0.00 0.00 178.15 177.24 3g42 h ASP 256 N 1.06 0.57 -0.35 1.72 3.58 -0.97 0.40 116.42 122.42 3g42 h ASP 256 Ca 0.27 -0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.59 3g42 h ASP 256 Cb 0.03 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.92 3g42 h ASP 256 CO -0.04 0.43 -0.11 0.03 -2.88 0.00 0.00 179.24 176.66 3g42 h ARG 257 N 0.66 0.80 -0.56 0.28 3.08 -0.81 -1.25 114.38 116.58 3g42 h ARG 257 Ca 0.18 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 3g42 h ARG 257 Cb -0.05 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3g42 h ARG 257 CO -0.04 0.88 -0.05 0.28 -1.07 0.00 0.00 179.97 179.97 3g42 h VAL 258 N 0.72 1.27 -0.79 2.04 2.07 -0.73 -2.71 116.25 118.12 3g42 h VAL 258 Ca 0.12 -1.20 0.01 0.00 0.82 0.00 0.00 66.70 66.45 3g42 h VAL 258 Cb 0.60 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 3g42 h VAL 258 CO 0.04 0.43 0.52 -0.78 0.02 0.00 0.00 177.57 177.80 3g42 h ASP 259 N 0.91 0.89 -0.96 0.57 3.58 0.32 -1.55 116.42 120.20 3g42 h ASP 259 Ca 0.15 -0.02 0.08 0.00 0.42 0.00 0.00 57.03 57.66 3g42 h ASP 259 Cb 0.62 -0.22 -0.07 0.00 1.72 0.00 0.00 39.33 41.38 3g42 h ASP 259 CO 0.04 0.64 0.62 0.44 -2.88 0.00 0.00 179.24 178.10 3g42 h ASP 260 N 1.05 0.94 0.18 2.28 3.32 -0.91 0.37 116.42 123.65 3g42 h ASP 260 Ca 0.29 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 3g42 h ASP 260 Cb -0.10 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.27 3g42 h ASP 260 CO -0.07 0.58 -0.09 0.40 -1.72 0.00 0.00 179.24 178.35 3g42 h ILE 261 N 1.06 0.93 0.10 0.35 2.04 -1.25 -2.67 117.51 118.06 3g42 h ILE 261 Ca 0.43 -0.64 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 3g42 h ILE 261 Cb 0.27 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3g42 h ILE 261 CO -0.18 0.14 -0.05 1.88 0.00 0.00 0.00 178.15 179.95 3g42 h TYR 262 N -0.56 -0.12 -0.27 1.37 -1.99 -0.98 -2.92 116.97 111.50 3g42 h TYR 262 Ca -0.02 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.72 3g42 h TYR 262 Cb 0.42 0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.18 3g42 h TYR 262 CO 0.03 0.00 0.18 -0.09 -0.00 0.00 0.00 178.16 178.28 3g42 h ARG 263 N -0.21 0.30 -0.49 4.88 2.43 -0.08 -1.97 114.38 119.24 3g42 h ARG 263 Ca -0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3g42 h ARG 263 Cb 0.18 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3g42 h ARG 263 CO 0.02 0.20 0.00 0.09 -1.51 0.00 0.00 179.97 178.77 3g42 n ASN 264 N -4.50 2.95 -4.74 -3.80 3.02 -1.00 -1.81 115.26 105.38 3g42 n ASN 264 Ca 0.02 -1.96 -0.38 0.00 -0.03 0.00 0.00 54.58 52.22 3g42 n ASN 264 Cb 0.12 -0.32 -0.06 0.00 -0.61 0.00 0.00 39.78 38.90 3g42 n ASN 264 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3g42 s THR 265 N -1.35 5.14 -0.83 3.41 2.01 -0.74 -4.97 115.64 118.31 3g42 s THR 265 Ca 0.37 0.96 -0.16 0.00 0.31 0.00 0.00 61.69 63.18 3g42 s THR 265 Cb 0.20 -3.81 0.18 0.00 0.01 0.00 0.00 72.50 69.08 3g42 s THR 265 CO 0.27 0.37 0.85 0.00 -0.69 0.00 0.00 174.62 175.42 3g42 s ALA 266 N 0.32 3.83 0.56 7.40 0.00 -1.26 -4.36 121.76 128.25 3g42 s ALA 266 Ca 0.26 -3.06 0.26 0.00 0.00 0.00 0.00 51.96 49.42 3g42 s ALA 266 Cb -0.16 -3.65 1.49 0.00 0.00 0.00 0.00 23.12 20.80 3g42 s ALA 266 CO 0.11 -2.46 2.03 -1.49 0.00 0.00 0.00 175.76 173.95 3g42 h TRP 267 N 8.21 0.00 -0.40 0.00 4.06 -1.76 0.27 115.95 126.33 3g42 h TRP 267 Ca 0.07 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.02 3g42 h TRP 267 Cb 1.04 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.20 3g42 h TRP 267 CO 1.04 0.00 0.00 -0.40 -3.56 0.00 0.00 178.44 175.52 3g42 n ASP 268 N -4.10 3.29 -1.05 -3.49 5.75 -1.26 -4.45 116.55 111.25 3g42 n ASP 268 Ca 0.06 -2.16 -0.14 0.00 -0.01 0.00 0.00 54.79 52.54 3g42 n ASP 268 Cb 0.47 -0.32 -0.06 0.00 -1.03 0.00 0.00 41.12 40.18 3g42 n ASP 268 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 3g42 n ASN 269 N 0.55 -5.50 0.00 -1.12 3.02 0.94 -4.81 115.26 108.35 3g42 n ASN 269 Ca 0.15 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 3g42 n ASN 269 Cb 0.54 -4.21 0.00 0.00 -0.61 0.00 0.00 39.78 35.50 3g42 n ASN 269 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g42 n ALA 270 N 1.25 0.00 1.10 5.41 0.00 -1.26 -5.03 120.51 121.98 3g42 n ALA 270 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.42 3g42 n ALA 270 Cb 0.59 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.23 3g42 n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g42 n GLY 271 N 1.19 -0.65 3.26 0.00 0.00 -1.26 -4.70 105.19 103.03 3g42 n GLY 271 Ca 0.00 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 3g42 n GLY 271 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3g42 n PHE 272 N -0.80 4.09 -4.26 1.61 7.35 -1.26 -4.86 117.46 119.32 3g42 n PHE 272 Ca 0.09 -2.80 -0.17 0.00 -0.76 0.00 0.00 57.45 53.81 3g42 n PHE 272 Cb 0.37 -2.58 -0.09 0.00 0.35 0.00 0.00 39.48 37.53 3g42 n PHE 272 CO 0.00 0.00 0.00 -1.59 -0.76 0.00 0.00 176.76 174.41 3g42 s LYS 273 N 3.98 1.55 0.00 -4.13 -2.85 -1.26 -2.05 119.74 114.98 3g42 s LYS 273 Ca 0.52 -1.88 0.00 0.00 -1.00 0.00 0.00 55.97 53.62 3g42 s LYS 273 Cb 0.08 0.25 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 3g42 s LYS 273 CO 0.02 -0.54 0.00 0.41 0.10 0.00 0.00 175.35 175.34 3g42 n GLY 274 N -0.50 0.75 3.66 0.59 0.00 -0.75 -5.04 105.19 103.90 3g42 n GLY 274 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3g42 n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g42 s TYR 275 N -2.12 3.37 0.00 1.61 1.51 -1.26 -4.82 117.35 115.64 3g42 s TYR 275 Ca 0.00 0.67 0.00 0.00 -1.01 0.00 0.00 57.07 56.73 3g42 s TYR 275 Cb 0.00 -2.58 0.00 0.00 -0.11 0.00 0.00 41.96 39.27 3g42 s TYR 275 CO 0.00 -0.05 0.00 0.41 -1.11 0.00 0.00 175.55 174.80 3g42 n GLY 276 N 3.94 4.11 3.28 0.71 0.00 -0.61 -2.73 105.19 113.89 3g42 n GLY 276 Ca -0.07 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.81 3g42 n GLY 276 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g42 s ILE 277 N -1.28 1.59 -0.18 -0.61 -4.36 -1.26 -0.50 121.20 114.59 3g42 s ILE 277 Ca 0.00 -1.70 -0.15 0.00 -0.26 0.00 0.00 60.65 58.54 3g42 s ILE 277 Cb 0.00 -1.60 0.05 0.00 1.25 0.00 0.00 42.46 42.16 3g42 s ILE 277 CO 0.00 -0.26 0.48 -1.58 0.24 0.00 0.00 174.94 173.82 3g42 s GLN 278 N -2.40 0.53 0.14 0.37 0.74 -1.03 -4.79 119.66 113.23 3g42 s GLN 278 Ca 0.09 0.72 -0.31 0.00 0.05 0.00 0.00 55.36 55.92 3g42 s GLN 278 Cb -0.07 0.20 -0.08 0.00 1.10 0.00 0.00 33.01 34.16 3g42 s GLN 278 CO 0.05 -0.09 1.34 0.42 -0.55 0.00 0.00 175.29 176.46 3g42 s ILE 279 N 0.58 3.32 -0.23 -2.34 1.01 -1.26 -0.60 121.20 121.67 3g42 s ILE 279 Ca -0.03 1.00 -0.08 0.00 0.00 0.00 0.00 60.65 61.55 3g42 s ILE 279 Cb -0.05 -3.64 -0.18 0.00 0.01 0.00 0.00 42.46 38.61 3g42 s ILE 279 CO -0.03 0.11 -0.09 1.21 0.00 0.00 0.00 174.94 176.13 3g42 n GLU 280 N 3.42 0.64 -3.70 2.79 4.07 0.14 -4.76 120.64 123.23 3g42 n GLU 280 Ca 0.09 0.26 -0.14 0.00 -0.06 0.00 0.00 57.16 57.32 3g42 n GLU 280 Cb 0.43 -1.58 -0.09 0.00 -0.06 0.00 0.00 31.44 30.14 3g42 n GLU 280 CO 0.00 0.00 0.00 -0.65 -0.06 0.00 0.00 177.13 176.42 3g42 s GLN 281 N -2.50 0.64 -0.12 5.31 -1.52 -1.08 -5.03 119.66 115.34 3g42 s GLN 281 Ca -0.33 0.41 0.02 0.00 -1.95 0.00 0.00 55.36 53.51 3g42 s GLN 281 Cb 0.10 0.30 0.00 0.00 -0.22 0.00 0.00 33.01 33.19 3g42 s GLN 281 CO 0.60 -0.12 -0.21 0.42 -0.25 0.00 0.00 175.29 175.73 3g42 s ILE 282 N -0.29 2.26 -0.23 1.08 1.01 -1.26 -1.04 121.20 122.72 3g42 s ILE 282 Ca -0.04 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 59.65 3g42 s ILE 282 Cb -0.03 -1.90 0.01 0.00 0.01 0.00 0.00 42.46 40.55 3g42 s ILE 282 CO 0.03 0.55 -0.06 -0.13 0.00 0.00 0.00 174.94 175.32 3g42 s ARG 283 N 0.57 3.12 -0.33 2.79 1.81 0.10 -4.98 118.95 122.03 3g42 s ARG 283 Ca -0.12 -0.79 -0.09 0.00 -1.72 0.00 0.00 55.73 53.01 3g42 s ARG 283 Cb -0.17 -2.98 0.01 0.00 -0.45 0.00 0.00 34.95 31.37 3g42 s ARG 283 CO 0.04 -0.29 0.15 0.42 -0.68 0.00 0.00 175.30 174.94 3g42 s ILE 284 N 1.41 4.39 -0.43 1.52 -1.09 -1.26 -0.98 121.20 124.75 3g42 s ILE 284 Ca 0.04 -0.69 -0.23 0.00 -2.23 0.00 0.00 60.65 57.54 3g42 s ILE 284 Cb -0.15 -3.34 0.02 0.00 -1.58 0.00 0.00 42.46 37.41 3g42 s ILE 284 CO -0.04 -0.06 0.77 -0.76 -1.23 0.00 0.00 174.94 173.62 3g42 s LEU 285 N 1.55 4.25 0.03 2.97 1.43 0.35 -4.91 118.68 124.36 3g42 s LEU 285 Ca 0.03 -0.05 0.26 0.00 -1.03 0.00 0.00 54.13 53.34 3g42 s LEU 285 Cb -0.18 -2.95 0.75 0.00 0.03 0.00 0.00 46.19 43.84 3g42 s LEU 285 CO 0.05 -0.87 1.60 0.29 0.23 0.00 0.00 176.35 177.66 3g42 n LYS 286 N 6.62 0.06 -3.81 1.70 5.02 -1.26 -2.47 118.16 124.02 3g42 n LYS 286 Ca 0.02 0.03 -0.11 0.00 -2.02 0.00 0.00 58.31 56.23 3g42 n LYS 286 Cb 0.48 -1.55 -0.08 0.00 -0.02 0.00 0.00 35.03 33.87 3g42 n LYS 286 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3g42 s SER 287 N -3.27 -0.03 0.72 4.39 1.04 -1.26 -4.88 113.70 110.41 3g42 s SER 287 Ca 0.11 -0.31 -0.16 0.00 0.48 0.00 0.00 55.95 56.08 3g42 s SER 287 Cb 0.17 0.32 0.03 0.00 0.10 0.00 0.00 66.02 66.64 3g42 s SER 287 CO 0.64 -0.59 1.17 -0.81 0.98 0.00 0.00 173.24 174.63 3g42 n PRO 288 N 0.60 0.63 -2.96 4.02 -0.04 -1.26 -4.66 135.00 131.33 3g42 n PRO 288 Ca -0.19 0.28 -0.41 0.00 -0.04 0.00 0.00 63.50 63.14 3g42 n PRO 288 Cb 0.59 -2.41 -0.05 0.00 -0.04 0.00 0.00 33.50 31.59 3g42 n PRO 288 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 3g42 s GLN 289 N -3.61 4.17 0.25 0.54 2.00 -0.12 -4.90 119.66 117.99 3g42 s GLN 289 Ca 0.77 0.82 -0.30 0.00 -2.00 0.00 0.00 55.36 54.66 3g42 s GLN 289 Cb -0.34 -3.64 -0.09 0.00 0.80 0.00 0.00 33.01 29.74 3g42 s GLN 289 CO 0.47 -0.47 1.24 -1.21 -0.50 0.00 0.00 175.29 174.81 3g42 s GLU 290 N 2.67 4.46 0.06 1.67 2.02 -1.26 -4.19 118.70 124.14 3g42 s GLU 290 Ca 0.32 2.00 0.06 0.00 0.02 0.00 0.00 54.97 57.37 3g42 s GLU 290 Cb -0.15 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 30.88 3g42 s GLU 290 CO 0.08 -0.09 -0.15 0.08 0.02 0.00 0.00 175.26 175.20 3g42 s VAL 291 N -0.56 1.22 0.44 2.63 1.01 -1.26 -5.05 120.40 118.83 3g42 s VAL 291 Ca 0.51 -1.21 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 3g42 s VAL 291 Cb -0.35 -1.13 -0.06 0.00 0.00 0.00 0.00 36.38 34.83 3g42 s VAL 291 CO 0.42 -0.09 0.82 -1.59 0.00 0.00 0.00 175.10 174.66 3g42 s LYS 292 N -1.49 3.79 0.22 2.72 -2.85 -1.26 -4.98 119.74 115.88 3g42 s LYS 292 Ca 0.01 0.55 -0.31 0.00 -1.00 0.00 0.00 55.97 55.22 3g42 s LYS 292 Cb -0.09 -2.33 -0.15 0.00 -2.06 0.00 0.00 37.83 33.19 3g42 s LYS 292 CO 0.02 -0.10 1.12 -0.35 0.10 0.00 0.00 175.35 176.13 3g42 n PRO 293 N -1.45 1.28 0.00 1.78 -0.04 -1.26 -2.05 135.00 133.26 3g42 n PRO 293 Ca 0.03 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 3g42 n PRO 293 Cb 0.54 -1.91 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 3g42 n PRO 293 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g42 n GLY 294 N 1.76 3.07 3.88 0.55 0.00 -1.26 -5.04 105.19 108.15 3g42 n GLY 294 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 3g42 n GLY 294 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g42 s GLU 295 N -0.27 2.63 0.11 1.61 -1.05 -0.87 -5.14 118.70 115.73 3g42 s GLU 295 Ca 0.00 -1.43 0.00 0.00 -0.15 0.00 0.00 54.97 53.40 3g42 s GLU 295 Cb 0.00 -2.45 -0.04 0.00 -0.44 0.00 0.00 34.13 31.20 3g42 s GLU 295 CO 0.00 -0.10 -0.01 -1.59 0.95 0.00 0.00 175.26 174.50 3g42 s LYS 296 N -4.11 0.87 -0.09 -4.83 0.00 -1.26 -4.72 119.74 105.60 3g42 s LYS 296 Ca 0.46 -1.38 -0.11 0.00 0.00 0.00 0.00 55.97 54.95 3g42 s LYS 296 Cb -0.05 -0.02 0.03 0.00 0.00 0.00 0.00 37.83 37.79 3g42 s LYS 296 CO 0.28 -0.12 0.28 -1.58 0.00 0.00 0.00 175.35 174.21 3g42 s HIS 297 N -3.80 -0.27 0.65 1.78 2.46 -1.26 -5.04 115.29 109.80 3g42 s HIS 297 Ca 0.17 0.64 0.38 0.00 0.47 0.00 0.00 55.06 56.72 3g42 s HIS 297 Cb 0.07 0.10 2.14 0.00 -0.13 0.00 0.00 32.58 34.75 3g42 s HIS 297 CO -0.02 -0.20 2.26 0.10 -2.47 0.00 0.00 174.74 174.41 3g42 h TYR 298 N 5.34 0.00 -0.59 3.88 -0.00 -1.92 -1.05 116.97 122.63 3g42 h TYR 298 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.46 3g42 h TYR 298 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.92 3g42 h TYR 298 CO 0.43 0.00 0.00 -1.71 -0.00 0.00 0.00 178.16 176.88 3g42 n ASN 299 N -3.25 3.60 -4.72 0.10 5.15 -1.26 -4.99 115.26 109.89 3g42 n ASN 299 Ca -0.02 -2.01 -0.31 0.00 -0.60 0.00 0.00 54.58 51.64 3g42 n ASN 299 Cb 0.15 -0.40 0.13 0.00 -0.53 0.00 0.00 39.78 39.13 3g42 n ASN 299 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g42 s MET 300 N -1.02 1.58 0.22 1.20 0.23 -0.40 -0.95 119.30 120.17 3g42 s MET 300 Ca 0.40 1.29 -0.01 0.00 -1.03 0.00 0.00 55.69 56.34 3g42 s MET 300 Cb 0.21 -1.81 0.21 0.00 -1.53 0.00 0.00 34.83 31.90 3g42 s MET 300 CO 0.27 -2.15 1.57 0.00 -2.03 0.00 0.00 175.02 172.67 3g42 h ALA 301 N -1.51 0.82 -2.31 3.16 0.00 -1.90 -3.44 119.26 114.08 3g42 h ALA 301 Ca -0.44 -0.47 -0.49 0.00 0.00 0.00 0.00 54.91 53.50 3g42 h ALA 301 Cb 1.25 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.97 3g42 h ALA 301 CO 0.47 0.66 0.13 -1.59 0.00 0.00 0.00 179.25 178.92 3g42 s LYS 302 N -4.10 3.65 0.41 0.00 -2.85 -1.26 -5.07 119.74 110.52 3g42 s LYS 302 Ca -0.07 0.35 -0.15 0.00 -1.00 0.00 0.00 55.97 55.09 3g42 s LYS 302 Cb 0.12 -2.37 -0.08 0.00 -2.06 0.00 0.00 37.83 33.44 3g42 s LYS 302 CO 0.82 -0.14 0.85 -1.12 0.10 0.00 0.00 175.35 175.86 3g42 s SER 303 N -3.68 6.71 0.02 0.03 0.01 -1.26 -4.98 113.70 110.55 3g42 s SER 303 Ca 0.49 1.40 0.02 0.00 1.31 0.00 0.00 55.95 59.17 3g42 s SER 303 Cb -0.10 -2.43 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 3g42 s SER 303 CO 0.39 -0.38 -0.07 -0.47 0.41 0.00 0.00 173.24 173.12 3g42 s TYR 304 N -2.28 0.63 -2.01 2.43 5.04 -1.26 -3.09 117.35 116.81 3g42 s TYR 304 Ca 0.56 -0.26 0.28 0.00 -2.44 0.00 0.00 57.07 55.21 3g42 s TYR 304 Cb -0.10 -0.39 1.04 0.00 0.35 0.00 0.00 41.96 42.86 3g42 s TYR 304 CO 0.23 -0.03 1.74 -0.35 -1.34 0.00 0.00 175.55 175.80 3g42 n PRO 305 N 2.32 1.10 -3.60 4.97 -0.04 -1.26 -1.88 135.00 136.61 3g42 n PRO 305 Ca -0.17 -0.56 -0.40 0.00 -0.04 0.00 0.00 63.50 62.33 3g42 n PRO 305 Cb 0.56 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.45 3g42 n PRO 305 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3g42 s ASN 306 N -2.29 5.64 0.46 3.54 -0.87 -1.26 -4.94 114.94 115.22 3g42 s ASN 306 Ca 0.32 -2.24 0.23 0.00 -1.57 0.00 0.00 52.86 49.59 3g42 s ASN 306 Cb 0.20 -1.97 1.09 0.00 -0.02 0.00 0.00 41.25 40.55 3g42 s ASN 306 CO 0.44 -0.58 1.92 1.05 -2.57 0.00 0.00 177.10 177.36 3g42 h GLU 307 N 7.98 0.00 0.00 -0.60 4.11 -1.91 -2.39 114.58 121.77 3g42 h GLU 307 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 3g42 h GLU 307 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3g42 h GLU 307 CO 0.79 0.22 0.00 -0.85 0.07 0.00 0.00 179.01 179.24 3g42 n GLU 308 N -3.65 0.08 -3.18 1.06 0.00 -1.26 -4.51 120.64 109.18 3g42 n GLU 308 Ca -0.01 0.42 -0.25 0.00 0.00 0.00 0.00 57.16 57.32 3g42 n GLU 308 Cb 0.35 -1.69 -0.01 0.00 0.00 0.00 0.00 31.44 30.09 3g42 n GLU 308 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 3g42 s LYS 309 N -3.19 3.50 0.34 3.44 2.20 -0.90 -5.01 119.74 120.13 3g42 s LYS 309 Ca 0.03 -0.19 0.11 0.00 -0.36 0.00 0.00 55.97 55.56 3g42 s LYS 309 Cb 0.07 -2.59 0.61 0.00 -1.51 0.00 0.00 37.83 34.41 3g42 s LYS 309 CO 0.23 0.06 1.77 0.22 -0.36 0.00 0.00 175.35 177.27 3g42 h ASP 310 N 0.64 0.06 -5.05 1.43 3.58 -1.86 -3.43 116.42 111.79 3g42 h ASP 310 Ca -0.49 -0.02 -0.38 0.00 0.42 0.00 0.00 57.03 56.56 3g42 h ASP 310 Cb 1.21 -0.02 -0.14 0.00 1.72 0.00 0.00 39.33 42.11 3g42 h ASP 310 CO 0.62 0.47 -0.57 0.00 -2.88 0.00 0.00 179.24 176.87 3g42 s ALA 311 N -4.10 1.76 0.89 -0.78 0.00 -1.26 -4.60 121.76 113.67 3g42 s ALA 311 Ca -0.03 -1.79 -0.13 0.00 0.00 0.00 0.00 51.96 50.00 3g42 s ALA 311 Cb 0.14 1.24 0.13 0.00 0.00 0.00 0.00 23.12 24.63 3g42 s ALA 311 CO 0.74 -0.54 1.19 -1.58 0.00 0.00 0.00 175.76 175.57 3g42 s TRP 312 N -3.72 2.41 -0.26 0.00 0.52 -1.26 -4.57 118.94 112.06 3g42 s TRP 312 Ca 0.37 0.68 -0.29 0.00 0.02 0.00 0.00 56.10 56.89 3g42 s TRP 312 Cb 0.05 -3.59 0.01 0.00 -1.15 0.00 0.00 33.47 28.80 3g42 s TRP 312 CO 0.17 -2.25 1.04 0.34 0.02 0.00 0.00 176.95 176.27 3g42 s ASP 313 N -4.43 7.03 0.33 2.95 -1.08 -0.79 -4.79 116.67 115.89 3g42 s ASP 313 Ca 0.65 1.25 0.10 0.00 -0.52 0.00 0.00 52.55 54.03 3g42 s ASP 313 Cb -0.11 -2.54 0.85 0.00 -1.46 0.00 0.00 42.92 39.67 3g42 s ASP 313 CO 0.52 -0.73 1.78 1.62 0.52 0.00 0.00 175.17 178.87 3g42 h VAL 314 N 5.54 0.65 -0.23 1.11 3.04 -1.93 -1.51 116.25 122.91 3g42 h VAL 314 Ca -0.20 -0.22 -0.02 0.00 -1.01 0.00 0.00 66.70 65.25 3g42 h VAL 314 Cb 1.06 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.28 3g42 h VAL 314 CO 0.99 0.12 0.06 0.11 -1.01 0.00 0.00 177.57 177.84 3g42 h LYS 315 N 0.64 0.37 -0.16 4.17 1.57 -1.99 -2.07 116.57 119.10 3g42 h LYS 315 Ca 0.58 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 59.20 3g42 h LYS 315 Cb 1.07 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 3g42 h LYS 315 CO -0.36 0.47 -0.24 0.52 -0.57 0.00 0.00 179.45 179.26 3g42 h MET 316 N 0.20 0.29 -0.42 3.15 2.86 -1.78 -2.31 114.93 116.93 3g42 h MET 316 Ca 0.07 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 3g42 h MET 316 Cb 0.26 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3g42 h MET 316 CO -0.00 0.53 -0.09 1.25 1.06 0.00 0.00 176.91 179.66 3g42 h LEU 317 N 0.27 0.80 -0.70 1.22 5.85 -1.12 0.51 115.31 122.14 3g42 h LEU 317 Ca 0.04 -0.36 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 3g42 h LEU 317 Cb 0.58 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 3g42 h LEU 317 CO 0.04 0.97 0.24 0.25 -0.34 0.00 0.00 178.44 179.60 3g42 h LEU 318 N 0.61 1.00 -0.55 2.25 5.85 -1.20 0.11 115.31 123.38 3g42 h LEU 318 Ca 0.11 -0.20 -0.13 0.00 0.84 0.00 0.00 57.88 58.50 3g42 h LEU 318 Cb 0.61 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 3g42 h LEU 318 CO 0.04 0.93 -0.24 -0.33 -0.34 0.00 0.00 178.44 178.50 3g42 h GLU 319 N 1.02 0.91 -0.37 1.25 5.08 -1.29 -1.12 114.58 120.06 3g42 h GLU 319 Ca 0.23 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 3g42 h GLU 319 Cb 0.27 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3g42 h GLU 319 CO -0.01 1.05 -0.01 0.37 -1.00 0.00 0.00 179.01 179.41 3g42 h GLN 320 N 0.78 0.66 -0.04 2.33 5.75 -0.49 -1.41 115.11 122.70 3g42 h GLN 320 Ca 0.10 -0.21 0.02 0.00 -0.15 0.00 0.00 58.65 58.41 3g42 h GLN 320 Cb 0.80 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 3g42 h GLN 320 CO 0.07 0.77 -0.11 0.35 -2.65 0.00 0.00 178.83 177.26 3g42 h PHE 321 N 0.48 -0.27 -0.99 3.99 3.57 -0.67 0.02 116.94 123.06 3g42 h PHE 321 Ca 0.10 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.69 3g42 h PHE 321 Cb 0.48 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 3g42 h PHE 321 CO 0.04 -0.16 0.63 0.77 -2.23 0.00 0.00 178.31 177.36 3g42 h SER 322 N -0.17 1.01 -0.07 0.41 0.02 -1.06 0.03 113.55 113.72 3g42 h SER 322 Ca 0.05 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 3g42 h SER 322 Cb 0.24 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 3g42 h SER 322 CO -0.13 0.63 0.02 0.15 -1.14 0.00 0.00 176.83 176.35 3g42 h PHE 323 N 1.14 0.12 -0.04 3.45 3.04 -0.66 -1.98 116.94 122.01 3g42 h PHE 323 Ca 0.43 -0.01 -0.12 0.00 3.98 0.00 0.00 57.97 62.24 3g42 h PHE 323 Cb 0.20 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.66 3g42 h PHE 323 CO -0.01 0.31 -0.54 -0.44 -2.02 0.00 0.00 178.31 175.62 3g42 h ASP 324 N -0.10 0.13 -0.11 0.41 3.45 -0.55 -3.17 116.42 116.48 3g42 h ASP 324 Ca 0.02 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.41 3g42 h ASP 324 Cb 0.25 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.98 3g42 h ASP 324 CO 0.00 0.65 0.00 0.00 -1.57 0.00 0.00 179.24 178.32 3g42 n ILE 325 N -3.91 0.12 -0.37 0.35 0.13 -0.05 -4.64 119.36 110.99 3g42 n ILE 325 Ca -0.02 -0.48 -0.01 0.00 -1.10 0.00 0.00 62.75 61.14 3g42 n ILE 325 Cb 0.56 1.07 0.04 0.00 -0.84 0.00 0.00 39.64 40.47 3g42 n ILE 325 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3g42 n ALA 326 N 1.03 -0.12 -0.24 1.51 0.00 -0.75 -0.48 120.51 121.46 3g42 n ALA 326 Ca 0.16 0.96 0.12 0.00 0.00 0.00 0.00 53.44 54.68 3g42 n ALA 326 Cb 0.52 -0.43 0.41 0.00 0.00 0.00 0.00 19.45 19.95 3g42 n ALA 326 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3g42 h GLU 327 N 0.00 0.61 0.04 0.00 4.81 -1.86 -1.76 114.58 116.43 3g42 h GLU 327 Ca 0.33 -0.04 -0.31 0.00 -0.13 0.00 0.00 59.36 59.21 3g42 h GLU 327 Cb 0.57 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 3g42 h GLU 327 CO -0.95 0.41 -1.79 0.39 -0.73 0.00 0.00 179.01 176.33 3g42 n GLU 328 N -4.54 0.67 0.24 1.92 -0.58 0.19 -3.97 120.64 114.59 3g42 n GLU 328 Ca 0.16 0.29 0.07 0.00 -0.42 0.00 0.00 57.16 57.27 3g42 n GLU 328 Cb 0.47 -1.77 0.58 0.00 -0.57 0.00 0.00 31.44 30.15 3g42 n GLU 328 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3g42 h ALA 329 N 0.70 1.72 0.00 0.62 0.00 -0.37 -1.85 119.26 120.07 3g42 h ALA 329 Ca -0.33 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3g42 h ALA 329 Cb 2.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.79 3g42 h ALA 329 CO 0.08 0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.36 3g42 n SER 330 N -4.28 0.21 0.00 0.00 3.41 -0.70 -2.51 113.62 109.76 3g42 n SER 330 Ca -0.03 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.25 3g42 n SER 330 Cb 0.20 -0.60 -0.09 0.00 -0.26 0.00 0.00 64.21 63.45 3g42 n SER 330 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3g42 n LYS 331 N -1.75 0.24 -4.50 4.33 5.02 -0.70 -4.89 118.16 115.92 3g42 n LYS 331 Ca 0.02 -0.06 -0.27 0.00 -2.02 0.00 0.00 58.31 55.99 3g42 n LYS 331 Cb 0.15 -1.52 -0.10 0.00 -0.02 0.00 0.00 35.03 33.54 3g42 n LYS 331 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3g42 s VAL 332 N -3.18 2.18 0.08 -0.18 -7.23 -1.04 -5.04 120.40 105.99 3g42 s VAL 332 Ca 0.03 -2.02 -0.18 0.00 -1.81 0.00 0.00 61.98 58.00 3g42 s VAL 332 Cb 0.15 -2.88 -0.09 0.00 0.56 0.00 0.00 36.38 34.12 3g42 s VAL 332 CO 0.86 -0.08 1.46 0.00 -0.31 0.00 0.00 175.10 177.04 3g42 s LEU 334 N -9.31 1.25 -0.07 0.00 1.43 -1.00 -2.35 118.68 108.62 3g42 s LEU 334 Ca -0.14 -0.18 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3g42 s LEU 334 Cb 0.07 0.99 -0.01 0.00 0.03 0.00 0.00 46.19 47.27 3g42 s LEU 334 CO 0.76 -0.48 -0.24 0.00 0.23 0.00 0.00 176.35 176.62 3g42 s ALA 335 N -1.88 2.14 -0.04 4.21 0.00 0.04 -0.57 121.76 125.66 3g42 s ALA 335 Ca -0.10 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.86 3g42 s ALA 335 Cb -0.04 -0.72 0.02 0.00 0.00 0.00 0.00 23.12 22.38 3g42 s ALA 335 CO 0.00 0.36 -0.05 -1.58 0.00 0.00 0.00 175.76 174.50 3g42 s HIS 336 N 0.03 0.74 -0.18 0.00 2.46 0.50 -2.14 115.29 116.71 3g42 s HIS 336 Ca -0.09 -0.20 -0.09 0.00 0.47 0.00 0.00 55.06 55.15 3g42 s HIS 336 Cb -0.15 -0.65 -0.05 0.00 -0.13 0.00 0.00 32.58 31.61 3g42 s HIS 336 CO 0.06 -0.18 0.12 -1.17 -2.47 0.00 0.00 174.74 171.10 3g42 s LEU 337 N 0.82 4.16 -0.18 8.88 2.96 -0.22 -1.23 118.68 133.88 3g42 s LEU 337 Ca -0.11 0.24 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 3g42 s LEU 337 Cb -0.14 -2.06 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 3g42 s LEU 337 CO 0.00 0.22 -0.08 -0.36 -1.32 0.00 0.00 176.35 174.81 3g42 s PHE 338 N 0.09 2.90 0.30 5.38 0.40 0.75 -0.75 117.98 127.05 3g42 s PHE 338 Ca 0.08 -0.80 0.04 0.00 -0.60 0.00 0.00 56.93 55.66 3g42 s PHE 338 Cb -0.11 -1.98 -0.02 0.00 0.51 0.00 0.00 43.02 41.42 3g42 s PHE 338 CO -0.01 -0.38 0.16 -2.37 0.70 0.00 0.00 175.22 173.32 3g42 n THR 339 N 4.18 0.00 -3.44 0.64 5.66 -0.50 -2.34 114.28 118.48 3g42 n THR 339 Ca -0.18 -1.91 -0.28 0.00 -3.05 0.00 0.00 64.05 58.64 3g42 n THR 339 Cb 0.52 0.79 -0.11 0.00 -1.55 0.00 0.00 70.33 69.98 3g42 n THR 339 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 3g42 s TYR 340 N -2.89 0.65 -0.11 1.09 5.04 -1.26 -2.41 117.35 117.45 3g42 s TYR 340 Ca 0.23 -1.61 -0.17 0.00 -2.44 0.00 0.00 57.07 53.07 3g42 s TYR 340 Cb 0.01 -0.86 0.04 0.00 0.35 0.00 0.00 41.96 41.51 3g42 s TYR 340 CO 0.16 -0.84 0.44 1.14 -1.34 0.00 0.00 175.55 175.11 3g42 s GLN 341 N 1.01 0.64 -1.00 4.97 -2.07 -1.26 -4.79 119.66 117.16 3g42 s GLN 341 Ca 0.19 0.35 -0.21 0.00 -1.82 0.00 0.00 55.36 53.88 3g42 s GLN 341 Cb -0.20 0.30 0.09 0.00 -1.09 0.00 0.00 33.01 32.11 3g42 s GLN 341 CO -0.01 -0.13 1.33 0.34 -1.32 0.00 0.00 175.29 175.50 3g42 s ASP 342 N -0.38 6.57 0.50 12.60 -1.08 -1.26 -4.53 116.67 129.08 3g42 s ASP 342 Ca -0.05 -1.75 -0.23 0.00 -0.52 0.00 0.00 52.55 50.00 3g42 s ASP 342 Cb -0.03 -2.50 -0.06 0.00 -1.46 0.00 0.00 42.92 38.86 3g42 s ASP 342 CO 0.03 -1.31 1.28 -0.36 0.52 0.00 0.00 175.17 175.33 3g42 s PHE 343 N 3.97 2.57 0.67 -5.34 0.08 -1.26 -4.27 117.98 114.40 3g42 s PHE 343 Ca 0.41 1.44 -0.17 0.00 0.12 0.00 0.00 56.93 58.73 3g42 s PHE 343 Cb -0.02 -3.62 0.00 0.00 -0.57 0.00 0.00 43.02 38.81 3g42 s PHE 343 CO -0.09 -2.26 1.24 -0.51 -0.10 0.00 0.00 175.22 173.50 3g42 s ASP 344 N -1.09 4.59 -1.71 1.36 -0.00 -1.26 -3.47 116.67 115.08 3g42 s ASP 344 Ca 0.67 2.47 -0.01 0.00 -0.00 0.00 0.00 52.55 55.68 3g42 s ASP 344 Cb -0.35 -2.60 0.00 0.00 -0.00 0.00 0.00 42.92 39.96 3g42 s ASP 344 CO 0.43 -2.01 0.07 0.23 -0.00 0.00 0.00 175.17 173.89 3g42 n MET 345 N -2.14 -1.98 -1.28 8.23 2.81 -1.26 -2.98 117.12 118.53 3g42 n MET 345 Ca 0.14 0.97 -0.10 0.00 -1.81 0.00 0.00 57.70 56.91 3g42 n MET 345 Cb 0.49 -5.63 -0.04 0.00 -0.71 0.00 0.00 33.22 27.34 3g42 n MET 345 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g42 n GLY 346 N -1.07 1.08 3.72 3.03 0.00 -1.23 -4.97 105.19 105.75 3g42 n GLY 346 Ca -0.23 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 3g42 n GLY 346 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g42 s THR 347 N -2.19 3.02 -0.10 2.61 2.01 -1.16 -4.90 115.64 114.92 3g42 s THR 347 Ca 0.00 0.75 0.18 0.00 0.31 0.00 0.00 61.69 62.92 3g42 s THR 347 Cb 0.00 -3.48 -0.26 0.00 0.01 0.00 0.00 72.50 68.77 3g42 s THR 347 CO 0.00 0.07 0.24 0.18 -0.69 0.00 0.00 174.62 174.42 3g42 n LEU 348 N 3.72 0.00 0.00 4.42 4.77 -1.26 -4.23 117.00 124.42 3g42 n LEU 348 Ca 0.11 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.07 3g42 n LEU 348 Cb 0.41 0.22 0.02 0.00 -2.33 0.00 0.00 43.42 41.74 3g42 n LEU 348 CO 0.60 0.22 0.66 0.61 -1.33 0.00 0.00 177.39 178.15 3g42 n GLY 349 N 1.65 0.71 3.55 -0.72 0.00 -1.26 -1.07 105.19 108.05 3g42 n GLY 349 Ca -0.16 -1.09 -0.17 0.00 0.00 0.00 0.00 46.02 44.60 3g42 n GLY 349 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g42 s LEU 350 N 0.00 -0.67 -0.03 0.99 2.96 -1.02 -5.01 118.68 115.90 3g42 s LEU 350 Ca 0.18 0.89 -0.27 0.00 -0.22 0.00 0.00 54.13 54.71 3g42 s LEU 350 Cb -0.02 2.49 0.06 0.00 0.50 0.00 0.00 46.19 49.22 3g42 s LEU 350 CO 0.04 -0.51 0.61 0.00 -1.32 0.00 0.00 176.35 175.17 3g42 s ALA 351 N -0.78 -1.57 0.10 5.97 0.00 -1.26 -0.61 121.76 123.61 3g42 s ALA 351 Ca -0.08 1.07 -0.29 0.00 0.00 0.00 0.00 51.96 52.67 3g42 s ALA 351 Cb -0.01 0.08 -0.06 0.00 0.00 0.00 0.00 23.12 23.13 3g42 s ALA 351 CO 0.07 -0.38 0.91 0.71 0.00 0.00 0.00 175.76 177.07 3g42 s TYR 352 N -1.42 3.80 -0.03 0.00 2.02 -1.12 -4.85 117.35 115.74 3g42 s TYR 352 Ca -0.10 1.72 -0.29 0.00 -0.37 0.00 0.00 57.07 58.02 3g42 s TYR 352 Cb -0.01 -2.98 -0.03 0.00 -0.40 0.00 0.00 41.96 38.54 3g42 s TYR 352 CO 0.07 0.24 0.97 0.08 -1.57 0.00 0.00 175.55 175.34 3g42 s VAL 353 N -0.10 4.86 0.74 0.71 1.01 -1.26 -3.22 120.40 123.13 3g42 s VAL 353 Ca 0.44 2.01 -0.05 0.00 0.00 0.00 0.00 61.98 64.38 3g42 s VAL 353 Cb -0.23 -4.30 0.11 0.00 0.00 0.00 0.00 36.38 31.96 3g42 s VAL 353 CO 0.28 0.12 1.03 -0.83 0.00 0.00 0.00 175.10 175.71 3g42 s GLY 354 N 1.02 1.75 0.07 4.51 0.00 -0.21 -3.99 107.32 110.47 3g42 s GLY 354 Ca 0.50 -1.32 -0.26 0.00 0.00 0.00 0.00 44.72 43.64 3g42 s GLY 354 CO 0.24 -0.80 0.75 -1.35 0.00 0.00 0.00 173.10 171.94 3g42 s SER 355 N -4.66 -0.47 0.28 1.64 1.04 -1.26 -4.07 113.70 106.21 3g42 s SER 355 Ca 0.65 0.02 0.25 0.00 0.48 0.00 0.00 55.95 57.34 3g42 s SER 355 Cb -0.07 0.49 1.01 0.00 0.10 0.00 0.00 66.02 67.55 3g42 s SER 355 CO 0.45 -0.78 1.74 1.55 0.98 0.00 0.00 173.24 177.18 3g42 h PRO 356 N 2.02 0.00 -6.58 4.02 0.13 -1.83 -3.45 132.00 126.31 3g42 h PRO 356 Ca -0.28 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.32 3g42 h PRO 356 Cb 1.27 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.45 3g42 h PRO 356 CO 0.34 0.00 1.05 0.54 -0.23 0.00 0.00 178.00 179.70 3g42 n ARG 357 N -2.32 2.75 -0.33 0.86 1.74 -1.26 -4.82 116.66 113.28 3g42 n ARG 357 Ca 0.02 1.00 0.06 0.00 -0.77 0.00 0.00 57.85 58.16 3g42 n ARG 357 Cb 0.24 -2.86 0.22 0.00 -1.02 0.00 0.00 32.46 29.04 3g42 n ARG 357 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g42 h ALA 358 N 7.53 1.39 -0.87 7.54 0.00 -2.00 -2.13 119.26 130.73 3g42 h ALA 358 Ca -0.45 0.03 -0.47 0.00 0.00 0.00 0.00 54.91 54.02 3g42 h ALA 358 Cb 1.21 -0.16 -0.27 0.00 0.00 0.00 0.00 17.79 18.57 3g42 h ALA 358 CO 0.95 0.15 0.60 -1.71 0.00 0.00 0.00 179.25 179.24 3g42 n ASN 359 N -4.69 4.13 -4.78 0.00 2.85 -1.26 -4.93 115.26 106.58 3g42 n ASN 359 Ca 0.17 -3.43 -0.39 0.00 -0.11 0.00 0.00 54.58 50.82 3g42 n ASN 359 Cb 0.35 -0.82 -0.06 0.00 1.24 0.00 0.00 39.78 40.48 3g42 n ASN 359 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3g42 s SER 360 N -1.05 7.33 -0.50 1.20 1.04 -0.80 -4.99 113.70 115.93 3g42 s SER 360 Ca 0.51 1.58 0.03 0.00 0.48 0.00 0.00 55.95 58.54 3g42 s SER 360 Cb 0.42 -2.48 0.58 0.00 0.10 0.00 0.00 66.02 64.64 3g42 s SER 360 CO 0.08 0.21 1.88 1.41 0.98 0.00 0.00 173.24 177.81 3g42 n HIS 361 N 1.57 2.90 -3.79 5.02 8.25 -1.26 -4.90 115.22 123.02 3g42 n HIS 361 Ca -0.06 -2.21 -0.08 0.00 -0.26 0.00 0.00 57.72 55.10 3g42 n HIS 361 Cb 0.49 -1.04 -0.02 0.00 1.12 0.00 0.00 29.99 30.54 3g42 n HIS 361 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3g42 s GLY 362 N -1.69 -0.17 0.00 -1.41 0.00 -1.26 -4.30 107.32 98.48 3g42 s GLY 362 Ca 0.58 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 45.12 3g42 s GLY 362 CO 0.06 -0.05 0.00 0.61 0.00 0.00 0.00 173.10 173.72 3g42 n GLY 363 N -0.45 -1.73 3.61 0.20 0.00 -0.80 -4.01 105.19 102.01 3g42 n GLY 363 Ca -0.06 -1.36 -0.44 0.00 0.00 0.00 0.00 46.02 44.16 3g42 n GLY 363 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3g42 n VAL 364 N 0.00 2.03 -0.67 1.61 0.24 -0.15 -3.96 118.33 117.43 3g42 n VAL 364 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 3g42 n VAL 364 Cb 0.00 -1.09 0.00 0.00 -1.47 0.00 0.00 33.84 31.28 3g42 n VAL 364 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g42 s PRO 366 N -2.70 4.22 -0.31 0.00 0.04 -1.26 -4.77 135.00 130.23 3g42 s PRO 366 Ca 0.00 2.25 -0.02 0.00 0.04 0.00 0.00 61.00 63.26 3g42 s PRO 366 Cb 0.00 -3.54 0.11 0.00 0.04 0.00 0.00 34.50 31.11 3g42 s PRO 366 CO 0.00 -0.68 0.13 0.21 0.04 0.00 0.00 177.00 176.71 3g42 s LYS 367 N 2.38 0.42 0.05 4.56 2.20 -1.26 -5.09 119.74 123.00 3g42 s LYS 367 Ca 0.71 -0.84 -0.16 0.00 -0.36 0.00 0.00 55.97 55.33 3g42 s LYS 367 Cb -0.38 -1.46 -0.09 0.00 -1.51 0.00 0.00 37.83 34.39 3g42 s LYS 367 CO 0.31 -1.04 0.36 0.00 -0.36 0.00 0.00 175.35 174.62 3g42 n ALA 368 N 4.92 -1.92 -3.52 3.13 0.00 -1.26 -4.69 120.51 117.17 3g42 n ALA 368 Ca -0.02 0.24 -0.18 0.00 0.00 0.00 0.00 53.44 53.48 3g42 n ALA 368 Cb 0.41 -0.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.95 3g42 n ALA 368 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3g42 s TYR 369 N -0.25 -0.26 0.24 0.00 6.14 0.20 -4.94 117.35 118.47 3g42 s TYR 369 Ca 0.35 0.28 -0.31 0.00 0.64 0.00 0.00 57.07 58.03 3g42 s TYR 369 Cb -0.50 -0.34 -0.12 0.00 0.42 0.00 0.00 41.96 41.41 3g42 s TYR 369 CO 0.26 -0.56 1.59 0.98 0.64 0.00 0.00 175.55 178.46 3g42 n TYR 370 N 5.32 2.59 -3.67 4.97 9.36 -1.26 -1.26 117.16 133.21 3g42 n TYR 370 Ca -0.05 0.24 -0.38 0.00 3.32 0.00 0.00 57.90 61.02 3g42 n TYR 370 Cb 0.50 -2.58 -0.10 0.00 -0.63 0.00 0.00 39.34 36.53 3g42 n TYR 370 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3g42 s SER 371 N 0.69 5.47 0.19 2.98 0.15 0.40 -4.90 113.70 118.68 3g42 s SER 371 Ca 0.70 -1.92 -0.16 0.00 0.70 0.00 0.00 55.95 55.27 3g42 s SER 371 Cb -0.56 -1.92 0.16 0.00 -1.71 0.00 0.00 66.02 61.99 3g42 s SER 371 CO 0.43 -0.60 1.64 -0.65 1.20 0.00 0.00 173.24 175.26 3g42 h PRO 372 N 8.25 -0.02 0.00 5.44 0.11 -1.93 1.15 132.00 144.99 3g42 h PRO 372 Ca -0.17 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.86 3g42 h PRO 372 Cb 1.06 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3g42 h PRO 372 CO 0.77 -0.02 -0.36 -0.24 -0.21 0.00 0.00 178.00 177.94 3g42 h VAL 373 N -0.02 1.11 0.00 3.15 3.04 -1.96 -3.06 116.25 118.50 3g42 h VAL 373 Ca 0.24 -1.32 0.00 0.00 -1.01 0.00 0.00 66.70 64.62 3g42 h VAL 373 Cb 0.40 1.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 3g42 h VAL 373 CO -0.54 0.36 -1.24 0.61 -1.01 0.00 0.00 177.57 175.75 3g42 n GLY 374 N -0.27 -1.33 3.21 3.17 0.00 -0.32 -4.99 105.19 104.65 3g42 n GLY 374 Ca -0.01 -0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 3g42 n GLY 374 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g42 n LYS 375 N -2.50 -6.28 -3.61 1.61 4.76 0.38 -4.99 118.16 107.52 3g42 n LYS 375 Ca -0.01 0.73 -0.02 0.00 -2.87 0.00 0.00 58.31 56.15 3g42 n LYS 375 Cb 0.54 -5.45 -0.01 0.00 -1.84 0.00 0.00 35.03 28.27 3g42 n LYS 375 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 3g42 s LYS 376 N -5.59 0.45 0.08 1.97 -2.85 -1.19 -5.00 119.74 107.62 3g42 s LYS 376 Ca 0.21 -0.22 -0.25 0.00 -1.00 0.00 0.00 55.97 54.72 3g42 s LYS 376 Cb -0.09 0.17 -0.06 0.00 -2.06 0.00 0.00 37.83 35.79 3g42 s LYS 376 CO 0.64 -0.20 0.76 -0.80 0.10 0.00 0.00 175.35 175.84 3g42 s ASN 377 N -2.64 7.26 0.34 0.03 0.01 -1.26 -0.45 114.94 118.23 3g42 s ASN 377 Ca 0.12 1.50 0.03 0.00 -0.71 0.00 0.00 52.86 53.80 3g42 s ASN 377 Cb 0.02 -2.47 -0.05 0.00 0.41 0.00 0.00 41.25 39.15 3g42 s ASN 377 CO -0.04 0.09 0.08 0.27 -1.51 0.00 0.00 177.10 175.99 3g42 s ILE 378 N -0.45 0.99 0.02 0.60 -4.36 -0.39 -4.86 121.20 112.75 3g42 s ILE 378 Ca 0.37 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.82 3g42 s ILE 378 Cb -0.21 -2.66 -0.02 0.00 1.25 0.00 0.00 42.46 40.82 3g42 s ILE 378 CO 0.24 0.00 -0.18 -0.31 0.24 0.00 0.00 174.94 174.92 3g42 s TYR 379 N -3.31 1.62 -0.40 1.37 1.51 -1.26 -0.63 117.35 116.26 3g42 s TYR 379 Ca 0.33 -0.34 0.06 0.00 -1.01 0.00 0.00 57.07 56.10 3g42 s TYR 379 Cb 0.07 -0.99 0.58 0.00 -0.11 0.00 0.00 41.96 41.50 3g42 s TYR 379 CO 0.15 0.03 1.71 1.28 -1.11 0.00 0.00 175.55 177.61 3g42 n LEU 380 N 2.17 5.65 -3.17 -1.29 4.77 -1.26 -4.62 117.00 119.25 3g42 n LEU 380 Ca -0.16 -3.78 -0.37 0.00 -0.03 0.00 0.00 56.01 51.67 3g42 n LEU 380 Cb 0.54 -0.75 -0.01 0.00 -2.33 0.00 0.00 43.42 40.87 3g42 n LEU 380 CO 0.23 1.22 1.88 -0.46 -1.33 0.00 0.00 177.39 178.93 3g42 n ASN 381 N -1.11 7.42 -4.20 -1.43 6.94 -1.25 -1.91 115.26 119.72 3g42 n ASN 381 Ca 0.48 -3.36 -0.12 0.00 -0.02 0.00 0.00 54.58 51.57 3g42 n ASN 381 Cb 1.31 -1.25 -0.10 0.00 -2.36 0.00 0.00 39.78 37.38 3g42 n ASN 381 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3g42 s SER 382 N -0.16 0.83 0.16 0.53 1.04 -1.26 -0.78 113.70 114.06 3g42 s SER 382 Ca 0.52 -1.18 -0.24 0.00 0.48 0.00 0.00 55.95 55.52 3g42 s SER 382 Cb 0.27 0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.65 3g42 s SER 382 CO -0.18 -0.63 0.98 -0.83 0.98 0.00 0.00 173.24 173.56 3g42 s GLY 383 N -3.12 -0.17 0.07 7.32 0.00 -0.91 -2.80 107.32 107.71 3g42 s GLY 383 Ca 0.23 0.05 -0.12 0.00 0.00 0.00 0.00 44.72 44.88 3g42 s GLY 383 CO 0.03 0.35 0.26 0.48 0.00 0.00 0.00 173.10 174.21 3g42 s LEU 384 N -3.02 1.09 -0.02 0.66 0.05 0.22 -1.06 118.68 116.60 3g42 s LEU 384 Ca 0.14 -0.38 0.01 0.00 0.05 0.00 0.00 54.13 53.95 3g42 s LEU 384 Cb -0.01 1.23 0.01 0.00 -2.05 0.00 0.00 46.19 45.37 3g42 s LEU 384 CO 0.03 -0.67 -0.03 -0.89 -0.55 0.00 0.00 176.35 174.25 3g42 s THR 385 N -3.10 0.32 -0.07 5.48 2.01 0.07 -2.44 115.64 117.91 3g42 s THR 385 Ca -0.01 -0.08 0.03 0.00 0.31 0.00 0.00 61.69 61.94 3g42 s THR 385 Cb 0.01 -0.34 -0.02 0.00 0.01 0.00 0.00 72.50 72.16 3g42 s THR 385 CO -0.07 0.14 -0.15 -0.55 -0.69 0.00 0.00 174.62 173.30 3g42 s SER 386 N 0.50 3.93 -0.23 3.53 0.15 -0.24 -1.41 113.70 119.94 3g42 s SER 386 Ca -0.05 -0.26 0.15 0.00 0.70 0.00 0.00 55.95 56.48 3g42 s SER 386 Cb -0.09 -1.03 0.76 0.00 -1.71 0.00 0.00 66.02 63.95 3g42 s SER 386 CO -0.01 0.29 1.68 0.35 1.20 0.00 0.00 173.24 176.76 3g42 n THR 387 N 2.68 2.67 -4.85 6.45 -2.24 -1.01 -4.85 114.28 113.13 3g42 n THR 387 Ca -0.17 -1.53 -0.31 0.00 -2.27 0.00 0.00 64.05 59.77 3g42 n THR 387 Cb 0.52 -0.28 -0.17 0.00 -2.10 0.00 0.00 70.33 68.31 3g42 n THR 387 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3g42 s LYS 388 N -2.80 2.78 -0.14 -0.78 2.20 -1.26 -0.57 119.74 119.17 3g42 s LYS 388 Ca 0.52 -0.78 -0.09 0.00 -0.36 0.00 0.00 55.97 55.27 3g42 s LYS 388 Cb 0.40 -2.20 0.05 0.00 -1.51 0.00 0.00 37.83 34.57 3g42 s LYS 388 CO 0.14 0.06 0.34 1.21 -0.36 0.00 0.00 175.35 176.75 3g42 s ASN 389 N 0.64 -0.40 -1.19 1.43 2.47 -0.27 -4.22 114.94 113.39 3g42 s ASN 389 Ca -0.12 0.73 -0.12 0.00 0.42 0.00 0.00 52.86 53.77 3g42 s ASN 389 Cb -0.16 0.64 -0.01 0.00 -1.45 0.00 0.00 41.25 40.26 3g42 s ASN 389 CO 0.03 -0.17 0.74 -1.22 -3.72 0.00 0.00 177.10 172.76 3g42 n TYR 390 N 3.96 -1.94 -0.64 0.43 4.02 -1.26 -2.68 117.16 119.05 3g42 n TYR 390 Ca -0.22 0.61 0.00 0.00 -0.01 0.00 0.00 57.90 58.29 3g42 n TYR 390 Cb 0.55 -3.75 0.00 0.00 -0.02 0.00 0.00 39.34 36.12 3g42 n TYR 390 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3g42 n GLY 391 N -1.64 0.73 3.32 2.72 0.00 -1.26 -4.97 105.19 104.08 3g42 n GLY 391 Ca -0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 3g42 n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g42 s LYS 392 N -0.38 1.41 0.18 1.61 -2.85 -1.09 -5.14 119.74 113.48 3g42 s LYS 392 Ca 0.00 -1.61 -0.30 0.00 -1.00 0.00 0.00 55.97 53.06 3g42 s LYS 392 Cb 0.00 0.33 -0.08 0.00 -2.06 0.00 0.00 37.83 36.03 3g42 s LYS 392 CO 0.00 -0.51 1.10 0.99 0.10 0.00 0.00 175.35 177.02 3g42 s THR 393 N -3.94 3.86 0.77 3.79 2.01 -1.26 -1.11 115.64 119.76 3g42 s THR 393 Ca 0.35 1.62 -0.11 0.00 0.31 0.00 0.00 61.69 63.86 3g42 s THR 393 Cb 0.04 -4.03 0.06 0.00 0.01 0.00 0.00 72.50 68.57 3g42 s THR 393 CO 0.14 0.28 1.09 0.27 -0.69 0.00 0.00 174.62 175.71 3g42 s ILE 394 N -0.29 3.29 0.58 1.82 -4.36 0.26 -4.87 121.20 117.63 3g42 s ILE 394 Ca 0.49 0.42 -0.19 0.00 -0.26 0.00 0.00 60.65 61.11 3g42 s ILE 394 Cb -0.29 -3.16 -0.04 0.00 1.25 0.00 0.00 42.46 40.22 3g42 s ILE 394 CO 0.35 -0.55 1.15 -0.76 0.24 0.00 0.00 174.94 175.37 3g42 s LEU 395 N -5.73 3.67 0.23 0.37 1.43 -1.26 -4.85 118.68 112.54 3g42 s LEU 395 Ca 0.60 2.20 -0.07 0.00 -1.03 0.00 0.00 54.13 55.83 3g42 s LEU 395 Cb -0.14 -4.58 0.28 0.00 0.03 0.00 0.00 46.19 41.77 3g42 s LEU 395 CO 0.54 -1.39 1.84 0.74 0.23 0.00 0.00 176.35 178.32 3g42 h THR 396 N 0.91 1.05 0.00 5.49 2.02 -2.00 0.11 112.91 120.50 3g42 h THR 396 Ca -0.50 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.36 3g42 h THR 396 Cb 1.27 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 3g42 h THR 396 CO 0.56 0.16 -0.09 0.07 0.37 0.00 0.00 175.52 176.59 3g42 h LYS 397 N 0.90 0.00 0.19 6.66 2.10 -1.97 -1.90 116.57 122.55 3g42 h LYS 397 Ca 0.34 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.68 3g42 h LYS 397 Cb 0.12 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.48 3g42 h LYS 397 CO -0.15 0.09 -1.36 0.93 -2.00 0.00 0.00 179.45 176.96 3g42 h GLU 398 N 0.00 0.41 -0.40 0.07 5.08 -1.35 -3.02 114.58 115.37 3g42 h GLU 398 Ca -0.00 -0.70 0.00 0.00 -1.00 0.00 0.00 59.36 57.66 3g42 h GLU 398 Cb 0.34 0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3g42 h GLU 398 CO 0.01 1.33 0.25 0.00 -1.00 0.00 0.00 179.01 179.61 3g42 h ALA 399 N 0.37 0.51 -0.74 3.43 0.00 -0.40 -0.87 119.26 121.57 3g42 h ALA 399 Ca -0.19 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 54.76 3g42 h ALA 399 Cb 2.07 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 19.63 3g42 h ALA 399 CO 0.24 -0.01 0.39 -0.44 0.00 0.00 0.00 179.25 179.43 3g42 h ASP 400 N 0.54 0.53 -0.45 0.00 5.19 -1.45 -1.92 116.42 118.86 3g42 h ASP 400 Ca 0.15 0.05 -0.06 0.00 -0.62 0.00 0.00 57.03 56.55 3g42 h ASP 400 Cb -0.03 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.43 3g42 h ASP 400 CO -0.03 0.31 0.03 -0.07 -3.12 0.00 0.00 179.24 176.36 3g42 h LEU 401 N 0.66 0.75 -0.07 1.55 3.38 -1.28 -0.71 115.31 119.60 3g42 h LEU 401 Ca 0.36 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3g42 h LEU 401 Cb 0.35 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3g42 h LEU 401 CO -0.25 0.86 0.04 0.58 0.09 0.00 0.00 178.44 179.76 3g42 h VAL 402 N 0.63 1.06 -0.54 1.22 2.07 -0.73 0.18 116.25 120.14 3g42 h VAL 402 Ca 0.13 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 3g42 h VAL 402 Cb 0.45 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 3g42 h VAL 402 CO 0.02 0.05 0.14 0.74 0.02 0.00 0.00 177.57 178.54 3g42 h THR 403 N 0.05 1.24 -0.76 2.57 2.02 -1.34 0.37 112.91 117.06 3g42 h THR 403 Ca 0.03 -0.85 0.08 0.00 0.77 0.00 0.00 66.41 66.44 3g42 h THR 403 Cb 0.04 0.77 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 3g42 h THR 403 CO -0.00 0.31 0.42 0.74 0.37 0.00 0.00 175.52 177.36 3g42 h THR 404 N 0.75 0.93 -0.21 3.16 2.02 -0.90 0.53 112.91 119.20 3g42 h THR 404 Ca 0.17 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 3g42 h THR 404 Cb 0.32 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 3g42 h THR 404 CO -0.00 0.14 -0.04 -0.74 0.37 0.00 0.00 175.52 175.25 3g42 h HIS 405 N 0.74 0.44 -0.31 3.16 6.17 -0.50 -0.21 115.15 124.64 3g42 h HIS 405 Ca 0.35 -0.09 -0.05 0.00 0.71 0.00 0.00 60.37 61.29 3g42 h HIS 405 Cb 0.28 -0.11 -0.01 0.00 2.52 0.00 0.00 27.41 30.09 3g42 h HIS 405 CO -0.07 0.62 -0.02 0.93 0.71 0.00 0.00 177.93 180.10 3g42 h GLU 406 N 0.13 0.55 -0.09 5.26 4.39 -0.60 -1.42 114.58 122.80 3g42 h GLU 406 Ca 0.05 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 3g42 h GLU 406 Cb 0.47 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 3g42 h GLU 406 CO 0.02 0.71 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.47 3g42 h LEU 407 N 0.34 0.11 -0.43 1.33 4.07 -0.91 -1.18 115.31 118.65 3g42 h LEU 407 Ca 0.08 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.04 3g42 h LEU 407 Cb 0.47 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 3g42 h LEU 407 CO 0.02 0.17 0.28 1.23 -1.08 0.00 0.00 178.44 179.06 3g42 h GLY 408 N 0.37 0.60 0.98 0.83 0.00 -0.10 0.20 103.07 105.94 3g42 h GLY 408 Ca 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 3g42 h GLY 408 CO 0.01 0.22 0.28 0.45 0.00 0.00 0.00 176.54 177.49 3g42 h HIS 409 N 0.58 0.78 -0.94 5.60 3.86 -0.25 -0.41 115.15 124.35 3g42 h HIS 409 Ca 0.16 -0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.40 3g42 h HIS 409 Cb -0.06 -0.24 -0.07 0.00 1.06 0.00 0.00 27.41 28.10 3g42 h HIS 409 CO -0.05 0.59 0.60 -0.91 0.86 0.00 0.00 177.93 179.03 3g42 h ASN 410 N 0.74 0.95 0.37 2.45 -0.26 -0.31 -0.09 115.58 119.42 3g42 h ASN 410 Ca 0.19 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.94 3g42 h ASN 410 Cb 0.10 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.17 3g42 h ASN 410 CO -0.03 0.60 0.00 0.49 -1.06 0.00 0.00 177.43 177.43 3g42 n PHE 411 N -4.56 0.00 0.00 1.19 3.01 0.60 -0.98 117.46 116.72 3g42 n PHE 411 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.60 3g42 n PHE 411 Cb 0.19 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.39 3g42 n PHE 411 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g42 n GLY 412 N 0.45 0.89 3.78 1.37 0.00 -0.25 -4.38 105.19 107.05 3g42 n GLY 412 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3g42 n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g42 s ALA 413 N -2.00 3.47 0.55 4.61 0.00 -0.22 -4.44 121.76 123.74 3g42 s ALA 413 Ca 0.00 0.21 0.09 0.00 0.00 0.00 0.00 51.96 52.26 3g42 s ALA 413 Cb 0.00 -2.85 0.07 0.00 0.00 0.00 0.00 23.12 20.34 3g42 s ALA 413 CO 0.00 0.25 0.71 -1.21 0.00 0.00 0.00 175.76 175.52 3g42 s GLU 414 N -0.77 2.35 0.43 0.00 0.41 -1.26 -4.00 118.70 115.86 3g42 s GLU 414 Ca 0.34 -1.65 -0.25 0.00 -0.41 0.00 0.00 54.97 53.00 3g42 s GLU 414 Cb -0.21 -2.58 -0.08 0.00 -1.78 0.00 0.00 34.13 29.48 3g42 s GLU 414 CO 0.22 -0.76 1.27 -1.01 -0.49 0.00 0.00 175.26 174.49 3g42 s HIS 415 N -2.65 2.80 0.23 1.61 3.76 -1.26 -4.88 115.29 114.91 3g42 s HIS 415 Ca 0.57 1.45 -0.31 0.00 -0.15 0.00 0.00 55.06 56.62 3g42 s HIS 415 Cb -0.06 -3.59 -0.11 0.00 1.11 0.00 0.00 32.58 29.93 3g42 s HIS 415 CO 0.36 -1.97 1.58 -0.51 -0.85 0.00 0.00 174.74 173.35 3g42 s ASP 416 N -0.93 6.49 0.00 1.40 1.01 -0.21 -4.94 116.67 119.50 3g42 s ASP 416 Ca 0.60 2.78 0.00 0.00 0.71 0.00 0.00 52.55 56.64 3g42 s ASP 416 Cb -0.36 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 40.96 3g42 s ASP 416 CO 0.45 -0.85 0.08 -2.65 0.21 0.00 0.00 175.17 172.41 3g42 n PRO 417 N 3.01 0.00 0.00 8.23 -0.02 -1.26 -4.58 135.00 140.38 3g42 n PRO 417 Ca 0.11 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3g42 n PRO 417 Cb 0.38 -0.46 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 3g42 n PRO 417 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3g42 n ASP 418 N -0.20 0.00 0.21 2.55 4.64 -1.26 -4.83 116.55 117.66 3g42 n ASP 418 Ca 0.00 0.00 0.14 0.00 -1.38 0.00 0.00 54.79 53.55 3g42 n ASP 418 Cb 0.00 0.00 0.49 0.00 -1.04 0.00 0.00 41.12 40.57 3g42 n ASP 418 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 3g42 h GLY 419 N 0.00 0.00 -7.26 0.27 0.00 -1.95 -3.39 103.07 90.75 3g42 h GLY 419 Ca 0.00 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 46.57 3g42 h GLY 419 CO 0.00 0.00 -0.18 1.08 0.00 0.00 0.00 176.54 177.44 3g42 s LEU 420 N -5.60 6.24 0.49 3.11 1.02 -1.26 -4.94 118.68 117.75 3g42 s LEU 420 Ca 0.04 -1.99 0.29 0.00 0.02 0.00 0.00 54.13 52.49 3g42 s LEU 420 Cb 0.09 -2.19 1.38 0.00 0.02 0.00 0.00 46.19 45.49 3g42 s LEU 420 CO 0.55 -0.78 1.83 0.00 0.02 0.00 0.00 176.35 177.96 3g42 h ALA 421 N 8.61 2.74 -0.22 4.21 0.00 -1.82 0.62 119.26 133.40 3g42 h ALA 421 Ca -0.21 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3g42 h ALA 421 Cb 1.08 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3g42 h ALA 421 CO 0.96 -1.06 -0.23 1.49 0.00 0.00 0.00 179.25 180.41 3g42 h GLU 422 N 0.13 0.40 -0.20 0.00 4.81 -1.95 -2.40 114.58 115.37 3g42 h GLU 422 Ca 0.52 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 3g42 h GLU 422 Cb 1.81 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.16 3g42 h GLU 422 CO -0.09 0.61 0.00 0.00 -0.73 0.00 0.00 179.01 178.80 3g42 n ALA 424 N 1.17 -0.32 -0.89 0.00 0.00 -0.83 -4.53 120.51 115.10 3g42 n ALA 424 Ca 0.17 -1.93 -0.31 0.00 0.00 0.00 0.00 53.44 51.37 3g42 n ALA 424 Cb 0.55 -1.17 0.14 0.00 0.00 0.00 0.00 19.45 18.96 3g42 n ALA 424 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3g42 s PRO 425 N 0.03 1.42 0.79 0.00 0.02 -0.93 -4.63 135.00 131.69 3g42 s PRO 425 Ca 0.31 1.47 -0.12 0.00 0.02 0.00 0.00 61.00 62.68 3g42 s PRO 425 Cb 0.24 -1.78 0.06 0.00 0.02 0.00 0.00 34.50 33.05 3g42 s PRO 425 CO -0.17 -2.32 1.11 -0.80 -0.33 0.00 0.00 177.00 174.49 3g42 s ASN 426 N -2.81 4.61 0.46 2.53 0.01 -1.26 -3.85 114.94 114.64 3g42 s ASN 426 Ca 0.66 1.19 0.20 0.00 -0.71 0.00 0.00 52.86 54.19 3g42 s ASN 426 Cb -0.22 -1.90 1.18 0.00 0.41 0.00 0.00 41.25 40.72 3g42 s ASN 426 CO 0.56 -1.88 1.93 -0.08 -1.51 0.00 0.00 177.10 176.12 3g42 h GLU 427 N -1.03 0.26 0.00 -0.60 4.81 -1.93 -0.21 114.58 115.88 3g42 h GLU 427 Ca -0.47 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 3g42 h GLU 427 Cb 1.28 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 3g42 h GLU 427 CO 0.61 0.17 -0.14 -0.44 -0.73 0.00 0.00 179.01 178.49 3g42 h ASP 428 N 0.27 0.00 -0.67 1.04 3.45 -1.97 -2.83 116.42 115.71 3g42 h ASP 428 Ca 0.36 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.47 3g42 h ASP 428 Cb 1.00 0.00 -0.20 0.00 -0.56 0.00 0.00 39.33 39.57 3g42 h ASP 428 CO -0.09 0.14 0.28 0.00 -1.57 0.00 0.00 179.24 178.00 3g42 n GLN 429 N -4.30 2.10 0.00 3.56 3.00 -0.18 -4.88 117.38 116.68 3g42 n GLN 429 Ca -0.03 -3.10 0.00 0.00 -0.01 0.00 0.00 57.00 53.86 3g42 n GLN 429 Cb 0.21 -2.00 0.00 0.00 0.00 0.00 0.00 30.24 28.45 3g42 n GLN 429 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3g42 n GLY 430 N -1.10 0.39 4.53 1.08 0.00 -1.07 -4.84 105.19 104.17 3g42 n GLY 430 Ca 0.46 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.50 3g42 n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g42 n GLY 431 N -1.67 -1.97 3.79 -0.02 0.00 -0.67 -0.04 105.19 104.62 3g42 n GLY 431 Ca 0.00 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 3g42 n GLY 431 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g42 s LYS 432 N -0.48 2.92 0.62 1.61 -0.14 -1.25 -4.14 119.74 118.89 3g42 s LYS 432 Ca 0.00 1.19 -0.04 0.00 -1.36 0.00 0.00 55.97 55.77 3g42 s LYS 432 Cb 0.00 -1.98 0.04 0.00 -1.68 0.00 0.00 37.83 34.21 3g42 s LYS 432 CO 0.00 -1.13 0.90 0.71 -0.76 0.00 0.00 175.35 175.07 3g42 s TYR 433 N -2.63 2.96 0.48 3.18 1.51 -1.26 -1.66 117.35 119.93 3g42 s TYR 433 Ca 0.63 0.31 0.19 0.00 -1.01 0.00 0.00 57.07 57.18 3g42 s TYR 433 Cb -0.17 -2.94 1.20 0.00 -0.11 0.00 0.00 41.96 39.94 3g42 s TYR 433 CO 0.45 -1.10 1.98 -0.24 -1.11 0.00 0.00 175.55 175.54 3g42 h VAL 434 N -0.27 0.82 -0.20 0.71 3.04 -0.67 -2.00 116.25 117.68 3g42 h VAL 434 Ca -0.44 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 3g42 h VAL 434 Cb 1.30 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 3g42 h VAL 434 CO 0.57 0.04 0.00 0.23 -1.01 0.00 0.00 177.57 177.41 3g42 n MET 435 N -4.44 1.93 -2.01 4.17 2.81 -1.26 -4.79 117.12 113.53 3g42 n MET 435 Ca 0.10 -0.91 -0.41 0.00 -1.81 0.00 0.00 57.70 54.67 3g42 n MET 435 Cb 0.48 -1.51 -0.02 0.00 -0.71 0.00 0.00 33.22 31.46 3g42 n MET 435 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3g42 s TYR 436 N -1.60 2.94 0.49 2.03 5.04 -0.75 -1.04 117.35 124.46 3g42 s TYR 436 Ca 0.16 1.20 0.18 0.00 -2.44 0.00 0.00 57.07 56.17 3g42 s TYR 436 Cb 0.11 -3.81 1.22 0.00 0.35 0.00 0.00 41.96 39.83 3g42 s TYR 436 CO 0.07 -2.44 2.05 -1.00 -1.34 0.00 0.00 175.55 172.88 3g42 h PRO 437 N 4.01 0.14 -5.17 4.97 0.13 -1.90 -3.39 132.00 130.79 3g42 h PRO 437 Ca -0.48 -0.01 -0.62 0.00 -0.87 0.00 0.00 66.00 64.02 3g42 h PRO 437 Cb 1.22 -0.03 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 3g42 h PRO 437 CO 0.70 0.09 -0.32 0.42 -0.23 0.00 0.00 178.00 178.67 3g42 s ILE 438 N -5.16 5.23 -0.40 -3.56 1.01 -1.26 -5.00 121.20 112.06 3g42 s ILE 438 Ca -0.06 0.47 -0.40 0.00 0.00 0.00 0.00 60.65 60.66 3g42 s ILE 438 Cb 0.19 -3.64 -0.16 0.00 0.01 0.00 0.00 42.46 38.86 3g42 s ILE 438 CO 0.72 0.23 2.01 0.00 0.00 0.00 0.00 174.94 177.90 3g42 n ALA 439 N 4.89 0.26 -1.18 9.38 0.00 -1.26 -4.92 120.51 127.68 3g42 n ALA 439 Ca -0.10 0.18 -0.32 0.00 0.00 0.00 0.00 53.44 53.20 3g42 n ALA 439 Cb 0.51 -2.26 0.10 0.00 0.00 0.00 0.00 19.45 17.81 3g42 n ALA 439 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3g42 s VAL 440 N 5.57 2.79 0.10 0.00 -7.23 -1.26 -4.95 120.40 115.42 3g42 s VAL 440 Ca 1.10 0.30 0.07 0.00 -1.81 0.00 0.00 61.98 61.64 3g42 s VAL 440 Cb -1.18 -2.69 -0.21 0.00 0.56 0.00 0.00 36.38 32.85 3g42 s VAL 440 CO 0.62 -0.29 1.20 0.77 -0.31 0.00 0.00 175.10 177.08 3g42 h SER 441 N -0.93 0.01 0.00 4.85 4.64 -1.97 -3.48 113.55 116.68 3g42 h SER 441 Ca -0.45 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3g42 h SER 441 Cb 1.26 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3g42 h SER 441 CO 0.49 1.01 0.00 0.61 -0.87 0.00 0.00 176.83 178.07 3g42 n GLY 442 N 1.38 0.36 0.18 -0.77 0.00 -1.26 -4.80 105.19 100.28 3g42 n GLY 442 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 3g42 n GLY 442 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3g42 h ASP 443 N 0.00 0.00 -3.09 1.61 3.32 -1.99 -3.46 116.42 112.80 3g42 h ASP 443 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 3g42 h ASP 443 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3g42 h ASP 443 CO 0.00 0.36 -0.35 -1.00 -1.72 0.00 0.00 179.24 176.53 3g42 s HIS 444 N -3.35 3.50 0.18 4.55 3.76 -1.26 -5.03 115.29 117.64 3g42 s HIS 444 Ca 0.02 0.52 -0.26 0.00 -0.15 0.00 0.00 55.06 55.19 3g42 s HIS 444 Cb 0.09 -1.97 0.04 0.00 1.11 0.00 0.00 32.58 31.85 3g42 s HIS 444 CO 0.69 0.48 1.55 1.49 -0.85 0.00 0.00 174.74 178.10 3g42 h GLU 445 N 3.03 -0.03 0.00 1.40 4.57 -1.87 -1.53 114.58 120.15 3g42 h GLU 445 Ca -0.46 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3g42 h GLU 445 Cb 1.17 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 3g42 h GLU 445 CO 0.72 -0.02 0.00 -0.91 -1.18 0.00 0.00 179.01 177.62 3g42 h ASN 446 N -0.03 0.00 -0.98 1.04 2.35 -0.68 -3.36 115.58 113.92 3g42 h ASN 446 Ca 0.22 0.00 0.34 0.00 -0.55 0.00 0.00 56.30 56.31 3g42 h ASN 446 Cb 0.49 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 38.69 3g42 h ASN 446 CO -0.93 0.00 0.42 0.78 -1.65 0.00 0.00 177.43 176.06 3g42 h ASN 447 N 0.00 0.21 -0.62 5.81 -0.26 -0.33 0.23 115.58 120.63 3g42 h ASN 447 Ca 0.00 0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.97 3g42 h ASN 447 Cb 0.55 0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 3g42 h ASN 447 CO 0.00 -0.28 0.00 2.29 -1.06 0.00 0.00 177.43 178.38 3g42 n LYS 448 N -5.22 3.75 -4.16 0.81 2.85 -1.26 -2.05 118.16 112.89 3g42 n LYS 448 Ca 0.31 -2.88 -0.23 0.00 -1.05 0.00 0.00 58.31 54.46 3g42 n LYS 448 Cb 1.02 -1.89 -0.06 0.00 -0.65 0.00 0.00 35.03 33.44 3g42 n LYS 448 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 3g42 s MET 449 N -1.92 2.42 -0.07 -1.58 -1.94 0.07 -4.88 119.30 111.40 3g42 s MET 449 Ca 0.50 -1.44 -0.11 0.00 -1.71 0.00 0.00 55.69 52.92 3g42 s MET 449 Cb 0.33 -2.22 -0.05 0.00 2.01 0.00 0.00 34.83 34.90 3g42 s MET 449 CO 0.23 0.23 0.28 -0.06 -0.01 0.00 0.00 175.02 175.69 3g42 s PHE 450 N -2.36 3.65 0.94 -0.03 0.08 -1.26 -1.51 117.98 117.49 3g42 s PHE 450 Ca 0.35 0.75 -0.12 0.00 0.12 0.00 0.00 56.93 58.03 3g42 s PHE 450 Cb -0.04 -2.14 0.16 0.00 -0.57 0.00 0.00 43.02 40.42 3g42 s PHE 450 CO 0.22 0.65 1.13 -1.54 -0.10 0.00 0.00 175.22 175.57 3g42 s SER 451 N -0.91 3.22 0.51 1.36 1.04 -1.26 -4.79 113.70 112.88 3g42 s SER 451 Ca 0.19 1.00 0.27 0.00 0.48 0.00 0.00 55.95 57.90 3g42 s SER 451 Cb -0.14 -1.59 1.40 0.00 0.10 0.00 0.00 66.02 65.78 3g42 s SER 451 CO 0.08 -2.74 2.04 1.56 0.98 0.00 0.00 173.24 175.17 3g42 h GLN 452 N -1.63 0.00 -0.28 4.02 1.08 -1.93 -0.29 115.11 116.09 3g42 h GLN 452 Ca -0.52 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 56.57 3g42 h GLN 452 Cb 1.33 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.76 3g42 h GLN 452 CO 0.60 0.13 -0.26 0.00 -0.95 0.00 0.00 178.83 178.35 3g42 h SER 454 N 0.39 0.85 -0.51 0.00 0.02 -1.70 -2.83 113.55 109.77 3g42 h SER 454 Ca 0.05 -0.47 0.04 0.00 -0.84 0.00 0.00 61.79 60.57 3g42 h SER 454 Cb 0.82 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.08 3g42 h SER 454 CO 0.07 1.14 0.26 0.11 -1.14 0.00 0.00 176.83 177.27 3g42 h LYS 455 N 0.57 0.49 -0.07 3.45 1.57 -1.05 0.44 116.57 121.96 3g42 h LYS 455 Ca 0.05 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3g42 h LYS 455 Cb 0.91 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 3g42 h LYS 455 CO 0.08 0.32 0.04 1.96 -0.57 0.00 0.00 179.45 181.28 3g42 h GLN 456 N 0.50 0.11 -0.42 3.15 4.20 -1.40 0.29 115.11 121.54 3g42 h GLN 456 Ca 0.22 -0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.93 3g42 h GLN 456 Cb 0.13 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 3g42 h GLN 456 CO -0.16 0.18 0.27 0.77 -0.67 0.00 0.00 178.83 179.23 3g42 h SER 457 N 0.00 0.47 -0.00 1.46 0.02 -1.23 -2.36 113.55 111.91 3g42 h SER 457 Ca 0.03 -0.01 -0.18 0.00 -0.84 0.00 0.00 61.79 60.79 3g42 h SER 457 Cb 0.11 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 3g42 h SER 457 CO -0.00 0.34 -0.63 0.40 -1.14 0.00 0.00 176.83 175.80 3g42 h ILE 458 N 0.55 1.32 -0.11 3.27 2.04 -0.83 -2.75 117.51 121.01 3g42 h ILE 458 Ca 0.16 -1.89 0.01 0.00 1.00 0.00 0.00 64.86 64.14 3g42 h ILE 458 Cb -0.05 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3g42 h ILE 458 CO -0.04 0.59 0.01 0.22 0.00 0.00 0.00 178.15 178.93 3g42 h TYR 459 N 0.45 0.02 -0.96 1.37 3.20 -0.26 0.22 116.97 121.02 3g42 h TYR 459 Ca -0.01 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.88 3g42 h TYR 459 Cb 1.20 0.01 -0.05 0.00 1.54 0.00 0.00 36.73 39.43 3g42 h TYR 459 CO 0.06 0.00 0.64 0.87 -1.64 0.00 0.00 178.16 178.09 3g42 h LYS 460 N 0.06 1.25 -0.02 1.82 6.56 -1.45 0.51 116.57 125.29 3g42 h LYS 460 Ca 0.05 -0.08 -0.01 0.00 -1.06 0.00 0.00 60.65 59.56 3g42 h LYS 460 Cb 0.05 -0.28 -0.00 0.00 -0.57 0.00 0.00 32.23 31.42 3g42 h LYS 460 CO -0.07 0.83 -0.01 1.15 -2.06 0.00 0.00 179.45 179.29 3g42 h THR 461 N 1.29 1.32 -0.58 -0.16 2.02 -1.11 -2.64 112.91 113.05 3g42 h THR 461 Ca 0.36 -0.96 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 3g42 h THR 461 Cb -0.13 1.92 -0.03 0.00 -1.74 0.00 0.00 68.15 68.17 3g42 h THR 461 CO -0.08 0.26 0.32 0.40 0.37 0.00 0.00 175.52 176.79 3g42 h ILE 462 N -0.34 1.19 -0.81 3.11 2.04 -0.42 0.46 117.51 122.73 3g42 h ILE 462 Ca 0.01 -0.46 0.13 0.00 1.00 0.00 0.00 64.86 65.53 3g42 h ILE 462 Cb 0.42 0.44 -0.09 0.00 -0.74 0.00 0.00 36.82 36.85 3g42 h ILE 462 CO 0.00 0.20 0.41 -0.08 0.00 0.00 0.00 178.15 178.68 3g42 h GLU 463 N 0.78 0.61 0.09 2.37 4.81 -0.88 0.26 114.58 122.62 3g42 h GLU 463 Ca 0.20 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.25 3g42 h GLU 463 Cb 0.03 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.29 3g42 h GLU 463 CO -0.03 0.40 -0.64 1.03 -0.73 0.00 0.00 179.01 179.04 3g42 h SER 464 N 0.62 0.41 0.91 1.04 0.87 -1.06 -3.39 113.55 112.95 3g42 h SER 464 Ca 0.43 -0.91 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 3g42 h SER 464 Cb 0.55 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 3g42 h SER 464 CO -0.33 1.29 -0.72 0.11 -0.53 0.00 0.00 176.83 176.64 3g42 h LYS 465 N -0.41 0.00 -0.16 2.24 1.79 -0.73 -3.40 116.57 115.90 3g42 h LYS 465 Ca -0.11 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.41 3g42 h LYS 465 Cb 1.46 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 32.05 3g42 h LYS 465 CO 0.12 0.00 -0.26 0.00 -1.08 0.00 0.00 179.45 178.23 3g42 h ALA 466 N 2.37 -0.23 0.00 3.86 0.00 -0.67 -0.94 119.26 123.66 3g42 h ALA 466 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3g42 h ALA 466 Cb 0.81 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 3g42 h ALA 466 CO 0.00 -0.71 -0.04 1.96 0.00 0.00 0.00 179.25 180.46 3g42 h GLN 467 N -0.31 0.00 0.08 0.00 7.50 -1.81 0.10 115.11 120.67 3g42 h GLN 467 Ca 0.11 0.00 -0.13 0.00 0.50 0.00 0.00 58.65 59.13 3g42 h GLN 467 Cb 0.48 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.02 3g42 h GLN 467 CO -0.34 0.04 -0.61 1.49 -1.50 0.00 0.00 178.83 177.91 3g42 h GLU 468 N 0.00 0.18 0.00 1.46 4.81 -1.45 -3.43 114.58 116.15 3g42 h GLU 468 Ca -0.00 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 3g42 h GLU 468 Cb 0.11 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.61 3g42 h GLU 468 CO 0.01 1.15 0.00 0.00 -0.73 0.00 0.00 179.01 179.43 3g42 s PHE 470 N -0.09 3.42 0.42 0.00 0.40 0.01 -4.61 117.98 117.53 3g42 s PHE 470 Ca 0.00 1.25 0.03 0.00 -0.60 0.00 0.00 56.93 57.61 3g42 s PHE 470 Cb 0.00 -2.59 -0.01 0.00 0.51 0.00 0.00 43.02 40.92 3g42 s PHE 470 CO 0.00 -0.11 0.11 1.04 0.70 0.00 0.00 175.22 176.96 3g42 n GLN 471 N -1.03 0.63 -2.47 0.44 6.02 0.14 -4.76 117.38 116.35 3g42 n GLN 471 Ca 0.04 -3.46 -0.25 0.00 -0.01 0.00 0.00 57.00 53.32 3g42 n GLN 471 Cb 0.54 1.66 0.04 0.00 1.02 0.00 0.00 30.24 33.50 3g42 n GLN 471 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 3g42 s GLU 472 N -3.59 2.71 0.00 -1.09 -1.05 -1.21 -0.25 118.70 114.21 3g42 s GLU 472 Ca 0.16 -0.26 0.00 0.00 -0.15 0.00 0.00 54.97 54.72 3g42 s GLU 472 Cb 0.01 -2.32 0.00 0.00 -0.44 0.00 0.00 34.13 31.38 3g42 s GLU 472 CO 0.11 -0.77 0.00 0.54 0.95 0.00 0.00 175.26 176.09