#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fby s SER 224 N 0.00 7.02 0.60 0.53 1.04 -1.26 -5.07 113.70 116.56 3fby s SER 224 Ca 0.00 2.13 0.06 0.00 0.48 0.00 0.00 55.95 58.62 3fby s SER 224 Cb 0.00 -2.60 0.10 0.00 0.10 0.00 0.00 66.02 63.62 3fby s SER 224 CO 0.00 -0.31 0.81 0.00 0.98 0.00 0.00 173.24 174.72 3fby n ALA 225 N 0.55 0.82 -1.75 5.32 0.00 -1.26 -5.09 120.51 119.09 3fby n ALA 225 Ca 0.02 -1.90 -0.40 0.00 0.00 0.00 0.00 53.44 51.16 3fby n ALA 225 Cb 0.47 0.45 -0.06 0.00 0.00 0.00 0.00 19.45 20.32 3fby n ALA 225 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3fby s GLN 226 N -4.60 4.82 0.40 0.00 -0.21 -1.26 -5.07 119.66 113.74 3fby s GLN 226 Ca 0.58 1.54 0.07 0.00 0.02 0.00 0.00 55.36 57.57 3fby s GLN 226 Cb -0.04 -3.26 -0.08 0.00 1.00 0.00 0.00 33.01 30.63 3fby s GLN 226 CO 0.37 0.46 -0.01 -0.98 -2.12 0.00 0.00 175.29 173.02 3fby s ARG 227 N -1.24 1.93 0.36 2.91 1.04 -1.26 -5.03 118.95 117.67 3fby s ARG 227 Ca 0.42 -2.08 -0.04 0.00 -1.04 0.00 0.00 55.73 52.98 3fby s ARG 227 Cb -0.27 -1.63 -0.05 0.00 -2.04 0.00 0.00 34.95 30.96 3fby s ARG 227 CO 0.33 -0.02 0.63 -0.06 -0.04 0.00 0.00 175.30 176.14 3fby s PHE 228 N -2.71 3.50 0.83 5.89 0.40 -1.26 -1.96 117.98 122.68 3fby s PHE 228 Ca 0.35 0.66 -0.11 0.00 -0.60 0.00 0.00 56.93 57.23 3fby s PHE 228 Cb 0.09 -2.14 0.09 0.00 0.51 0.00 0.00 43.02 41.57 3fby s PHE 228 CO 0.18 0.02 1.09 0.00 0.70 0.00 0.00 175.22 177.21 3fby h PRO 230 N -1.28 0.00 -0.54 0.00 0.11 -1.88 0.29 132.00 128.70 3fby h PRO 230 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fby h PRO 230 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3fby h PRO 230 CO 0.56 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 3fby n ASP 231 N -2.33 5.27 0.00 -2.05 3.85 -1.26 -4.95 116.55 115.08 3fby n ASP 231 Ca -0.01 -2.84 0.00 0.00 -0.71 0.00 0.00 54.79 51.23 3fby n ASP 231 Cb 0.07 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.20 3fby n ASP 231 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fby n GLY 232 N 0.56 0.52 3.85 6.12 0.00 0.10 -5.02 105.19 111.32 3fby n GLY 232 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 3fby n GLY 232 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fby s SER 233 N -2.19 6.73 0.16 1.61 1.04 -1.26 -4.81 113.70 114.98 3fby s SER 233 Ca 0.00 1.31 -0.31 0.00 0.48 0.00 0.00 55.95 57.43 3fby s SER 233 Cb 0.00 -2.39 -0.09 0.00 0.10 0.00 0.00 66.02 63.64 3fby s SER 233 CO 0.00 -0.28 1.48 -2.16 0.98 0.00 0.00 173.24 173.26 3fby s PRO 234 N -3.23 4.27 0.41 4.02 0.04 -1.26 0.45 135.00 139.70 3fby s PRO 234 Ca 0.55 2.24 -0.25 0.00 0.04 0.00 0.00 61.00 63.58 3fby s PRO 234 Cb -0.10 -3.18 -0.08 0.00 0.04 0.00 0.00 34.50 31.18 3fby s PRO 234 CO 0.20 -0.51 1.18 0.45 0.04 0.00 0.00 177.00 178.37 3fby s SER 235 N 0.98 6.41 -0.12 6.66 0.15 -0.83 -4.71 113.70 122.25 3fby s SER 235 Ca 0.66 2.37 0.15 0.00 0.70 0.00 0.00 55.95 59.83 3fby s SER 235 Cb -0.41 -2.61 0.40 0.00 -1.71 0.00 0.00 66.02 61.69 3fby s SER 235 CO 0.33 -0.75 1.30 -0.62 1.20 0.00 0.00 173.24 174.70 3fby n GLU 236 N -0.06 2.58 -1.80 5.44 1.02 -1.26 -4.85 120.64 121.71 3fby n GLU 236 Ca 0.05 -2.55 -0.29 0.00 -0.02 0.00 0.00 57.16 54.35 3fby n GLU 236 Cb 0.47 -1.61 0.14 0.00 -0.02 0.00 0.00 31.44 30.41 3fby n GLU 236 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3fby s HIS 238 N -3.60 1.77 0.28 0.00 2.46 -0.67 -4.92 115.29 110.62 3fby s HIS 238 Ca 0.67 1.12 0.26 0.00 0.47 0.00 0.00 55.06 57.57 3fby s HIS 238 Cb -0.09 -3.19 1.19 0.00 -0.13 0.00 0.00 32.58 30.37 3fby s HIS 238 CO 0.51 -3.29 1.95 1.49 -2.47 0.00 0.00 174.74 172.94 3fby h GLU 239 N -2.19 0.00 -0.80 2.88 4.81 -1.91 -3.07 114.58 114.31 3fby h GLU 239 Ca -0.57 0.00 -0.48 0.00 -0.13 0.00 0.00 59.36 58.18 3fby h GLU 239 Cb 1.33 0.00 -0.42 0.00 0.63 0.00 0.00 28.75 30.29 3fby h GLU 239 CO 0.54 0.18 -0.89 0.72 -0.73 0.00 0.00 179.01 178.82 3fby n HIS 240 N -3.51 2.43 -4.38 0.92 8.25 -1.26 -5.03 115.22 112.65 3fby n HIS 240 Ca -0.01 -2.35 -0.19 0.00 -0.26 0.00 0.00 57.72 54.91 3fby n HIS 240 Cb 0.33 -0.28 -0.10 0.00 1.12 0.00 0.00 29.99 31.06 3fby n HIS 240 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fby s ALA 241 N -3.61 2.01 0.07 -1.41 0.00 -1.16 -1.35 121.76 116.30 3fby s ALA 241 Ca 0.44 -1.92 0.09 0.00 0.00 0.00 0.00 51.96 50.57 3fby s ALA 241 Cb 0.39 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 24.20 3fby s ALA 241 CO -0.01 -0.33 -0.24 -0.51 0.00 0.00 0.00 175.76 174.67 3fby s ASP 242 N -3.38 2.88 -0.34 0.00 1.01 0.46 -4.73 116.67 112.56 3fby s ASP 242 Ca 0.34 -0.61 -0.21 0.00 0.71 0.00 0.00 52.55 52.78 3fby s ASP 242 Cb 0.07 -0.23 0.00 0.00 1.01 0.00 0.00 42.92 43.78 3fby s ASP 242 CO 0.13 0.18 0.66 0.00 0.21 0.00 0.00 175.17 176.36 3fby s VAL 244 N 2.76 2.46 0.29 0.00 0.11 0.21 -4.40 120.40 121.84 3fby s VAL 244 Ca 0.26 -0.89 -0.29 0.00 -2.93 0.00 0.00 61.98 58.13 3fby s VAL 244 Cb -0.14 -1.97 -0.10 0.00 -1.53 0.00 0.00 36.38 32.64 3fby s VAL 244 CO 0.14 0.55 1.19 -0.76 -3.33 0.00 0.00 175.10 172.89 3fby s LEU 245 N 0.16 4.50 0.46 2.54 2.01 -1.26 -1.75 118.68 125.34 3fby s LEU 245 Ca -0.11 2.43 -0.03 0.00 0.01 0.00 0.00 54.13 56.44 3fby s LEU 245 Cb -0.16 -3.63 -0.02 0.00 0.01 0.00 0.00 46.19 42.38 3fby s LEU 245 CO 0.06 -0.31 0.72 -1.61 1.01 0.00 0.00 176.35 176.22 3fby s GLU 246 N -1.51 3.34 0.00 1.70 0.41 0.12 -4.94 118.70 117.81 3fby s GLU 246 Ca 0.47 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.92 3fby s GLU 246 Cb -0.35 -2.47 0.00 0.00 -1.78 0.00 0.00 34.13 29.53 3fby s GLU 246 CO 0.45 -0.20 0.67 0.54 -0.49 0.00 0.00 175.26 176.23 3fby n ARG 247 N -2.15 0.00 0.11 1.61 1.74 -1.26 -1.81 116.66 114.90 3fby n ARG 247 Ca -0.00 0.67 0.08 0.00 -0.77 0.00 0.00 57.85 57.83 3fby n ARG 247 Cb 0.56 -1.00 0.56 0.00 -1.02 0.00 0.00 32.46 31.56 3fby n ARG 247 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 3fby h ASP 248 N 0.00 0.19 0.00 0.55 2.03 -2.01 -3.45 116.42 113.74 3fby h ASP 248 Ca 0.00 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3fby h ASP 248 Cb 0.00 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 38.45 3fby h ASP 248 CO 0.00 0.13 0.00 0.61 -1.03 0.00 0.00 179.24 178.95 3fby n GLY 249 N -1.53 0.65 0.92 7.15 0.00 -0.75 -5.16 105.19 106.47 3fby n GLY 249 Ca 0.02 -0.74 -0.04 0.00 0.00 0.00 0.00 46.02 45.26 3fby n GLY 249 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fby n SER 250 N 0.00 -0.37 -4.17 1.61 3.41 -1.26 -4.95 113.62 107.89 3fby n SER 250 Ca 0.00 -1.52 -0.23 0.00 -0.26 0.00 0.00 58.87 56.86 3fby n SER 250 Cb 0.00 0.70 -0.14 0.00 -0.26 0.00 0.00 64.21 64.50 3fby n SER 250 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3fby s ARG 251 N -2.22 1.21 -0.01 4.33 1.81 -1.26 -0.71 118.95 122.10 3fby s ARG 251 Ca 0.08 -0.72 -0.06 0.00 -1.72 0.00 0.00 55.73 53.31 3fby s ARG 251 Cb -0.00 -1.22 0.00 0.00 -0.45 0.00 0.00 34.95 33.28 3fby s ARG 251 CO 0.06 0.32 0.12 -1.12 -0.68 0.00 0.00 175.30 173.99 3fby s SER 252 N -0.81 0.01 -0.07 0.23 0.01 -0.72 -4.93 113.70 107.42 3fby s SER 252 Ca 0.05 -0.12 -0.04 0.00 1.31 0.00 0.00 55.95 57.15 3fby s SER 252 Cb -0.07 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 3fby s SER 252 CO 0.01 -0.28 0.12 0.00 0.41 0.00 0.00 173.24 173.49 3fby s VAL 254 N -1.10 -0.20 0.05 0.00 1.01 0.15 -3.51 120.40 116.79 3fby s VAL 254 Ca 0.19 0.20 -0.33 0.00 0.00 0.00 0.00 61.98 62.04 3fby s VAL 254 Cb -0.12 -0.37 -0.12 0.00 0.00 0.00 0.00 36.38 35.77 3fby s VAL 254 CO 0.09 0.02 1.77 0.00 0.00 0.00 0.00 175.10 176.97 3fby s ALA 256 N 2.67 2.85 -0.11 0.00 0.00 -0.46 -4.81 121.76 121.91 3fby s ALA 256 Ca 0.85 0.15 -0.37 0.00 0.00 0.00 0.00 51.96 52.59 3fby s ALA 256 Cb -0.64 -3.16 -0.15 0.00 0.00 0.00 0.00 23.12 19.18 3fby s ALA 256 CO 0.43 -0.82 1.68 1.55 0.00 0.00 0.00 175.76 178.61 3fby n VAL 257 N -2.47 0.29 0.00 0.00 3.14 -1.26 -0.82 118.33 117.20 3fby n VAL 257 Ca 0.07 -0.05 0.00 0.00 -2.96 0.00 0.00 64.34 61.40 3fby n VAL 257 Cb 0.54 -1.35 0.00 0.00 -1.06 0.00 0.00 33.84 31.96 3fby n VAL 257 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3fby n GLY 258 N 3.84 2.08 3.20 7.55 0.00 -1.26 -3.86 105.19 116.73 3fby n GLY 258 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 3fby n GLY 258 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fby s TRP 259 N -1.94 1.11 0.13 1.61 0.52 -0.00 0.70 118.94 121.06 3fby s TRP 259 Ca 0.00 -0.71 -0.03 0.00 0.02 0.00 0.00 56.10 55.39 3fby s TRP 259 Cb 0.00 -0.59 -0.03 0.00 -1.15 0.00 0.00 33.47 31.69 3fby s TRP 259 CO 0.00 0.01 0.09 0.00 0.02 0.00 0.00 176.95 177.07 3fby s ALA 260 N -2.80 0.64 0.00 0.98 0.00 0.11 -4.53 121.76 116.16 3fby s ALA 260 Ca 0.09 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3fby s ALA 260 Cb -0.01 0.79 0.00 0.00 0.00 0.00 0.00 23.12 23.90 3fby s ALA 260 CO -0.00 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.67 3fby n GLY 261 N -0.09 0.76 3.86 0.00 0.00 -1.15 -0.98 105.19 107.59 3fby n GLY 261 Ca -0.07 -2.13 -0.31 0.00 0.00 0.00 0.00 46.02 43.51 3fby n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fby s ASN 262 N -2.14 6.28 0.00 1.61 2.20 -1.24 -4.62 114.94 117.04 3fby s ASN 262 Ca 0.00 1.46 0.03 0.00 -0.94 0.00 0.00 52.86 53.41 3fby s ASN 262 Cb 0.00 -2.48 0.15 0.00 -2.00 0.00 0.00 41.25 36.92 3fby s ASN 262 CO 0.00 -0.83 0.89 0.61 -2.94 0.00 0.00 177.10 174.83 3fby n GLY 263 N -2.47 -0.36 0.13 0.45 0.00 -1.23 -2.49 105.19 99.23 3fby n GLY 263 Ca 0.06 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 3fby n GLY 263 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3fby n ILE 264 N -1.26 1.64 -4.08 -0.61 -0.00 -1.26 -1.66 119.36 112.13 3fby n ILE 264 Ca 0.01 -0.55 -0.34 0.00 -0.00 0.00 0.00 62.75 61.88 3fby n ILE 264 Cb 0.02 -1.67 -0.15 0.00 -0.00 0.00 0.00 39.64 37.85 3fby n ILE 264 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 3fby s LEU 265 N -6.98 2.67 0.14 1.39 1.43 -1.04 -3.62 118.68 112.68 3fby s LEU 265 Ca -0.29 -0.45 0.11 0.00 -1.03 0.00 0.00 54.13 52.48 3fby s LEU 265 Cb 0.08 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 3fby s LEU 265 CO 0.67 0.01 -0.26 0.00 0.23 0.00 0.00 176.35 177.00 3fby s GLY 267 N -2.15 0.85 0.20 0.00 0.00 -0.15 -4.91 107.32 101.15 3fby s GLY 267 Ca 0.15 -1.39 -0.31 0.00 0.00 0.00 0.00 44.72 43.17 3fby s GLY 267 CO 0.07 -1.47 1.60 -1.60 0.00 0.00 0.00 173.10 171.69 3fby s ARG 268 N -3.85 4.19 -0.62 2.90 3.52 -1.26 0.04 118.95 123.87 3fby s ARG 268 Ca 0.14 2.44 -0.04 0.00 -0.13 0.00 0.00 55.73 58.14 3fby s ARG 268 Cb 0.05 -3.12 0.16 0.00 -1.56 0.00 0.00 34.95 30.49 3fby s ARG 268 CO -0.03 -0.63 0.45 0.34 -0.81 0.00 0.00 175.30 174.62 3fby s ASP 269 N 1.00 5.38 0.07 -2.12 -1.08 0.22 -1.15 116.67 118.99 3fby s ASP 269 Ca 0.69 -2.76 -0.34 0.00 -0.52 0.00 0.00 52.55 49.62 3fby s ASP 269 Cb -0.45 -1.89 -0.18 0.00 -1.46 0.00 0.00 42.92 38.94 3fby s ASP 269 CO 0.34 -0.41 1.60 0.74 0.52 0.00 0.00 175.17 177.97 3fby h THR 270 N 5.33 0.20 -0.00 1.71 2.02 -1.83 -2.99 112.91 117.35 3fby h THR 270 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3fby h THR 270 Cb 0.97 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 3fby h THR 270 CO 0.72 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.71 3fby n ASP 271 N -5.54 0.12 -1.96 4.18 5.68 -1.25 -4.77 116.55 113.01 3fby n ASP 271 Ca -0.14 -1.07 -0.13 0.00 -0.50 0.00 0.00 54.79 52.95 3fby n ASP 271 Cb 0.42 -0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.43 3fby n ASP 271 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3fby n LEU 272 N -0.89 -2.46 -0.58 -2.12 4.77 -1.13 -4.54 117.00 110.05 3fby n LEU 272 Ca 0.23 -0.22 0.05 0.00 -0.03 0.00 0.00 56.01 56.04 3fby n LEU 272 Cb 0.13 -1.86 0.14 0.00 -2.33 0.00 0.00 43.42 39.50 3fby n LEU 272 CO 0.17 0.24 0.62 -0.90 -1.33 0.00 0.00 177.39 176.20 3fby n ASP 273 N -0.75 2.90 0.00 -1.43 5.75 -1.26 -4.72 116.55 117.04 3fby n ASP 273 Ca -0.03 -2.11 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 3fby n ASP 273 Cb 0.55 -0.23 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 3fby n ASP 273 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 274 N 0.28 1.31 3.33 6.12 0.00 -1.26 -4.40 105.19 110.57 3fby n GLY 274 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 3fby n GLY 274 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fby s PHE 275 N -2.36 2.59 0.64 1.61 0.08 -1.26 -4.28 117.98 115.01 3fby s PHE 275 Ca 0.00 -0.63 -0.16 0.00 0.12 0.00 0.00 56.93 56.26 3fby s PHE 275 Cb 0.00 -1.68 -0.01 0.00 -0.57 0.00 0.00 43.02 40.77 3fby s PHE 275 CO 0.00 -0.16 1.13 -1.25 -0.10 0.00 0.00 175.22 174.84 3fby s PRO 276 N -0.10 2.81 0.03 0.24 0.04 -1.26 -4.58 135.00 132.18 3fby s PRO 276 Ca -0.04 1.51 0.14 0.00 0.04 0.00 0.00 61.00 62.65 3fby s PRO 276 Cb -0.14 -1.94 0.60 0.00 0.04 0.00 0.00 34.50 33.06 3fby s PRO 276 CO 0.04 -1.26 1.45 -0.25 0.04 0.00 0.00 177.00 177.02 3fby n ASP 277 N -2.21 0.08 -3.62 6.66 8.00 -0.30 -1.08 116.55 124.08 3fby n ASP 277 Ca 0.11 0.52 -0.15 0.00 0.71 0.00 0.00 54.79 55.99 3fby n ASP 277 Cb 0.51 -0.54 -0.07 0.00 -0.02 0.00 0.00 41.12 41.00 3fby n ASP 277 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3fby s GLU 278 N -3.04 0.84 0.22 -1.24 2.56 -1.26 -4.69 118.70 112.08 3fby s GLU 278 Ca 0.06 0.78 -0.30 0.00 0.00 0.00 0.00 54.97 55.50 3fby s GLU 278 Cb 0.08 0.40 -0.10 0.00 2.00 0.00 0.00 34.13 36.52 3fby s GLU 278 CO 0.25 -0.14 1.45 0.21 -0.56 0.00 0.00 175.26 176.47 3fby s LYS 279 N 0.02 4.27 0.16 4.30 2.20 -1.26 -4.61 119.74 124.81 3fby s LYS 279 Ca -0.02 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 57.87 3fby s LYS 279 Cb -0.04 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 3fby s LYS 279 CO 0.03 -0.44 0.33 -0.51 -0.36 0.00 0.00 175.35 174.40 3fby s LEU 280 N -0.03 4.28 -0.77 5.43 1.02 0.25 -4.94 118.68 123.92 3fby s LEU 280 Ca 0.61 0.33 -0.17 0.00 0.02 0.00 0.00 54.13 54.92 3fby s LEU 280 Cb -0.42 -3.07 0.16 0.00 0.02 0.00 0.00 46.19 42.88 3fby s LEU 280 CO 0.40 0.02 0.82 0.00 0.02 0.00 0.00 176.35 177.62 3fby s ARG 281 N -3.13 3.42 -0.17 1.70 1.70 -1.26 -4.60 118.95 116.61 3fby s ARG 281 Ca 0.37 -1.95 -0.34 0.00 -0.47 0.00 0.00 55.73 53.35 3fby s ARG 281 Cb -0.11 -4.50 0.14 0.00 -0.57 0.00 0.00 34.95 29.90 3fby s ARG 281 CO 0.28 -1.48 1.16 0.00 -1.08 0.00 0.00 175.30 174.18 3fby h PRO 283 N 2.03 -0.70 -6.15 0.00 0.13 -1.96 -3.44 132.00 121.91 3fby h PRO 283 Ca -0.11 0.05 -0.59 0.00 -0.87 0.00 0.00 66.00 64.48 3fby h PRO 283 Cb 1.18 0.16 0.18 0.00 0.13 0.00 0.00 31.00 32.65 3fby h PRO 283 CO 0.24 -0.46 -0.99 -0.85 -0.23 0.00 0.00 178.00 175.71 3fby n GLU 284 N -4.69 0.13 -0.02 0.86 0.00 -1.26 -4.70 120.64 110.95 3fby n GLU 284 Ca -0.09 0.05 -0.09 0.00 0.00 0.00 0.00 57.16 57.03 3fby n GLU 284 Cb 0.28 -1.20 -0.03 0.00 0.00 0.00 0.00 31.44 30.50 3fby n GLU 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3fby h ARG 285 N -0.04 -0.11 -0.21 3.44 3.08 -1.99 0.11 114.38 118.67 3fby h ARG 285 Ca -0.42 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.63 3fby h ARG 285 Cb 1.42 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.50 3fby h ARG 285 CO 0.42 -0.07 0.00 0.00 -1.07 0.00 0.00 179.97 179.25 3fby n GLN 286 N -5.26 0.38 0.00 0.04 0.00 -1.26 0.14 117.38 111.42 3fby n GLN 286 Ca -0.03 0.00 0.12 0.00 0.00 0.00 0.00 57.00 57.09 3fby n GLN 286 Cb 0.18 -1.11 0.19 0.00 0.00 0.00 0.00 30.24 29.50 3fby n GLN 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3fby s ARG 288 N -2.86 2.90 0.28 0.00 1.70 0.12 0.88 118.95 121.98 3fby s ARG 288 Ca 0.14 -1.03 -0.30 0.00 -0.47 0.00 0.00 55.73 54.07 3fby s ARG 288 Cb 0.18 -2.57 -0.12 0.00 -0.57 0.00 0.00 34.95 31.87 3fby s ARG 288 CO 0.69 0.42 1.54 1.17 -1.08 0.00 0.00 175.30 178.03 3fby n LYS 289 N -1.00 2.51 -1.68 3.89 4.81 -1.26 -4.31 118.16 121.12 3fby n LYS 289 Ca -0.08 0.89 -0.47 0.00 -0.87 0.00 0.00 58.31 57.79 3fby n LYS 289 Cb 0.57 -2.64 -0.04 0.00 0.02 0.00 0.00 35.03 32.94 3fby n LYS 289 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 3fby n ASP 290 N 2.11 3.36 -0.16 3.14 -0.08 -0.24 -4.89 116.55 119.78 3fby n ASP 290 Ca 0.09 1.02 0.15 0.00 -1.51 0.00 0.00 54.79 54.54 3fby n ASP 290 Cb 0.35 -1.41 0.69 0.00 2.34 0.00 0.00 41.12 43.09 3fby n ASP 290 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3fby n ASN 291 N 5.20 0.56 -3.47 1.67 0.23 -1.26 -4.09 115.26 114.10 3fby n ASN 291 Ca 0.20 -0.90 -0.27 0.00 -0.53 0.00 0.00 54.58 53.09 3fby n ASN 291 Cb 0.30 -0.04 -0.10 0.00 -2.08 0.00 0.00 39.78 37.86 3fby n ASN 291 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fby h VAL 293 N 4.02 0.09 0.00 0.00 2.07 -1.95 -2.21 116.25 118.27 3fby h VAL 293 Ca 0.20 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.71 3fby h VAL 293 Cb 0.85 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3fby h VAL 293 CO 0.50 0.01 -0.95 0.35 0.02 0.00 0.00 177.57 177.49 3fby n THR 294 N -5.48 0.00 -3.55 2.57 -2.24 -1.26 -3.96 114.28 100.36 3fby n THR 294 Ca 0.20 -0.09 -0.41 0.00 -2.27 0.00 0.00 64.05 61.48 3fby n THR 294 Cb 0.66 0.93 -0.11 0.00 -2.10 0.00 0.00 70.33 69.71 3fby n THR 294 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3fby s VAL 295 N -2.80 4.94 -0.30 2.28 1.01 -0.83 -4.71 120.40 119.99 3fby s VAL 295 Ca 0.06 -0.59 -0.34 0.00 0.00 0.00 0.00 61.98 61.11 3fby s VAL 295 Cb 0.14 -3.67 -0.10 0.00 0.00 0.00 0.00 36.38 32.75 3fby s VAL 295 CO 0.77 -0.16 2.17 -0.81 0.00 0.00 0.00 175.10 177.06 3fby n PRO 296 N 5.07 1.33 -3.72 2.72 -0.04 -1.26 -4.75 135.00 134.35 3fby n PRO 296 Ca -0.12 0.38 -0.29 0.00 -0.04 0.00 0.00 63.50 63.43 3fby n PRO 296 Cb 0.48 -2.62 -0.12 0.00 -0.04 0.00 0.00 33.50 31.19 3fby n PRO 296 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3fby s ASN 297 N 7.23 3.60 0.44 3.54 4.22 -1.26 -4.96 114.94 127.73 3fby s ASN 297 Ca 1.06 -3.01 0.30 0.00 -2.14 0.00 0.00 52.86 49.07 3fby s ASN 297 Cb -0.75 -1.12 1.25 0.00 1.28 0.00 0.00 41.25 41.91 3fby s ASN 297 CO 0.47 -0.21 1.88 0.77 -2.04 0.00 0.00 177.10 177.98 3fby h SER 298 N 6.23 0.00 0.66 3.54 4.64 -1.89 -0.07 113.55 126.66 3fby h SER 298 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3fby h SER 298 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3fby h SER 298 CO 0.53 0.00 -0.21 0.61 -0.87 0.00 0.00 176.83 176.89 3fby n GLY 299 N -0.03 -1.27 2.15 -0.77 0.00 -1.26 -4.93 105.19 99.08 3fby n GLY 299 Ca 0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.78 3fby n GLY 299 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fby n GLN 300 N -1.37 -2.42 -1.65 1.61 1.13 -0.04 -4.89 117.38 109.76 3fby n GLN 300 Ca 0.08 0.09 -0.47 0.00 -1.94 0.00 0.00 57.00 54.76 3fby n GLN 300 Cb 0.32 -4.48 -0.05 0.00 0.11 0.00 0.00 30.24 26.15 3fby n GLN 300 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3fby n GLU 301 N -2.18 1.91 -3.51 -1.09 4.71 -1.26 -4.84 120.64 114.39 3fby n GLU 301 Ca -0.02 0.69 -0.29 0.00 -0.01 0.00 0.00 57.16 57.53 3fby n GLU 301 Cb 0.40 -2.43 -0.12 0.00 -1.01 0.00 0.00 31.44 28.28 3fby n GLU 301 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3fby s ASP 302 N 0.80 2.89 0.04 1.62 2.15 -1.26 -0.06 116.67 122.85 3fby s ASP 302 Ca 0.80 -2.45 -0.26 0.00 0.43 0.00 0.00 52.55 51.07 3fby s ASP 302 Cb -0.74 -0.56 -0.17 0.00 -0.30 0.00 0.00 42.92 41.15 3fby s ASP 302 CO 0.40 -0.27 1.50 0.58 -0.17 0.00 0.00 175.17 177.21 3fby h VAL 303 N 4.99 0.91 -0.06 1.11 2.07 -1.88 0.64 116.25 124.03 3fby h VAL 303 Ca 0.08 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 3fby h VAL 303 Cb 0.95 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3fby h VAL 303 CO 0.33 0.09 0.01 -0.90 0.02 0.00 0.00 177.57 177.12 3fby n ASP 304 N -5.11 1.65 -3.12 0.57 5.75 -1.21 -4.88 116.55 110.20 3fby n ASP 304 Ca -0.09 -2.10 -0.04 0.00 -0.01 0.00 0.00 54.79 52.56 3fby n ASP 304 Cb 0.18 -0.52 -0.00 0.00 -1.03 0.00 0.00 41.12 39.75 3fby n ASP 304 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 3fby n ARG 305 N 0.09 -0.99 -0.13 0.11 0.00 0.21 -4.79 116.66 111.16 3fby n ARG 305 Ca 0.03 -0.19 0.10 0.00 -0.00 0.00 0.00 57.85 57.79 3fby n ARG 305 Cb 0.37 0.06 0.30 0.00 -0.00 0.00 0.00 32.46 33.20 3fby n ARG 305 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3fby n ASP 306 N 0.26 2.09 0.00 2.89 3.85 -1.26 -4.95 116.55 119.43 3fby n ASP 306 Ca -0.02 -1.83 0.00 0.00 -0.71 0.00 0.00 54.79 52.23 3fby n ASP 306 Cb 0.06 -0.17 0.00 0.00 -1.35 0.00 0.00 41.12 39.66 3fby n ASP 306 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fby n GLY 307 N 1.20 3.00 3.73 6.12 0.00 -1.26 -5.00 105.19 112.97 3fby n GLY 307 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3fby n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fby s ILE 308 N -1.44 5.02 0.73 -0.61 1.01 -1.26 -4.74 121.20 119.90 3fby s ILE 308 Ca 0.00 1.39 -0.13 0.00 0.00 0.00 0.00 60.65 61.91 3fby s ILE 308 Cb 0.00 -4.01 0.03 0.00 0.01 0.00 0.00 42.46 38.49 3fby s ILE 308 CO 0.00 0.29 1.11 -0.83 0.00 0.00 0.00 174.94 175.50 3fby s GLY 309 N 0.58 1.91 0.22 6.18 0.00 0.17 -4.72 107.32 111.67 3fby s GLY 309 Ca 0.36 0.42 -0.08 0.00 0.00 0.00 0.00 44.72 45.43 3fby s GLY 309 CO 0.18 0.78 1.80 -0.55 0.00 0.00 0.00 173.10 175.30 3fby h ASP 310 N -0.61 0.54 0.00 1.64 3.32 -0.79 0.10 116.42 120.62 3fby h ASP 310 Ca -0.45 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.64 3fby h ASP 310 Cb 1.24 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3fby h ASP 310 CO 0.52 0.33 0.34 0.00 -1.72 0.00 0.00 179.24 178.71 3fby h ALA 311 N 1.39 1.28 0.00 3.45 0.00 -1.92 -2.90 119.26 120.57 3fby h ALA 311 Ca 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 3fby h ALA 311 Cb 0.28 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3fby h ALA 311 CO -0.22 -0.28 -0.17 0.00 0.00 0.00 0.00 179.25 178.58 3fby s ASP 313 N -0.44 6.60 0.44 0.00 -1.08 -0.03 -4.85 116.67 117.32 3fby s ASP 313 Ca 0.01 0.59 0.21 0.00 -0.52 0.00 0.00 52.55 52.85 3fby s ASP 313 Cb 0.02 -2.38 1.17 0.00 -1.46 0.00 0.00 42.92 40.27 3fby s ASP 313 CO -0.01 -0.55 1.83 1.55 0.52 0.00 0.00 175.17 178.51 3fby h PRO 314 N 8.12 0.31 -2.45 4.34 0.13 -1.90 -3.10 132.00 137.45 3fby h PRO 314 Ca -0.25 -0.02 -0.60 0.00 -0.87 0.00 0.00 66.00 64.26 3fby h PRO 314 Cb 1.11 -0.07 -0.41 0.00 0.13 0.00 0.00 31.00 31.75 3fby h PRO 314 CO 0.85 0.21 -0.69 -3.47 -0.23 0.00 0.00 178.00 174.67 3fby n ASP 315 N -4.49 2.71 -0.36 1.44 4.64 -1.26 -2.22 116.55 117.01 3fby n ASP 315 Ca 0.22 -3.19 0.33 0.00 -1.38 0.00 0.00 54.79 50.77 3fby n ASP 315 Cb 0.83 -0.68 0.60 0.00 -1.04 0.00 0.00 41.12 40.83 3fby n ASP 315 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3fby h ALA 316 N 4.64 2.30 -0.00 -1.67 0.00 -1.76 -1.24 119.26 121.54 3fby h ALA 316 Ca 0.17 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3fby h ALA 316 Cb 0.74 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3fby h ALA 316 CO 0.71 -1.04 -0.23 -0.40 0.00 0.00 0.00 179.25 178.29 3fby n ASP 317 N -5.10 0.61 -1.15 0.00 5.68 -1.24 -3.30 116.55 112.06 3fby n ASP 317 Ca 0.38 -0.81 -0.07 0.00 -0.50 0.00 0.00 54.79 53.79 3fby n ASP 317 Cb 1.31 0.76 0.01 0.00 -1.14 0.00 0.00 41.12 42.07 3fby n ASP 317 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fby n GLY 318 N 0.98 0.31 1.36 6.12 0.00 -0.47 -4.56 105.19 108.94 3fby n GLY 318 Ca 0.02 -0.49 0.10 0.00 0.00 0.00 0.00 46.02 45.65 3fby n GLY 318 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fby n ASP 319 N 0.38 3.99 0.00 1.61 5.75 -1.26 -4.93 116.55 122.09 3fby n ASP 319 Ca -0.03 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.55 3fby n ASP 319 Cb 0.54 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 3fby n ASP 319 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 320 N 1.33 2.31 3.57 6.12 0.00 -1.26 -4.61 105.19 112.64 3fby n GLY 320 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 3fby n GLY 320 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fby s VAL 321 N -2.07 4.94 0.33 1.61 1.01 -1.26 -5.03 120.40 119.93 3fby s VAL 321 Ca 0.00 0.58 -0.27 0.00 0.00 0.00 0.00 61.98 62.29 3fby s VAL 321 Cb 0.00 -4.02 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 3fby s VAL 321 CO 0.00 -0.24 0.94 -2.65 0.00 0.00 0.00 175.10 173.15 3fby n PRO 322 N 5.91 1.21 -0.23 2.72 -0.02 -1.26 -4.72 135.00 138.61 3fby n PRO 322 Ca -0.02 0.43 -0.12 0.00 -2.02 0.00 0.00 63.50 61.77 3fby n PRO 322 Cb 0.49 -1.81 -0.09 0.00 -0.02 0.00 0.00 33.50 32.06 3fby n PRO 322 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3fby h ASN 323 N 1.72 -1.84 0.18 2.55 2.35 -1.79 -0.47 115.58 118.28 3fby h ASN 323 Ca -0.40 0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 3fby h ASN 323 Cb 1.35 0.78 0.00 0.00 0.05 0.00 0.00 38.32 40.50 3fby h ASN 323 CO 0.59 -0.31 0.00 -1.84 -1.65 0.00 0.00 177.43 174.22 3fby n GLU 324 N -5.14 0.29 -0.19 0.81 -0.00 -1.26 -1.00 120.64 114.14 3fby n GLU 324 Ca -0.01 0.10 0.07 0.00 -0.00 0.00 0.00 57.16 57.33 3fby n GLU 324 Cb 0.29 -1.50 0.16 0.00 -0.00 0.00 0.00 31.44 30.38 3fby n GLU 324 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3fby n LYS 325 N -1.19 2.27 -4.07 3.44 4.76 -0.23 -5.00 118.16 118.14 3fby n LYS 325 Ca 0.08 -2.43 -0.32 0.00 -2.87 0.00 0.00 58.31 52.77 3fby n LYS 325 Cb 0.09 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 31.63 3fby n LYS 325 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 3fby s ASP 326 N -2.06 4.22 0.00 4.39 -1.08 -0.17 -4.83 116.67 117.14 3fby s ASP 326 Ca 0.29 -1.23 0.18 0.00 -0.52 0.00 0.00 52.55 51.27 3fby s ASP 326 Cb 0.24 -1.55 1.10 0.00 -1.46 0.00 0.00 42.92 41.25 3fby s ASP 326 CO 0.06 -0.16 1.52 -0.46 0.52 0.00 0.00 175.17 176.66 3fby n ASN 327 N 4.49 0.00 -3.24 -0.34 0.23 -1.26 -3.19 115.26 111.94 3fby n ASN 327 Ca -0.15 -0.78 -0.22 0.00 -0.53 0.00 0.00 54.58 52.90 3fby n ASN 327 Cb 0.44 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.06 3fby n ASN 327 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fby h PRO 329 N 5.40 0.00 -0.20 0.00 0.11 -1.85 -2.78 132.00 132.68 3fby h PRO 329 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 3fby h PRO 329 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3fby h PRO 329 CO 0.30 0.03 0.00 1.28 -0.21 0.00 0.00 178.00 179.40 3fby n LEU 330 N -3.14 2.76 -3.89 2.35 4.77 -1.26 -3.60 117.00 114.98 3fby n LEU 330 Ca 0.00 -1.34 -0.17 0.00 -0.03 0.00 0.00 56.01 54.46 3fby n LEU 330 Cb 0.29 -0.12 -0.16 0.00 -2.33 0.00 0.00 43.42 41.11 3fby n LEU 330 CO 0.27 0.57 -0.39 0.68 -1.33 0.00 0.00 177.39 177.19 3fby s VAL 331 N -1.27 0.37 0.30 4.08 -7.23 -1.05 -4.87 120.40 110.73 3fby s VAL 331 Ca 0.25 -0.09 -0.29 0.00 -1.81 0.00 0.00 61.98 60.04 3fby s VAL 331 Cb 0.16 -0.39 -0.10 0.00 0.56 0.00 0.00 36.38 36.61 3fby s VAL 331 CO 0.22 0.16 1.28 -0.13 -0.31 0.00 0.00 175.10 176.33 3fby s ARG 332 N 0.58 4.40 -0.40 4.82 0.52 -1.26 -4.67 118.95 122.93 3fby s ARG 332 Ca -0.07 2.14 0.02 0.00 -0.52 0.00 0.00 55.73 57.29 3fby s ARG 332 Cb -0.10 -3.11 0.26 0.00 0.52 0.00 0.00 34.95 32.52 3fby s ARG 332 CO -0.00 -0.15 1.08 0.27 0.02 0.00 0.00 175.30 176.52 3fby n ASN 333 N 1.23 -2.03 -0.11 0.23 6.94 -1.26 -5.01 115.26 115.24 3fby n ASN 333 Ca 0.01 -2.50 -0.04 0.00 -0.02 0.00 0.00 54.58 52.03 3fby n ASN 333 Cb 0.42 1.25 0.17 0.00 -2.36 0.00 0.00 39.78 39.26 3fby n ASN 333 CO 0.00 0.00 0.00 -0.65 -1.03 0.00 0.00 177.26 175.58 3fby h PRO 334 N 3.50 0.80 -1.18 -0.53 0.11 -1.92 0.23 132.00 133.02 3fby h PRO 334 Ca -0.20 -0.20 0.40 0.00 0.11 0.00 0.00 66.00 66.11 3fby h PRO 334 Cb 1.13 -0.10 -0.14 0.00 0.11 0.00 0.00 31.00 32.00 3fby h PRO 334 CO 0.05 0.79 0.72 0.38 -0.21 0.00 0.00 178.00 179.73 3fby h ASP 335 N 0.75 0.32 -2.36 -2.05 3.04 -1.95 -3.46 116.42 110.72 3fby h ASP 335 Ca 0.15 0.17 -0.26 0.00 -3.24 0.00 0.00 57.03 53.86 3fby h ASP 335 Cb 0.42 0.15 -0.07 0.00 -1.04 0.00 0.00 39.33 38.80 3fby h ASP 335 CO 0.02 -0.22 -0.27 0.00 -2.04 0.00 0.00 179.24 176.73 3fby n GLN 336 N -4.88 -1.65 -1.61 4.15 1.13 0.81 -4.93 117.38 110.39 3fby n GLN 336 Ca 0.36 0.69 -0.40 0.00 -1.94 0.00 0.00 57.00 55.71 3fby n GLN 336 Cb 1.29 -5.07 0.03 0.00 0.11 0.00 0.00 30.24 26.59 3fby n GLN 336 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 3fby n ARG 337 N -2.22 1.17 -3.03 -1.09 0.63 -1.26 -4.86 116.66 106.00 3fby n ARG 337 Ca -0.14 0.43 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 3fby n ARG 337 Cb 0.49 -2.09 -0.00 0.00 0.45 0.00 0.00 32.46 31.31 3fby n ARG 337 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3fby s ASN 338 N -0.94 -1.22 0.17 6.15 2.47 -1.26 -1.08 114.94 119.23 3fby s ASN 338 Ca 0.68 -0.78 0.00 0.00 0.42 0.00 0.00 52.86 53.18 3fby s ASN 338 Cb -0.49 1.57 0.02 0.00 -1.45 0.00 0.00 41.25 40.89 3fby s ASN 338 CO 0.53 -0.12 1.39 0.71 -3.72 0.00 0.00 177.10 175.90 3fby h THR 339 N 4.56 1.43 -0.01 -5.21 1.35 -1.89 -2.74 112.91 110.39 3fby h THR 339 Ca 0.03 -2.38 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 3fby h THR 339 Cb 1.18 2.31 0.00 0.00 -1.73 0.00 0.00 68.15 69.91 3fby h THR 339 CO 0.04 0.70 -0.08 -0.90 -0.25 0.00 0.00 175.52 175.04 3fby n ASP 340 N -3.75 1.45 -1.75 5.36 3.85 -1.16 -4.94 116.55 115.61 3fby n ASP 340 Ca -0.04 -1.36 -0.18 0.00 -0.71 0.00 0.00 54.79 52.50 3fby n ASP 340 Cb 0.77 0.05 -0.04 0.00 -1.35 0.00 0.00 41.12 40.54 3fby n ASP 340 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3fby n GLU 341 N 0.00 -1.36 -0.81 0.11 1.02 -1.04 -4.63 120.64 113.93 3fby n GLU 341 Ca 0.17 0.99 -0.09 0.00 -0.02 0.00 0.00 57.16 58.21 3fby n GLU 341 Cb 0.37 -5.39 0.06 0.00 -0.02 0.00 0.00 31.44 26.46 3fby n GLU 341 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3fby n ASP 342 N -1.20 0.16 -0.06 1.62 3.85 -1.26 -4.94 116.55 114.71 3fby n ASP 342 Ca -0.20 -1.22 0.20 0.00 -0.71 0.00 0.00 54.79 52.86 3fby n ASP 342 Cb 0.63 -0.29 0.66 0.00 -1.35 0.00 0.00 41.12 40.76 3fby n ASP 342 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 3fby h LYS 343 N 0.00 0.09 -5.23 0.11 1.57 -1.94 -3.41 116.57 107.75 3fby h LYS 343 Ca -0.13 -0.01 -0.62 0.00 -1.87 0.00 0.00 60.65 58.03 3fby h LYS 343 Cb 0.39 -0.02 -0.15 0.00 0.08 0.00 0.00 32.23 32.53 3fby h LYS 343 CO 0.10 0.06 -0.55 -1.58 -0.57 0.00 0.00 179.45 176.91 3fby s TRP 344 N -5.09 3.28 0.94 -1.35 0.52 -1.26 -4.68 118.94 111.30 3fby s TRP 344 Ca -0.06 0.11 -0.11 0.00 0.02 0.00 0.00 56.10 56.06 3fby s TRP 344 Cb 0.20 -2.13 0.16 0.00 -1.15 0.00 0.00 33.47 30.56 3fby s TRP 344 CO 0.74 0.14 1.12 0.20 0.02 0.00 0.00 176.95 179.17 3fby s GLY 345 N 0.53 1.66 0.56 0.98 0.00 -0.29 -4.74 107.32 106.03 3fby s GLY 345 Ca 0.05 0.39 0.26 0.00 0.00 0.00 0.00 44.72 45.42 3fby s GLY 345 CO 0.01 0.86 2.21 -0.55 0.00 0.00 0.00 173.10 175.62 3fby h ASP 346 N -1.92 0.00 0.00 1.64 3.45 -1.44 -1.85 116.42 116.30 3fby h ASP 346 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 3fby h ASP 346 Cb 1.28 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.05 3fby h ASP 346 CO 0.45 0.02 0.00 0.00 -1.57 0.00 0.00 179.24 178.14 3fby n ALA 347 N -2.36 1.96 -1.53 3.45 0.00 -1.26 -3.46 120.51 117.30 3fby n ALA 347 Ca -0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 3fby n ALA 347 Cb 0.11 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 3fby n ALA 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fby s ASP 349 N -0.20 5.74 0.00 0.00 -1.08 -0.76 -4.87 116.67 115.51 3fby s ASP 349 Ca 0.00 -0.89 0.00 0.00 -0.52 0.00 0.00 52.55 51.14 3fby s ASP 349 Cb 0.00 -2.03 0.00 0.00 -1.46 0.00 0.00 42.92 39.43 3fby s ASP 349 CO 0.00 -0.36 0.27 -0.46 0.52 0.00 0.00 175.17 175.15 3fby n ASN 350 N 5.01 0.60 -2.70 -0.34 6.94 -1.26 -3.29 115.26 120.21 3fby n ASN 350 Ca -0.12 -0.99 -0.07 0.00 -0.02 0.00 0.00 54.58 53.38 3fby n ASN 350 Cb 0.47 -0.25 0.10 0.00 -2.36 0.00 0.00 39.78 37.74 3fby n ASN 350 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3fby h ARG 352 N 2.61 0.02 -0.13 0.00 3.08 -1.91 -2.06 114.38 115.99 3fby h ARG 352 Ca -0.20 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.85 3fby h ARG 352 Cb 1.15 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 3fby h ARG 352 CO 0.06 0.01 0.00 0.43 -1.07 0.00 0.00 179.97 179.41 3fby n SER 353 N -4.20 2.55 -3.62 7.04 7.64 -1.26 -3.00 113.62 118.77 3fby n SER 353 Ca 0.40 -2.32 -0.15 0.00 1.01 0.00 0.00 58.87 57.81 3fby n SER 353 Cb 1.74 -0.21 -0.13 0.00 -1.01 0.00 0.00 64.21 64.60 3fby n SER 353 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3fby s GLN 354 N -1.56 0.14 -0.02 1.43 2.00 -0.77 -4.78 119.66 116.10 3fby s GLN 354 Ca 0.17 0.60 -0.34 0.00 -2.00 0.00 0.00 55.36 53.79 3fby s GLN 354 Cb 0.13 -0.32 -0.13 0.00 0.80 0.00 0.00 33.01 33.49 3fby s GLN 354 CO 0.06 -0.37 1.77 1.63 -0.50 0.00 0.00 175.29 177.88 3fby n LYS 355 N 5.34 2.11 -2.91 1.67 5.02 -1.26 -4.80 118.16 123.33 3fby n LYS 355 Ca -0.06 0.77 -0.10 0.00 -2.02 0.00 0.00 58.31 56.90 3fby n LYS 355 Cb 0.50 -2.58 -0.01 0.00 -0.02 0.00 0.00 35.03 32.91 3fby n LYS 355 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3fby n ASN 356 N 5.52 -2.61 -0.01 4.39 6.94 -1.26 -5.00 115.26 123.24 3fby n ASN 356 Ca 0.21 -2.84 -0.01 0.00 -0.02 0.00 0.00 54.58 51.92 3fby n ASN 356 Cb 0.28 1.17 0.28 0.00 -2.36 0.00 0.00 39.78 39.16 3fby n ASN 356 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3fby h ASP 357 N 4.97 0.52 1.09 0.53 3.32 -1.99 -0.73 116.42 124.13 3fby h ASP 357 Ca 0.08 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3fby h ASP 357 Cb 1.05 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.46 3fby h ASP 357 CO 0.15 0.59 0.00 -2.24 -1.72 0.00 0.00 179.24 176.01 3fby h ASP 358 N 0.52 0.00 -6.05 6.45 2.03 -2.02 -3.47 116.42 113.88 3fby h ASP 358 Ca 0.11 0.00 -0.44 0.00 -0.73 0.00 0.00 57.03 55.98 3fby h ASP 358 Cb 0.35 0.00 0.06 0.00 -0.83 0.00 0.00 39.33 38.90 3fby h ASP 358 CO 0.01 0.00 -0.71 0.00 -1.03 0.00 0.00 179.24 177.51 3fby n GLN 359 N -2.30 -6.85 -2.33 4.15 1.13 -0.28 -4.89 117.38 106.01 3fby n GLN 359 Ca 0.04 0.72 -0.43 0.00 -1.94 0.00 0.00 57.00 55.39 3fby n GLN 359 Cb 0.33 -5.71 -0.02 0.00 0.11 0.00 0.00 30.24 24.94 3fby n GLN 359 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3fby s LYS 360 N -6.46 4.25 -0.56 -1.09 2.20 -1.26 -4.90 119.74 111.93 3fby s LYS 360 Ca 0.63 1.80 0.04 0.00 -0.36 0.00 0.00 55.97 58.07 3fby s LYS 360 Cb -0.29 -3.74 0.15 0.00 -1.51 0.00 0.00 37.83 32.44 3fby s LYS 360 CO 0.77 -0.67 0.35 0.34 -0.36 0.00 0.00 175.35 175.78 3fby s ASP 361 N 2.10 4.11 0.26 1.43 2.15 -1.26 0.21 116.67 125.67 3fby s ASP 361 Ca 0.59 -3.24 -0.02 0.00 0.43 0.00 0.00 52.55 50.31 3fby s ASP 361 Cb -0.26 -1.40 0.48 0.00 -0.30 0.00 0.00 42.92 41.44 3fby s ASP 361 CO 0.20 -0.18 1.77 0.71 -0.17 0.00 0.00 175.17 177.51 3fby h THR 362 N 4.97 0.78 -0.55 1.71 1.35 -1.88 -0.22 112.91 119.07 3fby h THR 362 Ca 0.05 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 3fby h THR 362 Cb 0.85 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.34 3fby h THR 362 CO 0.63 0.12 0.00 -0.90 -0.25 0.00 0.00 175.52 175.12 3fby n ASP 363 N -4.84 4.29 -2.05 5.36 5.75 -1.14 -4.93 116.55 118.99 3fby n ASP 363 Ca 0.16 -2.45 -0.10 0.00 -0.01 0.00 0.00 54.79 52.39 3fby n ASP 363 Cb 0.38 -0.56 -0.02 0.00 -1.03 0.00 0.00 41.12 39.90 3fby n ASP 363 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3fby n GLN 364 N 0.87 -1.99 -0.08 0.11 1.13 -0.10 -4.80 117.38 112.53 3fby n GLN 364 Ca 0.22 0.50 0.11 0.00 -1.94 0.00 0.00 57.00 55.90 3fby n GLN 364 Cb 0.83 -4.94 0.36 0.00 0.11 0.00 0.00 30.24 26.60 3fby n GLN 364 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 3fby n ASP 365 N -1.17 1.99 0.00 1.08 3.85 -1.26 -4.95 116.55 116.09 3fby n ASP 365 Ca -0.11 -1.73 0.00 0.00 -0.71 0.00 0.00 54.79 52.24 3fby n ASP 365 Cb 0.49 -0.10 0.00 0.00 -1.35 0.00 0.00 41.12 40.16 3fby n ASP 365 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fby n GLY 366 N 1.21 3.10 3.63 6.12 0.00 -1.26 -5.02 105.19 112.96 3fby n GLY 366 Ca 0.17 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 3fby n GLY 366 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fby s ARG 367 N 0.00 3.99 0.93 1.61 1.81 -1.26 -4.65 118.95 121.38 3fby s ARG 367 Ca 0.00 0.94 -0.10 0.00 -1.72 0.00 0.00 55.73 54.85 3fby s ARG 367 Cb 0.00 -3.77 0.16 0.00 -0.45 0.00 0.00 34.95 30.88 3fby s ARG 367 CO 0.00 -0.99 1.13 0.20 -0.68 0.00 0.00 175.30 174.96 3fby s GLY 368 N 1.82 1.67 0.48 -3.53 0.00 0.29 -4.55 107.32 103.50 3fby s GLY 368 Ca 0.45 0.49 0.14 0.00 0.00 0.00 0.00 44.72 45.81 3fby s GLY 368 CO 0.19 0.94 2.07 -0.55 0.00 0.00 0.00 173.10 175.75 3fby h ASP 369 N -1.92 0.05 0.08 1.64 3.32 0.22 -0.38 116.42 119.44 3fby h ASP 369 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3fby h ASP 369 Cb 1.27 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3fby h ASP 369 CO 0.43 0.12 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 3fby n ALA 370 N -2.52 1.38 0.00 3.45 0.00 -1.26 -3.23 120.51 118.33 3fby n ALA 370 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3fby n ALA 370 Cb 0.16 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3fby n ALA 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fby s ASP 372 N -4.85 6.75 -0.13 0.00 3.68 -0.25 -4.90 116.67 116.97 3fby s ASP 372 Ca 0.00 2.12 0.13 0.00 2.13 0.00 0.00 52.55 56.93 3fby s ASP 372 Cb 0.00 -2.54 0.59 0.00 -1.45 0.00 0.00 42.92 39.52 3fby s ASP 372 CO 0.00 -0.85 1.44 -0.90 0.13 0.00 0.00 175.17 174.99 3fby n ASP 373 N 6.59 4.16 -3.20 -0.34 5.75 -1.26 -3.76 116.55 124.49 3fby n ASP 373 Ca 0.16 -2.50 -0.23 0.00 -0.01 0.00 0.00 54.79 52.21 3fby n ASP 373 Cb 0.43 -0.57 -0.06 0.00 -1.03 0.00 0.00 41.12 39.90 3fby n ASP 373 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3fby n ASP 374 N 0.67 0.60 0.27 -1.12 2.03 -1.26 0.49 116.55 118.24 3fby n ASP 374 Ca 0.21 -2.83 0.18 0.00 0.52 0.00 0.00 54.79 52.86 3fby n ASP 374 Cb 0.83 -0.63 0.91 0.00 -0.72 0.00 0.00 41.12 41.51 3fby n ASP 374 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 3fby h ILE 375 N 1.80 0.20 -0.00 5.18 3.07 -1.77 -0.58 117.51 125.41 3fby h ILE 375 Ca 0.09 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.50 3fby h ILE 375 Cb 0.89 0.80 0.00 0.00 -0.27 0.00 0.00 36.82 38.24 3fby h ILE 375 CO 0.50 0.00 -0.93 -0.90 -1.05 0.00 0.00 178.15 175.77 3fby n ASP 376 N -3.33 0.93 0.00 2.16 3.85 -1.24 -2.89 116.55 116.03 3fby n ASP 376 Ca -0.00 -0.90 0.00 0.00 -0.71 0.00 0.00 54.79 53.18 3fby n ASP 376 Cb 0.31 0.89 0.00 0.00 -1.35 0.00 0.00 41.12 40.97 3fby n ASP 376 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fby n GLY 377 N 1.50 2.92 0.14 6.12 0.00 -0.23 -4.47 105.19 111.16 3fby n GLY 377 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3fby n GLY 377 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fby n ASP 378 N 0.34 0.07 -4.07 1.61 5.68 -1.26 -4.79 116.55 114.13 3fby n ASP 378 Ca 0.00 -0.52 -0.31 0.00 -0.50 0.00 0.00 54.79 53.46 3fby n ASP 378 Cb 0.00 -0.04 -0.01 0.00 -1.14 0.00 0.00 41.12 39.93 3fby n ASP 378 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3fby n ARG 379 N -0.26 -3.71 -4.97 0.11 1.74 -1.26 -4.71 116.66 103.60 3fby n ARG 379 Ca 0.00 0.43 -0.32 0.00 -0.77 0.00 0.00 57.85 57.19 3fby n ARG 379 Cb 0.02 -5.00 -0.15 0.00 -1.02 0.00 0.00 32.46 26.31 3fby n ARG 379 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3fby s ILE 380 N -3.51 2.73 0.35 0.55 1.09 -1.26 -5.12 121.20 116.04 3fby s ILE 380 Ca 0.48 -0.81 -0.24 0.00 -1.10 0.00 0.00 60.65 58.98 3fby s ILE 380 Cb -0.26 -2.08 -0.14 0.00 -1.06 0.00 0.00 42.46 38.92 3fby s ILE 380 CO 0.89 0.56 0.62 0.54 -0.10 0.00 0.00 174.94 177.45 3fby n ARG 381 N 3.03 0.62 -0.13 2.79 1.74 -1.26 -4.65 116.66 118.79 3fby n ARG 381 Ca -0.18 0.22 -0.13 0.00 -0.77 0.00 0.00 57.85 56.99 3fby n ARG 381 Cb 0.52 -1.47 -0.09 0.00 -1.02 0.00 0.00 32.46 30.41 3fby n ARG 381 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3fby h ASN 382 N 1.07 -1.78 -0.89 0.55 2.35 -0.33 -0.21 115.58 116.34 3fby h ASN 382 Ca -0.38 0.24 0.13 0.00 -0.55 0.00 0.00 56.30 55.74 3fby h ASN 382 Cb 1.40 0.74 -0.07 0.00 0.05 0.00 0.00 38.32 40.43 3fby h ASN 382 CO 0.54 -0.40 0.57 1.56 -1.65 0.00 0.00 177.43 178.05 3fby h GLN 383 N -0.39 0.73 -0.01 0.81 7.50 -1.89 -2.01 115.11 119.84 3fby h GLN 383 Ca 0.09 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.19 3fby h GLN 383 Cb 0.60 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 27.97 3fby h GLN 383 CO -0.59 0.48 -0.29 0.00 -1.50 0.00 0.00 178.83 176.93 3fby n ALA 384 N -2.42 3.15 -2.71 3.87 0.00 -0.88 -4.89 120.51 116.64 3fby n ALA 384 Ca 0.17 -0.49 -0.40 0.00 0.00 0.00 0.00 53.44 52.71 3fby n ALA 384 Cb 0.43 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.82 3fby n ALA 384 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3fby s ASP 385 N -2.42 7.05 -0.09 0.00 -1.08 -0.14 -4.90 116.67 115.09 3fby s ASP 385 Ca 0.24 1.27 0.06 0.00 -0.52 0.00 0.00 52.55 53.60 3fby s ASP 385 Cb 0.19 -2.45 0.34 0.00 -1.46 0.00 0.00 42.92 39.54 3fby s ASP 385 CO 0.51 -0.18 1.05 -0.46 0.52 0.00 0.00 175.17 176.61 3fby n ASN 386 N 4.01 2.82 -2.74 -0.34 0.23 -1.26 -3.93 115.26 114.04 3fby n ASN 386 Ca 0.01 -2.34 -0.09 0.00 -0.53 0.00 0.00 54.58 51.63 3fby n ASN 386 Cb 0.51 -0.53 0.09 0.00 -2.08 0.00 0.00 39.78 37.77 3fby n ASN 386 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fby h PRO 388 N 2.53 0.00 -0.29 0.00 0.11 -1.86 0.41 132.00 132.90 3fby h PRO 388 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3fby h PRO 388 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3fby h PRO 388 CO 0.10 0.00 0.00 2.89 -0.21 0.00 0.00 178.00 180.78 3fby n ARG 389 N -3.81 2.94 -3.92 1.05 1.85 -1.26 -3.66 116.66 109.86 3fby n ARG 389 Ca 0.09 -2.63 -0.20 0.00 -1.00 0.00 0.00 57.85 54.12 3fby n ARG 389 Cb 0.69 -1.69 -0.17 0.00 -1.05 0.00 0.00 32.46 30.24 3fby n ARG 389 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3fby s VAL 390 N -2.32 0.29 -0.66 8.89 1.01 0.14 -4.86 120.40 122.89 3fby s VAL 390 Ca 0.37 0.08 -0.26 0.00 0.00 0.00 0.00 61.98 62.17 3fby s VAL 390 Cb 0.28 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 36.22 3fby s VAL 390 CO 0.11 0.20 2.01 -2.16 0.00 0.00 0.00 175.10 175.25 3fby s PRO 391 N 1.36 2.46 -0.85 2.72 0.04 -1.26 -4.77 135.00 134.70 3fby s PRO 391 Ca -0.05 0.56 0.01 0.00 0.04 0.00 0.00 61.00 61.56 3fby s PRO 391 Cb -0.13 -4.58 0.28 0.00 0.04 0.00 0.00 34.50 30.10 3fby s PRO 391 CO -0.02 -3.06 1.10 0.27 0.04 0.00 0.00 177.00 175.32 3fby n ASN 392 N 13.91 5.04 -0.11 6.66 6.94 -1.26 -4.97 115.26 141.47 3fby n ASN 392 Ca 0.29 -3.43 -0.06 0.00 -0.02 0.00 0.00 54.58 51.36 3fby n ASN 392 Cb 0.51 -0.96 -0.05 0.00 -2.36 0.00 0.00 39.78 36.92 3fby n ASN 392 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 3fby h SER 393 N 4.81 -0.94 -0.06 0.53 0.02 -1.87 -0.43 113.55 115.60 3fby h SER 393 Ca 0.20 0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.30 3fby h SER 393 Cb 0.64 0.40 -0.00 0.00 0.14 0.00 0.00 62.40 63.58 3fby h SER 393 CO 1.07 -0.17 0.07 -2.24 -1.14 0.00 0.00 176.83 174.42 3fby h ASP 394 N -0.14 0.00 -1.62 3.07 -0.00 -1.94 -3.47 116.42 112.33 3fby h ASP 394 Ca 0.05 0.00 -0.09 0.00 -0.00 0.00 0.00 57.03 56.99 3fby h ASP 394 Cb 0.26 0.00 0.02 0.00 -0.00 0.00 0.00 39.33 39.61 3fby h ASP 394 CO -0.34 0.00 -0.14 0.00 -0.00 0.00 0.00 179.24 178.76 3fby n GLN 395 N -3.80 -1.33 -2.19 4.15 1.13 -0.17 -5.00 117.38 110.17 3fby n GLN 395 Ca -0.02 0.20 -0.41 0.00 -1.94 0.00 0.00 57.00 54.84 3fby n GLN 395 Cb 0.16 -3.51 -0.03 0.00 0.11 0.00 0.00 30.24 26.98 3fby n GLN 395 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3fby s LYS 396 N -4.94 4.39 -0.36 -1.09 2.20 -1.26 -4.93 119.74 113.75 3fby s LYS 396 Ca 0.09 2.12 0.00 0.00 -0.36 0.00 0.00 55.97 57.82 3fby s LYS 396 Cb -0.04 -3.13 0.12 0.00 -1.51 0.00 0.00 37.83 33.26 3fby s LYS 396 CO 0.11 -0.18 0.15 0.34 -0.36 0.00 0.00 175.35 175.41 3fby s ASP 397 N -0.17 3.85 0.00 1.43 -1.08 -1.26 -1.08 116.67 118.36 3fby s ASP 397 Ca 0.52 -2.05 0.00 0.00 -0.52 0.00 0.00 52.55 50.50 3fby s ASP 397 Cb -0.38 -0.92 0.00 0.00 -1.46 0.00 0.00 42.92 40.16 3fby s ASP 397 CO 0.45 -0.35 0.46 -1.20 0.52 0.00 0.00 175.17 175.05 3fby n SER 398 N 4.31 0.00 0.00 -0.34 7.64 -1.26 -3.06 113.62 120.91 3fby n SER 398 Ca 0.03 0.48 0.04 0.00 1.01 0.00 0.00 58.87 60.43 3fby n SER 398 Cb 0.39 -0.09 0.24 0.00 -1.01 0.00 0.00 64.21 63.73 3fby n SER 398 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3fby n ASP 399 N -0.78 0.00 -3.55 6.43 5.68 -1.24 -4.82 116.55 118.26 3fby n ASP 399 Ca 0.00 -0.15 -0.26 0.00 -0.50 0.00 0.00 54.79 53.88 3fby n ASP 399 Cb 0.00 -0.08 0.01 0.00 -1.14 0.00 0.00 41.12 39.92 3fby n ASP 399 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fby n GLY 400 N -0.51 -0.50 0.24 6.12 0.00 -1.17 -4.47 105.19 104.91 3fby n GLY 400 Ca 0.06 0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.36 3fby n GLY 400 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fby n ASP 401 N -2.55 0.80 0.00 1.61 5.75 -1.26 -4.92 116.55 115.99 3fby n ASP 401 Ca -0.00 -1.07 0.00 0.00 -0.01 0.00 0.00 54.79 53.71 3fby n ASP 401 Cb 0.55 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 3fby n ASP 401 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 402 N 1.17 2.71 3.69 6.12 0.00 -1.26 -4.43 105.19 113.19 3fby n GLY 402 Ca 0.18 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 3fby n GLY 402 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fby s ILE 403 N -1.49 4.76 0.51 -0.61 -1.09 -1.26 -4.81 121.20 117.21 3fby s ILE 403 Ca 0.00 2.02 -0.23 0.00 -2.23 0.00 0.00 60.65 60.21 3fby s ILE 403 Cb 0.00 -4.30 -0.06 0.00 -1.58 0.00 0.00 42.46 36.53 3fby s ILE 403 CO 0.00 0.03 1.36 -0.83 -1.23 0.00 0.00 174.94 174.27 3fby s GLY 404 N 1.11 2.89 0.22 6.18 0.00 0.29 -4.81 107.32 113.20 3fby s GLY 404 Ca 0.49 1.34 -0.05 0.00 0.00 0.00 0.00 44.72 46.50 3fby s GLY 404 CO 0.20 1.88 1.72 -0.55 0.00 0.00 0.00 173.10 176.34 3fby h ASP 405 N 1.75 0.92 0.00 1.64 3.32 -1.43 -2.26 116.42 120.35 3fby h ASP 405 Ca -0.51 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 56.32 3fby h ASP 405 Cb 1.29 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.59 3fby h ASP 405 CO 0.59 0.95 0.65 0.00 -1.72 0.00 0.00 179.24 179.71 3fby h ALA 406 N 1.15 1.59 0.00 3.45 0.00 -1.92 -2.14 119.26 121.39 3fby h ALA 406 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3fby h ALA 406 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3fby h ALA 406 CO 0.02 -0.59 -0.23 0.00 0.00 0.00 0.00 179.25 178.45 3fby s ASP 408 N -0.46 6.01 0.00 0.00 2.15 -0.81 -4.93 116.67 118.63 3fby s ASP 408 Ca 0.01 -0.03 0.11 0.00 0.43 0.00 0.00 52.55 53.06 3fby s ASP 408 Cb 0.01 -2.12 0.65 0.00 -0.30 0.00 0.00 42.92 41.16 3fby s ASP 408 CO -0.00 -0.06 1.08 -0.46 -0.17 0.00 0.00 175.17 175.56 3fby n ASN 409 N 5.06 0.00 -2.90 -0.34 0.23 -1.26 -2.58 115.26 113.47 3fby n ASN 409 Ca -0.14 -0.42 -0.13 0.00 -0.53 0.00 0.00 54.58 53.37 3fby n ASN 409 Cb 0.52 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.25 3fby n ASN 409 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fby n PRO 411 N 0.81 0.20 -0.00 0.00 -0.04 -1.06 -1.81 135.00 133.10 3fby n PRO 411 Ca 0.13 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.60 3fby n PRO 411 Cb 0.65 -1.38 -0.01 0.00 -0.04 0.00 0.00 33.50 32.72 3fby n PRO 411 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 3fby n GLN 412 N -0.88 0.21 -3.67 0.54 -0.06 -1.26 -3.73 117.38 108.53 3fby n GLN 412 Ca 0.04 -0.01 -0.16 0.00 -2.00 0.00 0.00 57.00 54.86 3fby n GLN 412 Cb 0.02 -1.03 -0.15 0.00 -4.06 0.00 0.00 30.24 25.02 3fby n GLN 412 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 3fby s LYS 413 N -2.08 0.04 -0.89 3.69 2.47 -0.75 -4.72 119.74 117.50 3fby s LYS 413 Ca -0.01 0.55 -0.18 0.00 -1.56 0.00 0.00 55.97 54.78 3fby s LYS 413 Cb 0.01 -0.26 -0.25 0.00 -1.46 0.00 0.00 37.83 35.87 3fby s LYS 413 CO 0.06 -0.29 2.17 0.45 0.16 0.00 0.00 175.35 177.90 3fby n SER 414 N 5.23 -0.52 -3.49 1.43 2.88 -1.26 -4.88 113.62 113.01 3fby n SER 414 Ca -0.06 -0.16 -0.27 0.00 -1.33 0.00 0.00 58.87 57.05 3fby n SER 414 Cb 0.50 -0.65 -0.10 0.00 -0.75 0.00 0.00 64.21 63.21 3fby n SER 414 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3fby n ASN 415 N 7.18 0.94 -0.14 -3.46 6.94 -1.26 -4.99 115.26 120.46 3fby n ASN 415 Ca 0.60 -2.75 -0.08 0.00 -0.02 0.00 0.00 54.58 52.33 3fby n ASN 415 Cb 0.08 -0.63 -0.03 0.00 -2.36 0.00 0.00 39.78 36.84 3fby n ASN 415 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 3fby h PRO 416 N 5.15 -0.26 -0.23 -0.53 0.13 -1.90 -2.03 132.00 132.33 3fby h PRO 416 Ca 0.20 0.02 0.07 0.00 -0.87 0.00 0.00 66.00 65.41 3fby h PRO 416 Cb 0.84 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 3fby h PRO 416 CO 0.52 -0.17 0.25 0.38 -0.23 0.00 0.00 178.00 178.75 3fby h ASP 417 N -0.27 0.00 -0.33 1.44 2.03 -1.94 -3.46 116.42 113.89 3fby h ASP 417 Ca 0.17 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.32 3fby h ASP 417 Cb 0.56 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.01 3fby h ASP 417 CO -0.59 0.00 -0.13 0.00 -1.03 0.00 0.00 179.24 177.49 3fby n GLN 418 N -3.80 -1.28 -1.58 4.15 1.13 -0.77 -4.92 117.38 110.31 3fby n GLN 418 Ca 0.03 0.67 -0.61 0.00 -1.94 0.00 0.00 57.00 55.16 3fby n GLN 418 Cb 0.38 -4.80 -0.08 0.00 0.11 0.00 0.00 30.24 25.85 3fby n GLN 418 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fby n ALA 419 N 1.13 -2.63 -3.19 -1.58 0.00 -1.26 -4.76 120.51 108.22 3fby n ALA 419 Ca -0.07 0.56 -0.22 0.00 0.00 0.00 0.00 53.44 53.71 3fby n ALA 419 Cb 0.43 -1.86 -0.05 0.00 0.00 0.00 0.00 19.45 17.97 3fby n ALA 419 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3fby n ASP 420 N 2.44 0.70 -0.14 0.00 4.64 -1.26 0.93 116.55 123.86 3fby n ASP 420 Ca 0.23 -2.88 -0.13 0.00 -1.38 0.00 0.00 54.79 50.63 3fby n ASP 420 Cb 0.06 -0.63 -0.09 0.00 -1.04 0.00 0.00 41.12 39.42 3fby n ASP 420 CO 0.00 0.00 0.00 1.62 -0.82 0.00 0.00 177.20 178.00 3fby h VAL 421 N 1.64 0.02 0.00 5.18 3.04 -1.91 0.32 116.25 124.53 3fby h VAL 421 Ca 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.78 3fby h VAL 421 Cb 0.90 0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 3fby h VAL 421 CO 0.50 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.16 3fby n ASP 422 N -5.38 0.00 -3.54 3.17 3.85 -1.26 -4.90 116.55 108.48 3fby n ASP 422 Ca -0.03 0.05 -0.19 0.00 -0.71 0.00 0.00 54.79 53.91 3fby n ASP 422 Cb 0.34 -0.32 0.07 0.00 -1.35 0.00 0.00 41.12 39.86 3fby n ASP 422 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 3fby n HIS 423 N -1.32 -2.12 0.97 2.11 8.25 0.11 -4.89 115.22 118.35 3fby n HIS 423 Ca 0.10 0.91 0.10 0.00 -0.26 0.00 0.00 57.72 58.56 3fby n HIS 423 Cb 0.19 -4.82 -0.08 0.00 1.12 0.00 0.00 29.99 26.40 3fby n HIS 423 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3fby n ASP 424 N -3.09 1.36 0.00 0.41 5.75 -1.26 -4.52 116.55 115.19 3fby n ASP 424 Ca -0.28 -1.18 0.00 0.00 -0.01 0.00 0.00 54.79 53.32 3fby n ASP 424 Cb 0.67 0.80 0.00 0.00 -1.03 0.00 0.00 41.12 41.56 3fby n ASP 424 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3fby n PHE 425 N -0.94 0.00 -2.96 2.11 3.72 -1.26 -5.01 117.46 113.12 3fby n PHE 425 Ca 0.06 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 3fby n PHE 425 Cb 0.37 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.86 3fby n PHE 425 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3fby s VAL 426 N -3.10 4.83 1.13 -4.37 1.01 -1.26 -4.60 120.40 114.03 3fby s VAL 426 Ca 0.00 1.25 -0.17 0.00 0.00 0.00 0.00 61.98 63.06 3fby s VAL 426 Cb 0.00 -4.11 0.15 0.00 0.00 0.00 0.00 36.38 32.42 3fby s VAL 426 CO 0.00 -0.17 0.28 0.61 0.00 0.00 0.00 175.10 175.82 3fby n GLY 427 N 4.10 -2.36 0.31 4.51 0.00 -0.47 -4.51 105.19 106.77 3fby n GLY 427 Ca 0.03 -0.89 -0.06 0.00 0.00 0.00 0.00 46.02 45.11 3fby n GLY 427 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3fby h ASP 428 N -2.22 0.95 0.00 1.61 3.45 0.26 0.11 116.42 120.58 3fby h ASP 428 Ca -0.56 -0.21 0.00 0.00 0.43 0.00 0.00 57.03 56.70 3fby h ASP 428 Cb 1.35 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.87 3fby h ASP 428 CO 0.41 0.94 0.19 0.00 -1.57 0.00 0.00 179.24 179.20 3fby h ALA 429 N 1.18 1.14 0.00 3.45 0.00 -1.92 -3.21 119.26 119.90 3fby h ALA 429 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3fby h ALA 429 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3fby h ALA 429 CO 0.01 -0.14 -0.40 0.00 0.00 0.00 0.00 179.25 178.71 3fby n ASP 431 N -0.95 3.19 -0.23 0.00 4.64 0.33 -4.79 116.55 118.74 3fby n ASP 431 Ca 0.00 0.41 0.11 0.00 -1.38 0.00 0.00 54.79 53.93 3fby n ASP 431 Cb 0.14 -1.48 -0.02 0.00 -1.04 0.00 0.00 41.12 38.72 3fby n ASP 431 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 3fby n SER 432 N 10.28 1.41 -1.24 1.67 3.41 -1.26 -4.94 113.62 122.95 3fby n SER 432 Ca 0.30 -1.17 -0.07 0.00 -0.26 0.00 0.00 58.87 57.67 3fby n SER 432 Cb 0.38 0.68 -0.03 0.00 -0.26 0.00 0.00 64.21 64.99 3fby n SER 432 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3fby n ASP 433 N -0.82 -1.81 -4.39 4.04 10.43 -1.26 -4.88 116.55 117.85 3fby n ASP 433 Ca 0.07 0.17 -0.42 0.00 2.57 0.00 0.00 54.79 57.18 3fby n ASP 433 Cb 0.39 -1.93 -0.10 0.00 1.84 0.00 0.00 41.12 41.33 3fby n ASP 433 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3fby s GLN 434 N -2.66 2.88 -0.64 -1.24 -0.21 -1.26 -4.98 119.66 111.55 3fby s GLN 434 Ca 0.00 -1.20 0.05 0.00 0.02 0.00 0.00 55.36 54.23 3fby s GLN 434 Cb 0.00 -3.93 0.19 0.00 1.00 0.00 0.00 33.01 30.27 3fby s GLN 434 CO 0.00 -0.85 0.52 -3.47 -2.12 0.00 0.00 175.29 169.37 3fby n ASP 435 N 5.09 2.47 -0.30 5.90 2.03 -1.26 -1.48 116.55 129.00 3fby n ASP 435 Ca -0.11 -3.10 0.14 0.00 0.52 0.00 0.00 54.79 52.23 3fby n ASP 435 Cb 0.45 -0.71 0.29 0.00 -0.72 0.00 0.00 41.12 40.44 3fby n ASP 435 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 3fby h GLN 436 N 5.15 0.15 -0.06 -0.67 -0.00 -1.87 0.23 115.11 118.04 3fby h GLN 436 Ca 0.17 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.82 3fby h GLN 436 Cb 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 28.21 3fby h GLN 436 CO 0.67 0.10 0.00 -0.40 0.00 0.00 0.00 178.83 179.20 3fby n ASP 437 N -5.29 2.22 -2.34 -0.69 5.75 -1.25 -4.97 116.55 109.99 3fby n ASP 437 Ca 0.22 -1.74 -0.15 0.00 -0.01 0.00 0.00 54.79 53.11 3fby n ASP 437 Cb 0.71 -0.03 -0.01 0.00 -1.03 0.00 0.00 41.12 40.76 3fby n ASP 437 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 438 N 1.26 -0.32 0.13 6.12 0.00 0.79 -4.66 105.19 108.51 3fby n GLY 438 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 3fby n GLY 438 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fby n ASP 439 N -1.77 0.76 0.00 1.61 5.75 -1.26 -2.18 116.55 119.46 3fby n ASP 439 Ca -0.18 -0.58 0.00 0.00 -0.01 0.00 0.00 54.79 54.02 3fby n ASP 439 Cb 0.62 0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 3fby n ASP 439 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 440 N 1.41 1.49 3.56 6.12 0.00 -1.26 -4.40 105.19 112.10 3fby n GLY 440 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 3fby n GLY 440 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fby s HIS 441 N -1.63 3.19 0.20 1.61 3.76 -1.26 -5.01 115.29 116.15 3fby s HIS 441 Ca 0.00 -0.00 -0.32 0.00 -0.15 0.00 0.00 55.06 54.59 3fby s HIS 441 Cb 0.00 -2.34 -0.15 0.00 1.11 0.00 0.00 32.58 31.19 3fby s HIS 441 CO 0.00 -0.20 1.18 0.94 -0.85 0.00 0.00 174.74 175.81 3fby n GLN 442 N 5.01 1.32 -0.34 1.40 7.27 -1.26 -4.52 117.38 126.26 3fby n GLN 442 Ca -0.15 0.47 0.13 0.00 0.07 0.00 0.00 57.00 57.53 3fby n GLN 442 Cb 0.52 -1.97 0.34 0.00 2.41 0.00 0.00 30.24 31.54 3fby n GLN 442 CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 177.06 176.69 3fby h ASP 443 N 3.32 0.75 -1.09 1.69 3.45 -1.63 0.56 116.42 123.48 3fby h ASP 443 Ca -0.43 0.08 0.32 0.00 0.43 0.00 0.00 57.03 57.43 3fby h ASP 443 Cb 1.33 -0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 40.00 3fby h ASP 443 CO 0.70 0.29 0.92 0.28 -1.57 0.00 0.00 179.24 179.85 3fby h SER 444 N 0.74 0.00 0.00 6.45 0.02 -1.89 -2.26 113.55 116.62 3fby h SER 444 Ca 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 3fby h SER 444 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 3fby h SER 444 CO -0.34 0.00 -0.02 0.54 -1.14 0.00 0.00 176.83 175.88 3fby n ARG 445 N -3.85 1.72 -3.07 3.45 1.74 0.18 -5.02 116.66 111.82 3fby n ARG 445 Ca 0.24 -1.19 -0.40 0.00 -0.77 0.00 0.00 57.85 55.73 3fby n ARG 445 Cb 1.27 -0.83 -0.05 0.00 -1.02 0.00 0.00 32.46 31.83 3fby n ARG 445 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3fby s ASP 446 N -0.76 6.84 0.00 0.55 -1.08 -0.12 -4.82 116.67 117.28 3fby s ASP 446 Ca 0.02 1.02 0.05 0.00 -0.52 0.00 0.00 52.55 53.12 3fby s ASP 446 Cb 0.02 -2.38 0.31 0.00 -1.46 0.00 0.00 42.92 39.41 3fby s ASP 446 CO 0.00 -0.21 1.02 -0.46 0.52 0.00 0.00 175.17 176.04 3fby n ASN 447 N 4.49 0.00 -2.67 -0.34 6.94 -1.26 -3.98 115.26 118.44 3fby n ASN 447 Ca -0.01 -1.44 -0.04 0.00 -0.02 0.00 0.00 54.58 53.07 3fby n ASN 447 Cb 0.50 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 38.01 3fby n ASN 447 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3fby n PRO 449 N 1.26 0.08 -0.09 0.00 -0.02 -1.26 -3.11 135.00 131.87 3fby n PRO 449 Ca 0.00 0.53 -0.14 0.00 -2.02 0.00 0.00 63.50 61.87 3fby n PRO 449 Cb 0.72 -1.74 -0.08 0.00 -0.02 0.00 0.00 33.50 32.37 3fby n PRO 449 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3fby n THR 450 N -1.91 1.07 -2.88 3.45 -1.04 -1.26 -3.75 114.28 107.96 3fby n THR 450 Ca -0.00 -0.39 -0.40 0.00 -2.04 0.00 0.00 64.05 61.22 3fby n THR 450 Cb 0.05 -1.25 -0.05 0.00 -1.82 0.00 0.00 70.33 67.27 3fby n THR 450 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3fby s VAL 451 N -2.37 4.70 -0.17 12.58 1.01 -1.18 -4.55 120.40 130.42 3fby s VAL 451 Ca -0.25 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.23 3fby s VAL 451 Cb 0.07 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 32.23 3fby s VAL 451 CO 0.42 0.32 1.51 -2.84 0.00 0.00 0.00 175.10 174.51 3fby s PRO 452 N 0.14 4.02 -0.45 2.72 0.02 -1.26 -4.89 135.00 135.30 3fby s PRO 452 Ca 0.42 1.77 0.07 0.00 0.02 0.00 0.00 61.00 63.28 3fby s PRO 452 Cb -0.21 -3.94 0.22 0.00 0.02 0.00 0.00 34.50 30.59 3fby s PRO 452 CO 0.25 -1.01 0.66 0.27 -0.33 0.00 0.00 177.00 176.85 3fby n ASN 453 N 7.55 -1.66 0.03 2.53 6.94 -1.26 -5.00 115.26 124.39 3fby n ASN 453 Ca 0.17 -2.90 0.16 0.00 -0.02 0.00 0.00 54.58 51.99 3fby n ASN 453 Cb 0.45 0.67 0.64 0.00 -2.36 0.00 0.00 39.78 39.18 3fby n ASN 453 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 3fby h SER 454 N 4.41 0.08 0.54 0.53 0.02 -1.79 -0.02 113.55 117.32 3fby h SER 454 Ca 0.02 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3fby h SER 454 Cb 0.98 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 3fby h SER 454 CO 0.32 0.05 -0.36 0.00 -1.14 0.00 0.00 176.83 175.70 3fby h ALA 455 N 1.77 1.21 -4.67 3.77 0.00 -1.78 -3.44 119.26 116.11 3fby h ALA 455 Ca 0.21 -0.33 -0.39 0.00 0.00 0.00 0.00 54.91 54.41 3fby h ALA 455 Cb 0.73 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.48 3fby h ALA 455 CO -0.02 0.45 -0.57 1.04 0.00 0.00 0.00 179.25 180.15 3fby n GLN 456 N -3.83 -4.18 -1.03 0.00 1.13 -0.02 -4.91 117.38 104.53 3fby n GLN 456 Ca -0.01 0.77 -0.33 0.00 -1.94 0.00 0.00 57.00 55.48 3fby n GLN 456 Cb 0.43 -5.57 0.13 0.00 0.11 0.00 0.00 30.24 25.34 3fby n GLN 456 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3fby n GLU 457 N -3.84 0.06 -2.68 -1.09 4.71 -1.26 -4.92 120.64 111.61 3fby n GLU 457 Ca -0.09 0.09 -0.05 0.00 -0.01 0.00 0.00 57.16 57.10 3fby n GLU 457 Cb 0.60 -2.31 0.09 0.00 -1.01 0.00 0.00 31.44 28.81 3fby n GLU 457 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 3fby n ASP 458 N -2.91 -1.59 -0.37 1.62 2.03 -1.26 -2.04 116.55 112.03 3fby n ASP 458 Ca 0.12 -2.41 -0.05 0.00 0.52 0.00 0.00 54.79 52.97 3fby n ASP 458 Cb 0.51 1.35 -0.03 0.00 -0.72 0.00 0.00 41.12 42.23 3fby n ASP 458 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3fby n SER 459 N 0.23 -0.79 0.29 1.67 7.64 -1.26 0.10 113.62 121.50 3fby n SER 459 Ca -0.05 1.64 0.18 0.00 1.01 0.00 0.00 58.87 61.65 3fby n SER 459 Cb 0.73 -0.30 0.97 0.00 -1.01 0.00 0.00 64.21 64.61 3fby n SER 459 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3fby h ASP 460 N 0.00 0.00 -2.12 6.43 5.19 -1.92 -3.46 116.42 120.54 3fby h ASP 460 Ca 0.24 0.00 -0.42 0.00 -0.62 0.00 0.00 57.03 56.23 3fby h ASP 460 Cb 0.47 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 39.90 3fby h ASP 460 CO -0.90 0.00 -0.47 1.41 -3.12 0.00 0.00 179.24 176.16 3fby n HIS 461 N -3.45 -0.57 0.14 4.55 8.25 0.28 -4.88 115.22 119.54 3fby n HIS 461 Ca -0.01 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.54 3fby n HIS 461 Cb 0.20 -3.76 0.05 0.00 1.12 0.00 0.00 29.99 27.60 3fby n HIS 461 CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 3fby h ASP 462 N 0.00 0.00 0.00 0.41 3.04 -1.89 -3.48 116.42 114.51 3fby h ASP 462 Ca -0.47 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.32 3fby h ASP 462 Cb 1.36 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.65 3fby h ASP 462 CO 0.60 0.13 0.00 0.61 -2.04 0.00 0.00 179.24 178.54 3fby n GLY 463 N 1.19 1.30 3.56 7.15 0.00 -1.26 -5.09 105.19 112.04 3fby n GLY 463 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3fby n GLY 463 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3fby s GLN 464 N -0.12 3.67 -0.03 1.61 0.74 -1.26 -4.63 119.66 119.64 3fby s GLN 464 Ca 0.00 -0.27 -0.36 0.00 0.05 0.00 0.00 55.36 54.78 3fby s GLN 464 Cb 0.00 -3.77 -0.15 0.00 1.10 0.00 0.00 33.01 30.19 3fby s GLN 464 CO 0.00 -0.49 1.63 0.41 -0.55 0.00 0.00 175.29 176.29 3fby n GLY 465 N 4.87 0.97 0.34 2.59 0.00 0.20 -4.66 105.19 109.50 3fby n GLY 465 Ca -0.08 0.78 -0.04 0.00 0.00 0.00 0.00 46.02 46.68 3fby n GLY 465 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3fby h ASP 466 N 6.68 -1.15 0.00 1.61 3.32 -1.75 -0.36 116.42 124.77 3fby h ASP 466 Ca -0.47 0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.82 3fby h ASP 466 Cb 1.30 0.59 0.00 0.00 0.22 0.00 0.00 39.33 41.43 3fby h ASP 466 CO 0.89 -0.30 0.00 0.00 -1.72 0.00 0.00 179.24 178.11 3fby n ALA 467 N -3.19 1.75 -2.74 3.45 0.00 -1.26 -0.76 120.51 117.75 3fby n ALA 467 Ca 0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.42 3fby n ALA 467 Cb 0.36 -1.06 0.05 0.00 0.00 0.00 0.00 19.45 18.81 3fby n ALA 467 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fby s ASP 469 N -3.09 2.93 0.00 0.00 2.15 0.06 -4.79 116.67 113.93 3fby s ASP 469 Ca 0.25 -1.06 0.27 0.00 0.43 0.00 0.00 52.55 52.44 3fby s ASP 469 Cb 0.40 -0.13 1.17 0.00 -0.30 0.00 0.00 42.92 44.06 3fby s ASP 469 CO -0.02 -0.42 1.87 0.47 -0.17 0.00 0.00 175.17 176.91 3fby n ASP 470 N 5.27 0.00 -3.79 -0.34 9.92 -1.26 -3.51 116.55 122.83 3fby n ASP 470 Ca -0.05 0.47 -0.28 0.00 -0.53 0.00 0.00 54.79 54.40 3fby n ASP 470 Cb 0.44 -0.49 -0.11 0.00 -0.64 0.00 0.00 41.12 40.32 3fby n ASP 470 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3fby n ASP 471 N -1.49 2.97 -0.26 -2.24 4.64 -1.26 -3.12 116.55 115.79 3fby n ASP 471 Ca 0.07 -3.21 0.05 0.00 -1.38 0.00 0.00 54.79 50.32 3fby n ASP 471 Cb 0.31 -0.73 0.19 0.00 -1.04 0.00 0.00 41.12 39.85 3fby n ASP 471 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 3fby h ASP 472 N 5.18 0.32 -3.12 1.67 3.32 -1.79 -3.36 116.42 118.64 3fby h ASP 472 Ca 0.16 0.10 -0.65 0.00 0.02 0.00 0.00 57.03 56.66 3fby h ASP 472 Cb 0.74 0.07 -0.35 0.00 0.22 0.00 0.00 39.33 40.02 3fby h ASP 472 CO 0.72 0.13 -0.86 1.51 -1.72 0.00 0.00 179.24 179.02 3fby s ASP 473 N -5.36 2.99 0.00 6.45 1.47 -1.26 -3.85 116.67 117.12 3fby s ASP 473 Ca -0.12 -0.59 -0.00 0.00 1.18 0.00 0.00 52.55 53.01 3fby s ASP 473 Cb 0.21 -1.38 -0.01 0.00 -0.34 0.00 0.00 42.92 41.39 3fby s ASP 473 CO 0.76 0.01 0.85 0.59 0.68 0.00 0.00 175.17 178.07 3fby n ASN 474 N 4.47 0.01 -0.11 2.11 4.13 -1.26 -4.24 115.26 120.37 3fby n ASN 474 Ca -0.20 -1.77 -0.22 0.00 1.68 0.00 0.00 54.58 54.07 3fby n ASN 474 Cb 0.50 -0.42 -0.08 0.00 -1.54 0.00 0.00 39.78 38.24 3fby n ASN 474 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3fby n ASP 475 N 4.67 1.76 0.00 6.41 5.68 -1.26 -5.08 116.55 128.74 3fby n ASP 475 Ca 0.01 0.19 0.00 0.00 -0.50 0.00 0.00 54.79 54.48 3fby n ASP 475 Cb 0.01 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.40 3fby n ASP 475 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fby n GLY 476 N 1.79 3.78 3.70 6.12 0.00 -1.26 -5.01 105.19 114.30 3fby n GLY 476 Ca -0.43 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 3fby n GLY 476 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fby s VAL 477 N 0.00 2.63 0.67 1.61 1.01 -1.26 -4.96 120.40 120.10 3fby s VAL 477 Ca 0.00 0.23 -0.17 0.00 0.00 0.00 0.00 61.98 62.04 3fby s VAL 477 Cb 0.00 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.24 3fby s VAL 477 CO 0.00 0.00 1.22 -2.16 0.00 0.00 0.00 175.10 174.17 3fby s PRO 478 N 2.31 2.48 0.00 2.72 0.04 -1.26 -4.73 135.00 136.56 3fby s PRO 478 Ca 0.77 1.83 0.16 0.00 0.04 0.00 0.00 61.00 63.80 3fby s PRO 478 Cb -0.44 -1.87 0.50 0.00 0.04 0.00 0.00 34.50 32.73 3fby s PRO 478 CO 0.34 -1.59 1.39 -0.40 0.04 0.00 0.00 177.00 176.78 3fby n ASP 479 N -2.22 1.99 -0.00 6.66 5.75 -1.18 -0.89 116.55 126.65 3fby n ASP 479 Ca 0.14 -1.89 -0.12 0.00 -0.01 0.00 0.00 54.79 52.90 3fby n ASP 479 Cb 0.50 -0.20 -0.10 0.00 -1.03 0.00 0.00 41.12 40.29 3fby n ASP 479 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3fby h SER 480 N 2.34 -0.06 -2.26 -1.12 4.64 -1.91 -3.36 113.55 111.82 3fby h SER 480 Ca 0.00 -0.54 -0.61 0.00 -0.47 0.00 0.00 61.79 60.17 3fby h SER 480 Cb 0.53 0.02 -0.41 0.00 -0.31 0.00 0.00 62.40 62.22 3fby h SER 480 CO 0.00 0.55 -0.54 0.54 -0.87 0.00 0.00 176.83 176.51 3fby n ARG 481 N -4.83 3.08 -3.91 4.77 3.00 -1.22 -4.95 116.66 112.60 3fby n ARG 481 Ca -0.09 -4.79 -0.30 0.00 -0.01 0.00 0.00 57.85 52.67 3fby n ARG 481 Cb 0.30 -2.26 -0.14 0.00 0.00 0.00 0.00 32.46 30.36 3fby n ARG 481 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3fby s ASP 482 N -3.01 4.24 0.26 0.55 -1.08 -0.07 -4.49 116.67 113.07 3fby s ASP 482 Ca 0.45 -2.80 0.05 0.00 -0.52 0.00 0.00 52.55 49.72 3fby s ASP 482 Cb 0.22 -1.51 0.71 0.00 -1.46 0.00 0.00 42.92 40.88 3fby s ASP 482 CO -0.09 -0.26 1.25 -0.46 0.52 0.00 0.00 175.17 176.13 3fby n ASN 483 N 3.37 -0.01 -4.22 -0.34 0.23 -1.26 -1.82 115.26 111.21 3fby n ASN 483 Ca 0.05 1.35 -0.42 0.00 -0.53 0.00 0.00 54.58 55.03 3fby n ASN 483 Cb 0.34 -0.53 -0.06 0.00 -2.08 0.00 0.00 39.78 37.46 3fby n ASN 483 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3fby h ARG 485 N 7.34 0.55 0.00 0.00 3.08 -1.68 -3.37 114.38 120.30 3fby h ARG 485 Ca 0.06 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 3fby h ARG 485 Cb 0.99 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 3fby h ARG 485 CO 0.74 0.37 -1.54 1.28 -1.07 0.00 0.00 179.97 179.74 3fby n LEU 486 N -4.91 2.77 -4.73 3.04 4.77 -1.26 -4.09 117.00 112.59 3fby n LEU 486 Ca 0.16 -0.05 -0.41 0.00 -0.03 0.00 0.00 56.01 55.69 3fby n LEU 486 Cb 0.44 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.18 3fby n LEU 486 CO 0.20 0.63 0.55 0.68 -1.33 0.00 0.00 177.39 178.12 3fby s VAL 487 N -2.19 4.73 0.36 4.08 -7.23 -1.26 -4.45 120.40 114.44 3fby s VAL 487 Ca -0.12 1.81 -0.28 0.00 -1.81 0.00 0.00 61.98 61.58 3fby s VAL 487 Cb 0.03 -4.20 -0.11 0.00 0.56 0.00 0.00 36.38 32.66 3fby s VAL 487 CO 0.23 0.30 1.44 -2.16 -0.31 0.00 0.00 175.10 174.60 3fby s PRO 488 N 0.26 4.17 -0.33 4.82 0.04 -1.26 -4.75 135.00 137.95 3fby s PRO 488 Ca 0.43 2.48 -0.04 0.00 0.04 0.00 0.00 61.00 63.92 3fby s PRO 488 Cb -0.21 -2.99 0.19 0.00 0.04 0.00 0.00 34.50 31.52 3fby s PRO 488 CO 0.25 -0.45 0.89 0.54 0.04 0.00 0.00 177.00 178.27 3fby s ASN 489 N -0.22 -0.81 0.53 6.66 4.22 -1.26 -5.01 114.94 119.05 3fby s ASN 489 Ca 0.52 -0.18 0.28 0.00 -2.14 0.00 0.00 52.86 51.34 3fby s ASN 489 Cb -0.45 1.24 1.51 0.00 1.28 0.00 0.00 41.25 44.84 3fby s ASN 489 CO 0.60 -0.12 2.10 1.55 -2.04 0.00 0.00 177.10 179.20 3fby h PRO 490 N 6.69 0.00 0.00 3.55 0.13 -1.95 -2.82 132.00 137.60 3fby h PRO 490 Ca -0.03 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 3fby h PRO 490 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 3fby h PRO 490 CO -0.01 0.10 -0.05 0.78 -0.23 0.00 0.00 178.00 178.60 3fby h GLY 491 N 0.75 0.00 0.00 1.56 0.00 -2.02 -3.47 103.07 99.89 3fby h GLY 491 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fby h GLY 491 CO 0.01 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.49 3fby n GLN 492 N -3.12 0.00 -1.77 4.80 1.13 -1.07 -4.88 117.38 112.48 3fby n GLN 492 Ca 0.03 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.68 3fby n GLN 492 Cb 0.49 -4.08 0.00 0.00 0.11 0.00 0.00 30.24 26.77 3fby n GLN 492 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 3fby n GLU 493 N -1.99 2.57 -3.55 -1.09 0.00 -1.26 -4.76 120.64 110.55 3fby n GLU 493 Ca 0.00 0.90 -0.28 0.00 0.00 0.00 0.00 57.16 57.79 3fby n GLU 493 Cb 0.00 -2.66 -0.11 0.00 0.00 0.00 0.00 31.44 28.67 3fby n GLU 493 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3fby s ASP 494 N -0.22 2.56 0.15 -1.84 3.68 -1.26 -1.83 116.67 117.91 3fby s ASP 494 Ca 0.55 -3.23 -0.17 0.00 2.13 0.00 0.00 52.55 51.83 3fby s ASP 494 Cb -0.47 -0.80 0.00 0.00 -1.45 0.00 0.00 42.92 40.20 3fby s ASP 494 CO 0.62 -0.16 1.80 0.00 0.13 0.00 0.00 175.17 177.57 3fby h ALA 495 N 5.68 0.49 0.00 3.66 0.00 -1.94 -2.17 119.26 124.98 3fby h ALA 495 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3fby h ALA 495 Cb 0.87 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3fby h ALA 495 CO 0.47 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.27 3fby n ASP 496 N -4.81 0.40 -1.78 0.00 5.75 -1.26 -4.93 116.55 109.92 3fby n ASP 496 Ca 0.00 0.57 -0.08 0.00 -0.01 0.00 0.00 54.79 55.28 3fby n ASP 496 Cb 0.03 -0.67 0.03 0.00 -1.03 0.00 0.00 41.12 39.48 3fby n ASP 496 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3fby n ARG 497 N -1.92 -2.80 -2.60 0.11 3.00 -0.82 -4.98 116.66 106.66 3fby n ARG 497 Ca 0.04 0.32 -0.22 0.00 -0.00 0.00 0.00 57.85 57.99 3fby n ARG 497 Cb 0.27 -3.78 0.00 0.00 0.00 0.00 0.00 32.46 28.95 3fby n ARG 497 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3fby n ASP 498 N -0.90 3.71 0.00 6.15 5.75 -1.26 -5.03 116.55 124.97 3fby n ASP 498 Ca -0.05 -3.43 0.00 0.00 -0.01 0.00 0.00 54.79 51.30 3fby n ASP 498 Cb 0.54 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 3fby n ASP 498 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fby n GLY 499 N -0.32 1.94 3.67 6.12 0.00 -1.26 -4.88 105.19 110.46 3fby n GLY 499 Ca 0.30 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.84 3fby n GLY 499 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3fby n VAL 500 N 0.00 0.31 -0.61 1.61 3.14 -1.26 -4.74 118.33 116.78 3fby n VAL 500 Ca 0.00 -0.06 -0.30 0.00 -2.96 0.00 0.00 64.34 61.02 3fby n VAL 500 Cb 0.00 -1.66 0.27 0.00 -1.06 0.00 0.00 33.84 31.39 3fby n VAL 500 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 3fby s GLY 501 N 2.63 1.48 0.01 7.55 0.00 -1.20 -4.83 107.32 112.97 3fby s GLY 501 Ca 0.87 -0.75 -0.19 0.00 0.00 0.00 0.00 44.72 44.66 3fby s GLY 501 CO 0.47 0.18 1.07 -0.55 0.00 0.00 0.00 173.10 174.26 3fby h ASP 502 N -3.05 0.64 0.00 1.64 3.32 -1.66 -3.34 116.42 113.96 3fby h ASP 502 Ca -0.47 -0.81 0.00 0.00 0.02 0.00 0.00 57.03 55.77 3fby h ASP 502 Cb 1.33 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3fby h ASP 502 CO 0.34 1.38 0.02 0.52 -1.72 0.00 0.00 179.24 179.77 3fby n VAL 503 N -4.07 1.20 -2.79 -1.35 0.31 -1.26 -3.09 118.33 107.28 3fby n VAL 503 Ca -0.12 0.32 -0.10 0.00 -0.01 0.00 0.00 64.34 64.43 3fby n VAL 503 Cb 0.79 -1.32 0.08 0.00 -0.91 0.00 0.00 33.84 32.48 3fby n VAL 503 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fby n GLN 505 N 0.24 0.00 -0.39 0.00 -0.06 -1.18 -3.91 117.38 112.08 3fby n GLN 505 Ca 0.08 0.50 0.10 0.00 -2.00 0.00 0.00 57.00 55.68 3fby n GLN 505 Cb 0.71 -1.30 0.31 0.00 -4.06 0.00 0.00 30.24 25.90 3fby n GLN 505 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3fby n ASP 506 N -1.99 3.80 -3.23 1.69 10.43 -1.26 -4.64 116.55 121.35 3fby n ASP 506 Ca 0.00 -2.08 -0.22 0.00 2.57 0.00 0.00 54.79 55.06 3fby n ASP 506 Cb 0.00 -0.48 -0.07 0.00 1.84 0.00 0.00 41.12 42.41 3fby n ASP 506 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 3fby n ASP 507 N 1.40 -0.88 0.28 -2.24 2.03 -1.25 0.15 116.55 116.04 3fby n ASP 507 Ca 0.23 -2.57 0.13 0.00 0.52 0.00 0.00 54.79 53.11 3fby n ASP 507 Cb 0.63 -0.13 0.62 0.00 -0.72 0.00 0.00 41.12 41.52 3fby n ASP 507 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3fby h PHE 508 N 5.10 0.00 0.00 -0.67 3.57 -1.77 -2.08 116.94 121.09 3fby h PHE 508 Ca 0.17 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3fby h PHE 508 Cb 0.94 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.68 3fby h PHE 508 CO 0.25 0.00 0.00 -0.40 -2.23 0.00 0.00 178.31 175.93 3fby n ASP 509 N -2.92 0.88 -2.34 0.41 3.85 -1.24 -4.23 116.55 110.96 3fby n ASP 509 Ca 0.01 -1.13 -0.20 0.00 -0.71 0.00 0.00 54.79 52.75 3fby n ASP 509 Cb 0.59 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.34 3fby n ASP 509 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3fby n ALA 510 N -0.07 -0.61 -0.35 2.12 0.00 -0.78 -4.63 120.51 116.19 3fby n ALA 510 Ca 0.00 0.18 0.04 0.00 0.00 0.00 0.00 53.44 53.65 3fby n ALA 510 Cb 0.11 -2.15 0.28 0.00 0.00 0.00 0.00 19.45 17.68 3fby n ALA 510 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3fby n ASP 511 N -1.95 4.31 0.00 0.00 5.68 -1.26 -4.89 116.55 118.43 3fby n ASP 511 Ca -0.24 -2.69 0.00 0.00 -0.50 0.00 0.00 54.79 51.36 3fby n ASP 511 Cb 0.68 -0.64 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 3fby n ASP 511 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 3fby n LYS 512 N 0.38 -1.25 -4.58 0.11 3.00 -1.26 -4.95 118.16 109.61 3fby n LYS 512 Ca 0.21 0.31 -0.33 0.00 -0.00 0.00 0.00 58.31 58.50 3fby n LYS 512 Cb 0.95 -4.60 -0.15 0.00 0.00 0.00 0.00 35.03 31.23 3fby n LYS 512 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3fby s VAL 513 N -1.21 2.56 0.29 3.15 1.01 -1.26 -5.09 120.40 119.85 3fby s VAL 513 Ca 0.00 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.87 3fby s VAL 513 Cb 0.00 -2.07 -0.11 0.00 0.00 0.00 0.00 36.38 34.20 3fby s VAL 513 CO 0.00 0.52 1.51 -0.69 0.00 0.00 0.00 175.10 176.44 3fby s VAL 514 N 0.78 2.32 0.27 2.92 1.01 -1.26 -4.62 120.40 121.82 3fby s VAL 514 Ca -0.06 0.28 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 3fby s VAL 514 Cb -0.15 -3.18 0.33 0.00 0.00 0.00 0.00 36.38 33.38 3fby s VAL 514 CO 0.00 0.05 1.61 0.44 0.00 0.00 0.00 175.10 177.20 3fby h ASP 515 N 4.65 -0.38 -1.03 3.32 3.32 1.00 1.15 116.42 128.45 3fby h ASP 515 Ca -0.47 0.23 0.28 0.00 0.02 0.00 0.00 57.03 57.09 3fby h ASP 515 Cb 1.22 0.39 -0.13 0.00 0.22 0.00 0.00 39.33 41.04 3fby h ASP 515 CO 0.76 -0.24 0.62 0.50 -1.72 0.00 0.00 179.24 179.16 3fby h LYS 516 N 0.08 0.43 0.00 3.56 3.64 -1.91 -3.20 116.57 119.17 3fby h LYS 516 Ca 0.49 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.84 3fby h LYS 516 Cb 0.92 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3fby h LYS 516 CO -0.76 0.28 0.00 1.51 -2.27 0.00 0.00 179.45 178.21 3fby n ILE 517 N -4.88 0.00 -2.30 2.00 0.13 0.11 -4.97 119.36 109.46 3fby n ILE 517 Ca 0.29 -0.40 -0.42 0.00 -1.10 0.00 0.00 62.75 61.12 3fby n ILE 517 Cb 0.88 1.02 -0.03 0.00 -0.84 0.00 0.00 39.64 40.68 3fby n ILE 517 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3fby s ASP 518 N -0.71 6.04 0.57 9.51 3.68 0.35 -4.88 116.67 131.23 3fby s ASP 518 Ca 0.00 0.52 0.36 0.00 2.13 0.00 0.00 52.55 55.55 3fby s ASP 518 Cb 0.00 -2.54 1.22 0.00 -1.45 0.00 0.00 42.92 40.15 3fby s ASP 518 CO 0.00 -1.73 1.36 0.55 0.13 0.00 0.00 175.17 175.48 3fby n VAL 519 N 7.01 0.00 -3.19 1.11 3.14 -0.99 -3.12 118.33 122.28 3fby n VAL 519 Ca 0.15 1.31 -0.20 0.00 -2.96 0.00 0.00 64.34 62.65 3fby n VAL 519 Cb 0.49 -2.28 -0.06 0.00 -1.06 0.00 0.00 33.84 30.93 3fby n VAL 519 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3fby n PRO 521 N 2.86 0.09 0.09 0.00 -0.02 -1.18 -0.29 135.00 136.54 3fby n PRO 521 Ca 0.26 0.39 -0.12 0.00 -2.02 0.00 0.00 63.50 62.01 3fby n PRO 521 Cb 0.51 -1.70 -0.13 0.00 -0.02 0.00 0.00 33.50 32.16 3fby n PRO 521 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3fby h GLU 522 N 0.00 0.16 -5.13 -0.52 4.39 -1.93 -3.30 114.58 108.25 3fby h GLU 522 Ca 0.00 -0.27 -0.65 0.00 0.34 0.00 0.00 59.36 58.78 3fby h GLU 522 Cb 0.24 0.10 -0.16 0.00 -0.10 0.00 0.00 28.75 28.83 3fby h GLU 522 CO 0.00 1.13 -0.16 1.21 -1.16 0.00 0.00 179.01 180.03 3fby s ASN 523 N -6.96 6.27 0.00 1.42 3.84 0.60 -4.83 114.94 115.27 3fby s ASN 523 Ca -0.02 -0.04 0.00 0.00 0.21 0.00 0.00 52.86 53.02 3fby s ASN 523 Cb 0.08 -2.24 0.00 0.00 -0.55 0.00 0.00 41.25 38.55 3fby s ASN 523 CO 0.86 -0.38 0.59 0.00 -2.79 0.00 0.00 177.10 175.37 3fby n ALA 524 N 5.55 0.00 -3.12 1.71 0.00 -1.26 -2.88 120.51 120.51 3fby n ALA 524 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.10 3fby n ALA 524 Cb 0.49 0.30 -0.05 0.00 0.00 0.00 0.00 19.45 20.18 3fby n ALA 524 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3fby n GLU 525 N -2.45 3.04 -3.85 0.00 0.00 -1.26 -4.48 120.64 111.64 3fby n GLU 525 Ca 0.00 -4.79 -0.26 0.00 0.00 0.00 0.00 57.16 52.11 3fby n GLU 525 Cb 0.00 -2.26 -0.17 0.00 0.00 0.00 0.00 31.44 29.01 3fby n GLU 525 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3fby s VAL 526 N -3.68 0.83 -0.05 3.84 1.01 -1.14 -5.08 120.40 116.14 3fby s VAL 526 Ca 0.45 -0.32 -0.09 0.00 0.00 0.00 0.00 61.98 62.02 3fby s VAL 526 Cb 0.22 -0.99 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 3fby s VAL 526 CO -0.09 0.20 -0.18 1.07 0.00 0.00 0.00 175.10 176.11 3fby n THR 527 N 4.99 1.36 -4.40 3.92 5.66 -1.26 -4.24 114.28 120.30 3fby n THR 527 Ca -0.10 0.26 -0.20 0.00 -3.05 0.00 0.00 64.05 60.96 3fby n THR 527 Cb 0.49 -1.97 -0.10 0.00 -1.55 0.00 0.00 70.33 67.20 3fby n THR 527 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 3fby s LEU 528 N -7.44 2.15 -0.18 1.09 2.01 -1.26 -2.36 118.68 112.68 3fby s LEU 528 Ca -0.15 -1.32 -0.29 0.00 0.01 0.00 0.00 54.13 52.38 3fby s LEU 528 Cb 0.02 -0.33 -0.07 0.00 0.01 0.00 0.00 46.19 45.82 3fby s LEU 528 CO 0.22 -0.57 2.17 0.41 1.01 0.00 0.00 176.35 179.59 3fby n THR 529 N -0.58 0.41 -3.45 5.49 -1.04 -1.26 -4.92 114.28 108.93 3fby n THR 529 Ca -0.03 -0.38 -0.19 0.00 -2.04 0.00 0.00 64.05 61.41 3fby n THR 529 Cb 0.66 -2.42 -0.11 0.00 -1.82 0.00 0.00 70.33 66.63 3fby n THR 529 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3fby s ASP 530 N 7.48 1.78 0.00 8.00 2.15 -1.24 -4.51 116.67 130.33 3fby s ASP 530 Ca 1.00 -0.62 0.20 0.00 0.43 0.00 0.00 52.55 53.55 3fby s ASP 530 Cb -0.41 0.37 0.60 0.00 -0.30 0.00 0.00 42.92 43.18 3fby s ASP 530 CO 0.38 -0.37 1.46 0.49 -0.17 0.00 0.00 175.17 176.96 3fby n PHE 531 N 5.31 0.35 -0.34 -5.34 3.72 0.04 -4.54 117.46 116.66 3fby n PHE 531 Ca -0.04 -0.18 0.05 0.00 -0.05 0.00 0.00 57.45 57.24 3fby n PHE 531 Cb 0.47 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.22 3fby n PHE 531 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fby h ARG 532 N 2.77 0.91 -4.94 -1.08 3.08 -1.86 -3.32 114.38 109.94 3fby h ARG 532 Ca 0.00 -0.05 -0.69 0.00 0.07 0.00 0.00 59.98 59.31 3fby h ARG 532 Cb 0.61 -0.21 -0.18 0.00 0.08 0.00 0.00 29.97 30.28 3fby h ARG 532 CO 0.00 0.60 0.00 0.00 -1.07 0.00 0.00 179.97 179.50 3fby s ALA 533 N -5.99 3.40 0.03 0.04 0.00 -1.26 -5.01 121.76 112.97 3fby s ALA 533 Ca -0.12 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.17 3fby s ALA 533 Cb 0.21 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 3fby s ALA 533 CO 0.80 -1.93 -0.11 -0.59 0.00 0.00 0.00 175.76 173.92 3fby s PHE 534 N 2.53 1.00 0.56 0.00 -0.12 -1.25 -3.67 117.98 117.03 3fby s PHE 534 Ca 0.15 -0.34 -0.17 0.00 -0.05 0.00 0.00 56.93 56.52 3fby s PHE 534 Cb -0.19 -0.60 -0.05 0.00 -0.63 0.00 0.00 43.02 41.55 3fby s PHE 534 CO 0.12 0.00 1.05 -1.14 -0.05 0.00 0.00 175.22 175.20 3fby s GLN 535 N -1.03 3.47 -0.30 1.99 0.74 0.11 -4.84 119.66 119.80 3fby s GLN 535 Ca -0.00 1.23 -0.03 0.00 0.05 0.00 0.00 55.36 56.60 3fby s GLN 535 Cb -0.07 -2.05 0.10 0.00 1.10 0.00 0.00 33.01 32.09 3fby s GLN 535 CO 0.01 -0.69 0.13 -0.08 -0.55 0.00 0.00 175.29 174.11 3fby s THR 536 N -2.35 0.28 -0.09 -0.34 -1.32 -1.26 -0.31 115.64 110.24 3fby s THR 536 Ca 0.64 -1.08 -0.13 0.00 -1.21 0.00 0.00 61.69 59.91 3fby s THR 536 Cb -0.16 -1.23 -0.05 0.00 -1.51 0.00 0.00 72.50 69.56 3fby s THR 536 CO 0.33 -0.74 0.32 -0.69 -2.21 0.00 0.00 174.62 171.63 3fby s VAL 537 N 1.83 5.23 -0.25 5.08 1.01 -0.63 -4.93 120.40 127.74 3fby s VAL 537 Ca 0.10 0.62 -0.07 0.00 0.00 0.00 0.00 61.98 62.63 3fby s VAL 537 Cb -0.17 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 3fby s VAL 537 CO -0.29 0.50 0.07 -0.69 0.00 0.00 0.00 175.10 174.69 3fby s VAL 538 N -0.40 4.29 -0.10 2.92 1.01 -1.26 -0.06 120.40 126.80 3fby s VAL 538 Ca 0.20 -0.22 0.16 0.00 0.00 0.00 0.00 61.98 62.12 3fby s VAL 538 Cb -0.14 -3.02 0.08 0.00 0.00 0.00 0.00 36.38 33.29 3fby s VAL 538 CO 0.08 0.31 1.50 -0.07 0.00 0.00 0.00 175.10 176.93 3fby h LEU 539 N 8.24 0.00 -7.28 3.92 -0.00 -1.76 -3.40 115.31 115.03 3fby h LEU 539 Ca -0.38 0.00 -0.63 0.00 -0.00 0.00 0.00 57.88 56.87 3fby h LEU 539 Cb 1.17 0.00 -0.41 0.00 -0.00 0.00 0.00 40.66 41.42 3fby h LEU 539 CO 0.58 0.47 -0.67 -0.62 -0.00 0.00 0.00 178.44 178.21 3fby s ASP 540 N -6.44 4.14 0.28 -0.43 2.15 -1.25 -0.77 116.67 114.34 3fby s ASP 540 Ca 0.03 -2.85 -0.01 0.00 0.43 0.00 0.00 52.55 50.16 3fby s ASP 540 Cb 0.08 -1.46 0.39 0.00 -0.30 0.00 0.00 42.92 41.63 3fby s ASP 540 CO 0.73 -0.25 1.80 -0.65 -0.17 0.00 0.00 175.17 176.63 3fby h PRO 541 N 6.64 0.79 0.00 4.34 0.11 -1.85 -0.03 132.00 142.00 3fby h PRO 541 Ca -0.06 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3fby h PRO 541 Cb 0.91 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3fby h PRO 541 CO 0.62 0.75 0.00 0.39 -0.21 0.00 0.00 178.00 179.55 3fby n GLU 542 N -4.25 0.18 -0.06 1.05 4.71 -1.26 -4.93 120.64 116.08 3fby n GLU 542 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.18 3fby n GLU 542 Cb 0.26 -1.26 0.00 0.00 -1.01 0.00 0.00 31.44 29.43 3fby n GLU 542 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3fby n GLY 543 N -0.48 0.00 0.12 0.62 0.00 -0.03 -4.87 105.19 100.56 3fby n GLY 543 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 3fby n GLY 543 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3fby h ASP 544 N 0.10 -0.55 -0.21 1.61 3.58 -1.92 0.92 116.42 119.95 3fby h ASP 544 Ca 0.00 0.08 0.06 0.00 0.42 0.00 0.00 57.03 57.59 3fby h ASP 544 Cb 0.00 0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 3fby h ASP 544 CO 0.00 -0.09 0.37 0.00 -2.88 0.00 0.00 179.24 176.64 3fby h ALA 545 N -0.79 1.75 -1.24 -0.78 0.00 -1.93 -3.44 119.26 112.82 3fby h ALA 545 Ca 0.03 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 3fby h ALA 545 Cb 0.14 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.85 3fby h ALA 545 CO -0.20 -0.48 -0.22 0.94 0.00 0.00 0.00 179.25 179.28 3fby n GLN 546 N -3.37 -1.36 -4.12 0.00 -0.06 0.32 -4.93 117.38 103.87 3fby n GLN 546 Ca 0.03 0.74 -0.34 0.00 -2.00 0.00 0.00 57.00 55.43 3fby n GLN 546 Cb 0.49 -4.94 -0.15 0.00 -4.06 0.00 0.00 30.24 21.58 3fby n GLN 546 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 3fby s ILE 547 N -1.99 2.79 0.32 1.69 1.01 -1.26 -5.05 121.20 118.71 3fby s ILE 547 Ca 0.00 -0.70 -0.24 0.00 0.00 0.00 0.00 60.65 59.71 3fby s ILE 547 Cb 0.00 -2.22 -0.10 0.00 0.01 0.00 0.00 42.46 40.15 3fby s ILE 547 CO 0.00 0.48 0.90 -1.81 0.00 0.00 0.00 174.94 174.52 3fby s ASP 548 N 1.26 7.22 0.42 3.58 1.01 -1.26 -1.26 116.67 127.63 3fby s ASP 548 Ca 0.03 1.73 -0.26 0.00 0.71 0.00 0.00 52.55 54.76 3fby s ASP 548 Cb -0.14 -2.54 -0.10 0.00 1.01 0.00 0.00 42.92 41.15 3fby s ASP 548 CO -0.06 -0.10 1.26 -0.81 0.21 0.00 0.00 175.17 175.67 3fby n PRO 549 N 0.38 1.91 -3.63 8.23 -0.04 -1.26 -4.87 135.00 135.72 3fby n PRO 549 Ca 0.02 0.68 -0.40 0.00 -0.04 0.00 0.00 63.50 63.76 3fby n PRO 549 Cb 0.51 -2.36 -0.11 0.00 -0.04 0.00 0.00 33.50 31.50 3fby n PRO 549 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 3fby s ASN 550 N -0.53 5.65 -0.03 3.54 3.04 -1.26 -4.99 114.94 120.36 3fby s ASN 550 Ca 0.61 -1.08 -0.15 0.00 0.04 0.00 0.00 52.86 52.28 3fby s ASN 550 Cb -0.51 -1.99 -0.05 0.00 -1.54 0.00 0.00 41.25 37.15 3fby s ASN 550 CO 0.58 -0.39 0.40 0.26 -3.04 0.00 0.00 177.10 174.91 3fby s TRP 551 N 1.51 3.67 -0.04 0.43 0.52 -1.26 -1.70 118.94 122.07 3fby s TRP 551 Ca 0.01 0.93 0.02 0.00 0.02 0.00 0.00 56.10 57.09 3fby s TRP 551 Cb -0.20 -2.32 0.01 0.00 -1.15 0.00 0.00 33.47 29.81 3fby s TRP 551 CO 0.06 0.55 -0.10 0.08 0.02 0.00 0.00 176.95 177.56 3fby s VAL 552 N -0.71 0.88 -0.24 4.03 1.01 0.12 -4.99 120.40 120.49 3fby s VAL 552 Ca 0.23 -0.37 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 3fby s VAL 552 Cb -0.16 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 3fby s VAL 552 CO 0.12 0.28 0.01 -0.69 0.00 0.00 0.00 175.10 174.83 3fby s VAL 553 N 0.46 3.75 0.51 2.92 1.01 -1.26 -1.29 120.40 126.50 3fby s VAL 553 Ca -0.08 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.49 3fby s VAL 553 Cb -0.12 -2.77 0.01 0.00 0.00 0.00 0.00 36.38 33.49 3fby s VAL 553 CO 0.02 0.33 0.25 -0.76 0.00 0.00 0.00 175.10 174.93 3fby s LEU 554 N 1.52 2.66 -1.84 3.92 1.43 0.15 -4.66 118.68 121.87 3fby s LEU 554 Ca 0.05 -1.33 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 3fby s LEU 554 Cb -0.15 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 44.95 3fby s LEU 554 CO -0.00 -0.93 0.00 -3.20 0.23 0.00 0.00 176.35 172.45 3fby n ASN 555 N -1.53 -4.99 -2.95 2.29 5.15 -1.26 -1.20 115.26 110.77 3fby n ASN 555 Ca -0.06 0.33 -0.13 0.00 -0.60 0.00 0.00 54.58 54.12 3fby n ASN 555 Cb 0.65 -4.37 0.07 0.00 -0.53 0.00 0.00 39.78 35.59 3fby n ASN 555 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fby n GLN 556 N -2.44 -3.69 -0.80 1.20 1.13 -1.26 -2.92 117.38 108.60 3fby n GLN 556 Ca -0.19 0.70 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 3fby n GLN 556 Cb 0.62 -5.14 0.00 0.00 0.11 0.00 0.00 30.24 25.83 3fby n GLN 556 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fby n GLY 557 N -1.19 0.55 0.00 1.08 0.00 -1.11 -4.67 105.19 99.84 3fby n GLY 557 Ca -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3fby n GLY 557 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fby n ARG 558 N -2.80 1.91 -3.73 1.61 1.74 -1.12 -0.78 116.66 113.50 3fby n ARG 558 Ca 0.00 -1.21 -0.12 0.00 -0.77 0.00 0.00 57.85 55.75 3fby n ARG 558 Cb 0.00 -0.97 -0.13 0.00 -1.02 0.00 0.00 32.46 30.34 3fby n ARG 558 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3fby s GLU 559 N -0.71 0.22 -0.00 5.56 2.12 -0.34 0.02 118.70 125.56 3fby s GLU 559 Ca 0.00 0.54 0.07 0.00 0.36 0.00 0.00 54.97 55.94 3fby s GLU 559 Cb 0.00 -0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.26 3fby s GLU 559 CO 0.00 -0.16 -0.21 0.42 -0.54 0.00 0.00 175.26 174.77 3fby s ILE 560 N 1.25 1.68 -0.01 -3.70 1.01 0.86 0.35 121.20 122.64 3fby s ILE 560 Ca -0.09 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.60 3fby s ILE 560 Cb -0.10 -1.41 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 3fby s ILE 560 CO -0.09 0.42 -0.07 0.54 0.00 0.00 0.00 174.94 175.74 3fby s VAL 561 N -0.57 0.54 -0.07 2.92 0.11 -0.41 -0.20 120.40 122.72 3fby s VAL 561 Ca 0.08 -0.29 0.04 0.00 -2.93 0.00 0.00 61.98 58.89 3fby s VAL 561 Cb -0.08 -0.46 -0.00 0.00 -1.53 0.00 0.00 36.38 34.30 3fby s VAL 561 CO -0.00 0.16 -0.20 -1.58 -3.33 0.00 0.00 175.10 170.14 3fby s GLN 562 N -0.11 2.41 -0.01 1.54 -0.44 -0.88 0.12 119.66 122.29 3fby s GLN 562 Ca 0.02 -0.73 0.09 0.00 -2.50 0.00 0.00 55.36 52.24 3fby s GLN 562 Cb -0.03 -1.93 -0.13 0.00 -1.64 0.00 0.00 33.01 29.28 3fby s GLN 562 CO -0.00 0.20 0.26 0.25 0.50 0.00 0.00 175.29 176.50 3fby n THR 563 N 3.38 0.00 -3.19 -0.34 -2.24 -0.69 -1.10 114.28 110.10 3fby n THR 563 Ca -0.19 -0.24 -0.33 0.00 -2.27 0.00 0.00 64.05 61.02 3fby n THR 563 Cb 0.53 0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 69.23 3fby n THR 563 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 3fby s MET 564 N -2.37 4.03 -0.99 -0.78 -1.94 -1.26 -3.82 119.30 112.17 3fby s MET 564 Ca -0.01 0.64 -0.19 0.00 -1.71 0.00 0.00 55.69 54.42 3fby s MET 564 Cb 0.06 -2.61 0.12 0.00 2.01 0.00 0.00 34.83 34.42 3fby s MET 564 CO 0.38 0.26 1.23 1.21 -0.01 0.00 0.00 175.02 178.08 3fby s ASN 565 N -2.10 6.68 0.48 3.03 2.47 -1.26 -3.60 114.94 120.63 3fby s ASN 565 Ca 0.49 -2.10 0.04 0.00 0.42 0.00 0.00 52.86 51.71 3fby s ASN 565 Cb -0.12 -2.43 -0.03 0.00 -1.45 0.00 0.00 41.25 37.23 3fby s ASN 565 CO 0.19 -1.08 0.08 -0.94 -3.72 0.00 0.00 177.10 171.63 3fby s SER 566 N 3.72 4.19 0.91 -4.21 1.04 -1.26 -4.84 113.70 113.25 3fby s SER 566 Ca 0.36 -1.46 -0.10 0.00 0.48 0.00 0.00 55.95 55.23 3fby s SER 566 Cb -0.04 0.17 0.14 0.00 0.10 0.00 0.00 66.02 66.40 3fby s SER 566 CO -0.08 -0.76 1.14 -1.81 0.98 0.00 0.00 173.24 172.71 3fby s ASP 567 N -3.90 3.00 0.41 7.02 -0.00 -0.39 -1.33 116.67 121.48 3fby s ASP 567 Ca 0.21 2.15 -0.24 0.00 -0.00 0.00 0.00 52.55 54.66 3fby s ASP 567 Cb 0.03 -2.56 -0.08 0.00 -0.00 0.00 0.00 42.92 40.31 3fby s ASP 567 CO 0.11 -3.05 1.13 -2.84 -0.00 0.00 0.00 175.17 170.53 3fby s PRO 568 N -4.67 4.01 0.06 8.23 0.02 -1.26 -4.43 135.00 136.96 3fby s PRO 568 Ca 0.66 1.73 -0.26 0.00 0.02 0.00 0.00 61.00 63.15 3fby s PRO 568 Cb -0.22 -2.57 0.09 0.00 0.02 0.00 0.00 34.50 31.81 3fby s PRO 568 CO 0.58 -0.33 0.76 0.20 -0.33 0.00 0.00 177.00 177.88 3fby s GLY 569 N -1.31 -0.53 0.03 0.52 0.00 -0.68 -1.96 107.32 103.39 3fby s GLY 569 Ca 0.59 0.84 0.07 0.00 0.00 0.00 0.00 44.72 46.23 3fby s GLY 569 CO 0.34 0.31 -0.22 1.08 0.00 0.00 0.00 173.10 174.62 3fby s LEU 570 N -2.49 2.13 -0.26 0.66 1.43 0.91 -2.94 118.68 118.12 3fby s LEU 570 Ca 0.02 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.57 3fby s LEU 570 Cb -0.01 -1.07 -0.00 0.00 0.03 0.00 0.00 46.19 45.14 3fby s LEU 570 CO -0.09 0.21 0.04 0.00 0.23 0.00 0.00 176.35 176.74 3fby s ALA 571 N -0.71 3.02 -0.20 4.21 0.00 -0.85 -1.60 121.76 125.63 3fby s ALA 571 Ca 0.08 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.76 3fby s ALA 571 Cb -0.09 -2.00 0.03 0.00 0.00 0.00 0.00 23.12 21.06 3fby s ALA 571 CO 0.01 -0.68 -0.18 0.08 0.00 0.00 0.00 175.76 174.99 3fby s VAL 572 N 1.52 2.12 0.59 0.00 1.01 0.58 -0.39 120.40 125.83 3fby s VAL 572 Ca 0.04 -1.06 -0.19 0.00 0.00 0.00 0.00 61.98 60.77 3fby s VAL 572 Cb -0.16 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 3fby s VAL 572 CO 0.01 0.43 1.21 -0.83 0.00 0.00 0.00 175.10 175.91 3fby s GLY 573 N 1.26 2.74 0.33 4.51 0.00 -0.10 0.08 107.32 116.14 3fby s GLY 573 Ca 0.02 1.01 0.15 0.00 0.00 0.00 0.00 44.72 45.90 3fby s GLY 573 CO -0.11 1.40 1.70 -0.97 0.00 0.00 0.00 173.10 175.12 3fby h TYR 574 N 0.92 0.00 -3.28 1.90 0.05 -1.87 -3.39 116.97 111.31 3fby h TYR 574 Ca -0.50 0.00 -0.54 0.00 0.05 0.00 0.00 58.73 57.74 3fby h TYR 574 Cb 1.30 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.02 3fby h TYR 574 CO 0.47 0.48 0.49 0.95 -1.05 0.00 0.00 178.16 179.49 3fby s THR 575 N -3.69 4.48 -0.11 -2.88 -4.23 -1.26 -4.96 115.64 103.00 3fby s THR 575 Ca -0.01 1.78 -0.09 0.00 -1.18 0.00 0.00 61.69 62.19 3fby s THR 575 Cb 0.12 -4.14 -0.04 0.00 1.34 0.00 0.00 72.50 69.77 3fby s THR 575 CO 0.72 0.11 0.20 0.00 -0.54 0.00 0.00 174.62 175.11 3fby s ALA 576 N 1.23 3.82 0.41 3.99 0.00 -1.26 -4.14 121.76 125.80 3fby s ALA 576 Ca 0.55 -0.56 0.06 0.00 0.00 0.00 0.00 51.96 52.01 3fby s ALA 576 Cb -0.24 -2.09 -0.07 0.00 0.00 0.00 0.00 23.12 20.72 3fby s ALA 576 CO 0.27 0.53 0.01 -0.06 0.00 0.00 0.00 175.76 176.51 3fby s PHE 577 N -0.85 2.39 -0.43 0.00 0.40 0.76 -3.89 117.98 116.37 3fby s PHE 577 Ca 0.16 -0.73 0.08 0.00 -0.60 0.00 0.00 56.93 55.84 3fby s PHE 577 Cb -0.13 -1.71 0.32 0.00 0.51 0.00 0.00 43.02 42.01 3fby s PHE 577 CO 0.05 0.38 0.94 0.27 0.70 0.00 0.00 175.22 177.57 3fby n ASN 578 N -0.98 -1.10 0.00 1.36 6.94 -1.26 0.49 115.26 120.70 3fby n ASN 578 Ca -0.06 -3.39 0.00 0.00 -0.02 0.00 0.00 54.58 51.10 3fby n ASN 578 Cb 0.67 0.89 0.00 0.00 -2.36 0.00 0.00 39.78 38.98 3fby n ASN 578 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fby n GLY 579 N 0.43 1.70 2.94 4.83 0.00 -1.23 -4.54 105.19 109.31 3fby n GLY 579 Ca 0.14 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 3fby n GLY 579 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fby s VAL 580 N 0.00 0.12 -0.34 1.61 0.11 0.92 -0.82 120.40 122.00 3fby s VAL 580 Ca 0.00 -0.55 0.04 0.00 -2.93 0.00 0.00 61.98 58.54 3fby s VAL 580 Cb 0.00 -0.20 0.10 0.00 -1.53 0.00 0.00 36.38 34.75 3fby s VAL 580 CO 0.00 -0.27 0.05 -1.81 -3.33 0.00 0.00 175.10 169.74 3fby s ASP 581 N -0.85 4.73 -0.08 3.54 1.11 -0.47 -0.69 116.67 123.96 3fby s ASP 581 Ca -0.09 -2.13 0.04 0.00 0.18 0.00 0.00 52.55 50.56 3fby s ASP 581 Cb -0.06 -1.60 -0.01 0.00 1.07 0.00 0.00 42.92 42.32 3fby s ASP 581 CO -0.00 -0.38 -0.21 0.12 1.18 0.00 0.00 175.17 175.88 3fby s PHE 582 N 0.93 2.57 -0.04 4.23 5.36 -0.67 -2.12 117.98 128.24 3fby s PHE 582 Ca 0.11 -0.72 -0.15 0.00 -0.96 0.00 0.00 56.93 55.21 3fby s PHE 582 Cb -0.19 -1.68 0.03 0.00 -0.34 0.00 0.00 43.02 40.84 3fby s PHE 582 CO -0.09 -0.22 0.33 -1.83 -1.46 0.00 0.00 175.22 171.95 3fby s GLU 583 N -0.00 0.63 0.14 10.12 -1.05 0.22 -0.11 118.70 128.64 3fby s GLU 583 Ca -0.07 -0.05 -0.24 0.00 -0.15 0.00 0.00 54.97 54.45 3fby s GLU 583 Cb -0.15 0.28 0.07 0.00 -0.44 0.00 0.00 34.13 33.89 3fby s GLU 583 CO 0.05 -0.16 0.71 0.20 0.95 0.00 0.00 175.26 177.01 3fby s GLY 584 N -1.04 -0.48 -0.43 -3.83 0.00 -1.02 0.07 107.32 100.59 3fby s GLY 584 Ca -0.11 0.48 -0.17 0.00 0.00 0.00 0.00 44.72 44.91 3fby s GLY 584 CO 0.04 0.16 0.46 -1.59 0.00 0.00 0.00 173.10 172.16 3fby s THR 585 N -3.59 5.07 -0.15 0.90 2.01 -0.34 -0.99 115.64 118.55 3fby s THR 585 Ca 0.04 -0.39 -0.22 0.00 0.31 0.00 0.00 61.69 61.44 3fby s THR 585 Cb -0.02 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 3fby s THR 585 CO -0.08 -0.47 0.66 0.12 -0.69 0.00 0.00 174.62 174.16 3fby s PHE 586 N 2.17 3.45 -0.16 4.92 5.36 0.14 -0.77 117.98 133.11 3fby s PHE 586 Ca 0.12 1.06 -0.06 0.00 -0.96 0.00 0.00 56.93 57.09 3fby s PHE 586 Cb -0.17 -2.80 0.07 0.00 -0.34 0.00 0.00 43.02 39.78 3fby s PHE 586 CO 0.13 -0.07 0.33 -1.58 -1.46 0.00 0.00 175.22 172.58 3fby s HIS 587 N 1.47 -0.58 -0.46 10.12 2.46 -0.17 -0.94 115.29 127.20 3fby s HIS 587 Ca 0.32 1.20 -0.15 0.00 0.47 0.00 0.00 55.06 56.91 3fby s HIS 587 Cb -0.16 0.12 0.07 0.00 -0.13 0.00 0.00 32.58 32.48 3fby s HIS 587 CO 0.13 -0.40 0.37 0.54 -2.47 0.00 0.00 174.74 172.91 3fby s VAL 588 N 2.36 5.12 -1.38 0.89 0.11 -1.26 0.05 120.40 126.30 3fby s VAL 588 Ca -0.01 -1.05 -0.11 0.00 -2.93 0.00 0.00 61.98 57.87 3fby s VAL 588 Cb -0.12 -4.04 0.10 0.00 -1.53 0.00 0.00 36.38 30.79 3fby s VAL 588 CO -0.10 -0.54 2.11 -3.20 -3.33 0.00 0.00 175.10 170.03 3fby n ASN 589 N 5.16 4.84 0.00 3.54 5.15 -0.23 -0.61 115.26 133.12 3fby n ASN 589 Ca -0.12 -2.97 0.00 0.00 -0.60 0.00 0.00 54.58 50.89 3fby n ASN 589 Cb 0.44 -1.56 0.00 0.00 -0.53 0.00 0.00 39.78 38.13 3fby n ASN 589 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 3fby n THR 590 N 4.04 0.00 0.01 -0.44 5.66 -1.26 -4.88 114.28 117.41 3fby n THR 590 Ca 0.48 0.00 -0.18 0.00 -3.05 0.00 0.00 64.05 61.30 3fby n THR 590 Cb 0.36 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.03 3fby n THR 590 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 175.07 171.65 3fby h VAL 591 N 0.96 1.43 -3.16 1.08 -1.51 -1.95 -3.34 116.25 109.77 3fby h VAL 591 Ca 0.00 -2.12 -0.56 0.00 -1.23 0.00 0.00 66.70 62.79 3fby h VAL 591 Cb 0.00 2.64 0.10 0.00 -2.13 0.00 0.00 31.29 31.90 3fby h VAL 591 CO 0.00 0.61 0.63 0.35 -1.23 0.00 0.00 177.57 177.94 3fby n THR 592 N -4.21 1.49 -1.62 7.19 -2.24 -1.26 -4.71 114.28 108.92 3fby n THR 592 Ca -0.11 -0.37 0.02 0.00 -2.27 0.00 0.00 64.05 61.33 3fby n THR 592 Cb 0.69 -1.65 -0.01 0.00 -2.10 0.00 0.00 70.33 67.26 3fby n THR 592 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3fby n ASP 593 N 1.44 -1.38 -1.92 3.42 -0.08 -1.26 -4.84 116.55 111.93 3fby n ASP 593 Ca 0.07 0.18 -0.01 0.00 -1.51 0.00 0.00 54.79 53.53 3fby n ASP 593 Cb 0.35 -0.52 0.04 0.00 2.34 0.00 0.00 41.12 43.34 3fby n ASP 593 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 3fby n ASP 594 N -0.94 -0.53 0.00 1.67 5.75 -1.26 -5.04 116.55 116.20 3fby n ASP 594 Ca 0.00 -1.43 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 3fby n ASP 594 Cb 0.08 0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 3fby n ASP 594 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3fby n ASP 595 N -0.53 0.00 -4.74 -1.12 8.00 -1.26 -2.71 116.55 114.19 3fby n ASP 595 Ca -0.07 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.06 3fby n ASP 595 Cb 0.63 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.67 3fby n ASP 595 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3fby s TYR 596 N 2.86 3.53 0.12 1.24 1.51 -0.89 -3.35 117.35 122.38 3fby s TYR 596 Ca 0.00 0.87 0.05 0.00 -1.01 0.00 0.00 57.07 56.98 3fby s TYR 596 Cb 0.00 -2.50 -0.04 0.00 -0.11 0.00 0.00 41.96 39.31 3fby s TYR 596 CO 0.00 0.23 -0.11 0.00 -1.11 0.00 0.00 175.55 174.56 3fby s ALA 597 N 0.39 1.32 0.00 3.71 0.00 -0.90 -2.30 121.76 123.98 3fby s ALA 597 Ca 0.25 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.91 3fby s ALA 597 Cb -0.15 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 22.97 3fby s ALA 597 CO 0.10 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.27 3fby n GLY 598 N 0.38 1.37 3.28 0.00 0.00 -0.54 0.39 105.19 110.07 3fby n GLY 598 Ca -0.14 -0.85 -0.16 0.00 0.00 0.00 0.00 46.02 44.86 3fby n GLY 598 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3fby s PHE 599 N -4.88 1.46 -0.01 1.61 -0.12 -0.79 -1.78 117.98 113.46 3fby s PHE 599 Ca 0.00 -1.40 0.00 0.00 -0.05 0.00 0.00 56.93 55.48 3fby s PHE 599 Cb 0.00 -0.73 0.01 0.00 -0.63 0.00 0.00 43.02 41.67 3fby s PHE 599 CO 0.00 -0.60 -0.00 0.42 -0.05 0.00 0.00 175.22 174.99 3fby s ILE 600 N -3.80 0.08 0.07 -4.49 1.01 0.98 -0.97 121.20 114.08 3fby s ILE 600 Ca 0.38 0.03 -0.03 0.00 0.00 0.00 0.00 60.65 61.03 3fby s ILE 600 Cb 0.06 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.37 3fby s ILE 600 CO 0.17 0.06 0.04 0.72 0.00 0.00 0.00 174.94 175.94 3fby s PHE 601 N 0.41 0.48 -1.38 3.97 -0.12 -0.85 -1.19 117.98 119.30 3fby s PHE 601 Ca -0.04 -0.97 -0.07 0.00 -0.05 0.00 0.00 56.93 55.81 3fby s PHE 601 Cb -0.06 -0.31 0.01 0.00 -0.63 0.00 0.00 43.02 42.03 3fby s PHE 601 CO -0.01 -0.45 0.89 0.41 -0.05 0.00 0.00 175.22 176.01 3fby n GLY 602 N 0.03 -0.47 3.66 1.99 0.00 -1.01 0.15 105.19 109.54 3fby n GLY 602 Ca -0.13 0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 3fby n GLY 602 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fby s TYR 603 N -3.24 2.95 -0.05 1.61 5.04 -0.75 -4.14 117.35 118.77 3fby s TYR 603 Ca 0.44 1.08 0.05 0.00 -2.44 0.00 0.00 57.07 56.20 3fby s TYR 603 Cb -0.19 -3.47 -0.07 0.00 0.35 0.00 0.00 41.96 38.58 3fby s TYR 603 CO 0.55 -1.52 0.02 1.04 -1.34 0.00 0.00 175.55 174.29 3fby n GLN 604 N 6.36 3.10 -3.60 4.97 6.02 -0.51 -0.34 117.38 133.38 3fby n GLN 604 Ca 0.13 -0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 57.08 3fby n GLN 604 Cb 0.45 -1.14 -0.02 0.00 1.02 0.00 0.00 30.24 30.56 3fby n GLN 604 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 3fby s ASP 605 N -3.67 -0.17 0.00 1.08 1.47 -1.19 -4.99 116.67 109.21 3fby s ASP 605 Ca -0.03 -0.07 0.00 0.00 1.18 0.00 0.00 52.55 53.63 3fby s ASP 605 Cb 0.02 0.23 0.00 0.00 -0.34 0.00 0.00 42.92 42.83 3fby s ASP 605 CO 0.22 -0.40 0.75 -1.54 0.68 0.00 0.00 175.17 174.88 3fby n SER 606 N -0.25 0.00 0.00 2.11 3.41 -1.26 -0.64 113.62 116.99 3fby n SER 606 Ca -0.04 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 3fby n SER 606 Cb 0.60 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 3fby n SER 606 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3fby n SER 607 N -1.25 0.66 -3.62 4.04 7.64 -1.26 -4.41 113.62 115.42 3fby n SER 607 Ca 0.00 -0.83 -0.29 0.00 1.01 0.00 0.00 58.87 58.76 3fby n SER 607 Cb 0.14 0.33 -0.14 0.00 -1.01 0.00 0.00 64.21 63.54 3fby n SER 607 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3fby s SER 608 N -0.33 3.59 0.18 6.43 0.01 0.19 0.86 113.70 124.62 3fby s SER 608 Ca 0.00 -1.92 -0.24 0.00 1.31 0.00 0.00 55.95 55.10 3fby s SER 608 Cb 0.00 -0.68 0.05 0.00 0.21 0.00 0.00 66.02 65.60 3fby s SER 608 CO 0.00 -0.36 0.78 0.72 0.41 0.00 0.00 173.24 174.79 3fby s PHE 609 N 1.30 -0.27 0.05 2.43 -0.12 -0.12 -1.42 117.98 119.83 3fby s PHE 609 Ca 0.13 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.97 3fby s PHE 609 Cb -0.20 0.63 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 3fby s PHE 609 CO -0.15 -0.94 0.18 0.71 -0.05 0.00 0.00 175.22 174.97 3fby s TYR 610 N -3.59 3.46 -0.01 3.49 1.51 0.12 0.66 117.35 123.00 3fby s TYR 610 Ca 0.08 0.23 0.01 0.00 -1.01 0.00 0.00 57.07 56.39 3fby s TYR 610 Cb -0.03 -1.74 0.00 0.00 -0.11 0.00 0.00 41.96 40.08 3fby s TYR 610 CO -0.01 0.58 -0.04 0.08 -1.11 0.00 0.00 175.55 175.06 3fby s VAL 611 N -1.46 0.33 -0.20 0.71 1.01 0.03 -2.01 120.40 118.80 3fby s VAL 611 Ca 0.33 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 62.08 3fby s VAL 611 Cb -0.13 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 3fby s VAL 611 CO 0.26 0.10 0.06 -0.69 0.00 0.00 0.00 175.10 174.83 3fby s VAL 612 N 0.03 4.53 0.33 2.92 1.01 -0.14 -0.60 120.40 128.48 3fby s VAL 612 Ca 0.00 -0.12 0.09 0.00 0.00 0.00 0.00 61.98 61.95 3fby s VAL 612 Cb -0.03 -3.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 3fby s VAL 612 CO -0.00 0.42 0.05 -0.04 0.00 0.00 0.00 175.10 175.53 3fby s MET 613 N 0.84 2.19 -0.26 2.72 -1.94 -0.52 -1.89 119.30 120.45 3fby s MET 613 Ca 0.03 -1.65 -0.03 0.00 -1.71 0.00 0.00 55.69 52.33 3fby s MET 613 Cb -0.14 -2.03 0.15 0.00 2.01 0.00 0.00 34.83 34.82 3fby s MET 613 CO 0.02 0.14 0.47 -0.46 -0.01 0.00 0.00 175.02 175.19 3fby s TRP 614 N -2.47 -1.13 0.24 -0.03 -0.00 0.16 -2.06 118.94 113.64 3fby s TRP 614 Ca 0.35 1.26 -0.05 0.00 -0.00 0.00 0.00 56.10 57.66 3fby s TRP 614 Cb -0.01 0.27 -0.05 0.00 -0.00 0.00 0.00 33.47 33.67 3fby s TRP 614 CO 0.20 -0.76 0.49 0.21 -0.00 0.00 0.00 176.95 177.09 3fby s LYS 615 N 2.68 3.64 -0.01 5.86 2.20 -1.26 -2.12 119.74 130.72 3fby s LYS 615 Ca 0.14 -0.03 -0.13 0.00 -0.36 0.00 0.00 55.97 55.59 3fby s LYS 615 Cb -0.15 -2.72 -0.33 0.00 -1.51 0.00 0.00 37.83 33.12 3fby s LYS 615 CO -0.18 0.31 0.82 0.37 -0.36 0.00 0.00 175.35 176.31 3fby h GLN 616 N 2.09 0.46 -4.80 4.03 4.15 -1.54 -3.27 115.11 116.22 3fby h GLN 616 Ca -0.47 -0.78 -0.40 0.00 0.77 0.00 0.00 58.65 57.77 3fby h GLN 616 Cb 1.18 0.29 -0.28 0.00 0.21 0.00 0.00 27.48 28.88 3fby h GLN 616 CO 0.68 1.37 -0.78 -1.64 -1.93 0.00 0.00 178.83 176.53 3fby s MET 617 N -2.59 0.75 0.16 1.69 -1.94 -1.10 -3.95 119.30 112.33 3fby s MET 617 Ca -0.13 -0.39 -0.34 0.00 -1.71 0.00 0.00 55.69 53.12 3fby s MET 617 Cb 0.05 -0.72 -0.14 0.00 2.01 0.00 0.00 34.83 36.02 3fby s MET 617 CO 0.90 0.19 1.50 0.39 -0.01 0.00 0.00 175.02 177.99 3fby n GLU 618 N 2.69 1.96 -3.47 2.03 1.02 -1.26 -4.62 120.64 118.99 3fby n GLU 618 Ca -0.14 0.71 0.01 0.00 -0.02 0.00 0.00 57.16 57.71 3fby n GLU 618 Cb 0.56 -2.43 -0.04 0.00 -0.02 0.00 0.00 31.44 29.51 3fby n GLU 618 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3fby s GLN 619 N 0.58 0.36 -0.20 3.49 0.74 -0.71 -5.01 119.66 118.91 3fby s GLN 619 Ca 0.78 0.87 -0.29 0.00 0.05 0.00 0.00 55.36 56.76 3fby s GLN 619 Cb -0.72 0.48 -0.01 0.00 1.10 0.00 0.00 33.01 33.86 3fby s GLN 619 CO 0.42 -0.12 1.31 0.99 -0.55 0.00 0.00 175.29 177.34 3fby s THR 620 N 2.41 4.17 0.30 -0.34 2.01 -1.26 -1.76 115.64 121.17 3fby s THR 620 Ca -0.04 1.39 -0.26 0.00 0.31 0.00 0.00 61.69 63.09 3fby s THR 620 Cb -0.07 -4.00 -0.15 0.00 0.01 0.00 0.00 72.50 68.30 3fby s THR 620 CO -0.18 -0.24 0.71 0.00 -0.69 0.00 0.00 174.62 174.23 3fby n TYR 621 N 7.03 0.17 0.58 4.92 9.36 -0.76 -4.84 117.16 133.63 3fby n TYR 621 Ca 0.15 0.75 0.12 0.00 3.32 0.00 0.00 57.90 62.24 3fby n TYR 621 Cb 0.45 -2.08 0.45 0.00 -0.63 0.00 0.00 39.34 37.54 3fby n TYR 621 CO 0.00 0.00 0.00 -2.67 0.22 0.00 0.00 176.86 174.41 3fby n TRP 622 N -0.19 0.61 -3.07 2.98 2.14 -1.26 -4.24 117.44 114.41 3fby n TRP 622 Ca 0.13 0.21 -0.45 0.00 2.07 0.00 0.00 57.50 59.46 3fby n TRP 622 Cb 0.32 -0.84 -0.04 0.00 -0.81 0.00 0.00 31.31 29.95 3fby n TRP 622 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 3fby s GLN 623 N -3.15 3.15 0.07 -2.67 -0.21 -1.26 -4.88 119.66 110.71 3fby s GLN 623 Ca 0.08 -1.37 0.24 0.00 0.02 0.00 0.00 55.36 54.34 3fby s GLN 623 Cb 0.12 -4.34 0.98 0.00 1.00 0.00 0.00 33.01 30.77 3fby s GLN 623 CO 0.47 -1.59 1.77 0.00 -2.12 0.00 0.00 175.29 173.81 3fby n ALA 624 N 6.40 2.09 -2.82 6.09 0.00 -1.26 -4.59 120.51 126.42 3fby n ALA 624 Ca -0.04 -0.05 -0.35 0.00 0.00 0.00 0.00 53.44 53.00 3fby n ALA 624 Cb 0.44 -1.41 -0.07 0.00 0.00 0.00 0.00 19.45 18.42 3fby n ALA 624 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3fby s ASN 625 N -3.44 5.99 0.39 0.00 3.84 -1.26 -2.68 114.94 117.79 3fby s ASN 625 Ca 0.11 0.31 0.28 0.00 0.21 0.00 0.00 52.86 53.76 3fby s ASN 625 Cb 0.14 -1.84 0.99 0.00 -0.55 0.00 0.00 41.25 39.99 3fby s ASN 625 CO 0.47 0.35 1.81 1.55 -2.79 0.00 0.00 177.10 178.48 3fby h PRO 626 N 4.60 0.00 -2.39 0.43 0.13 -1.86 -3.49 132.00 129.43 3fby h PRO 626 Ca -0.52 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.56 3fby h PRO 626 Cb 1.20 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.16 3fby h PRO 626 CO 0.60 0.00 0.13 -0.59 -0.23 0.00 0.00 178.00 177.91 3fby s PHE 627 N -3.40 -0.56 -1.02 1.56 -0.71 -1.09 -5.10 117.98 107.66 3fby s PHE 627 Ca 0.05 0.81 -0.23 0.00 -1.04 0.00 0.00 56.93 56.51 3fby s PHE 627 Cb 0.09 0.40 0.01 0.00 -1.21 0.00 0.00 43.02 42.31 3fby s PHE 627 CO 0.53 -0.64 1.66 0.50 -1.34 0.00 0.00 175.22 175.93 3fby s ARG 628 N -1.86 3.26 -0.22 1.99 3.52 -1.14 -4.70 118.95 119.80 3fby s ARG 628 Ca -0.08 -0.96 -0.22 0.00 -0.13 0.00 0.00 55.73 54.34 3fby s ARG 628 Cb -0.01 -5.28 -0.02 0.00 -1.56 0.00 0.00 34.95 28.08 3fby s ARG 628 CO 0.04 -2.67 0.70 0.00 -0.81 0.00 0.00 175.30 172.56 3fby s ALA 629 N 6.78 3.58 -0.03 6.12 0.00 -1.26 -5.01 121.76 131.94 3fby s ALA 629 Ca 0.55 -0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.31 3fby s ALA 629 Cb -0.02 -3.09 -0.03 0.00 0.00 0.00 0.00 23.12 19.99 3fby s ALA 629 CO -0.04 -0.72 -0.16 0.54 0.00 0.00 0.00 175.76 175.38 3fby s VAL 630 N 2.31 2.90 -0.12 0.00 0.11 -1.26 -1.82 120.40 122.51 3fby s VAL 630 Ca 0.31 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.53 3fby s VAL 630 Cb -0.16 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.55 3fby s VAL 630 CO 0.09 0.56 -0.14 0.00 -3.33 0.00 0.00 175.10 172.28 3fby s ALA 631 N -0.74 2.57 0.41 1.54 0.00 -0.73 -1.71 121.76 123.11 3fby s ALA 631 Ca 0.12 -0.90 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 3fby s ALA 631 Cb -0.11 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 3fby s ALA 631 CO 0.01 0.27 0.65 -2.00 0.00 0.00 0.00 175.76 174.69 3fby s GLU 632 N 0.29 3.43 0.74 0.00 2.56 -1.26 -1.73 118.70 122.73 3fby s GLU 632 Ca -0.11 -0.17 -0.08 0.00 0.00 0.00 0.00 54.97 54.62 3fby s GLU 632 Cb -0.16 -2.54 0.08 0.00 2.00 0.00 0.00 34.13 33.51 3fby s GLU 632 CO 0.06 -0.04 1.06 -1.25 -0.56 0.00 0.00 175.26 174.52 3fby s PRO 633 N -4.51 2.00 0.00 4.30 0.04 -1.26 -4.59 135.00 130.98 3fby s PRO 633 Ca 0.44 -0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.18 3fby s PRO 633 Cb -0.10 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.31 3fby s PRO 633 CO 0.39 -1.39 0.00 0.41 0.04 0.00 0.00 177.00 176.45 3fby n GLY 634 N -3.03 1.24 3.58 0.56 0.00 -0.92 -4.29 105.19 102.33 3fby n GLY 634 Ca 0.09 -1.22 -0.48 0.00 0.00 0.00 0.00 46.02 44.40 3fby n GLY 634 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3fby n ILE 635 N 2.89 0.92 -4.69 -0.61 -0.00 -1.26 -4.40 119.36 112.21 3fby n ILE 635 Ca 0.00 -0.23 -0.31 0.00 -0.00 0.00 0.00 62.75 62.21 3fby n ILE 635 Cb 0.00 -0.88 -0.13 0.00 -0.00 0.00 0.00 39.64 38.63 3fby n ILE 635 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 3fby s GLN 636 N -0.40 2.13 -0.22 0.38 -0.21 -0.88 -1.01 119.66 119.45 3fby s GLN 636 Ca 0.73 -0.94 -0.05 0.00 0.02 0.00 0.00 55.36 55.11 3fby s GLN 636 Cb -0.84 -2.22 -0.02 0.00 1.00 0.00 0.00 33.01 30.94 3fby s GLN 636 CO 0.52 0.55 0.01 -1.17 -2.12 0.00 0.00 175.29 173.08 3fby s LEU 637 N -1.36 3.19 0.03 2.90 1.98 0.96 -1.43 118.68 124.95 3fby s LEU 637 Ca 0.14 -0.27 0.06 0.00 -2.89 0.00 0.00 54.13 51.17 3fby s LEU 637 Cb -0.11 -1.83 -0.02 0.00 0.66 0.00 0.00 46.19 44.90 3fby s LEU 637 CO 0.05 0.00 -0.17 -0.54 -1.89 0.00 0.00 176.35 173.80 3fby s LYS 638 N 1.38 1.21 -0.16 1.98 1.02 0.23 0.74 119.74 126.13 3fby s LYS 638 Ca 0.05 -0.78 -0.07 0.00 0.02 0.00 0.00 55.97 55.19 3fby s LYS 638 Cb -0.15 -1.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.88 3fby s LYS 638 CO 0.01 0.32 0.08 0.00 -0.92 0.00 0.00 175.35 174.84 3fby s ALA 639 N -0.70 3.52 -0.26 5.17 0.00 0.02 -0.79 121.76 128.74 3fby s ALA 639 Ca 0.05 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 3fby s ALA 639 Cb -0.08 -1.92 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 3fby s ALA 639 CO 0.01 0.30 0.03 0.08 0.00 0.00 0.00 175.76 176.18 3fby s VAL 640 N -0.01 3.81 -0.40 0.00 1.01 0.21 -1.84 120.40 123.18 3fby s VAL 640 Ca 0.07 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3fby s VAL 640 Cb -0.12 -2.84 0.14 0.00 0.00 0.00 0.00 36.38 33.56 3fby s VAL 640 CO 0.01 0.26 0.23 -0.75 0.00 0.00 0.00 175.10 174.85 3fby s LYS 641 N 1.51 0.91 -0.21 2.72 2.47 -0.94 -0.94 119.74 125.26 3fby s LYS 641 Ca 0.04 -1.68 -0.17 0.00 -1.56 0.00 0.00 55.97 52.60 3fby s LYS 641 Cb -0.16 -1.78 -0.03 0.00 -1.46 0.00 0.00 37.83 34.40 3fby s LYS 641 CO 0.01 -1.20 0.46 0.45 0.16 0.00 0.00 175.35 175.23 3fby s SER 642 N 0.68 6.49 0.03 1.43 0.15 0.25 -3.92 113.70 118.81 3fby s SER 642 Ca 0.19 0.59 -0.25 0.00 0.70 0.00 0.00 55.95 57.17 3fby s SER 642 Cb -0.22 -2.26 -0.18 0.00 -1.71 0.00 0.00 66.02 61.65 3fby s SER 642 CO -0.01 -0.15 1.47 -1.28 1.20 0.00 0.00 173.24 174.48 3fby h SER 643 N 7.49 -0.07 0.07 5.45 0.87 -0.63 -3.33 113.55 123.39 3fby h SER 643 Ca -0.34 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 59.98 3fby h SER 643 Cb 1.16 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 3fby h SER 643 CO 0.72 0.20 -0.03 0.71 -0.53 0.00 0.00 176.83 177.90 3fby h THR 644 N -0.33 1.03 0.00 2.23 1.35 -1.93 -3.51 112.91 111.74 3fby h THR 644 Ca -0.01 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.34 3fby h THR 644 Cb 0.30 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 3fby h THR 644 CO 0.01 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.20 3fby n GLY 645 N 1.14 -3.25 1.96 5.82 0.00 -1.25 -5.01 105.19 104.60 3fby n GLY 645 Ca -0.07 -2.16 -0.34 0.00 0.00 0.00 0.00 46.02 43.44 3fby n GLY 645 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3fby n PRO 646 N -0.21 0.00 0.00 1.61 -0.02 -1.26 -4.21 135.00 130.92 3fby n PRO 646 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3fby n PRO 646 Cb 0.00 -0.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 3fby n PRO 646 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fby n GLY 647 N 1.53 1.47 0.06 -1.23 0.00 0.05 -4.72 105.19 102.34 3fby n GLY 647 Ca 0.14 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.41 3fby n GLY 647 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fby n GLU 648 N -1.78 -0.06 0.02 1.61 1.02 -1.26 -1.65 120.64 118.54 3fby n GLU 648 Ca 0.00 0.23 -0.01 0.00 -0.02 0.00 0.00 57.16 57.36 3fby n GLU 648 Cb 0.00 -0.34 -0.01 0.00 -0.02 0.00 0.00 31.44 31.08 3fby n GLU 648 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3fby h GLN 649 N 0.00 -0.06 -0.79 3.49 1.08 -1.93 -2.39 115.11 114.52 3fby h GLN 649 Ca 0.02 0.00 0.20 0.00 -1.45 0.00 0.00 58.65 57.42 3fby h GLN 649 Cb 0.06 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.46 3fby h GLN 649 CO -0.13 -0.04 0.54 1.25 -0.95 0.00 0.00 178.83 179.50 3fby h LEU 650 N -0.06 0.21 0.19 1.46 5.85 -1.63 -1.72 115.31 119.61 3fby h LEU 650 Ca -0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3fby h LEU 650 Cb 0.05 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3fby h LEU 650 CO 0.00 0.09 -0.09 -0.09 -0.34 0.00 0.00 178.44 178.01 3fby h ARG 651 N 0.21 -0.25 -0.83 1.25 2.43 -1.03 0.40 114.38 116.56 3fby h ARG 651 Ca 0.39 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.57 3fby h ARG 651 Cb 1.21 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.78 3fby h ARG 651 CO -0.08 0.13 0.48 -0.91 -1.51 0.00 0.00 179.97 178.08 3fby h ASN 652 N -0.70 1.01 -0.76 -3.80 4.21 -1.30 -2.16 115.58 112.08 3fby h ASN 652 Ca -0.03 -0.08 0.05 0.00 1.21 0.00 0.00 56.30 57.46 3fby h ASN 652 Cb 0.49 -0.26 -0.05 0.00 -1.12 0.00 0.00 38.32 37.38 3fby h ASN 652 CO 0.04 0.80 0.46 0.00 -1.29 0.00 0.00 177.43 177.44 3fby h ALA 653 N 1.26 1.02 -0.44 -0.83 0.00 -1.15 0.47 119.26 119.58 3fby h ALA 653 Ca 0.29 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 3fby h ALA 653 Cb -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3fby h ALA 653 CO -0.05 0.19 0.02 -0.07 0.00 0.00 0.00 179.25 179.34 3fby h LEU 654 N 0.86 0.74 -1.52 0.00 3.38 0.12 -2.83 115.31 116.05 3fby h LEU 654 Ca 0.32 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3fby h LEU 654 Cb 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3fby h LEU 654 CO -0.15 0.85 -0.19 -0.25 0.09 0.00 0.00 178.44 178.79 3fby h TRP 655 N 0.60 0.07 -3.36 1.13 2.91 -0.73 -3.44 115.95 113.13 3fby h TRP 655 Ca 0.13 -0.01 -0.55 0.00 1.13 0.00 0.00 58.89 59.59 3fby h TRP 655 Cb 0.46 -0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 29.06 3fby h TRP 655 CO 0.04 0.26 0.37 -1.58 -1.03 0.00 0.00 178.44 176.50 3fby s HIS 656 N -4.60 3.60 -0.15 2.65 2.46 0.09 -4.07 115.29 115.27 3fby s HIS 656 Ca -0.04 1.59 -0.29 0.00 0.47 0.00 0.00 55.06 56.78 3fby s HIS 656 Cb 0.15 -3.08 -0.02 0.00 -0.13 0.00 0.00 32.58 29.50 3fby s HIS 656 CO 0.71 -0.06 1.37 0.99 -2.47 0.00 0.00 174.74 175.28 3fby s THR 657 N 1.26 4.09 0.00 0.89 2.01 -0.69 -4.85 115.64 118.35 3fby s THR 657 Ca 0.48 1.31 0.00 0.00 0.31 0.00 0.00 61.69 63.80 3fby s THR 657 Cb -0.20 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.43 3fby s THR 657 CO 0.23 -0.15 0.00 0.61 -0.69 0.00 0.00 174.62 174.62 3fby n GLY 658 N 3.82 2.15 3.74 4.40 0.00 -1.26 -4.92 105.19 113.12 3fby n GLY 658 Ca 0.15 -1.95 -0.39 0.00 0.00 0.00 0.00 46.02 43.84 3fby n GLY 658 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fby n ASP 659 N 0.00 2.60 -3.88 1.61 8.00 -1.26 -4.69 116.55 118.92 3fby n ASP 659 Ca 0.00 0.98 -0.27 0.00 0.71 0.00 0.00 54.79 56.21 3fby n ASP 659 Cb 0.00 -1.56 -0.17 0.00 -0.02 0.00 0.00 41.12 39.37 3fby n ASP 659 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3fby s THR 660 N -1.29 0.95 0.20 -3.53 2.01 0.12 -4.99 115.64 109.10 3fby s THR 660 Ca 0.71 -0.29 -0.33 0.00 0.31 0.00 0.00 61.69 62.10 3fby s THR 660 Cb -0.42 -1.01 -0.13 0.00 0.01 0.00 0.00 72.50 70.94 3fby s THR 660 CO 0.50 0.31 1.53 -0.62 -0.69 0.00 0.00 174.62 175.65 3fby n GLU 661 N 4.96 2.18 -1.29 4.92 1.02 -1.26 -1.01 120.64 130.16 3fby n GLU 661 Ca -0.12 0.78 -0.10 0.00 -0.02 0.00 0.00 57.16 57.71 3fby n GLU 661 Cb 0.50 -2.52 -0.04 0.00 -0.02 0.00 0.00 31.44 29.35 3fby n GLU 661 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3fby n SER 662 N 2.95 -4.97 0.01 1.62 7.64 -1.26 -4.76 113.62 114.86 3fby n SER 662 Ca 0.15 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.27 3fby n SER 662 Cb 0.30 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 60.15 3fby n SER 662 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3fby n GLN 663 N -1.69 0.00 -3.75 1.43 1.13 -0.65 0.12 117.38 113.98 3fby n GLN 663 Ca -0.10 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.83 3fby n GLN 663 Cb 0.46 -0.02 -0.09 0.00 0.11 0.00 0.00 30.24 30.70 3fby n GLN 663 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3fby s VAL 664 N -1.12 0.04 -0.04 5.09 0.11 -0.18 -2.22 120.40 122.09 3fby s VAL 664 Ca 0.00 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 58.67 3fby s VAL 664 Cb 0.00 -0.61 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 3fby s VAL 664 CO 0.00 -0.20 0.07 -0.60 -3.33 0.00 0.00 175.10 171.03 3fby s ARG 665 N -1.04 -0.03 -0.43 1.54 3.52 -0.77 0.13 118.95 121.87 3fby s ARG 665 Ca -0.11 0.32 -0.25 0.00 -0.13 0.00 0.00 55.73 55.56 3fby s ARG 665 Cb -0.05 -0.35 0.02 0.00 -1.56 0.00 0.00 34.95 33.02 3fby s ARG 665 CO 0.04 -0.25 0.90 -1.17 -0.81 0.00 0.00 175.30 174.01 3fby s LEU 666 N 1.64 4.04 -0.08 -0.88 1.98 -1.26 -0.80 118.68 123.32 3fby s LEU 666 Ca -0.02 0.21 0.03 0.00 -2.89 0.00 0.00 54.13 51.46 3fby s LEU 666 Cb -0.12 -3.17 -0.25 0.00 0.66 0.00 0.00 46.19 43.31 3fby s LEU 666 CO -0.04 -0.96 0.51 0.18 -1.89 0.00 0.00 176.35 174.15 3fby n LEU 667 N 6.96 1.73 -3.73 -0.68 4.77 0.23 -4.90 117.00 121.37 3fby n LEU 667 Ca 0.06 0.31 -0.12 0.00 -0.03 0.00 0.00 56.01 56.22 3fby n LEU 667 Cb 0.48 -0.46 -0.07 0.00 -2.33 0.00 0.00 43.42 41.04 3fby n LEU 667 CO 0.61 0.62 0.07 0.86 -1.33 0.00 0.00 177.39 178.21 3fby s TRP 668 N -2.58 -0.18 -0.11 -1.77 -0.00 -1.05 -4.97 118.94 108.29 3fby s TRP 668 Ca -0.13 0.14 -0.10 0.00 -0.00 0.00 0.00 56.10 56.01 3fby s TRP 668 Cb 0.07 0.13 0.03 0.00 -0.00 0.00 0.00 33.47 33.70 3fby s TRP 668 CO 0.80 -0.49 0.29 0.21 -0.00 0.00 0.00 176.95 177.76 3fby s LYS 669 N -2.14 0.33 -0.06 5.86 2.20 -1.26 -0.03 119.74 124.64 3fby s LYS 669 Ca -0.08 0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 55.65 3fby s LYS 669 Cb -0.02 0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.41 3fby s LYS 669 CO -0.01 -0.05 1.22 0.34 -0.36 0.00 0.00 175.35 176.50 3fby s ASP 670 N 0.23 7.02 0.00 1.43 2.15 -0.18 -4.88 116.67 122.43 3fby s ASP 670 Ca -0.01 1.82 0.24 0.00 0.43 0.00 0.00 52.55 55.04 3fby s ASP 670 Cb -0.03 -2.56 1.16 0.00 -0.30 0.00 0.00 42.92 41.20 3fby s ASP 670 CO -0.00 -0.62 1.79 -2.65 -0.17 0.00 0.00 175.17 173.52 3fby n PRO 671 N 5.38 0.25 0.18 4.34 -0.02 -1.26 -1.40 135.00 142.48 3fby n PRO 671 Ca 0.11 0.07 0.14 0.00 -2.02 0.00 0.00 63.50 61.80 3fby n PRO 671 Cb 0.46 -1.50 0.55 0.00 -0.02 0.00 0.00 33.50 32.99 3fby n PRO 671 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fby h ARG 672 N 0.00 0.00 -6.87 -0.52 3.08 -1.96 -3.47 114.38 104.65 3fby h ARG 672 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 3fby h ARG 672 Cb 0.27 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 30.15 3fby h ARG 672 CO 0.00 0.00 -0.86 -1.71 -1.07 0.00 0.00 179.97 176.33 3fby n ASN 673 N -2.54 0.48 -4.44 7.04 5.15 -0.49 -4.97 115.26 115.48 3fby n ASN 673 Ca 0.02 -1.14 -0.33 0.00 -0.60 0.00 0.00 54.58 52.53 3fby n ASN 673 Cb 0.27 -1.41 -0.13 0.00 -0.53 0.00 0.00 39.78 37.98 3fby n ASN 673 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3fby s VAL 674 N -4.19 3.33 0.88 3.44 1.01 -1.26 -4.54 120.40 119.07 3fby s VAL 674 Ca 0.04 -0.58 -0.12 0.00 0.00 0.00 0.00 61.98 61.32 3fby s VAL 674 Cb -0.02 -2.40 0.12 0.00 0.00 0.00 0.00 36.38 34.08 3fby s VAL 674 CO 0.88 0.54 1.10 -0.83 0.00 0.00 0.00 175.10 176.79 3fby s GLY 675 N 0.04 1.60 0.74 4.51 0.00 -1.25 -2.16 107.32 110.80 3fby s GLY 675 Ca -0.03 -0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.33 3fby s GLY 675 CO 0.04 0.24 1.07 0.66 0.00 0.00 0.00 173.10 175.11 3fby s TRP 676 N -3.10 2.88 0.09 1.90 1.48 -1.24 -4.89 118.94 116.06 3fby s TRP 676 Ca 0.63 1.45 -0.02 0.00 -1.06 0.00 0.00 56.10 57.09 3fby s TRP 676 Cb -0.16 -2.96 -0.05 0.00 -1.16 0.00 0.00 33.47 29.14 3fby s TRP 676 CO 0.55 -1.51 0.28 0.15 -4.06 0.00 0.00 176.95 172.37 3fby s LYS 677 N -5.00 3.52 0.28 3.25 1.02 -1.26 -4.74 119.74 116.81 3fby s LYS 677 Ca 0.59 -0.27 -0.30 0.00 0.02 0.00 0.00 55.97 56.01 3fby s LYS 677 Cb -0.15 -2.96 -0.13 0.00 -0.52 0.00 0.00 37.83 34.07 3fby s LYS 677 CO 0.55 0.55 1.40 -0.25 -0.92 0.00 0.00 175.35 176.69 3fby n ASP 678 N 0.25 2.93 -3.10 2.83 8.00 -1.26 -2.83 116.55 123.37 3fby n ASP 678 Ca -0.04 1.16 -0.22 0.00 0.71 0.00 0.00 54.79 56.40 3fby n ASP 678 Cb 0.51 -1.47 0.02 0.00 -0.02 0.00 0.00 41.12 40.16 3fby n ASP 678 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3fby n LYS 679 N 1.59 -4.11 -5.01 -1.24 5.02 0.22 -4.97 118.16 109.67 3fby n LYS 679 Ca 0.09 0.73 -0.28 0.00 -2.02 0.00 0.00 58.31 56.84 3fby n LYS 679 Cb 0.34 -5.52 -0.16 0.00 -0.02 0.00 0.00 35.03 29.67 3fby n LYS 679 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3fby s LYS 680 N -5.77 1.86 -0.04 1.97 2.20 -1.13 -4.98 119.74 113.86 3fby s LYS 680 Ca 0.32 -0.73 -0.24 0.00 -0.36 0.00 0.00 55.97 54.96 3fby s LYS 680 Cb -0.15 -1.70 -0.04 0.00 -1.51 0.00 0.00 37.83 34.43 3fby s LYS 680 CO 0.39 0.37 0.72 -1.12 -0.36 0.00 0.00 175.35 175.36 3fby s SER 681 N -0.27 7.05 0.09 1.43 0.01 -1.26 -4.33 113.70 116.41 3fby s SER 681 Ca 0.02 1.26 0.09 0.00 1.31 0.00 0.00 55.95 58.63 3fby s SER 681 Cb -0.10 -2.43 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 3fby s SER 681 CO 0.01 -0.09 -0.23 -0.31 0.41 0.00 0.00 173.24 173.03 3fby s TYR 682 N 0.62 2.00 -0.09 2.43 1.51 -0.11 -3.83 117.35 119.88 3fby s TYR 682 Ca 0.38 -0.40 0.04 0.00 -1.01 0.00 0.00 57.07 56.09 3fby s TYR 682 Cb -0.18 -1.13 -0.01 0.00 -0.11 0.00 0.00 41.96 40.53 3fby s TYR 682 CO 0.19 0.20 -0.22 0.50 -1.11 0.00 0.00 175.55 175.12 3fby s ARG 683 N -1.68 2.88 0.01 -0.62 3.52 -0.23 0.28 118.95 123.11 3fby s ARG 683 Ca 0.09 -0.84 0.03 0.00 -0.13 0.00 0.00 55.73 54.88 3fby s ARG 683 Cb -0.10 -2.31 -0.03 0.00 -1.56 0.00 0.00 34.95 30.95 3fby s ARG 683 CO 0.04 0.29 -0.06 1.67 -0.81 0.00 0.00 175.30 176.43 3fby s TRP 684 N 0.08 2.91 -0.11 5.12 -2.14 -0.17 -0.46 118.94 124.18 3fby s TRP 684 Ca -0.10 -0.03 0.01 0.00 2.66 0.00 0.00 56.10 58.64 3fby s TRP 684 Cb -0.15 -1.61 0.02 0.00 -3.10 0.00 0.00 33.47 28.63 3fby s TRP 684 CO 0.06 0.39 -0.10 -0.06 -2.66 0.00 0.00 176.95 174.57 3fby s PHE 685 N -1.02 1.63 -0.08 1.66 0.40 -0.44 -2.44 117.98 117.68 3fby s PHE 685 Ca 0.18 -0.78 0.01 0.00 -0.60 0.00 0.00 56.93 55.73 3fby s PHE 685 Cb -0.11 -1.27 -0.03 0.00 0.51 0.00 0.00 43.02 42.12 3fby s PHE 685 CO 0.08 -0.48 -0.08 -1.17 0.70 0.00 0.00 175.22 174.27 3fby s LEU 686 N 1.36 3.08 -0.13 -0.37 2.96 0.85 -1.60 118.68 124.82 3fby s LEU 686 Ca -0.01 -0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.83 3fby s LEU 686 Cb -0.14 -1.67 0.02 0.00 0.50 0.00 0.00 46.19 44.90 3fby s LEU 686 CO -0.05 0.32 -0.15 -1.10 -1.32 0.00 0.00 176.35 174.06 3fby s GLN 687 N -0.58 2.26 -0.13 1.98 -0.21 0.64 -1.68 119.66 121.95 3fby s GLN 687 Ca 0.09 -0.56 -0.01 0.00 0.02 0.00 0.00 55.36 54.90 3fby s GLN 687 Cb -0.12 -1.99 0.03 0.00 1.00 0.00 0.00 33.01 31.94 3fby s GLN 687 CO 0.02 -0.14 -0.04 -1.58 -2.12 0.00 0.00 175.29 171.43 3fby s HIS 688 N 1.22 1.32 -0.53 0.91 2.46 0.14 -1.09 115.29 119.72 3fby s HIS 688 Ca -0.01 -0.73 0.04 0.00 0.47 0.00 0.00 55.06 54.82 3fby s HIS 688 Cb -0.14 -1.14 0.15 0.00 -0.13 0.00 0.00 32.58 31.32 3fby s HIS 688 CO -0.06 -0.51 0.34 1.03 -2.47 0.00 0.00 174.74 173.06 3fby s ARG 689 N 1.76 1.72 0.00 2.88 1.81 -0.16 -0.05 118.95 126.91 3fby s ARG 689 Ca 0.03 -2.55 0.24 0.00 -1.72 0.00 0.00 55.73 51.73 3fby s ARG 689 Cb -0.14 -2.72 1.25 0.00 -0.45 0.00 0.00 34.95 32.90 3fby s ARG 689 CO -0.07 -1.22 1.79 -0.35 -0.68 0.00 0.00 175.30 174.77 3fby n PRO 690 N 2.87 0.43 0.19 3.54 -0.04 -1.26 -0.43 135.00 140.30 3fby n PRO 690 Ca 0.14 0.05 0.05 0.00 -0.04 0.00 0.00 63.50 63.71 3fby n PRO 690 Cb 0.36 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.69 3fby n PRO 690 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 3fby h GLN 691 N 0.00 0.00 0.00 0.54 -0.00 -1.94 -3.05 115.11 110.66 3fby h GLN 691 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3fby h GLN 691 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.66 3fby h GLN 691 CO 0.00 0.37 0.00 1.33 -0.00 0.00 0.00 178.83 180.53 3fby n VAL 692 N -3.64 0.80 -2.07 1.86 0.24 -1.03 -5.01 118.33 109.49 3fby n VAL 692 Ca -0.01 -0.88 -0.14 0.00 -2.04 0.00 0.00 64.34 61.27 3fby n VAL 692 Cb 0.48 0.61 -0.02 0.00 -1.47 0.00 0.00 33.84 33.43 3fby n VAL 692 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fby n GLY 693 N -0.40 0.18 3.71 7.63 0.00 -0.17 -4.82 105.19 111.32 3fby n GLY 693 Ca 0.00 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 3fby n GLY 693 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3fby s TYR 694 N -2.66 3.60 -0.03 1.61 5.04 0.43 -0.42 117.35 124.91 3fby s TYR 694 Ca 0.00 1.58 0.01 0.00 -2.44 0.00 0.00 57.07 56.21 3fby s TYR 694 Cb 0.00 -3.22 0.02 0.00 0.35 0.00 0.00 41.96 39.11 3fby s TYR 694 CO 0.00 -0.43 -0.03 0.42 -1.34 0.00 0.00 175.55 174.17 3fby s ILE 695 N 0.89 0.40 -0.17 3.14 1.01 0.75 -0.99 121.20 126.23 3fby s ILE 695 Ca 0.54 -0.07 -0.08 0.00 0.00 0.00 0.00 60.65 61.03 3fby s ILE 695 Cb -0.24 -0.43 0.06 0.00 0.01 0.00 0.00 42.46 41.86 3fby s ILE 695 CO 0.29 0.18 0.39 -0.60 0.00 0.00 0.00 174.94 175.20 3fby s ARG 696 N 0.78 0.35 0.01 2.79 6.06 -0.25 -1.44 118.95 127.25 3fby s ARG 696 Ca -0.09 0.80 0.03 0.00 -2.50 0.00 0.00 55.73 53.97 3fby s ARG 696 Cb -0.12 0.02 -0.01 0.00 0.06 0.00 0.00 34.95 34.90 3fby s ARG 696 CO -0.00 -0.18 -0.09 0.14 -2.50 0.00 0.00 175.30 172.67 3fby s VAL 697 N 1.64 0.67 0.02 7.11 -7.23 -1.26 -0.26 120.40 121.10 3fby s VAL 697 Ca -0.08 -0.55 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 3fby s VAL 697 Cb -0.09 -0.60 -0.02 0.00 0.56 0.00 0.00 36.38 36.23 3fby s VAL 697 CO -0.12 0.06 -0.05 -0.13 -0.31 0.00 0.00 175.10 174.55 3fby s ARG 698 N -0.54 0.38 -0.03 4.82 3.00 -0.63 -2.83 118.95 123.11 3fby s ARG 698 Ca 0.01 -0.56 0.05 0.00 0.00 0.00 0.00 55.73 55.22 3fby s ARG 698 Cb -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 34.95 34.78 3fby s ARG 698 CO 0.00 0.01 -0.17 -0.06 0.00 0.00 0.00 175.30 175.08 3fby s PHE 699 N -1.14 1.65 -0.22 -0.53 0.08 0.32 -1.33 117.98 116.82 3fby s PHE 699 Ca -0.10 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.56 3fby s PHE 699 Cb -0.08 -1.09 0.03 0.00 -0.57 0.00 0.00 43.02 41.31 3fby s PHE 699 CO -0.00 -0.10 -0.15 0.71 -0.10 0.00 0.00 175.22 175.58 3fby s TYR 700 N -0.17 2.98 -0.67 0.36 1.51 0.40 0.44 117.35 122.20 3fby s TYR 700 Ca 0.01 -1.82 -0.23 0.00 -1.01 0.00 0.00 57.07 54.02 3fby s TYR 700 Cb -0.09 -1.95 0.06 0.00 -0.11 0.00 0.00 41.96 39.87 3fby s TYR 700 CO 0.01 -0.81 1.00 -2.00 -1.11 0.00 0.00 175.55 172.64 3fby s GLU 701 N 1.24 3.12 4.30 -0.62 2.12 -0.14 -1.06 118.70 127.65 3fby s GLU 701 Ca -0.00 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.58 3fby s GLU 701 Cb -0.16 -4.22 0.00 0.00 0.26 0.00 0.00 34.13 30.01 3fby s GLU 701 CO -0.09 -1.86 0.00 0.41 -0.54 0.00 0.00 175.26 173.18 3fby n GLY 702 N 5.33 1.22 0.29 -1.50 0.00 -1.25 -3.12 105.19 106.16 3fby n GLY 702 Ca -0.03 -0.65 0.04 0.00 0.00 0.00 0.00 46.02 45.38 3fby n GLY 702 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fby h PRO 703 N 0.00 0.60 -6.78 1.61 0.13 -1.89 -3.42 132.00 122.25 3fby h PRO 703 Ca 0.00 -0.04 -0.54 0.00 -0.87 0.00 0.00 66.00 64.55 3fby h PRO 703 Cb 0.00 -0.14 0.09 0.00 0.13 0.00 0.00 31.00 31.08 3fby h PRO 703 CO 0.00 0.40 0.80 0.39 -0.23 0.00 0.00 178.00 179.36 3fby n GLU 704 N -4.86 2.57 -3.07 0.86 1.02 -1.18 -4.87 120.64 111.11 3fby n GLU 704 Ca 0.14 0.91 -0.43 0.00 -0.02 0.00 0.00 57.16 57.76 3fby n GLU 704 Cb 0.34 -2.66 -0.06 0.00 -0.02 0.00 0.00 31.44 29.04 3fby n GLU 704 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3fby s LEU 705 N -0.66 4.51 0.08 -4.62 0.20 -1.26 -0.97 118.68 115.95 3fby s LEU 705 Ca 0.62 -0.41 0.18 0.00 0.69 0.00 0.00 54.13 55.21 3fby s LEU 705 Cb -0.52 -2.72 -0.12 0.00 -0.43 0.00 0.00 46.19 42.40 3fby s LEU 705 CO 0.52 -0.86 0.84 1.33 -0.29 0.00 0.00 176.35 177.89 3fby n VAL 706 N 5.89 1.11 -3.96 1.68 0.24 0.17 -4.93 118.33 118.53 3fby n VAL 706 Ca -0.02 -0.67 -0.09 0.00 -2.04 0.00 0.00 64.34 61.52 3fby n VAL 706 Cb 0.47 -0.68 -0.10 0.00 -1.47 0.00 0.00 33.84 32.06 3fby n VAL 706 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fby s ALA 707 N -2.98 0.03 0.22 2.33 0.00 -0.98 -4.97 121.76 115.41 3fby s ALA 707 Ca -0.03 -0.54 -0.14 0.00 0.00 0.00 0.00 51.96 51.25 3fby s ALA 707 Cb 0.09 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.39 3fby s ALA 707 CO 0.81 -0.22 0.48 0.34 0.00 0.00 0.00 175.76 177.17 3fby s ASP 708 N -1.71 -0.13 -0.37 0.00 -1.08 -1.26 -0.52 116.67 111.60 3fby s ASP 708 Ca -0.12 -0.77 0.10 0.00 -0.52 0.00 0.00 52.55 51.25 3fby s ASP 708 Cb -0.06 0.57 0.38 0.00 -1.46 0.00 0.00 42.92 42.35 3fby s ASP 708 CO -0.02 -1.10 1.40 -1.54 0.52 0.00 0.00 175.17 174.43 3fby n SER 709 N -0.35 -1.70 -1.64 -0.34 3.41 -1.13 -4.96 113.62 106.91 3fby n SER 709 Ca -0.05 -2.32 -0.23 0.00 -0.26 0.00 0.00 58.87 56.01 3fby n SER 709 Cb 0.62 0.89 -0.03 0.00 -0.26 0.00 0.00 64.21 65.43 3fby n SER 709 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3fby n ASN 710 N -0.90 0.37 -3.82 4.04 3.02 -1.26 -3.60 115.26 113.10 3fby n ASN 710 Ca -0.09 0.41 -0.34 0.00 -0.03 0.00 0.00 54.58 54.53 3fby n ASN 710 Cb 0.85 -0.31 0.03 0.00 -0.61 0.00 0.00 39.78 39.74 3fby n ASN 710 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3fby n VAL 711 N 1.28 -4.69 -2.23 2.41 0.24 -1.25 -4.92 118.33 109.17 3fby n VAL 711 Ca 0.10 -0.81 -0.42 0.00 -2.04 0.00 0.00 64.34 61.17 3fby n VAL 711 Cb -0.01 -3.60 -0.03 0.00 -1.47 0.00 0.00 33.84 28.73 3fby n VAL 711 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3fby s VAL 712 N -3.57 3.77 -0.22 3.34 1.01 -0.52 -4.92 120.40 119.29 3fby s VAL 712 Ca 0.40 1.12 -0.06 0.00 0.00 0.00 0.00 61.98 63.43 3fby s VAL 712 Cb -0.16 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 3fby s VAL 712 CO 0.89 -0.02 0.04 -0.76 0.00 0.00 0.00 175.10 175.25 3fby s LEU 713 N 2.63 3.36 0.12 3.92 1.43 -1.26 -0.18 118.68 128.71 3fby s LEU 713 Ca 0.63 -0.19 -0.17 0.00 -1.03 0.00 0.00 54.13 53.37 3fby s LEU 713 Cb -0.30 -1.88 0.04 0.00 0.03 0.00 0.00 46.19 44.08 3fby s LEU 713 CO 0.25 0.02 0.43 -0.62 0.23 0.00 0.00 176.35 176.67 3fby s ASP 714 N 1.28 -0.29 0.00 2.29 -1.08 0.44 -5.01 116.67 114.30 3fby s ASP 714 Ca 0.04 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 51.83 3fby s ASP 714 Cb -0.15 0.49 0.00 0.00 -1.46 0.00 0.00 42.92 41.80 3fby s ASP 714 CO 0.02 -0.85 0.18 1.07 0.52 0.00 0.00 175.17 176.11 3fby n THR 715 N -0.19 0.00 0.26 1.71 5.66 -1.26 -4.29 114.28 116.16 3fby n THR 715 Ca -0.16 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 60.96 3fby n THR 715 Cb 0.64 1.33 0.67 0.00 -1.55 0.00 0.00 70.33 71.42 3fby n THR 715 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 3fby h THR 716 N 1.85 0.55 -3.31 1.09 2.02 -1.98 -3.37 112.91 109.76 3fby h THR 716 Ca 0.00 -0.66 -0.54 0.00 0.77 0.00 0.00 66.41 65.98 3fby h THR 716 Cb 0.71 1.44 -0.40 0.00 -1.74 0.00 0.00 68.15 68.16 3fby h THR 716 CO 0.00 0.14 -0.77 -0.04 0.37 0.00 0.00 175.52 175.22 3fby s MET 717 N -4.06 0.81 -1.14 6.66 -1.94 -1.26 -5.02 119.30 113.34 3fby s MET 717 Ca -0.02 -0.58 -0.16 0.00 -1.71 0.00 0.00 55.69 53.23 3fby s MET 717 Cb 0.12 -2.17 0.15 0.00 2.01 0.00 0.00 34.83 34.95 3fby s MET 717 CO 0.59 -0.67 1.38 1.03 -0.01 0.00 0.00 175.02 177.34 3fby s ARG 718 N 1.76 3.94 0.00 2.03 0.52 -0.93 -4.90 118.95 121.38 3fby s ARG 718 Ca -0.01 -2.28 0.00 0.00 -0.52 0.00 0.00 55.73 52.92 3fby s ARG 718 Cb -0.17 -5.07 0.00 0.00 0.52 0.00 0.00 34.95 30.22 3fby s ARG 718 CO -0.10 -1.82 0.00 0.41 0.02 0.00 0.00 175.30 173.81 3fby n GLY 719 N 4.65 -1.20 0.00 -3.53 0.00 -1.26 -4.20 105.19 99.65 3fby n GLY 719 Ca 0.34 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3fby n GLY 719 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fby n GLY 720 N -1.28 0.17 3.97 -0.02 0.00 0.18 -4.50 105.19 103.71 3fby n GLY 720 Ca 0.00 -1.61 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 3fby n GLY 720 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fby s ARG 721 N -2.00 2.95 0.30 1.61 0.52 0.54 -0.17 118.95 122.69 3fby s ARG 721 Ca 0.00 -0.66 0.07 0.00 -0.52 0.00 0.00 55.73 54.62 3fby s ARG 721 Cb 0.00 -2.59 -0.03 0.00 0.52 0.00 0.00 34.95 32.85 3fby s ARG 721 CO 0.00 -0.32 0.24 -0.51 0.02 0.00 0.00 175.30 174.73 3fby s LEU 722 N -4.53 3.67 0.00 2.53 1.43 -1.26 -1.80 118.68 118.72 3fby s LEU 722 Ca 0.50 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 3fby s LEU 722 Cb -0.10 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.87 3fby s LEU 722 CO 0.37 -0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.36 3fby n GLY 723 N -1.27 -1.18 3.44 -3.19 0.00 -0.33 -0.93 105.19 101.73 3fby n GLY 723 Ca -0.05 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.79 3fby n GLY 723 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fby s VAL 724 N -2.50 2.44 0.08 1.61 -7.23 0.48 -0.02 120.40 115.26 3fby s VAL 724 Ca 0.00 -1.95 0.08 0.00 -1.81 0.00 0.00 61.98 58.31 3fby s VAL 724 Cb 0.00 -2.16 -0.03 0.00 0.56 0.00 0.00 36.38 34.75 3fby s VAL 724 CO 0.00 -0.08 -0.22 0.12 -0.31 0.00 0.00 175.10 174.61 3fby s PHE 725 N -1.58 1.86 0.17 2.82 5.36 -0.73 -2.01 117.98 123.87 3fby s PHE 725 Ca 0.20 -0.40 -0.22 0.00 -0.96 0.00 0.00 56.93 55.56 3fby s PHE 725 Cb -0.08 -1.06 0.06 0.00 -0.34 0.00 0.00 43.02 41.60 3fby s PHE 725 CO 0.10 0.17 0.58 0.00 -1.46 0.00 0.00 175.22 174.62 3fby s PHE 727 N -3.78 -1.16 -1.35 0.00 5.99 -0.97 -1.69 117.98 115.02 3fby s PHE 727 Ca 0.03 1.21 -0.02 0.00 0.00 0.00 0.00 56.93 58.15 3fby s PHE 727 Cb -0.01 0.26 0.01 0.00 0.00 0.00 0.00 43.02 43.27 3fby s PHE 727 CO -0.10 -0.79 0.68 0.45 -0.00 0.00 0.00 175.22 175.46 3fby n SER 728 N 5.39 -1.41 -3.66 6.13 2.88 -0.44 -2.08 113.62 120.43 3fby n SER 728 Ca -0.02 -0.85 -0.05 0.00 -1.33 0.00 0.00 58.87 56.62 3fby n SER 728 Cb 0.51 -3.87 -0.07 0.00 -0.75 0.00 0.00 64.21 60.02 3fby n SER 728 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 3fby s GLN 729 N -6.14 0.48 0.06 -1.46 2.00 -1.26 -4.40 119.66 108.93 3fby s GLN 729 Ca 0.08 1.23 -0.03 0.00 -2.00 0.00 0.00 55.36 54.64 3fby s GLN 729 Cb -0.04 0.54 -0.04 0.00 0.80 0.00 0.00 33.01 34.27 3fby s GLN 729 CO 0.83 -0.21 0.25 -1.83 -0.50 0.00 0.00 175.29 173.83 3fby s GLU 730 N 2.56 3.50 -1.16 1.67 -1.05 -1.24 -4.52 118.70 118.46 3fby s GLU 730 Ca -0.05 -0.27 -0.04 0.00 -0.15 0.00 0.00 54.97 54.46 3fby s GLU 730 Cb -0.11 -3.02 0.00 0.00 -0.44 0.00 0.00 34.13 30.57 3fby s GLU 730 CO -0.16 0.60 0.99 0.09 0.95 0.00 0.00 175.26 177.73 3fby n ASN 731 N 0.51 -3.88 -4.77 0.83 5.03 -0.26 -4.78 115.26 107.94 3fby n ASN 731 Ca -0.07 -0.53 -0.38 0.00 0.87 0.00 0.00 54.58 54.47 3fby n ASN 731 Cb 0.52 -4.69 -0.05 0.00 -1.02 0.00 0.00 39.78 34.54 3fby n ASN 731 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3fby s ILE 732 N -3.31 3.91 -0.14 2.41 -1.09 -0.98 -1.07 121.20 120.92 3fby s ILE 732 Ca 0.25 1.67 0.02 0.00 -2.23 0.00 0.00 60.65 60.36 3fby s ILE 732 Cb -0.11 -3.97 0.01 0.00 -1.58 0.00 0.00 42.46 36.81 3fby s ILE 732 CO 0.67 0.22 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.75 3fby s ILE 733 N -1.46 2.16 -0.32 2.92 1.01 0.11 -2.07 121.20 123.55 3fby s ILE 733 Ca 0.49 -0.94 -0.08 0.00 0.00 0.00 0.00 60.65 60.12 3fby s ILE 733 Cb -0.24 -1.87 0.02 0.00 0.01 0.00 0.00 42.46 40.38 3fby s ILE 733 CO 0.30 0.54 0.12 0.26 0.00 0.00 0.00 174.94 176.16 3fby s TRP 734 N 0.84 3.19 0.00 3.97 0.51 0.72 -1.00 118.94 127.17 3fby s TRP 734 Ca -0.06 -0.98 0.07 0.00 -2.12 0.00 0.00 56.10 53.00 3fby s TRP 734 Cb -0.15 -2.31 -0.02 0.00 -0.81 0.00 0.00 33.47 30.18 3fby s TRP 734 CO -0.02 -0.60 -0.21 0.00 -0.51 0.00 0.00 176.95 175.62 3fby s ALA 735 N 1.51 1.72 -0.75 0.98 0.00 0.05 -0.10 121.76 125.18 3fby s ALA 735 Ca 0.02 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 3fby s ALA 735 Cb -0.18 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.54 3fby s ALA 735 CO 0.04 0.41 0.65 -1.71 0.00 0.00 0.00 175.76 175.15 3fby n ASN 736 N 2.33 -3.83 -4.71 0.00 5.15 -0.64 -1.20 115.26 112.35 3fby n ASN 736 Ca -0.16 -0.32 -0.37 0.00 -0.60 0.00 0.00 54.58 53.13 3fby n ASN 736 Cb 0.53 -3.10 0.06 0.00 -0.53 0.00 0.00 39.78 36.74 3fby n ASN 736 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3fby n LEU 737 N -2.99 5.54 -3.65 1.20 7.99 0.10 -4.45 117.00 120.75 3fby n LEU 737 Ca -0.04 0.86 -0.09 0.00 -0.01 0.00 0.00 56.01 56.73 3fby n LEU 737 Cb 0.55 -1.53 -0.08 0.00 -0.11 0.00 0.00 43.42 42.25 3fby n LEU 737 CO 0.36 -1.04 0.31 -0.60 -1.51 0.00 0.00 177.39 174.91 3fby s ARG 738 N -3.16 0.68 0.33 3.23 3.52 0.11 -4.86 118.95 118.80 3fby s ARG 738 Ca 0.79 1.11 0.03 0.00 -0.13 0.00 0.00 55.73 57.53 3fby s ARG 738 Cb -0.40 0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.11 3fby s ARG 738 CO 0.43 -0.14 0.09 1.52 -0.81 0.00 0.00 175.30 176.39 3fby s TYR 739 N 1.35 1.81 -0.13 5.12 -0.85 -1.26 0.68 117.35 124.08 3fby s TYR 739 Ca -0.08 -1.10 -0.28 0.00 -0.52 0.00 0.00 57.07 55.10 3fby s TYR 739 Cb -0.05 -1.15 0.07 0.00 0.38 0.00 0.00 41.96 41.20 3fby s TYR 739 CO -0.15 -0.16 0.67 1.03 -1.52 0.00 0.00 175.55 175.42 3fby s ARG 740 N -3.88 0.95 0.02 -3.49 0.52 -0.90 -4.75 118.95 107.41 3fby s ARG 740 Ca 0.34 0.50 -0.30 0.00 -0.52 0.00 0.00 55.73 55.75 3fby s ARG 740 Cb 0.07 0.45 -0.05 0.00 0.52 0.00 0.00 34.95 35.95 3fby s ARG 740 CO 0.15 -0.24 1.17 0.00 0.02 0.00 0.00 175.30 176.40 3fby s ASN 742 N 1.17 -0.31 -0.07 0.00 3.84 -0.00 -4.84 114.94 114.72 3fby s ASN 742 Ca 0.57 0.61 0.13 0.00 0.21 0.00 0.00 52.86 54.38 3fby s ASN 742 Cb -0.27 1.47 -0.19 0.00 -0.55 0.00 0.00 41.25 41.71 3fby s ASN 742 CO 0.27 -0.27 0.18 0.47 -2.79 0.00 0.00 177.10 174.96 3fby n ASP 743 N 5.39 1.78 -4.60 -4.21 8.00 -1.26 -2.87 116.55 118.78 3fby n ASP 743 Ca -0.05 0.00 -0.48 0.00 0.71 0.00 0.00 54.79 54.98 3fby n ASP 743 Cb 0.50 1.25 -0.05 0.00 -0.02 0.00 0.00 41.12 42.80 3fby n ASP 743 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3fby n THR 744 N -2.23 0.43 -2.43 -3.53 -2.24 -1.26 -4.87 114.28 98.15 3fby n THR 744 Ca -0.12 -0.22 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 3fby n THR 744 Cb 0.63 -1.96 -0.02 0.00 -2.10 0.00 0.00 70.33 66.88 3fby n THR 744 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fby s ILE 745 N 5.87 4.22 0.50 2.28 1.09 -1.26 -4.98 121.20 128.92 3fby s ILE 745 Ca 0.99 1.44 -0.19 0.00 -1.10 0.00 0.00 60.65 61.79 3fby s ILE 745 Cb -0.66 -4.08 -0.12 0.00 -1.06 0.00 0.00 42.46 36.54 3fby s ILE 745 CO 0.48 -0.29 0.29 -2.65 -0.10 0.00 0.00 174.94 172.66 3fby n PRO 746 N 6.93 0.32 -0.12 2.79 -0.02 -1.26 -4.91 135.00 138.73 3fby n PRO 746 Ca 0.14 0.12 -0.07 0.00 -2.02 0.00 0.00 63.50 61.67 3fby n PRO 746 Cb 0.46 -1.38 0.01 0.00 -0.02 0.00 0.00 33.50 32.56 3fby n PRO 746 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3fby h GLU 747 N 0.29 0.47 0.00 -0.52 4.81 -2.04 -2.58 114.58 115.02 3fby h GLU 747 Ca -0.42 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3fby h GLU 747 Cb 1.42 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3fby h GLU 747 CO 0.46 0.31 0.00 -0.40 -0.73 0.00 0.00 179.01 178.66 3fby n ASP 748 N -4.85 0.00 -0.00 1.04 5.68 -1.26 -2.64 116.55 114.52 3fby n ASP 748 Ca 0.01 -1.02 -0.12 0.00 -0.50 0.00 0.00 54.79 53.16 3fby n ASP 748 Cb 0.05 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 39.96 3fby n ASP 748 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 3fby h TYR 749 N 0.00 0.09 0.03 2.11 5.03 -1.81 -0.09 116.97 122.33 3fby h TYR 749 Ca 0.00 -0.01 -0.22 0.00 2.58 0.00 0.00 58.73 61.09 3fby h TYR 749 Cb 0.00 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.24 3fby h TYR 749 CO 0.00 0.23 -0.99 0.93 -1.32 0.00 0.00 178.16 177.02 3fby h GLU 750 N -0.08 0.17 -0.10 1.82 4.39 -1.71 -1.32 114.58 117.75 3fby h GLU 750 Ca 0.02 -0.22 0.04 0.00 0.34 0.00 0.00 59.36 59.54 3fby h GLU 750 Cb 0.18 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.84 3fby h GLU 750 CO -0.00 1.02 -0.39 1.15 -1.16 0.00 0.00 179.01 179.63 3fby h THR 751 N 0.07 0.19 0.00 1.13 2.02 -1.55 0.33 112.91 115.10 3fby h THR 751 Ca -0.06 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 3fby h THR 751 Cb 1.67 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 3fby h THR 751 CO 0.15 0.00 -0.01 -0.74 0.37 0.00 0.00 175.52 175.29 3fby h HIS 752 N -0.49 0.00 0.12 3.16 -0.00 -0.98 -1.37 115.15 115.60 3fby h HIS 752 Ca 0.07 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.18 3fby h HIS 752 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 3fby h HIS 752 CO -0.45 0.01 -1.36 1.96 -0.00 0.00 0.00 177.93 178.10 3fby h GLN 753 N 0.00 0.26 0.00 5.26 1.08 0.05 -3.32 115.11 118.45 3fby h GLN 753 Ca -0.00 -0.44 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 3fby h GLN 753 Cb 0.20 0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 3fby h GLN 753 CO 0.00 1.21 0.00 1.47 -0.95 0.00 0.00 178.83 180.56 3fby n LEU 754 N -3.93 0.00 0.15 1.46 -0.00 0.10 -4.16 117.00 110.62 3fby n LEU 754 Ca -0.24 0.44 0.12 0.00 -0.00 0.00 0.00 56.01 56.34 3fby n LEU 754 Cb 0.90 -0.44 0.65 0.00 -0.00 0.00 0.00 43.42 44.52 3fby n LEU 754 CO 0.42 -0.00 1.12 -0.09 -0.00 0.00 0.00 177.39 178.84 3fby h ARG 755 N 0.00 0.03 -0.95 1.47 2.43 -1.34 -0.93 114.38 115.08 3fby h ARG 755 Ca 0.00 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 3fby h ARG 755 Cb 0.44 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 3fby h ARG 755 CO 0.00 0.02 0.04 1.04 -1.51 0.00 0.00 179.97 179.56 3fby n GLN 756 N -4.48 1.51 0.00 0.20 3.00 -1.26 -5.09 117.38 111.26 3fby n GLN 756 Ca 0.02 -0.53 0.05 0.00 -0.01 0.00 0.00 57.00 56.53 3fby n GLN 756 Cb 0.28 -1.48 0.31 0.00 0.00 0.00 0.00 30.24 29.35 3fby n GLN 756 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06