#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2raj h GLY 215 N 0.00 0.00 1.04 0.55 0.00 -2.05 -3.00 103.07 99.61 2raj h GLY 215 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 2raj h GLY 215 CO 0.00 0.00 0.40 -0.84 0.00 0.00 0.00 176.54 176.10 2raj h THR 216 N 0.00 0.89 -0.49 4.70 2.02 -1.99 0.77 112.91 118.80 2raj h THR 216 Ca 0.00 -0.13 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 2raj h THR 216 Cb 0.49 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2raj h THR 216 CO 0.00 0.07 -0.09 -0.33 0.37 0.00 0.00 175.52 175.54 2raj h GLU 217 N 0.39 0.92 -0.07 6.66 5.08 -1.96 -2.79 114.58 122.81 2raj h GLU 217 Ca 0.28 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2raj h GLU 217 Cb 0.57 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 2raj h GLU 217 CO -0.07 1.00 -0.39 0.37 -1.00 0.00 0.00 179.01 178.91 2raj h GLN 218 N 0.77 -0.49 -0.45 2.33 4.15 -1.01 0.39 115.11 120.81 2raj h GLN 218 Ca 0.13 0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.65 2raj h GLN 218 Cb 0.64 0.11 -0.06 0.00 0.21 0.00 0.00 27.48 28.38 2raj h GLN 218 CO 0.04 -0.33 0.09 -0.92 -1.93 0.00 0.00 178.83 175.79 2raj h TYR 219 N -0.51 0.15 -0.24 3.99 3.20 -1.43 1.44 116.97 123.57 2raj h TYR 219 Ca 0.07 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.81 2raj h TYR 219 Cb 0.62 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2raj h TYR 219 CO -0.43 0.01 -0.49 -0.07 -1.64 0.00 0.00 178.16 175.54 2raj h LEU 220 N 0.22 0.70 -0.76 2.82 3.38 -1.15 -3.31 115.31 117.22 2raj h LEU 220 Ca 0.22 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2raj h LEU 220 Cb 0.28 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2raj h LEU 220 CO -0.29 1.07 -0.45 0.18 0.09 0.00 0.00 178.44 179.04 2raj n LEU 221 N -4.00 1.58 -3.98 1.67 4.77 0.13 -3.99 117.00 113.18 2raj n LEU 221 Ca -0.03 -0.72 -0.45 0.00 -0.03 0.00 0.00 56.01 54.79 2raj n LEU 221 Cb 0.57 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 2raj n LEU 221 CO 0.47 0.31 0.07 0.00 -1.33 0.00 0.00 177.39 176.91 2raj n ALA 222 N -0.32 -2.79 -0.35 -1.18 0.00 0.49 -4.75 120.51 111.60 2raj n ALA 222 Ca 0.07 0.42 0.25 0.00 0.00 0.00 0.00 53.44 54.17 2raj n ALA 222 Cb 0.36 -1.47 0.49 0.00 0.00 0.00 0.00 19.45 18.83 2raj n ALA 222 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2raj h LYS 223 N 1.18 0.31 -0.11 0.00 1.57 -1.95 -3.46 116.57 114.11 2raj h LYS 223 Ca -0.28 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2raj h LYS 223 Cb 1.30 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2raj h LYS 223 CO 0.52 0.21 0.00 0.94 -0.57 0.00 0.00 179.45 180.55 2raj n GLN 224 N -4.96 0.00 0.00 3.15 -0.06 -1.26 -4.89 117.38 109.35 2raj n GLN 224 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.32 2raj n GLN 224 Cb 1.01 -0.02 0.00 0.00 -4.06 0.00 0.00 30.24 27.17 2raj n GLN 224 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2raj n LEU 225 N 0.64 0.00 -4.55 1.69 7.94 -1.26 -5.09 117.00 116.37 2raj n LEU 225 Ca 0.00 -0.17 -0.32 0.00 -1.11 0.00 0.00 56.01 54.41 2raj n LEU 225 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 2raj n LEU 225 CO 0.00 0.31 1.87 0.00 -1.11 0.00 0.00 177.39 178.46 2raj n ALA 226 N 0.00 0.69 -2.53 1.96 0.00 -1.26 -4.96 120.51 114.40 2raj n ALA 226 Ca 0.00 -1.03 -0.42 0.00 0.00 0.00 0.00 53.44 51.99 2raj n ALA 226 Cb 0.35 -3.22 -0.03 0.00 0.00 0.00 0.00 19.45 16.56 2raj n ALA 226 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2raj s LYS 227 N 8.43 4.39 0.52 0.00 1.02 -1.26 -5.02 119.74 127.83 2raj s LYS 227 Ca 0.98 1.59 -0.17 0.00 0.02 0.00 0.00 55.97 58.39 2raj s LYS 227 Cb -0.18 -3.53 -0.07 0.00 -0.52 0.00 0.00 37.83 33.53 2raj s LYS 227 CO 0.23 -0.37 1.00 -1.25 -0.92 0.00 0.00 175.35 174.03 2raj s PRO 228 N 1.99 3.87 0.00 -1.68 0.04 -1.26 -5.03 135.00 132.92 2raj s PRO 228 Ca 0.54 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.57 2raj s PRO 228 Cb -0.23 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2raj s PRO 228 CO 0.22 -0.34 0.00 1.63 0.04 0.00 0.00 177.00 178.55 2raj n LYS 229 N -1.62 0.00 -2.77 4.56 5.02 -1.26 -4.76 118.16 117.32 2raj n LYS 229 Ca 0.07 0.27 -0.43 0.00 -2.02 0.00 0.00 58.31 56.20 2raj n LYS 229 Cb 0.54 -0.73 -0.04 0.00 -0.02 0.00 0.00 35.03 34.78 2raj n LYS 229 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2raj s GLU 230 N -0.68 3.52 -0.04 1.97 4.04 -1.26 -5.02 118.70 121.22 2raj s GLU 230 Ca 0.00 0.14 -0.16 0.00 0.04 0.00 0.00 54.97 55.00 2raj s GLU 230 Cb 0.00 -3.96 -0.05 0.00 0.02 0.00 0.00 34.13 30.14 2raj s GLU 230 CO 0.00 -1.33 0.41 0.21 -1.84 0.00 0.00 175.26 172.71 2raj s LYS 231 N 3.99 4.06 -0.29 -4.83 2.20 -1.26 -4.81 119.74 118.79 2raj s LYS 231 Ca 0.38 0.39 -0.01 0.00 -0.36 0.00 0.00 55.97 56.37 2raj s LYS 231 Cb -0.10 -3.29 0.05 0.00 -1.51 0.00 0.00 37.83 32.98 2raj s LYS 231 CO 0.26 0.51 -0.02 0.42 -0.36 0.00 0.00 175.35 176.17 2raj s ILE 232 N -0.50 2.90 0.35 5.43 1.01 -0.07 -5.02 121.20 125.31 2raj s ILE 232 Ca 0.24 -1.39 -0.19 0.00 0.00 0.00 0.00 60.65 59.31 2raj s ILE 232 Cb -0.16 -2.66 -0.10 0.00 0.01 0.00 0.00 42.46 39.55 2raj s ILE 232 CO 0.12 -0.08 0.84 -2.16 0.00 0.00 0.00 174.94 173.65 2raj s PRO 233 N 1.24 4.17 -0.04 2.79 0.04 -1.26 -1.09 135.00 140.86 2raj s PRO 233 Ca -0.05 0.93 0.02 0.00 0.04 0.00 0.00 61.00 61.93 2raj s PRO 233 Cb -0.20 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 31.94 2raj s PRO 233 CO -0.02 0.13 -0.06 0.42 0.04 0.00 0.00 177.00 177.51 2raj s ILE 234 N -1.97 0.64 0.16 0.56 1.01 -1.10 -3.86 121.20 116.64 2raj s ILE 234 Ca 0.55 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.04 2raj s ILE 234 Cb -0.11 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 2raj s ILE 234 CO 0.17 0.24 -0.09 0.27 0.00 0.00 0.00 174.94 175.52 2raj s ILE 235 N 0.69 1.18 -0.55 2.92 -4.36 -0.69 -0.54 121.20 119.86 2raj s ILE 235 Ca -0.10 -2.07 -0.16 0.00 -0.26 0.00 0.00 60.65 58.06 2raj s ILE 235 Cb -0.13 -1.90 0.13 0.00 1.25 0.00 0.00 42.46 41.81 2raj s ILE 235 CO 0.01 -0.70 0.52 -0.69 0.24 0.00 0.00 174.94 174.32 2raj s VAL 236 N -3.32 5.17 0.00 8.37 1.01 -1.26 0.19 120.40 130.56 2raj s VAL 236 Ca 0.18 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 60.71 2raj s VAL 236 Cb 0.03 -4.36 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2raj s VAL 236 CO 0.02 -0.90 0.00 0.61 0.00 0.00 0.00 175.10 174.83 2raj n GLY 237 N 5.25 -0.33 0.15 4.51 0.00 -1.10 -4.94 105.19 108.73 2raj n GLY 237 Ca -0.13 -1.40 -0.07 0.00 0.00 0.00 0.00 46.02 44.42 2raj n GLY 237 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2raj h ASP 238 N 0.00 0.29 -2.28 1.61 3.32 -2.02 -3.38 116.42 113.96 2raj h ASP 238 Ca 0.00 -0.19 -0.59 0.00 0.02 0.00 0.00 57.03 56.27 2raj h ASP 238 Cb 0.00 -0.08 -0.40 0.00 0.22 0.00 0.00 39.33 39.06 2raj h ASP 238 CO 0.00 0.90 -0.87 0.00 -1.72 0.00 0.00 179.24 177.56 2raj n TYR 239 N -3.79 1.09 0.00 4.55 -0.00 -1.26 -5.10 117.16 112.65 2raj n TYR 239 Ca -0.03 -3.77 0.00 0.00 -0.00 0.00 0.00 57.90 54.10 2raj n TYR 239 Cb 0.69 -0.32 0.00 0.00 -0.00 0.00 0.00 39.34 39.72 2raj n TYR 239 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2raj n GLY 240 N 1.63 1.64 3.75 -7.48 0.00 -1.26 -5.00 105.19 98.48 2raj n GLY 240 Ca 0.25 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 2raj n GLY 240 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2raj s PRO 241 N -2.74 4.20 0.19 1.61 0.04 -1.26 -2.72 135.00 134.32 2raj s PRO 241 Ca 0.00 2.43 -0.01 0.00 0.04 0.00 0.00 61.00 63.47 2raj s PRO 241 Cb 0.00 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.43 2raj s PRO 241 CO 0.00 -0.52 0.11 0.00 0.04 0.00 0.00 177.00 176.63 2raj s MET 242 N -0.49 1.16 0.92 4.56 0.23 0.13 -3.39 119.30 122.42 2raj s MET 242 Ca 0.61 -1.60 -0.13 0.00 -1.03 0.00 0.00 55.69 53.53 2raj s MET 242 Cb -0.45 0.19 0.15 0.00 -1.53 0.00 0.00 34.83 33.19 2raj s MET 242 CO 0.46 -0.34 1.18 -1.58 -2.03 0.00 0.00 175.02 172.71 2raj s TRP 243 N -4.08 2.30 -0.35 3.16 0.23 -1.26 -1.70 118.94 117.25 2raj s TRP 243 Ca 0.35 0.70 -0.11 0.00 -2.03 0.00 0.00 56.10 55.01 2raj s TRP 243 Cb 0.07 -3.56 0.01 0.00 0.03 0.00 0.00 33.47 30.02 2raj s TRP 243 CO 0.10 -2.38 0.20 0.08 0.96 0.00 0.00 176.95 175.91 2raj s VAL 244 N -3.45 4.78 -0.11 4.03 1.01 -1.25 -4.75 120.40 120.66 2raj s VAL 244 Ca 0.66 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.85 2raj s VAL 244 Cb -0.11 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2raj s VAL 244 CO 0.52 -0.09 0.70 -0.31 0.00 0.00 0.00 175.10 175.93 2raj s TYR 245 N 1.62 3.52 0.47 5.22 1.51 -1.26 -4.87 117.35 123.55 2raj s TYR 245 Ca 0.04 1.19 -0.24 0.00 -1.01 0.00 0.00 57.07 57.04 2raj s TYR 245 Cb -0.18 -2.83 -0.07 0.00 -0.11 0.00 0.00 41.96 38.77 2raj s TYR 245 CO 0.07 -0.01 1.36 -1.25 -1.11 0.00 0.00 175.55 174.62 2raj s PRO 246 N 1.20 3.58 0.26 -1.71 0.04 -1.26 -4.90 135.00 132.22 2raj s PRO 246 Ca 0.36 2.26 -0.04 0.00 0.04 0.00 0.00 61.00 63.61 2raj s PRO 246 Cb -0.17 -2.54 0.34 0.00 0.04 0.00 0.00 34.50 32.17 2raj s PRO 246 CO 0.16 -0.84 1.90 1.79 0.04 0.00 0.00 177.00 180.04 2raj h THR 247 N 2.04 1.15 -3.74 1.26 1.35 -2.05 -3.38 112.91 109.54 2raj h THR 247 Ca -0.50 -0.42 -0.67 0.00 -0.55 0.00 0.00 66.41 64.27 2raj h THR 247 Cb 1.27 -0.18 -0.19 0.00 -1.73 0.00 0.00 68.15 67.33 2raj h THR 247 CO 0.60 0.22 -0.48 -0.55 -0.25 0.00 0.00 175.52 175.06 2raj s SER 248 N -5.96 6.06 -0.24 5.36 0.15 -1.26 -5.06 113.70 112.73 2raj s SER 248 Ca -0.13 -0.36 -0.09 0.00 0.70 0.00 0.00 55.95 56.07 2raj s SER 248 Cb 0.19 -2.14 -0.04 0.00 -1.71 0.00 0.00 66.02 62.32 2raj s SER 248 CO 0.81 -0.21 0.13 0.42 1.20 0.00 0.00 173.24 175.60 2raj s THR 249 N 1.73 5.01 0.35 6.45 -4.23 -1.26 -5.09 115.64 118.59 2raj s THR 249 Ca 0.06 0.06 0.08 0.00 -1.18 0.00 0.00 61.69 60.71 2raj s THR 249 Cb -0.17 -3.34 -0.04 0.00 1.34 0.00 0.00 72.50 70.29 2raj s THR 249 CO 0.11 0.34 0.20 0.72 -0.54 0.00 0.00 174.62 175.45 2raj s PHE 250 N 1.24 2.76 0.27 3.99 -0.12 -1.26 -5.03 117.98 119.83 2raj s PHE 250 Ca 0.06 -0.38 0.02 0.00 -0.05 0.00 0.00 56.93 56.58 2raj s PHE 250 Cb -0.14 -1.73 -0.05 0.00 -0.63 0.00 0.00 43.02 40.46 2raj s PHE 250 CO 0.05 0.26 0.10 0.34 -0.05 0.00 0.00 175.22 175.92 2raj s ASP 251 N -3.91 1.29 -0.06 1.98 3.68 -1.26 -4.35 116.67 114.04 2raj s ASP 251 Ca 0.39 -1.41 0.02 0.00 2.13 0.00 0.00 52.55 53.69 2raj s ASP 251 Cb -0.03 0.19 0.01 0.00 -1.45 0.00 0.00 42.92 41.64 2raj s ASP 251 CO 0.24 -0.75 -0.12 0.00 0.13 0.00 0.00 175.17 174.67 2raj s VAL 253 N 0.61 5.08 -0.29 0.00 1.01 -0.81 -4.68 120.40 121.32 2raj s VAL 253 Ca -0.13 1.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.92 2raj s VAL 253 Cb -0.15 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.33 2raj s VAL 253 CO 0.03 0.20 0.07 -0.69 0.00 0.00 0.00 175.10 174.72 2raj s VAL 254 N 1.32 3.89 0.00 2.92 1.01 -1.26 -1.27 120.40 127.02 2raj s VAL 254 Ca 0.29 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.53 2raj s VAL 254 Cb -0.16 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2raj s VAL 254 CO 0.12 0.07 0.00 0.00 0.00 0.00 0.00 175.10 175.28 2raj n ALA 255 N 4.85 0.00 -3.70 5.51 0.00 -0.61 -4.90 120.51 121.66 2raj n ALA 255 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.99 2raj n ALA 255 Cb 0.48 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.97 2raj n ALA 255 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2raj n ASP 256 N -0.62 -4.74 -4.75 0.00 8.00 -1.26 -0.59 116.55 112.58 2raj n ASP 256 Ca 0.00 -1.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.09 2raj n ASP 256 Cb 0.00 -3.42 -0.02 0.00 -0.02 0.00 0.00 41.12 37.66 2raj n ASP 256 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2raj s PRO 257 N -6.00 4.27 -0.02 -0.24 0.04 -1.26 -4.36 135.00 127.44 2raj s PRO 257 Ca 0.41 2.30 -0.25 0.00 0.04 0.00 0.00 61.00 63.50 2raj s PRO 257 Cb -0.15 -3.10 0.06 0.00 0.04 0.00 0.00 34.50 31.35 2raj s PRO 257 CO 0.86 -0.39 0.56 -0.98 0.04 0.00 0.00 177.00 177.09 2raj s ARG 258 N -0.70 0.96 0.67 4.56 1.04 -1.16 -4.96 118.95 119.35 2raj s ARG 258 Ca 0.57 0.05 -0.17 0.00 -1.04 0.00 0.00 55.73 55.14 2raj s ARG 258 Cb -0.42 0.45 -0.00 0.00 -2.04 0.00 0.00 34.95 32.94 2raj s ARG 258 CO 0.46 -0.30 1.26 1.63 -0.04 0.00 0.00 175.30 178.30 2raj n LYS 259 N 0.90 0.98 -4.30 3.89 4.01 -1.26 -1.48 118.16 120.90 2raj n LYS 259 Ca -0.19 0.39 -0.16 0.00 -0.51 0.00 0.00 58.31 57.84 2raj n LYS 259 Cb 0.57 -2.49 -0.10 0.00 -0.51 0.00 0.00 35.03 32.50 2raj n LYS 259 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2raj s GLY 260 N -1.46 1.42 0.30 0.72 0.00 -0.73 -4.82 107.32 102.75 2raj s GLY 260 Ca 0.81 -1.69 0.01 0.00 0.00 0.00 0.00 44.72 43.85 2raj s GLY 260 CO 0.42 -1.62 0.33 -0.56 0.00 0.00 0.00 173.10 171.67 2raj s SER 261 N -3.26 0.97 0.00 1.64 0.01 -1.26 -3.70 113.70 108.11 2raj s SER 261 Ca 0.26 -1.53 0.00 0.00 1.31 0.00 0.00 55.95 55.99 2raj s SER 261 Cb 0.05 0.56 0.00 0.00 0.21 0.00 0.00 66.02 66.84 2raj s SER 261 CO 0.07 -1.11 0.00 1.17 0.41 0.00 0.00 173.24 173.78 2raj n LYS 262 N -0.51 0.00 -2.42 12.44 4.81 -1.26 -4.95 118.16 126.27 2raj n LYS 262 Ca 0.03 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.41 2raj n LYS 262 Cb 0.63 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.69 2raj n LYS 262 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2raj n MET 263 N 0.00 -1.26 0.00 1.64 2.81 -1.26 -5.00 117.12 114.05 2raj n MET 263 Ca 0.00 0.26 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 2raj n MET 263 Cb 0.00 -3.82 0.00 0.00 -0.71 0.00 0.00 33.22 28.69 2raj n MET 263 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2raj n TYR 264 N -3.65 0.00 0.00 2.03 4.01 -1.26 -5.12 117.16 113.17 2raj n TYR 264 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2raj n TYR 264 Cb 0.54 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 2raj n TYR 264 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2raj n GLY 265 N 2.21 0.15 0.43 2.72 0.00 -1.26 -4.88 105.19 104.55 2raj n GLY 265 Ca 0.00 -0.23 0.07 0.00 0.00 0.00 0.00 46.02 45.86 2raj n GLY 265 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2raj n LEU 266 N 0.00 2.30 -1.93 0.99 7.94 -1.26 -4.52 117.00 120.52 2raj n LEU 266 Ca 0.00 -3.29 -0.19 0.00 -1.11 0.00 0.00 56.01 51.42 2raj n LEU 266 Cb 0.00 -0.43 0.11 0.00 0.53 0.00 0.00 43.42 43.63 2raj n LEU 266 CO 0.00 1.00 1.13 1.17 -1.11 0.00 0.00 177.39 179.58 2raj n LYS 267 N -1.09 1.97 -1.09 1.96 4.81 -1.26 -4.98 118.16 118.48 2raj n LYS 267 Ca 0.16 -2.17 -0.37 0.00 -0.87 0.00 0.00 58.31 55.06 2raj n LYS 267 Cb 0.70 -1.85 -0.02 0.00 0.02 0.00 0.00 35.03 33.88 2raj n LYS 267 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2raj n SER 268 N -0.52 -1.33 -4.40 3.14 2.88 -1.26 -4.97 113.62 107.16 2raj n SER 268 Ca 0.43 0.83 -0.32 0.00 -1.33 0.00 0.00 58.87 58.48 2raj n SER 268 Cb 1.12 -0.74 -0.14 0.00 -0.75 0.00 0.00 64.21 63.69 2raj n SER 268 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2raj s TYR 269 N -0.93 2.58 0.15 0.66 1.13 -1.24 -4.92 117.35 114.77 2raj s TYR 269 Ca 0.50 -0.34 -0.31 0.00 -1.41 0.00 0.00 57.07 55.51 2raj s TYR 269 Cb -0.68 -1.61 -0.09 0.00 -1.10 0.00 0.00 41.96 38.48 2raj s TYR 269 CO 0.46 0.05 1.53 0.42 -2.51 0.00 0.00 175.55 175.50 2raj s ILE 270 N -0.54 2.80 -0.24 -3.49 -1.09 -1.26 -1.78 121.20 115.60 2raj s ILE 270 Ca 0.07 0.56 0.01 0.00 -2.23 0.00 0.00 60.65 59.07 2raj s ILE 270 Cb -0.11 -3.36 0.06 0.00 -1.58 0.00 0.00 42.46 37.47 2raj s ILE 270 CO 0.01 0.04 -0.07 -0.70 -1.23 0.00 0.00 174.94 172.99 2raj s GLU 271 N 1.25 1.76 0.68 2.79 2.12 -0.55 -3.89 118.70 122.85 2raj s GLU 271 Ca 0.69 -1.08 -0.11 0.00 0.36 0.00 0.00 54.97 54.83 2raj s GLU 271 Cb -0.42 -2.66 -0.00 0.00 0.26 0.00 0.00 34.13 31.31 2raj s GLU 271 CO 0.31 -0.59 1.07 0.71 -0.54 0.00 0.00 175.26 176.21 2raj s TYR 272 N 1.33 3.40 -0.09 5.30 1.51 0.15 -3.01 117.35 125.93 2raj s TYR 272 Ca -0.06 1.17 0.01 0.00 -1.01 0.00 0.00 57.07 57.17 2raj s TYR 272 Cb -0.19 -2.92 -0.02 0.00 -0.11 0.00 0.00 41.96 38.71 2raj s TYR 272 CO -0.06 -1.03 -0.10 -1.14 -1.11 0.00 0.00 175.55 172.11 2raj s GLN 273 N -5.25 3.01 -0.19 -0.62 0.74 0.24 -0.43 119.66 117.15 2raj s GLN 273 Ca 0.57 -0.62 -0.02 0.00 0.05 0.00 0.00 55.36 55.34 2raj s GLN 273 Cb -0.11 -2.60 -0.00 0.00 1.10 0.00 0.00 33.01 31.40 2raj s GLN 273 CO 0.53 0.46 -0.10 -0.51 -0.55 0.00 0.00 175.29 175.12 2raj s LEU 274 N -0.28 2.64 -0.44 3.68 1.43 0.31 -1.58 118.68 124.45 2raj s LEU 274 Ca 0.03 -0.45 0.03 0.00 -1.03 0.00 0.00 54.13 52.70 2raj s LEU 274 Cb -0.13 -1.64 0.12 0.00 0.03 0.00 0.00 46.19 44.58 2raj s LEU 274 CO 0.03 0.02 0.20 -0.89 0.23 0.00 0.00 176.35 175.94 2raj s THR 275 N 1.21 1.98 0.19 5.49 2.01 -0.40 -2.42 115.64 123.70 2raj s THR 275 Ca 0.02 -2.71 -0.31 0.00 0.31 0.00 0.00 61.69 59.01 2raj s THR 275 Cb -0.14 -2.40 -0.10 0.00 0.01 0.00 0.00 72.50 69.87 2raj s THR 275 CO -0.04 -0.78 1.48 -2.16 -0.69 0.00 0.00 174.62 172.43 2raj s PRO 276 N 0.32 4.26 0.00 4.92 0.04 -1.26 -1.92 135.00 141.36 2raj s PRO 276 Ca 0.15 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.47 2raj s PRO 276 Cb -0.23 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.15 2raj s PRO 276 CO -0.04 -0.50 0.43 0.25 0.04 0.00 0.00 177.00 177.18 2raj n THR 277 N 3.35 0.00 -0.04 1.26 -2.24 0.08 -1.29 114.28 115.41 2raj n THR 277 Ca 0.11 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.87 2raj n THR 277 Cb 0.40 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.38 2raj n THR 277 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 2raj h ASN 278 N 0.18 0.00 -0.11 3.42 -1.24 -1.87 -3.43 115.58 112.53 2raj h ASN 278 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2raj h ASN 278 Cb 0.11 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.16 2raj h ASN 278 CO 0.00 0.44 0.00 0.35 -1.29 0.00 0.00 177.43 176.93 2raj n THR 279 N -3.83 0.90 -1.99 -3.57 -2.24 -1.18 -5.01 114.28 97.37 2raj n THR 279 Ca -0.03 -0.95 0.00 0.00 -2.27 0.00 0.00 64.05 60.80 2raj n THR 279 Cb 0.11 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 2raj n THR 279 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2raj n ASN 280 N -0.10 -0.69 -4.58 3.42 3.02 -0.41 -4.90 115.26 111.03 2raj n ASN 280 Ca 0.04 0.34 -0.37 0.00 -0.03 0.00 0.00 54.58 54.56 2raj n ASN 280 Cb 0.29 -0.81 -0.11 0.00 -0.61 0.00 0.00 39.78 38.54 2raj n ASN 280 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2raj s ARG 281 N -3.92 3.92 0.18 3.52 0.52 -1.26 -4.96 118.95 116.94 2raj s ARG 281 Ca 0.00 -0.34 -0.12 0.00 -0.52 0.00 0.00 55.73 54.74 2raj s ARG 281 Cb 0.00 -3.57 -0.07 0.00 0.52 0.00 0.00 34.95 31.83 2raj s ARG 281 CO 0.00 -0.13 0.55 -1.12 0.02 0.00 0.00 175.30 174.62 2raj s SER 282 N 1.59 6.75 0.12 0.23 0.01 -1.26 -4.51 113.70 116.62 2raj s SER 282 Ca 0.07 1.02 0.04 0.00 1.31 0.00 0.00 55.95 58.38 2raj s SER 282 Cb -0.15 -2.26 -0.04 0.00 0.21 0.00 0.00 66.02 63.77 2raj s SER 282 CO 0.08 0.04 -0.09 0.68 0.41 0.00 0.00 173.24 174.36 2raj s VAL 283 N -1.60 0.99 0.21 3.43 -7.23 -1.01 -4.97 120.40 110.21 2raj s VAL 283 Ca 0.41 -1.92 0.07 0.00 -1.81 0.00 0.00 61.98 58.73 2raj s VAL 283 Cb -0.13 -1.68 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 2raj s VAL 283 CO 0.20 -0.73 0.11 0.20 -0.31 0.00 0.00 175.10 174.56 2raj s ASN 284 N -2.95 5.23 -0.25 4.85 0.01 -1.26 -0.53 114.94 120.04 2raj s ASN 284 Ca 0.13 -0.30 -0.16 0.00 -0.71 0.00 0.00 52.86 51.82 2raj s ASN 284 Cb 0.02 -1.26 0.07 0.00 0.41 0.00 0.00 41.25 40.49 2raj s ASN 284 CO -0.01 0.03 0.63 -1.00 -1.51 0.00 0.00 177.10 175.24 2raj s HIS 285 N -1.96 -0.91 0.58 2.20 3.76 0.43 -4.95 115.29 114.44 2raj s HIS 285 Ca 0.31 1.90 -0.06 0.00 -0.15 0.00 0.00 55.06 57.06 2raj s HIS 285 Cb -0.09 0.49 -0.00 0.00 1.11 0.00 0.00 32.58 34.09 2raj s HIS 285 CO 0.22 -0.46 0.89 -0.98 -0.85 0.00 0.00 174.74 173.57 2raj s ARG 286 N 1.33 3.05 0.16 1.40 1.70 -1.26 0.30 118.95 125.63 2raj s ARG 286 Ca -0.08 0.08 -0.19 0.00 -0.47 0.00 0.00 55.73 55.07 2raj s ARG 286 Cb -0.06 -2.27 0.07 0.00 -0.57 0.00 0.00 34.95 32.13 2raj s ARG 286 CO -0.14 -0.62 1.65 -0.92 -1.08 0.00 0.00 175.30 174.18 2raj h TYR 287 N -0.13 -0.42 -1.27 5.89 3.20 -1.98 -1.00 116.97 121.26 2raj h TYR 287 Ca -0.46 0.04 0.39 0.00 3.14 0.00 0.00 58.73 61.85 2raj h TYR 287 Cb 1.24 0.24 -0.11 0.00 1.54 0.00 0.00 36.73 39.64 2raj h TYR 287 CO 0.50 -0.25 0.84 -0.22 -1.64 0.00 0.00 178.16 177.39 2raj h LYS 288 N -0.11 0.15 -0.48 1.82 3.64 -1.93 0.30 116.57 119.95 2raj h LYS 288 Ca 0.17 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 2raj h LYS 288 Cb 0.38 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 2raj h LYS 288 CO -0.42 0.10 -0.07 0.45 -2.27 0.00 0.00 179.45 177.24 2raj h HIS 289 N 0.15 0.94 -0.36 1.91 3.86 -1.55 -1.33 115.15 118.77 2raj h HIS 289 Ca 0.75 -0.17 -0.14 0.00 -1.16 0.00 0.00 60.37 59.65 2raj h HIS 289 Cb 2.35 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 30.56 2raj h HIS 289 CO -0.00 0.89 -0.35 0.74 0.86 0.00 0.00 177.93 180.07 2raj h PHE 290 N 0.78 0.98 -0.91 2.45 0.04 -0.44 -1.46 116.94 118.38 2raj h PHE 290 Ca 0.14 -0.27 -0.01 0.00 2.80 0.00 0.00 57.97 60.62 2raj h PHE 290 Cb 0.57 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.46 2raj h PHE 290 CO 0.03 1.05 0.52 0.22 -0.60 0.00 0.00 178.31 179.53 2raj h ASP 291 N 0.69 1.11 -0.21 2.17 -0.00 -1.26 -0.03 116.42 118.88 2raj h ASP 291 Ca 0.07 -0.08 0.00 0.00 -0.00 0.00 0.00 57.03 57.01 2raj h ASP 291 Cb 0.90 -0.28 -0.01 0.00 -0.00 0.00 0.00 39.33 39.94 2raj h ASP 291 CO 0.08 0.88 0.14 -0.25 -0.00 0.00 0.00 179.24 180.08 2raj h TRP 292 N 1.26 0.26 -0.74 0.28 7.01 -0.78 -1.99 115.95 121.25 2raj h TRP 292 Ca 0.32 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.28 2raj h TRP 292 Cb -0.01 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 26.93 2raj h TRP 292 CO 0.01 0.17 0.29 1.25 -2.79 0.00 0.00 178.44 177.37 2raj h LEU 293 N 0.28 1.03 -0.38 0.65 5.85 -0.70 -2.02 115.31 120.02 2raj h LEU 293 Ca 0.08 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.68 2raj h LEU 293 Cb -0.02 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.69 2raj h LEU 293 CO -0.02 0.93 0.07 0.22 -0.34 0.00 0.00 178.44 179.30 2raj h TYR 294 N 1.07 0.12 -0.37 1.25 3.20 -0.73 0.13 116.97 121.64 2raj h TYR 294 Ca 0.25 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 2raj h TYR 294 Cb 0.22 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 2raj h TYR 294 CO 0.02 0.01 0.14 0.93 -1.64 0.00 0.00 178.16 177.62 2raj h GLU 295 N 0.20 0.56 -0.72 1.82 5.08 -1.14 -0.92 114.58 119.46 2raj h GLU 295 Ca 0.18 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2raj h GLU 295 Cb 0.22 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2raj h GLU 295 CO -0.24 0.55 0.42 0.00 -1.00 0.00 0.00 179.01 178.75 2raj h ARG 296 N 0.45 0.97 -0.25 2.33 2.47 -0.87 -0.15 114.38 119.34 2raj h ARG 296 Ca 0.12 -0.09 -0.19 0.00 -1.26 0.00 0.00 59.98 58.56 2raj h ARG 296 Cb 0.21 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.33 2raj h ARG 296 CO -0.01 0.69 -0.60 -0.07 0.56 0.00 0.00 179.97 180.54 2raj h LEU 297 N 0.99 0.93 -0.10 3.04 3.38 -0.75 -1.08 115.31 121.73 2raj h LEU 297 Ca 0.26 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2raj h LEU 297 Cb -0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 2raj h LEU 297 CO -0.05 1.32 0.04 0.25 0.09 0.00 0.00 178.44 180.09 2raj h LEU 298 N 0.62 0.14 -0.24 1.67 5.85 -0.78 0.32 115.31 122.89 2raj h LEU 298 Ca -0.00 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.57 2raj h LEU 298 Cb 1.21 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2raj h LEU 298 CO 0.13 0.27 0.09 0.58 -0.34 0.00 0.00 178.44 179.17 2raj h VAL 299 N -0.00 0.95 0.01 1.05 2.07 -1.00 0.24 116.25 119.56 2raj h VAL 299 Ca 0.03 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.41 2raj h VAL 299 Cb 0.18 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2raj h VAL 299 CO -0.00 0.04 -0.27 0.50 0.02 0.00 0.00 177.57 177.86 2raj h LYS 300 N 0.21 0.17 0.00 1.57 3.64 -1.07 -0.90 116.57 120.19 2raj h LYS 300 Ca 0.10 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2raj h LYS 300 Cb 0.06 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 2raj h LYS 300 CO -0.10 0.94 -1.10 1.19 -2.27 0.00 0.00 179.45 178.12 2raj n PHE 301 N -4.49 0.00 -0.26 1.91 3.01 0.11 -3.87 117.46 113.88 2raj n PHE 301 Ca -0.10 0.00 0.33 0.00 1.01 0.00 0.00 57.45 58.69 2raj n PHE 301 Cb 0.52 -0.14 0.64 0.00 -0.01 0.00 0.00 39.48 40.49 2raj n PHE 301 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2raj h GLY 302 N 3.21 0.00 1.75 1.37 0.00 -0.35 0.18 103.07 109.24 2raj h GLY 302 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2raj h GLY 302 CO 0.00 0.00 -0.07 1.44 0.00 0.00 0.00 176.54 177.91 2raj n SER 303 N -3.66 0.09 0.00 0.19 7.64 -1.26 -4.23 113.62 112.39 2raj n SER 303 Ca 0.24 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.38 2raj n SER 303 Cb 1.37 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 64.21 2raj n SER 303 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2raj n ALA 304 N -1.44 1.69 -3.26 -0.43 0.00 0.46 -4.80 120.51 112.73 2raj n ALA 304 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.27 2raj n ALA 304 Cb 0.32 0.17 -0.16 0.00 0.00 0.00 0.00 19.45 19.78 2raj n ALA 304 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2raj s ILE 305 N -1.69 1.25 0.21 0.00 1.01 -0.15 -4.82 121.20 117.01 2raj s ILE 305 Ca 0.00 -0.57 -0.31 0.00 0.00 0.00 0.00 60.65 59.77 2raj s ILE 305 Cb 0.00 -1.12 -0.10 0.00 0.01 0.00 0.00 42.46 41.25 2raj s ILE 305 CO 0.00 0.38 1.55 -2.84 0.00 0.00 0.00 174.94 174.02 2raj s PRO 306 N 0.44 4.21 -0.43 2.79 0.02 -1.26 -4.12 135.00 136.65 2raj s PRO 306 Ca -0.11 2.39 -0.02 0.00 0.02 0.00 0.00 61.00 63.27 2raj s PRO 306 Cb -0.14 -3.12 0.12 0.00 0.02 0.00 0.00 34.50 31.37 2raj s PRO 306 CO 0.03 -0.57 0.22 0.42 -0.33 0.00 0.00 177.00 176.77 2raj s ILE 307 N 0.69 3.24 0.14 2.83 -1.09 -1.26 -5.05 121.20 120.70 2raj s ILE 307 Ca 0.67 -2.20 -0.34 0.00 -2.23 0.00 0.00 60.65 56.55 2raj s ILE 307 Cb -0.44 -3.22 -0.13 0.00 -1.58 0.00 0.00 42.46 37.09 2raj s ILE 307 CO 0.37 -0.71 1.63 -0.81 -1.23 0.00 0.00 174.94 174.19 2raj n PRO 308 N 4.43 2.24 -1.09 2.79 -0.04 -1.26 -4.94 135.00 137.13 2raj n PRO 308 Ca -0.01 0.81 -0.31 0.00 -0.04 0.00 0.00 63.50 63.95 2raj n PRO 308 Cb 0.41 -2.60 0.12 0.00 -0.04 0.00 0.00 33.50 31.39 2raj n PRO 308 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2raj s SER 309 N 1.30 3.98 0.45 3.54 0.15 -1.26 -5.05 113.70 116.80 2raj s SER 309 Ca 0.80 1.92 -0.01 0.00 0.70 0.00 0.00 55.95 59.36 2raj s SER 309 Cb -0.66 -2.52 -0.01 0.00 -1.71 0.00 0.00 66.02 61.12 2raj s SER 309 CO 0.39 -2.39 0.68 -0.76 1.20 0.00 0.00 173.24 172.36 2raj s LEU 310 N -6.14 3.69 1.39 3.45 1.43 -1.26 -5.07 118.68 116.16 2raj s LEU 310 Ca 0.63 0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 53.97 2raj s LEU 310 Cb -0.19 -3.34 0.36 0.00 0.03 0.00 0.00 46.19 43.05 2raj s LEU 310 CO 0.57 -0.63 0.94 -2.84 0.23 0.00 0.00 176.35 174.62 2raj s PRO 311 N -4.57 -2.70 0.00 1.29 0.02 -1.26 -5.07 135.00 122.71 2raj s PRO 311 Ca 0.47 0.27 0.00 0.00 0.02 0.00 0.00 61.00 61.76 2raj s PRO 311 Cb -0.10 -1.39 0.00 0.00 0.02 0.00 0.00 34.50 33.03 2raj s PRO 311 CO 0.39 -4.76 0.00 -3.47 -0.33 0.00 0.00 177.00 168.83 2raj n ASP 312 N -5.57 0.85 -4.59 2.53 -0.08 -1.26 -5.11 116.55 103.32 2raj n ASP 312 Ca 0.11 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 53.01 2raj n ASP 312 Cb 0.59 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.94 2raj n ASP 312 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2raj s LYS 313 N 1.93 3.95 0.00 -0.67 -2.85 -1.26 -5.08 119.74 115.77 2raj s LYS 313 Ca 0.00 -0.32 0.00 0.00 -1.00 0.00 0.00 55.97 54.65 2raj s LYS 313 Cb 0.00 -3.64 0.00 0.00 -2.06 0.00 0.00 37.83 32.13 2raj s LYS 313 CO 0.00 -0.16 0.00 0.94 0.10 0.00 0.00 175.35 176.23 2raj n GLN 314 N 4.98 1.72 -3.64 1.78 -0.06 -1.26 -5.04 117.38 115.86 2raj n GLN 314 Ca -0.14 0.00 -0.33 0.00 -2.00 0.00 0.00 57.00 54.53 2raj n GLN 314 Cb 0.52 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.65 2raj n GLN 314 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2raj s VAL 315 N 0.00 5.14 -0.65 1.69 1.01 -1.26 -4.98 120.40 121.36 2raj s VAL 315 Ca 0.00 0.17 -0.20 0.00 0.00 0.00 0.00 61.98 61.95 2raj s VAL 315 Cb 0.00 -3.62 -0.17 0.00 0.00 0.00 0.00 36.38 32.59 2raj s VAL 315 CO 0.00 0.12 1.87 0.41 0.00 0.00 0.00 175.10 177.49 2raj n THR 316 N 0.35 1.57 -1.90 3.92 -1.04 -1.26 -2.70 114.28 113.21 2raj n THR 316 Ca -0.04 -1.28 0.00 0.00 -2.04 0.00 0.00 64.05 60.69 2raj n THR 316 Cb 0.52 -2.22 0.00 0.00 -1.82 0.00 0.00 70.33 66.81 2raj n THR 316 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2raj n GLY 317 N 4.48 0.52 3.53 3.41 0.00 -1.26 -5.05 105.19 110.82 2raj n GLY 317 Ca 0.47 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.17 2raj n GLY 317 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2raj n ARG 318 N 0.00 0.08 -0.03 1.61 1.85 -1.10 -3.95 116.66 115.13 2raj n ARG 318 Ca 0.00 -1.33 0.00 0.00 -1.00 0.00 0.00 57.85 55.52 2raj n ARG 318 Cb 0.54 -3.14 0.00 0.00 -1.05 0.00 0.00 32.46 28.81 2raj n ARG 318 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2raj n PHE 319 N 13.77 0.00 -3.93 2.89 0.99 -1.26 -4.97 117.46 124.95 2raj n PHE 319 Ca 0.44 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.80 2raj n PHE 319 Cb 0.44 0.13 -0.05 0.00 -1.00 0.00 0.00 39.48 39.00 2raj n PHE 319 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 2raj s GLU 320 N 0.00 1.43 0.00 -1.08 2.02 -1.25 -5.00 118.70 114.82 2raj s GLU 320 Ca 0.00 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 53.84 2raj s GLU 320 Cb 0.00 0.46 0.00 0.00 0.10 0.00 0.00 34.13 34.69 2raj s GLU 320 CO 0.00 -0.59 0.00 0.39 0.02 0.00 0.00 175.26 175.08 2raj n GLU 321 N -0.34 0.00 -0.34 1.61 4.71 -1.26 -0.10 120.64 124.93 2raj n GLU 321 Ca -0.05 0.00 0.09 0.00 -0.01 0.00 0.00 57.16 57.19 2raj n GLU 321 Cb 0.62 0.00 0.18 0.00 -1.01 0.00 0.00 31.44 31.24 2raj n GLU 321 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2raj n GLU 322 N -0.88 -0.08 0.00 3.49 4.07 -1.26 -1.17 120.64 124.81 2raj n GLU 322 Ca 0.00 1.45 0.00 0.00 -0.06 0.00 0.00 57.16 58.55 2raj n GLU 322 Cb 0.00 -2.22 0.00 0.00 -0.06 0.00 0.00 31.44 29.16 2raj n GLU 322 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2raj n PHE 323 N -5.49 0.00 0.08 4.31 7.35 0.86 -3.84 117.46 120.73 2raj n PHE 323 Ca 0.18 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.91 2raj n PHE 323 Cb 0.56 -0.10 0.24 0.00 0.35 0.00 0.00 39.48 40.53 2raj n PHE 323 CO 0.00 0.00 0.00 0.44 -0.76 0.00 0.00 176.76 176.44 2raj n ILE 324 N -0.79 1.26 -0.06 -2.13 -6.64 -1.16 -1.68 119.36 108.15 2raj n ILE 324 Ca 0.00 0.62 -0.22 0.00 -1.77 0.00 0.00 62.75 61.38 2raj n ILE 324 Cb 0.00 -1.62 -0.12 0.00 -1.44 0.00 0.00 39.64 36.46 2raj n ILE 324 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 2raj n LYS 325 N -1.78 0.65 0.21 6.28 4.76 -0.31 -1.79 118.16 126.17 2raj n LYS 325 Ca -0.01 0.44 0.08 0.00 -2.87 0.00 0.00 58.31 55.95 2raj n LYS 325 Cb 0.12 -1.72 0.36 0.00 -1.84 0.00 0.00 35.03 31.95 2raj n LYS 325 CO 0.00 0.00 0.00 1.98 -1.37 0.00 0.00 177.40 178.01 2raj h MET 326 N -0.56 0.00 0.12 1.97 4.05 -1.61 -0.61 114.93 118.30 2raj h MET 326 Ca -0.39 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.02 2raj h MET 326 Cb 1.62 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.42 2raj h MET 326 CO -0.10 0.27 -0.06 -0.09 0.23 0.00 0.00 176.91 177.17 2raj h ARG 327 N 0.00 -0.16 0.00 0.39 2.43 -1.46 -1.45 114.38 114.13 2raj h ARG 327 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2raj h ARG 327 Cb 0.88 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 2raj h ARG 327 CO 0.04 0.32 0.12 1.98 -1.51 0.00 0.00 179.97 180.91 2raj h MET 328 N -0.80 0.00 0.35 0.20 4.05 -1.21 0.68 114.93 118.19 2raj h MET 328 Ca -0.02 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 2raj h MET 328 Cb 0.55 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 2raj h MET 328 CO 0.03 0.00 -0.17 1.49 0.23 0.00 0.00 176.91 178.49 2raj h GLU 329 N 0.00 -0.46 0.00 0.39 4.57 -0.77 -2.72 114.58 115.59 2raj h GLU 329 Ca 0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2raj h GLU 329 Cb 0.24 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 2raj h GLU 329 CO 0.00 -0.26 0.00 0.54 -1.18 0.00 0.00 179.01 178.11 2raj n ARG 330 N -5.09 0.22 0.10 1.92 1.74 -0.58 -2.50 116.66 112.47 2raj n ARG 330 Ca -0.07 0.36 -0.15 0.00 -0.77 0.00 0.00 57.85 57.22 2raj n ARG 330 Cb 0.21 -1.85 -0.14 0.00 -1.02 0.00 0.00 32.46 29.66 2raj n ARG 330 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2raj h LEU 331 N 0.00 0.39 -0.38 0.55 6.46 -0.98 -2.43 115.31 118.93 2raj h LEU 331 Ca 0.00 -0.42 -0.06 0.00 -0.12 0.00 0.00 57.88 57.28 2raj h LEU 331 Cb 0.49 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 2raj h LEU 331 CO 0.00 1.33 0.01 -0.61 -0.62 0.00 0.00 178.44 178.55 2raj h GLN 332 N 0.07 0.66 -0.45 1.25 5.75 -1.17 -0.77 115.11 120.45 2raj h GLN 332 Ca -0.13 -0.21 -0.02 0.00 -0.15 0.00 0.00 58.65 58.14 2raj h GLN 332 Cb 1.96 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 30.43 2raj h GLN 332 CO 0.20 0.76 0.19 0.00 -2.65 0.00 0.00 178.83 177.32 2raj h ALA 333 N 0.88 0.59 -0.72 3.38 0.00 -1.53 -1.51 119.26 120.36 2raj h ALA 333 Ca 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2raj h ALA 333 Cb 0.45 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2raj h ALA 333 CO 0.02 0.18 0.38 2.35 0.00 0.00 0.00 179.25 182.18 2raj h TRP 334 N 0.59 1.00 -0.51 0.00 7.01 -1.26 -2.26 115.95 120.52 2raj h TRP 334 Ca 0.15 -0.03 -0.11 0.00 2.11 0.00 0.00 58.89 61.01 2raj h TRP 334 Cb 0.17 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 26.90 2raj h TRP 334 CO -0.00 0.72 -0.11 0.52 -2.79 0.00 0.00 178.44 176.78 2raj h MET 335 N 0.99 0.95 -0.24 2.65 2.86 -1.00 -2.75 114.93 118.39 2raj h MET 335 Ca 0.25 -0.34 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 2raj h MET 335 Cb 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2raj h MET 335 CO -0.04 1.00 0.13 1.15 1.06 0.00 0.00 176.91 180.21 2raj h THR 336 N 0.84 1.12 -0.35 2.22 2.02 -0.99 0.15 112.91 117.92 2raj h THR 336 Ca 0.13 -0.34 0.07 0.00 0.77 0.00 0.00 66.41 67.04 2raj h THR 336 Cb 0.66 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 2raj h THR 336 CO 0.05 0.12 -0.04 0.03 0.37 0.00 0.00 175.52 176.05 2raj h ARG 337 N 0.27 0.05 0.02 6.66 2.47 -1.38 0.01 114.38 122.48 2raj h ARG 337 Ca 0.08 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.80 2raj h ARG 337 Cb 0.08 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.39 2raj h ARG 337 CO -0.01 0.03 -0.01 0.52 0.56 0.00 0.00 179.97 181.06 2raj h MET 338 N 0.05 -0.02 -0.90 0.04 2.86 -1.18 -2.38 114.93 113.39 2raj h MET 338 Ca 0.17 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.95 2raj h MET 338 Cb 0.25 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 31.82 2raj h MET 338 CO -0.32 0.14 0.51 0.00 1.06 0.00 0.00 176.91 178.31 2raj n ARG 340 N -4.78 0.36 -2.84 0.00 5.12 -0.03 -4.61 116.66 109.88 2raj n ARG 340 Ca 0.18 0.02 -0.42 0.00 -1.93 0.00 0.00 57.85 55.69 2raj n ARG 340 Cb 0.41 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.17 2raj n ARG 340 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2raj s HIS 341 N -2.62 3.31 0.53 -1.55 2.46 -0.46 -4.93 115.29 112.02 2raj s HIS 341 Ca 0.25 1.20 0.28 0.00 0.47 0.00 0.00 55.06 57.26 2raj s HIS 341 Cb 0.19 -3.11 1.51 0.00 -0.13 0.00 0.00 32.58 31.04 2raj s HIS 341 CO 0.44 -0.43 1.84 -1.00 -2.47 0.00 0.00 174.74 173.12 2raj h PRO 342 N 7.65 0.00 0.00 2.88 0.13 -1.86 -1.56 132.00 139.24 2raj h PRO 342 Ca -0.22 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.59 2raj h PRO 342 Cb 1.08 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.17 2raj h PRO 342 CO 0.90 0.00 -2.02 0.28 -0.23 0.00 0.00 178.00 176.93 2raj n VAL 343 N -2.74 1.32 0.06 1.56 0.31 -1.26 -4.43 118.33 113.16 2raj n VAL 343 Ca -0.02 -0.23 -0.11 0.00 -0.01 0.00 0.00 64.34 63.97 2raj n VAL 343 Cb 0.34 -1.90 -0.05 0.00 -0.91 0.00 0.00 33.84 31.32 2raj n VAL 343 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2raj h ILE 344 N -0.84 0.56 0.00 2.52 1.08 -1.83 -2.45 117.51 116.55 2raj h ILE 344 Ca -0.48 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 2raj h ILE 344 Cb 1.39 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.70 2raj h ILE 344 CO -0.29 0.00 0.00 0.77 -0.69 0.00 0.00 178.15 177.94 2raj h SER 345 N -0.31 0.00 -0.15 1.72 4.64 -1.33 -1.63 113.55 116.50 2raj h SER 345 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2raj h SER 345 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2raj h SER 345 CO -0.17 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.17 2raj n GLU 346 N -2.87 2.38 -2.30 4.77 -0.58 -0.95 -4.50 120.64 116.59 2raj n GLU 346 Ca -0.02 -2.04 -0.32 0.00 -0.42 0.00 0.00 57.16 54.36 2raj n GLU 346 Cb 0.13 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.50 2raj n GLU 346 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2raj s SER 347 N -1.83 6.39 0.11 1.62 1.04 -0.61 -4.91 113.70 115.50 2raj s SER 347 Ca 0.32 1.64 -0.18 0.00 0.48 0.00 0.00 55.95 58.20 2raj s SER 347 Cb 0.21 -2.52 -0.06 0.00 0.10 0.00 0.00 66.02 63.76 2raj s SER 347 CO 0.31 -0.75 1.63 -0.08 0.98 0.00 0.00 173.24 175.33 2raj h GLU 348 N 0.77 0.43 -0.03 4.02 4.81 -1.93 -0.54 114.58 122.11 2raj h GLU 348 Ca -0.47 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 58.65 2raj h GLU 348 Cb 1.19 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 2raj h GLU 348 CO 0.60 0.47 -0.12 -0.24 -0.73 0.00 0.00 179.01 179.00 2raj h VAL 349 N 0.29 1.10 0.14 0.32 3.04 -1.93 0.69 116.25 119.91 2raj h VAL 349 Ca 0.09 -0.48 -0.19 0.00 -1.01 0.00 0.00 66.70 65.11 2raj h VAL 349 Cb 0.21 1.21 0.02 0.00 -2.01 0.00 0.00 31.29 30.72 2raj h VAL 349 CO -0.01 0.14 -0.84 0.15 -1.01 0.00 0.00 177.57 176.01 2raj h PHE 350 N 0.05 0.55 -0.12 3.17 3.57 -1.75 -2.87 116.94 119.54 2raj h PHE 350 Ca 0.01 -0.40 0.03 0.00 3.53 0.00 0.00 57.97 61.13 2raj h PHE 350 Cb 0.24 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 2raj h PHE 350 CO 0.00 1.32 -0.04 1.96 -2.23 0.00 0.00 178.31 179.32 2raj h GLN 351 N -0.36 -0.02 0.00 1.11 1.08 -0.79 -2.07 115.11 114.06 2raj h GLN 351 Ca -0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 2raj h GLN 351 Cb 1.65 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.09 2raj h GLN 351 CO 0.15 -0.02 0.00 0.37 -0.95 0.00 0.00 178.83 178.39 2raj h GLN 352 N -0.02 0.00 0.00 1.46 4.15 -0.99 -0.40 115.11 119.31 2raj h GLN 352 Ca 0.06 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.37 2raj h GLN 352 Cb 0.12 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 2raj h GLN 352 CO -0.14 0.00 -0.56 0.35 -1.93 0.00 0.00 178.83 176.56 2raj h PHE 353 N 0.00 0.00 0.00 3.99 3.57 -1.14 -3.29 116.94 120.08 2raj h PHE 353 Ca 0.00 0.00 -0.28 0.00 3.53 0.00 0.00 57.97 61.22 2raj h PHE 353 Cb 0.36 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.05 2raj h PHE 353 CO 0.00 0.56 -2.16 1.28 -2.23 0.00 0.00 178.31 175.76 2raj n LEU 354 N -3.47 0.17 -3.89 0.59 4.32 -0.77 -4.76 117.00 109.19 2raj n LEU 354 Ca 0.00 0.08 -0.28 0.00 -0.02 0.00 0.00 56.01 55.79 2raj n LEU 354 Cb 0.66 0.34 -0.12 0.00 -1.62 0.00 0.00 43.42 42.68 2raj n LEU 354 CO 0.40 0.37 -0.04 0.20 -1.22 0.00 0.00 177.39 177.10 2raj s ASN 355 N -5.41 4.79 0.00 -1.43 0.01 -0.23 -4.71 114.94 107.95 2raj s ASN 355 Ca -0.08 -3.84 0.02 0.00 -0.71 0.00 0.00 52.86 48.24 2raj s ASN 355 Cb 0.08 -1.62 -0.01 0.00 0.41 0.00 0.00 41.25 40.11 2raj s ASN 355 CO 0.84 -0.09 -0.05 0.72 -1.51 0.00 0.00 177.10 177.01 2raj s PHE 356 N -1.43 0.46 -0.12 2.20 -0.12 -1.26 -4.69 117.98 113.03 2raj s PHE 356 Ca 0.25 -0.12 0.17 0.00 -0.05 0.00 0.00 56.93 57.18 2raj s PHE 356 Cb -0.05 -0.30 -0.21 0.00 -0.63 0.00 0.00 43.02 41.84 2raj s PHE 356 CO -0.17 -0.01 0.54 0.54 -0.05 0.00 0.00 175.22 176.07 2raj n ARG 357 N 2.82 0.65 -3.86 1.99 5.12 -1.26 -4.95 116.66 117.17 2raj n ARG 357 Ca -0.14 0.12 -0.08 0.00 -1.93 0.00 0.00 57.85 55.83 2raj n ARG 357 Cb 0.58 -1.69 -0.01 0.00 -1.16 0.00 0.00 32.46 30.18 2raj n ARG 357 CO 0.00 0.00 0.00 0.16 -1.93 0.00 0.00 177.63 175.86 2raj s ASP 358 N -5.61 -0.16 0.07 0.55 -4.77 -1.26 -5.01 116.67 100.48 2raj s ASP 358 Ca -0.06 -0.78 0.03 0.00 -3.30 0.00 0.00 52.55 48.45 2raj s ASP 358 Cb 0.08 0.75 0.17 0.00 -1.09 0.00 0.00 42.92 42.83 2raj s ASP 358 CO 0.83 -1.41 0.94 -0.62 0.70 0.00 0.00 175.17 175.61 2raj n GLU 359 N -0.47 0.02 -0.01 2.11 -0.58 -1.26 -1.17 120.64 119.28 2raj n GLU 359 Ca -0.05 0.38 -0.18 0.00 -0.42 0.00 0.00 57.16 56.89 2raj n GLU 359 Cb 0.59 -1.77 -0.14 0.00 -0.57 0.00 0.00 31.44 29.55 2raj n GLU 359 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2raj h LYS 360 N 0.00 0.16 -0.28 3.49 1.57 -1.99 -3.08 116.57 116.43 2raj h LYS 360 Ca 0.00 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.39 2raj h LYS 360 Cb 0.41 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 2raj h LYS 360 CO 0.00 1.13 -0.31 0.93 -0.57 0.00 0.00 179.45 180.63 2raj h GLU 361 N -0.66 0.71 -0.24 3.15 5.08 -1.55 -2.25 114.58 118.81 2raj h GLU 361 Ca -0.11 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2raj h GLU 361 Cb 1.37 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 2raj h GLU 361 CO 0.06 1.00 0.15 2.35 -1.00 0.00 0.00 179.01 181.58 2raj h TRP 362 N 0.45 0.31 0.10 4.33 2.91 -1.58 0.21 115.95 122.68 2raj h TRP 362 Ca 0.04 0.01 -0.27 0.00 1.13 0.00 0.00 58.89 59.79 2raj h TRP 362 Cb 0.89 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.42 2raj h TRP 362 CO 0.07 0.21 -1.32 0.87 -1.03 0.00 0.00 178.44 177.25 2raj h LYS 363 N 0.33 0.20 -0.01 2.65 1.79 -1.47 -2.46 116.57 117.61 2raj h LYS 363 Ca 0.09 -0.35 -0.22 0.00 -2.18 0.00 0.00 60.65 57.99 2raj h LYS 363 Cb -0.02 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 2raj h LYS 363 CO -0.02 1.11 -0.92 0.00 -1.08 0.00 0.00 179.45 178.54 2raj h THR 364 N 0.06 1.40 0.00 -0.16 1.03 -0.97 -2.97 112.91 111.30 2raj h THR 364 Ca -0.15 -2.41 -0.12 0.00 -0.01 0.00 0.00 66.41 63.72 2raj h THR 364 Cb 1.95 2.38 -0.02 0.00 -1.07 0.00 0.00 68.15 71.40 2raj h THR 364 CO 0.17 0.72 -0.56 1.23 -0.01 0.00 0.00 175.52 177.07 2raj h GLY 365 N 1.23 0.00 2.00 2.99 0.00 -0.68 -2.57 103.07 106.04 2raj h GLY 365 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2raj h GLY 365 CO 0.16 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.87 2raj n LYS 366 N -3.64 0.23 -0.11 4.80 4.81 -0.92 -2.95 118.16 120.38 2raj n LYS 366 Ca -0.01 0.32 -0.20 0.00 -0.87 0.00 0.00 58.31 57.56 2raj n LYS 366 Cb 0.61 -1.85 -0.09 0.00 0.02 0.00 0.00 35.03 33.72 2raj n LYS 366 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2raj n ARG 367 N -2.27 0.55 0.25 1.64 0.63 -0.99 -3.44 116.66 113.03 2raj n ARG 367 Ca 0.04 0.49 0.08 0.00 -0.92 0.00 0.00 57.85 57.54 2raj n ARG 367 Cb 0.33 -1.68 0.61 0.00 0.45 0.00 0.00 32.46 32.17 2raj n ARG 367 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 2raj h LYS 368 N -1.00 0.00 -0.14 -0.14 2.10 -1.60 -1.76 116.57 114.03 2raj h LYS 368 Ca -0.35 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.19 2raj h LYS 368 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 2raj h LYS 368 CO -0.21 0.11 -0.34 0.00 -2.00 0.00 0.00 179.45 177.01 2raj h ALA 369 N 1.89 0.23 0.00 0.07 0.00 -1.72 -1.99 119.26 117.74 2raj h ALA 369 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2raj h ALA 369 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2raj h ALA 369 CO 0.01 0.29 0.00 0.93 0.00 0.00 0.00 179.25 180.48 2raj h GLU 370 N 0.09 0.00 -0.19 0.00 5.08 -1.46 -2.73 114.58 115.36 2raj h GLU 370 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2raj h GLU 370 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2raj h GLU 370 CO 0.07 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.62 2raj n ARG 371 N -3.08 2.51 -2.68 2.33 1.74 -0.71 -4.94 116.66 111.83 2raj n ARG 371 Ca -0.01 -2.77 -0.43 0.00 -0.77 0.00 0.00 57.85 53.88 2raj n ARG 371 Cb 0.19 -1.75 -0.03 0.00 -1.02 0.00 0.00 32.46 29.85 2raj n ARG 371 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2raj s ASP 372 N -2.17 6.49 0.00 0.55 3.68 -0.76 -4.87 116.67 119.58 2raj s ASP 372 Ca 0.39 0.12 0.08 0.00 2.13 0.00 0.00 52.55 55.27 2raj s ASP 372 Cb 0.32 -2.51 0.28 0.00 -1.45 0.00 0.00 42.92 39.56 2raj s ASP 372 CO 0.07 -1.29 1.21 -1.84 0.13 0.00 0.00 175.17 173.46 2raj n GLU 373 N 7.84 1.40 -2.71 4.34 0.28 -1.26 -4.29 120.64 126.24 2raj n GLU 373 Ca 0.08 -0.62 -0.43 0.00 -0.16 0.00 0.00 57.16 56.03 2raj n GLU 373 Cb 0.49 -1.17 0.00 0.00 1.43 0.00 0.00 31.44 32.19 2raj n GLU 373 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2raj n LEU 374 N -0.03 6.05 0.00 -1.84 4.77 -1.26 -4.88 117.00 119.82 2raj n LEU 374 Ca 0.07 -4.69 0.00 0.00 -0.03 0.00 0.00 56.01 51.37 2raj n LEU 374 Cb 0.16 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.75 2raj n LEU 374 CO 0.05 1.20 0.00 0.00 -1.33 0.00 0.00 177.39 177.31 2raj n ALA 375 N 4.04 0.00 -0.66 -1.18 0.00 -1.26 -4.64 120.51 116.82 2raj n ALA 375 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2raj n ALA 375 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 2raj n ALA 375 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2raj n GLY 376 N 0.00 2.42 0.10 0.00 0.00 -0.34 -0.75 105.19 106.63 2raj n GLY 376 Ca 0.00 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.81 2raj n GLY 376 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2raj n VAL 377 N 0.00 0.72 0.43 1.61 0.24 -1.26 -2.74 118.33 117.33 2raj n VAL 377 Ca 0.00 0.07 0.09 0.00 -2.04 0.00 0.00 64.34 62.46 2raj n VAL 377 Cb 0.00 -0.93 0.40 0.00 -1.47 0.00 0.00 33.84 31.83 2raj n VAL 377 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 2raj n MET 378 N -2.12 0.10 -0.01 7.34 2.00 0.07 -2.86 117.12 121.64 2raj n MET 378 Ca 0.04 0.35 0.04 0.00 0.00 0.00 0.00 57.70 58.12 2raj n MET 378 Cb 0.29 -1.69 0.41 0.00 0.00 0.00 0.00 33.22 32.23 2raj n MET 378 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 175.97 176.94 2raj h ILE 379 N 0.00 1.11 0.00 2.02 6.09 -1.47 -1.68 117.51 123.58 2raj h ILE 379 Ca 0.00 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.27 2raj h ILE 379 Cb 0.29 0.50 0.00 0.00 0.47 0.00 0.00 36.82 38.09 2raj h ILE 379 CO 0.00 0.11 0.00 -0.26 -3.07 0.00 0.00 178.15 174.93 2raj h PHE 380 N 0.57 0.00 0.00 2.19 0.04 -1.79 -1.36 116.94 116.59 2raj h PHE 380 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 2raj h PHE 380 Cb -0.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.10 2raj h PHE 380 CO 0.00 0.00 0.00 -1.13 -0.60 0.00 0.00 178.31 176.58 2raj n SER 381 N -3.04 0.66 -0.87 2.17 3.41 -0.63 -2.28 113.62 113.04 2raj n SER 381 Ca -0.02 0.61 0.12 0.00 -0.26 0.00 0.00 58.87 59.33 2raj n SER 381 Cb 0.13 -0.77 0.25 0.00 -0.26 0.00 0.00 64.21 63.56 2raj n SER 381 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2raj n THR 382 N -2.17 0.17 -3.70 6.66 -2.24 -0.51 -4.82 114.28 107.67 2raj n THR 382 Ca 0.04 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.95 2raj n THR 382 Cb 0.31 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.48 2raj n THR 382 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2raj s MET 383 N -1.83 3.80 -0.45 -0.78 1.00 -0.97 -0.89 119.30 119.18 2raj s MET 383 Ca 0.33 0.04 0.03 0.00 0.00 0.00 0.00 55.69 56.10 2raj s MET 383 Cb 0.21 -3.27 0.13 0.00 0.00 0.00 0.00 34.83 31.89 2raj s MET 383 CO 0.31 0.60 0.22 -2.00 0.00 0.00 0.00 175.02 174.14 2raj s GLU 384 N -0.61 1.57 0.02 2.03 2.12 -0.25 -4.93 118.70 118.66 2raj s GLU 384 Ca 0.17 -2.19 -0.30 0.00 0.36 0.00 0.00 54.97 53.00 2raj s GLU 384 Cb -0.13 -2.84 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 2raj s GLU 384 CO 0.06 -1.10 1.14 -1.25 -0.54 0.00 0.00 175.26 173.57 2raj s PRO 385 N 0.23 4.45 -1.17 4.30 0.04 -1.26 -2.72 135.00 138.86 2raj s PRO 385 Ca 0.16 1.66 -0.06 0.00 0.04 0.00 0.00 61.00 62.80 2raj s PRO 385 Cb -0.24 -3.42 0.24 0.00 0.04 0.00 0.00 34.50 31.12 2raj s PRO 385 CO -0.02 -0.25 1.73 0.39 0.04 0.00 0.00 177.00 178.89 2raj n GLU 386 N 4.20 4.26 -3.81 4.56 1.02 0.30 -4.90 120.64 126.28 2raj n GLU 386 Ca 0.09 -4.10 -0.05 0.00 -0.02 0.00 0.00 57.16 53.07 2raj n GLU 386 Cb 0.47 -2.67 -0.00 0.00 -0.02 0.00 0.00 31.44 29.22 2raj n GLU 386 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2raj s ALA 387 N -1.64 -1.40 0.88 0.62 0.00 -1.26 -4.52 121.76 114.43 2raj s ALA 387 Ca 0.37 -0.21 -0.11 0.00 0.00 0.00 0.00 51.96 52.01 2raj s ALA 387 Cb 0.09 0.71 0.12 0.00 0.00 0.00 0.00 23.12 24.04 2raj s ALA 387 CO 0.04 -1.04 1.10 -2.14 0.00 0.00 0.00 175.76 173.72 2raj s PRO 388 N -3.03 1.38 0.62 0.00 0.02 -1.26 -5.00 135.00 127.73 2raj s PRO 388 Ca 0.14 1.11 -0.16 0.00 0.02 0.00 0.00 61.00 62.12 2raj s PRO 388 Cb -0.03 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.67 2raj s PRO 388 CO 0.05 -2.24 1.09 -0.51 -0.33 0.00 0.00 177.00 175.07 2raj s ASP 389 N -3.17 5.40 0.01 2.53 -0.00 -1.26 -5.04 116.67 115.15 2raj s ASP 389 Ca 0.64 1.96 0.01 0.00 -0.00 0.00 0.00 52.55 55.16 2raj s ASP 389 Cb -0.19 -2.55 -0.04 0.00 -0.00 0.00 0.00 42.92 40.14 2raj s ASP 389 CO 0.57 -1.43 0.04 -0.76 -0.00 0.00 0.00 175.17 173.60 2raj s LEU 390 N -4.62 3.69 0.41 1.23 1.43 -1.26 -5.10 118.68 114.46 2raj s LEU 390 Ca 0.66 0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 53.65 2raj s LEU 390 Cb -0.19 -2.16 -0.09 0.00 0.03 0.00 0.00 46.19 43.78 2raj s LEU 390 CO 0.38 0.27 0.85 1.51 0.23 0.00 0.00 176.35 179.59 2raj s ASP 391 N -1.72 6.73 0.32 2.29 1.47 -1.26 -4.79 116.67 119.71 2raj s ASP 391 Ca 0.22 1.42 0.09 0.00 1.18 0.00 0.00 52.55 55.45 2raj s ASP 391 Cb -0.12 -2.43 0.84 0.00 -0.34 0.00 0.00 42.92 40.87 2raj s ASP 391 CO 0.13 -0.37 1.75 0.25 0.68 0.00 0.00 175.17 177.61 2raj h LEU 392 N 1.65 0.70 -0.03 2.11 5.85 -1.99 -2.10 115.31 121.51 2raj h LEU 392 Ca -0.48 0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.38 2raj h LEU 392 Cb 1.18 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2raj h LEU 392 CO 0.63 0.17 -0.13 0.58 -0.34 0.00 0.00 178.44 179.35 2raj h VAL 393 N 0.64 0.66 -0.62 1.05 2.07 -2.00 0.10 116.25 118.15 2raj h VAL 393 Ca 0.61 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 68.09 2raj h VAL 393 Cb 1.11 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 2raj h VAL 393 CO -0.42 0.00 0.20 -0.08 0.02 0.00 0.00 177.57 177.29 2raj h GLU 394 N -0.21 0.94 -0.18 1.57 4.81 -1.80 -2.62 114.58 117.09 2raj h GLU 394 Ca 0.06 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 2raj h GLU 394 Cb 0.29 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2raj h GLU 394 CO -0.15 0.81 0.08 0.82 -0.73 0.00 0.00 179.01 179.84 2raj h ILE 395 N 0.92 1.14 -0.70 2.32 2.04 -0.88 -1.77 117.51 120.57 2raj h ILE 395 Ca 0.21 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2raj h ILE 395 Cb 0.25 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2raj h ILE 395 CO -0.01 0.13 0.38 -0.08 0.00 0.00 0.00 178.15 178.57 2raj h GLU 396 N 0.16 0.97 -0.34 2.37 4.81 -0.80 -1.98 114.58 119.76 2raj h GLU 396 Ca 0.06 -0.11 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 2raj h GLU 396 Cb 0.13 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2raj h GLU 396 CO -0.01 0.72 -0.42 -0.56 -0.73 0.00 0.00 179.01 178.01 2raj h GLN 397 N 0.98 0.87 -0.39 1.92 3.07 -1.29 -1.16 115.11 119.10 2raj h GLN 397 Ca 0.25 -0.47 -0.01 0.00 0.09 0.00 0.00 58.65 58.51 2raj h GLN 397 Cb 0.04 0.02 -0.02 0.00 0.08 0.00 0.00 27.48 27.60 2raj h GLN 397 CO -0.04 1.12 0.21 -0.22 0.09 0.00 0.00 178.83 179.99 2raj h LYS 398 N 0.70 0.55 -0.64 0.06 1.63 -1.06 0.15 116.57 117.97 2raj h LYS 398 Ca 0.05 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 2raj h LYS 398 Cb 1.00 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.50 2raj h LYS 398 CO 0.10 0.46 0.35 0.00 -3.45 0.00 0.00 179.45 176.91 2raj h GLU 400 N 0.87 0.98 -0.13 0.00 4.81 -0.84 -1.16 114.58 119.11 2raj h GLU 400 Ca 0.22 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2raj h GLU 400 Cb 0.03 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2raj h GLU 400 CO -0.04 0.98 0.05 0.00 -0.73 0.00 0.00 179.01 179.27 2raj h ALA 401 N 1.07 0.17 -0.14 2.92 0.00 -0.64 -1.71 119.26 120.92 2raj h ALA 401 Ca 0.16 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2raj h ALA 401 Cb 0.55 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2raj h ALA 401 CO 0.03 -0.23 0.05 0.28 0.00 0.00 0.00 179.25 179.38 2raj h VAL 402 N 0.05 0.98 -0.86 0.00 2.07 -1.19 -0.54 116.25 116.74 2raj h VAL 402 Ca 0.04 -0.04 0.15 0.00 0.82 0.00 0.00 66.70 67.67 2raj h VAL 402 Cb 0.19 0.84 -0.09 0.00 -1.52 0.00 0.00 31.29 30.70 2raj h VAL 402 CO -0.00 0.02 0.45 1.23 0.02 0.00 0.00 177.57 179.29 2raj h GLY 403 N 0.12 1.40 0.71 2.17 0.00 -1.04 -1.23 103.07 105.20 2raj h GLY 403 Ca 0.06 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 2raj h GLY 403 CO -0.06 -0.03 -0.08 1.70 0.00 0.00 0.00 176.54 178.08 2raj h LYS 404 N 0.64 0.27 -0.23 4.80 3.64 -0.86 -2.79 116.57 122.04 2raj h LYS 404 Ca 0.47 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.71 2raj h LYS 404 Cb 0.65 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2raj h LYS 404 CO -0.36 0.64 0.11 0.35 -2.27 0.00 0.00 179.45 177.91 2raj h PHE 405 N -0.10 0.34 -0.61 1.91 3.57 -0.61 -1.29 116.94 120.15 2raj h PHE 405 Ca 0.02 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 2raj h PHE 405 Cb 0.57 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 2raj h PHE 405 CO 0.08 0.34 0.26 1.79 -2.23 0.00 0.00 178.31 178.55 2raj h THR 406 N 0.23 1.21 -0.19 4.41 1.35 -1.33 -0.00 112.91 118.60 2raj h THR 406 Ca 0.08 -0.65 -0.04 0.00 -0.55 0.00 0.00 66.41 65.25 2raj h THR 406 Cb 0.14 0.47 -0.01 0.00 -1.73 0.00 0.00 68.15 67.02 2raj h THR 406 CO -0.01 0.26 -0.04 0.50 -0.25 0.00 0.00 175.52 175.98 2raj h LYS 407 N 0.88 0.36 -0.02 4.72 1.63 -1.34 -0.11 116.57 122.69 2raj h LYS 407 Ca 0.21 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2raj h LYS 407 Cb 0.15 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.76 2raj h LYS 407 CO -0.02 0.61 0.01 0.00 -3.45 0.00 0.00 179.45 176.60 2raj h ALA 408 N 0.74 0.02 -0.71 5.00 0.00 -0.92 -2.16 119.26 121.23 2raj h ALA 408 Ca 0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2raj h ALA 408 Cb 0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2raj h ALA 408 CO 0.02 -0.47 0.34 1.98 0.00 0.00 0.00 179.25 181.12 2raj h MET 409 N 0.01 1.01 -0.49 0.00 1.85 -0.98 0.03 114.93 116.36 2raj h MET 409 Ca 0.01 -0.14 0.07 0.00 -0.61 0.00 0.00 59.70 59.03 2raj h MET 409 Cb 0.01 -0.19 -0.06 0.00 0.43 0.00 0.00 31.60 31.80 2raj h MET 409 CO -0.00 0.78 0.16 0.22 -0.40 0.00 0.00 176.91 177.67 2raj h ASP 410 N 1.01 0.14 -0.32 1.39 -0.00 -0.70 0.68 116.42 118.61 2raj h ASP 410 Ca 0.25 0.07 -0.03 0.00 -0.00 0.00 0.00 57.03 57.31 2raj h ASP 410 Cb 0.10 0.06 -0.01 0.00 -0.00 0.00 0.00 39.33 39.48 2raj h ASP 410 CO -0.03 0.10 0.08 0.44 -0.00 0.00 0.00 179.24 179.83 2raj h ASP 411 N 0.32 0.48 -0.74 2.28 3.45 -0.70 -0.07 116.42 121.44 2raj h ASP 411 Ca 0.24 -0.23 0.02 0.00 0.43 0.00 0.00 57.03 57.49 2raj h ASP 411 Cb 0.27 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 38.88 2raj h ASP 411 CO -0.26 0.58 0.49 1.23 -1.57 0.00 0.00 179.24 179.71 2raj h GLY 412 N 0.36 1.04 1.47 2.75 0.00 -0.03 -0.64 103.07 108.01 2raj h GLY 412 Ca 0.10 -0.38 -0.20 0.00 0.00 0.00 0.00 47.33 46.85 2raj h GLY 412 CO 0.00 0.36 -0.77 -2.08 0.00 0.00 0.00 176.54 174.05 2raj h VAL 413 N 0.97 1.35 -0.52 4.60 2.07 0.60 -2.86 116.25 122.46 2raj h VAL 413 Ca 0.28 -2.12 -0.06 0.00 0.82 0.00 0.00 66.70 65.61 2raj h VAL 413 Cb -0.06 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 2raj h VAL 413 CO -0.07 0.65 0.08 0.50 0.02 0.00 0.00 177.57 178.75 2raj h LYS 414 N 0.35 0.87 -0.60 1.57 3.64 -0.43 -2.30 116.57 119.67 2raj h LYS 414 Ca -0.04 -0.24 0.04 0.00 -1.27 0.00 0.00 60.65 59.13 2raj h LYS 414 Cb 1.36 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 33.04 2raj h LYS 414 CO 0.14 0.86 0.35 1.49 -2.27 0.00 0.00 179.45 180.02 2raj h GLU 415 N 0.75 0.66 -0.66 1.90 4.81 -1.09 -1.82 114.58 119.14 2raj h GLU 415 Ca 0.16 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2raj h GLU 415 Cb 0.41 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 2raj h GLU 415 CO 0.01 0.44 0.17 1.25 -0.73 0.00 0.00 179.01 180.15 2raj h LEU 416 N 0.68 0.99 -1.45 1.64 6.46 -1.34 -2.28 115.31 120.01 2raj h LEU 416 Ca 0.25 -0.23 -0.05 0.00 -0.12 0.00 0.00 57.88 57.73 2raj h LEU 416 Cb 0.07 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.73 2raj h LEU 416 CO -0.13 0.96 -0.20 -0.07 -0.62 0.00 0.00 178.44 178.38 2raj h LEU 417 N 0.98 0.09 0.22 2.25 3.38 -1.12 -0.93 115.31 120.18 2raj h LEU 417 Ca 0.21 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2raj h LEU 417 Cb 0.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2raj h LEU 417 CO 0.00 0.31 -0.10 0.74 0.09 0.00 0.00 178.44 179.48 2raj h THR 418 N 0.09 0.70 -0.09 0.22 2.02 -0.89 -2.47 112.91 112.49 2raj h THR 418 Ca 0.02 -0.98 -0.04 0.00 0.77 0.00 0.00 66.41 66.18 2raj h THR 418 Cb 0.42 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 2raj h THR 418 CO 0.03 0.17 -0.12 -0.37 0.37 0.00 0.00 175.52 175.60 2raj h VAL 419 N -0.89 1.14 0.67 3.16 -1.51 -1.44 -2.27 116.25 115.12 2raj h VAL 419 Ca -0.03 -0.63 -0.03 0.00 -1.23 0.00 0.00 66.70 64.78 2raj h VAL 419 Cb 0.51 1.21 -0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2raj h VAL 419 CO 0.05 0.19 -0.43 1.23 -1.23 0.00 0.00 177.57 177.38 2raj h GLY 420 N 0.60 -1.22 1.62 5.19 0.00 -1.16 -0.91 103.07 107.18 2raj h GLY 420 Ca 0.03 0.51 0.04 0.00 0.00 0.00 0.00 47.33 47.91 2raj h GLY 420 CO 0.02 -0.41 0.17 -1.61 0.00 0.00 0.00 176.54 174.71 2raj h GLN 421 N -1.04 0.13 -0.34 4.80 5.75 -1.26 0.11 115.11 123.26 2raj h GLN 421 Ca -0.09 -0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.35 2raj h GLN 421 Cb 0.84 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.35 2raj h GLN 421 CO 0.08 0.09 0.02 0.93 -2.65 0.00 0.00 178.83 177.30 2raj h GLU 422 N 0.14 0.58 0.00 1.69 5.08 -1.08 -0.53 114.58 120.45 2raj h GLU 422 Ca 0.11 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2raj h GLU 422 Cb 0.25 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2raj h GLU 422 CO -0.01 0.69 -0.22 1.25 -1.00 0.00 0.00 179.01 179.71 2raj h HIS 423 N 0.40 0.00 -0.01 4.33 2.76 -0.35 -2.51 115.15 119.76 2raj h HIS 423 Ca 0.10 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.25 2raj h HIS 423 Cb 0.41 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.37 2raj h HIS 423 CO 0.03 0.22 -0.08 2.35 -1.30 0.00 0.00 177.93 179.15 2raj h TRP 424 N 0.00 0.10 0.00 5.26 2.91 -0.61 -1.98 115.95 121.62 2raj h TRP 424 Ca -0.00 -0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.97 2raj h TRP 424 Cb 0.73 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.37 2raj h TRP 424 CO 0.00 0.77 0.00 0.36 -1.03 0.00 0.00 178.44 178.54 2raj n LYS 425 N -4.67 0.01 -0.03 2.65 2.85 -0.24 -2.36 118.16 116.36 2raj n LYS 425 Ca -0.09 0.26 -0.14 0.00 -1.05 0.00 0.00 58.31 57.30 2raj n LYS 425 Cb 0.39 -1.52 -0.14 0.00 -0.65 0.00 0.00 35.03 33.11 2raj n LYS 425 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2raj n ARG 426 N -1.54 0.68 0.02 -1.58 3.00 -0.95 -2.70 116.66 113.58 2raj n ARG 426 Ca 0.03 0.24 0.14 0.00 -0.00 0.00 0.00 57.85 58.26 2raj n ARG 426 Cb 0.17 -1.71 0.58 0.00 0.00 0.00 0.00 32.46 31.49 2raj n ARG 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2raj n THR 428 N -1.64 0.00 0.00 0.00 -2.24 -1.04 -3.22 114.28 106.15 2raj n THR 428 Ca 0.07 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2raj n THR 428 Cb 0.36 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 2raj n THR 428 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2raj n GLY 429 N 1.22 0.31 0.34 3.38 0.00 -1.10 -4.86 105.19 104.48 2raj n GLY 429 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2raj n GLY 429 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2raj h PRO 430 N 0.00 1.09 -0.29 1.61 0.13 -1.77 -3.25 132.00 129.52 2raj h PRO 430 Ca 0.00 -0.15 -0.03 0.00 -0.87 0.00 0.00 66.00 64.95 2raj h PRO 430 Cb 0.00 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 30.92 2raj h PRO 430 CO 0.00 0.84 0.09 1.25 -0.23 0.00 0.00 178.00 179.94 2raj h LEU 431 N 1.08 0.43 -1.22 1.56 5.85 -1.75 -2.65 115.31 118.61 2raj h LEU 431 Ca 0.26 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2raj h LEU 431 Cb 0.11 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2raj h LEU 431 CO -0.03 0.53 0.19 -0.65 -0.34 0.00 0.00 178.44 178.14 2raj h PRO 432 N 0.31 0.73 0.00 5.25 0.11 -1.78 -2.31 132.00 134.31 2raj h PRO 432 Ca 0.09 -0.11 -0.05 0.00 0.11 0.00 0.00 66.00 66.05 2raj h PRO 432 Cb 0.26 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 2raj h PRO 432 CO -0.00 0.61 -0.22 0.87 -0.21 0.00 0.00 178.00 179.05 2raj h LYS 433 N 0.72 0.00 -0.11 1.05 1.57 -1.55 -1.66 116.57 116.59 2raj h LYS 433 Ca 0.17 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.85 2raj h LYS 433 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2raj h LYS 433 CO -0.01 0.22 -0.34 0.93 -0.57 0.00 0.00 179.45 179.67 2raj h GLU 434 N 0.00 0.43 0.00 3.15 5.08 -1.06 -0.11 114.58 122.07 2raj h GLU 434 Ca -0.00 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 57.99 2raj h GLU 434 Cb 0.45 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2raj h GLU 434 CO 0.03 0.93 -0.27 1.88 -1.00 0.00 0.00 179.01 180.58 2raj h TYR 435 N 0.00 0.00 -0.25 4.33 -1.99 -1.45 -2.19 116.97 115.42 2raj h TYR 435 Ca -0.01 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.66 2raj h TYR 435 Cb 0.96 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.68 2raj h TYR 435 CO 0.11 0.27 -0.09 0.37 -0.00 0.00 0.00 178.16 178.83 2raj h GLN 436 N 0.00 0.50 -0.54 4.88 5.75 -1.07 -2.25 115.11 122.37 2raj h GLN 436 Ca -0.00 -0.20 -0.10 0.00 -0.15 0.00 0.00 58.65 58.20 2raj h GLN 436 Cb 0.66 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.17 2raj h GLN 436 CO 0.04 0.74 -0.05 0.87 -2.65 0.00 0.00 178.83 177.77 2raj h LYS 437 N 0.23 0.99 -0.43 1.69 1.57 -0.67 -2.16 116.57 117.78 2raj h LYS 437 Ca 0.06 -0.34 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2raj h LYS 437 Cb 0.57 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2raj h LYS 437 CO 0.03 1.02 0.26 0.82 -0.57 0.00 0.00 179.45 181.00 2raj h ILE 438 N 0.86 1.14 -0.33 1.86 2.04 -1.42 0.45 117.51 122.12 2raj h ILE 438 Ca 0.15 -0.34 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 2raj h ILE 438 Cb 0.60 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2raj h ILE 438 CO 0.04 0.15 -0.01 1.23 0.00 0.00 0.00 178.15 179.55 2raj h GLY 439 N 0.57 0.56 1.50 5.37 0.00 -1.25 -0.15 103.07 109.67 2raj h GLY 439 Ca 0.16 -0.33 -0.29 0.00 0.00 0.00 0.00 47.33 46.86 2raj h GLY 439 CO -0.03 0.31 -1.34 0.50 0.00 0.00 0.00 176.54 175.99 2raj h LYS 440 N 0.50 0.30 -0.83 4.80 1.57 -1.20 -3.00 116.57 118.71 2raj h LYS 440 Ca 0.11 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 2raj h LYS 440 Cb 0.34 0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 2raj h LYS 440 CO 0.01 1.22 0.48 0.00 -0.57 0.00 0.00 179.45 180.59 2raj h ALA 441 N 0.51 1.29 -0.14 3.86 0.00 -0.59 0.60 119.26 124.79 2raj h ALA 441 Ca -0.17 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2raj h ALA 441 Cb 2.01 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 2raj h ALA 441 CO 0.20 0.60 -0.41 -0.07 0.00 0.00 0.00 179.25 179.57 2raj h LEU 442 N 1.14 0.34 -0.14 0.00 3.38 -1.07 -2.62 115.31 116.34 2raj h LEU 442 Ca 0.29 -0.15 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 2raj h LEU 442 Cb -0.01 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.65 2raj h LEU 442 CO -0.05 0.72 -0.74 1.56 0.09 0.00 0.00 178.44 180.02 2raj h GLN 443 N 0.27 0.75 -0.64 1.13 4.20 -1.20 -1.69 115.11 117.94 2raj h GLN 443 Ca 0.02 -0.62 0.01 0.00 0.06 0.00 0.00 58.65 58.13 2raj h GLN 443 Cb 0.85 0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.72 2raj h GLN 443 CO 0.07 1.23 0.42 0.77 -0.67 0.00 0.00 178.83 180.64 2raj h SER 444 N 0.47 0.71 -0.00 1.46 0.02 -0.86 -0.64 113.55 114.71 2raj h SER 444 Ca -0.05 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2raj h SER 444 Cb 1.37 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 2raj h SER 444 CO 0.15 0.51 0.00 0.25 -1.14 0.00 0.00 176.83 176.61 2raj h LEU 445 N 0.84 0.00 -0.94 5.07 5.85 -1.44 -2.12 115.31 122.58 2raj h LEU 445 Ca 0.24 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.93 2raj h LEU 445 Cb -0.07 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 2raj h LEU 445 CO -0.06 0.08 0.60 0.00 -0.34 0.00 0.00 178.44 178.72 2raj h ALA 446 N 0.93 1.26 -0.90 1.25 0.00 -0.98 -0.68 119.26 120.14 2raj h ALA 446 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2raj h ALA 446 Cb 0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2raj h ALA 446 CO -0.00 0.44 0.54 1.15 0.00 0.00 0.00 179.25 181.38 2raj h THR 447 N 1.14 1.25 -0.39 0.00 2.02 -0.90 0.11 112.91 116.14 2raj h THR 447 Ca 0.39 -0.54 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 2raj h THR 447 Cb 0.07 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 2raj h THR 447 CO -0.14 0.26 0.04 0.58 0.37 0.00 0.00 175.52 176.63 2raj h VAL 448 N 1.25 1.25 -0.82 3.16 2.07 -0.61 -2.84 116.25 119.70 2raj h VAL 448 Ca 0.32 -0.92 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2raj h VAL 448 Cb -0.05 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2raj h VAL 448 CO -0.06 0.31 0.55 -0.26 0.02 0.00 0.00 177.57 178.13 2raj h PHE 449 N 0.50 1.03 0.00 1.57 0.05 -0.36 -1.44 116.94 118.29 2raj h PHE 449 Ca 0.12 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.93 2raj h PHE 449 Cb 0.41 -0.35 0.00 0.00 2.00 0.00 0.00 35.95 38.01 2raj h PHE 449 CO 0.03 0.64 0.00 0.66 -0.18 0.00 0.00 178.31 179.46 2raj h SER 450 N 1.10 0.00 -0.54 2.17 4.64 -0.56 -2.28 113.55 118.08 2raj h SER 450 Ca 0.31 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.52 2raj h SER 450 Cb -0.11 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 61.92 2raj h SER 450 CO -0.07 0.00 0.10 -1.54 -0.87 0.00 0.00 176.83 174.46 2raj n SER 451 N -2.58 4.58 0.21 4.97 3.41 -0.54 -4.49 113.62 119.18 2raj n SER 451 Ca -0.01 -3.16 0.11 0.00 -0.26 0.00 0.00 58.87 55.56 2raj n SER 451 Cb 0.13 -0.67 0.25 0.00 -0.26 0.00 0.00 64.21 63.67 2raj n SER 451 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2raj h SER 452 N 2.59 0.00 0.00 4.04 4.64 -1.48 -3.47 113.55 119.87 2raj h SER 452 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2raj h SER 452 Cb 1.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.05 2raj h SER 452 CO 0.51 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 177.20 2raj n GLY 453 N 0.86 2.02 3.81 -0.77 0.00 -1.26 -4.99 105.19 104.86 2raj n GLY 453 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2raj n GLY 453 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2raj s TYR 454 N -3.01 3.07 0.28 1.61 5.04 -1.26 -5.04 117.35 118.04 2raj s TYR 454 Ca 0.00 1.45 -0.00 0.00 -2.44 0.00 0.00 57.07 56.08 2raj s TYR 454 Cb 0.00 -2.92 -0.04 0.00 0.35 0.00 0.00 41.96 39.35 2raj s TYR 454 CO 0.00 -1.19 0.48 -0.65 -1.34 0.00 0.00 175.55 172.85 2raj s GLN 455 N -4.72 3.51 -1.46 4.97 1.11 -1.26 -4.52 119.66 117.30 2raj s GLN 455 Ca 0.60 -0.33 -0.08 0.00 0.01 0.00 0.00 55.36 55.56 2raj s GLN 455 Cb -0.15 -2.74 0.02 0.00 -1.01 0.00 0.00 33.01 29.14 2raj s GLN 455 CO 0.49 0.26 0.88 0.41 0.01 0.00 0.00 175.29 177.34 2raj n GLY 456 N -1.27 -0.53 0.01 3.09 0.00 -1.26 -4.91 105.19 100.32 2raj n GLY 456 Ca -0.05 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.22 2raj n GLY 456 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2raj n GLU 457 N -4.48 0.54 -0.48 1.61 2.13 -1.26 -4.46 120.64 114.24 2raj n GLU 457 Ca -0.04 -0.12 0.40 0.00 0.66 0.00 0.00 57.16 58.06 2raj n GLU 457 Cb 0.58 -1.33 0.71 0.00 0.27 0.00 0.00 31.44 31.67 2raj n GLU 457 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2raj h THR 458 N 0.00 0.20 0.00 6.31 2.02 -1.91 -0.36 112.91 119.16 2raj h THR 458 Ca -0.03 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2raj h THR 458 Cb 0.73 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2raj h THR 458 CO 0.00 0.01 0.00 -0.67 0.37 0.00 0.00 175.52 175.23 2raj n ASP 459 N -4.34 0.00 0.40 4.18 -0.08 -1.26 -2.41 116.55 113.05 2raj n ASP 459 Ca 0.35 0.90 -0.19 0.00 -1.51 0.00 0.00 54.79 54.34 2raj n ASP 459 Cb 1.50 -0.40 -0.10 0.00 2.34 0.00 0.00 41.12 44.46 2raj n ASP 459 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2raj h LEU 460 N 0.00 -1.20 -1.47 -2.67 5.85 -1.38 -3.15 115.31 111.30 2raj h LEU 460 Ca 0.00 0.07 0.35 0.00 0.84 0.00 0.00 57.88 59.14 2raj h LEU 460 Cb 0.00 0.35 -0.10 0.00 0.37 0.00 0.00 40.66 41.28 2raj h LEU 460 CO 0.00 -0.71 0.78 0.78 -0.34 0.00 0.00 178.44 178.94 2raj h ASN 461 N -1.13 0.31 -0.25 1.25 -0.26 -1.54 0.36 115.58 114.32 2raj h ASN 461 Ca -0.10 0.09 -0.10 0.00 -0.56 0.00 0.00 56.30 55.64 2raj h ASN 461 Cb 0.92 0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 38.23 2raj h ASN 461 CO 0.08 -0.03 -0.23 -0.78 -1.06 0.00 0.00 177.43 175.41 2raj h ASP 462 N 0.22 0.64 -0.29 5.81 1.82 -1.46 -0.80 116.42 122.36 2raj h ASP 462 Ca 0.69 -0.47 -0.06 0.00 -0.39 0.00 0.00 57.03 56.80 2raj h ASP 462 Cb 2.06 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 41.87 2raj h ASP 462 CO -0.30 0.97 0.01 0.00 -1.61 0.00 0.00 179.24 178.31 2raj h ALA 463 N 0.68 1.28 -0.27 -0.78 0.00 -0.33 -1.53 119.26 118.32 2raj h ALA 463 Ca 0.04 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 2raj h ALA 463 Cb 0.79 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2raj h ALA 463 CO 0.06 0.49 -0.35 0.82 0.00 0.00 0.00 179.25 180.26 2raj h ILE 464 N 0.59 1.30 -0.61 0.00 2.04 -0.96 -0.88 117.51 118.99 2raj h ILE 464 Ca 0.12 -1.54 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 2raj h ILE 464 Cb 0.36 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2raj h ILE 464 CO 0.01 0.49 0.29 0.74 0.00 0.00 0.00 178.15 179.68 2raj h THR 465 N 0.45 1.20 -0.10 -0.27 2.02 -0.85 -1.39 112.91 113.97 2raj h THR 465 Ca 0.03 -0.57 -0.19 0.00 0.77 0.00 0.00 66.41 66.44 2raj h THR 465 Cb 0.94 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2raj h THR 465 CO 0.08 0.24 -0.75 -0.33 0.37 0.00 0.00 175.52 175.14 2raj h GLU 466 N 0.87 0.50 -0.79 6.66 4.39 -1.14 -2.05 114.58 123.02 2raj h GLU 466 Ca 0.21 -0.41 -0.03 0.00 0.34 0.00 0.00 59.36 59.47 2raj h GLU 466 Cb 0.10 0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2raj h GLU 466 CO -0.03 1.05 0.39 0.00 -1.16 0.00 0.00 179.01 179.26 2raj h ALA 467 N 0.84 1.02 -0.74 3.43 0.00 -0.79 0.19 119.26 123.21 2raj h ALA 467 Ca -0.04 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 2raj h ALA 467 Cb 1.34 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 2raj h ALA 467 CO 0.14 0.58 0.23 0.78 0.00 0.00 0.00 179.25 180.98 2raj h GLY 468 N 1.12 1.24 1.96 0.00 0.00 -1.15 -2.03 103.07 104.21 2raj h GLY 468 Ca 0.27 -0.73 -0.11 0.00 0.00 0.00 0.00 47.33 46.77 2raj h GLY 468 CO -0.04 0.68 -0.49 0.50 0.00 0.00 0.00 176.54 177.19 2raj h LYS 469 N 1.11 0.04 -0.59 4.80 1.57 -0.63 -2.81 116.57 120.06 2raj h LYS 469 Ca 0.24 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2raj h LYS 469 Cb 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 2raj h LYS 469 CO -0.01 0.53 0.12 1.15 -0.57 0.00 0.00 179.45 180.67 2raj h THR 470 N 0.04 1.25 0.00 -0.16 2.02 -0.14 -2.09 112.91 113.83 2raj h THR 470 Ca -0.00 -0.94 -0.03 0.00 0.77 0.00 0.00 66.41 66.21 2raj h THR 470 Cb 0.88 0.73 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2raj h THR 470 CO 0.07 0.35 -0.15 1.88 0.37 0.00 0.00 175.52 178.03 2raj h TYR 471 N 0.86 0.00 -0.14 3.16 -1.99 -1.14 -0.66 116.97 117.06 2raj h TYR 471 Ca 0.18 0.00 -0.21 0.00 2.00 0.00 0.00 58.73 60.70 2raj h TYR 471 Cb 0.38 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.12 2raj h TYR 471 CO 0.03 0.15 -0.74 0.93 -0.00 0.00 0.00 178.16 178.53 2raj h GLU 472 N 0.00 0.75 -0.16 4.88 5.08 -1.22 -0.89 114.58 123.01 2raj h GLU 472 Ca -0.00 -0.62 -0.07 0.00 -1.00 0.00 0.00 59.36 57.67 2raj h GLU 472 Cb 0.41 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2raj h GLU 472 CO 0.02 1.23 -0.20 0.93 -1.00 0.00 0.00 179.01 179.99 2raj h GLU 473 N 0.47 0.28 -0.25 2.33 5.08 -0.77 -2.38 114.58 119.34 2raj h GLU 473 Ca -0.05 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 2raj h GLU 473 Cb 1.38 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.59 2raj h GLU 473 CO 0.15 0.47 -0.26 0.82 -1.00 0.00 0.00 179.01 179.20 2raj h ILE 474 N 0.26 1.31 -0.28 3.13 2.04 -1.00 -1.47 117.51 121.51 2raj h ILE 474 Ca 0.05 -1.43 0.06 0.00 1.00 0.00 0.00 64.86 64.54 2raj h ILE 474 Cb 0.50 1.67 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 2raj h ILE 474 CO 0.03 0.45 -0.14 0.00 0.00 0.00 0.00 178.15 178.49 2raj h ALA 475 N 0.67 0.09 -0.70 1.87 0.00 -0.73 0.24 119.26 120.70 2raj h ALA 475 Ca 0.04 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2raj h ALA 475 Cb 0.82 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2raj h ALA 475 CO 0.06 -0.54 0.32 0.77 0.00 0.00 0.00 179.25 179.87 2raj h SER 476 N -0.10 0.93 -0.31 0.00 0.02 -1.41 -1.20 113.55 111.49 2raj h SER 476 Ca 0.15 -0.14 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2raj h SER 476 Cb 0.32 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2raj h SER 476 CO -0.35 0.81 0.03 0.25 -1.14 0.00 0.00 176.83 176.44 2raj h LEU 477 N 0.98 0.60 -0.52 5.07 5.85 -0.57 -1.98 115.31 124.74 2raj h LEU 477 Ca 0.24 -0.11 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 2raj h LEU 477 Cb 0.14 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2raj h LEU 477 CO -0.03 0.65 -0.12 0.58 -0.34 0.00 0.00 178.44 179.18 2raj h VAL 478 N 0.61 1.27 0.00 1.05 2.07 0.07 -2.47 116.25 118.84 2raj h VAL 478 Ca 0.13 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.37 2raj h VAL 478 Cb 0.34 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2raj h VAL 478 CO 0.01 0.45 0.00 0.00 0.02 0.00 0.00 177.57 178.05 2raj h ALA 479 N 0.91 1.00 -0.23 1.67 0.00 -0.83 -3.08 119.26 118.70 2raj h ALA 479 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2raj h ALA 479 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2raj h ALA 479 CO 0.05 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.69 2raj n GLU 480 N -2.85 1.91 -0.04 0.00 -0.58 -0.78 -4.64 120.64 113.67 2raj n GLU 480 Ca 0.02 -1.82 -0.15 0.00 -0.42 0.00 0.00 57.16 54.79 2raj n GLU 480 Cb 0.32 -1.34 -0.08 0.00 -0.57 0.00 0.00 31.44 29.77 2raj n GLU 480 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2raj h GLN 481 N 3.06 0.51 -1.05 3.49 5.75 -1.35 -3.31 115.11 122.19 2raj h GLN 481 Ca 0.00 -0.37 0.31 0.00 -0.15 0.00 0.00 58.65 58.44 2raj h GLN 481 Cb 0.74 0.06 -0.13 0.00 1.07 0.00 0.00 27.48 29.23 2raj h GLN 481 CO 0.00 0.99 0.63 -1.35 -2.65 0.00 0.00 178.83 176.46 2raj h PRO 482 N 0.11 0.35 0.00 -2.39 0.11 -1.82 0.13 132.00 128.49 2raj h PRO 482 Ca -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2raj h PRO 482 Cb 1.04 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2raj h PRO 482 CO 0.09 0.23 0.00 0.87 -0.21 0.00 0.00 178.00 178.98 2raj h LYS 483 N 0.36 0.00 0.00 1.05 1.57 -1.91 0.54 116.57 118.18 2raj h LYS 483 Ca 0.70 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 59.33 2raj h LYS 483 Cb 1.67 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.96 2raj h LYS 483 CO -0.49 0.00 -1.74 1.63 -0.57 0.00 0.00 179.45 178.28 2raj n LYS 484 N -2.78 0.64 0.11 3.15 5.02 0.46 -4.69 118.16 120.06 2raj n LYS 484 Ca -0.01 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2raj n LYS 484 Cb 0.16 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 2raj n LYS 484 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2raj n ASP 485 N -2.67 0.33 -0.24 4.39 3.85 -1.09 -4.84 116.55 116.29 2raj n ASP 485 Ca -0.12 0.35 0.01 0.00 -0.71 0.00 0.00 54.79 54.32 2raj n ASP 485 Cb 0.81 0.12 0.13 0.00 -1.35 0.00 0.00 41.12 40.83 2raj n ASP 485 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2raj h LEU 486 N 0.00 0.45 -0.76 -2.12 5.85 -1.72 -2.07 115.31 114.93 2raj h LEU 486 Ca 0.00 0.06 0.17 0.00 0.84 0.00 0.00 57.88 58.95 2raj h LEU 486 Cb 0.00 -0.02 -0.13 0.00 0.37 0.00 0.00 40.66 40.88 2raj h LEU 486 CO 0.00 0.26 0.00 -0.74 -0.34 0.00 0.00 178.44 177.62 2raj h HIS 487 N 0.59 -0.05 -0.43 1.25 2.76 -1.18 -0.39 115.15 117.70 2raj h HIS 487 Ca 0.34 0.06 -0.14 0.00 -2.20 0.00 0.00 60.37 58.43 2raj h HIS 487 Cb 0.35 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 2raj h HIS 487 CO -0.11 -0.25 -0.26 0.74 -1.30 0.00 0.00 177.93 176.75 2raj h PHE 488 N 0.10 1.06 -0.72 5.26 -1.00 -1.65 -1.29 116.94 118.71 2raj h PHE 488 Ca 0.42 -0.27 -0.01 0.00 2.81 0.00 0.00 57.97 60.92 2raj h PHE 488 Cb 0.74 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.02 2raj h PHE 488 CO -0.43 1.07 0.40 1.25 -1.61 0.00 0.00 178.31 179.00 2raj h LEU 489 N 0.78 0.89 -0.57 1.54 5.85 -1.03 -1.57 115.31 121.21 2raj h LEU 489 Ca 0.09 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 2raj h LEU 489 Cb 0.83 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2raj h LEU 489 CO 0.07 0.72 -0.04 0.24 -0.34 0.00 0.00 178.44 179.09 2raj h MET 490 N 0.98 1.03 -0.41 1.25 2.86 -0.97 -2.32 114.93 117.35 2raj h MET 490 Ca 0.25 -0.35 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 2raj h MET 490 Cb 0.02 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 2raj h MET 490 CO -0.04 1.04 0.16 0.93 1.06 0.00 0.00 176.91 180.06 2raj h GLU 491 N 0.92 0.62 -0.56 1.72 4.39 -0.84 0.33 114.58 121.16 2raj h GLU 491 Ca 0.16 -0.11 0.03 0.00 0.34 0.00 0.00 59.36 59.77 2raj h GLU 491 Cb 0.60 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 2raj h GLU 491 CO 0.04 0.58 0.34 0.00 -1.16 0.00 0.00 179.01 178.80 2raj h ASN 493 N 0.67 0.39 -0.30 0.00 4.21 -1.02 -1.99 115.58 117.54 2raj h ASN 493 Ca 0.23 -0.16 -0.02 0.00 1.21 0.00 0.00 56.30 57.56 2raj h ASN 493 Cb 0.03 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.11 2raj h ASN 493 CO -0.10 0.74 0.11 0.45 -1.29 0.00 0.00 177.43 177.34 2raj h HIS 494 N 0.32 0.47 -0.48 1.19 3.86 0.45 -1.46 115.15 119.49 2raj h HIS 494 Ca 0.03 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.15 2raj h HIS 494 Cb 0.81 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 2raj h HIS 494 CO 0.02 0.47 0.10 1.49 0.86 0.00 0.00 177.93 180.87 2raj h GLU 495 N 0.34 0.74 0.00 2.45 4.81 -0.83 -2.32 114.58 119.76 2raj h GLU 495 Ca 0.10 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 59.09 2raj h GLU 495 Cb 0.21 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2raj h GLU 495 CO -0.01 0.68 -0.46 1.88 -0.73 0.00 0.00 179.01 180.37 2raj h TYR 496 N 0.71 0.00 -0.46 0.92 -1.99 -1.06 -1.91 116.97 113.18 2raj h TYR 496 Ca 0.16 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.75 2raj h TYR 496 Cb 0.29 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 2raj h TYR 496 CO 0.01 0.46 -0.24 -0.22 -0.00 0.00 0.00 178.16 178.17 2raj h LYS 497 N 0.00 0.98 -0.21 4.88 3.64 -0.93 0.03 116.57 124.98 2raj h LYS 497 Ca -0.00 -0.44 0.05 0.00 -1.27 0.00 0.00 60.65 58.98 2raj h LYS 497 Cb 0.91 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.66 2raj h LYS 497 CO 0.06 1.11 -0.09 0.78 -2.27 0.00 0.00 179.45 179.05 2raj h GLY 498 N 0.83 0.10 0.92 5.01 0.00 -0.91 0.43 103.07 109.45 2raj h GLY 498 Ca 0.10 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 2raj h GLY 498 CO 0.07 -0.11 -0.02 0.74 0.00 0.00 0.00 176.54 177.22 2raj h PHE 499 N -0.05 -0.05 0.00 5.60 -1.00 -1.10 -2.49 116.94 117.84 2raj h PHE 499 Ca 0.11 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 2raj h PHE 499 Cb 0.22 0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.79 2raj h PHE 499 CO -0.25 0.05 -0.06 -0.07 -1.61 0.00 0.00 178.31 176.36 2raj h LEU 500 N -0.13 0.00 -0.51 1.54 3.38 -0.67 -1.29 115.31 117.62 2raj h LEU 500 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2raj h LEU 500 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2raj h LEU 500 CO 0.01 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.21 2raj n GLY 501 N -1.04 -1.18 0.14 0.83 0.00 0.15 -2.64 105.19 101.45 2raj n GLY 501 Ca -0.02 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2raj n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2raj h PHE 503 N 0.00 0.58 -0.86 0.00 -1.00 -1.61 -3.05 116.94 111.00 2raj h PHE 503 Ca -0.00 -0.13 0.13 0.00 2.81 0.00 0.00 57.97 60.78 2raj h PHE 503 Cb 1.00 -0.14 -0.09 0.00 3.61 0.00 0.00 35.95 40.34 2raj h PHE 503 CO 0.00 0.74 0.47 -1.35 -1.61 0.00 0.00 178.31 176.56 2raj h PRO 504 N 0.45 0.68 -0.03 1.51 0.11 -1.77 0.21 132.00 133.16 2raj h PRO 504 Ca 0.06 -0.04 -0.20 0.00 0.11 0.00 0.00 66.00 65.93 2raj h PRO 504 Cb 0.72 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 2raj h PRO 504 CO 0.06 0.45 -0.83 -0.44 -0.21 0.00 0.00 178.00 177.03 2raj h ASP 505 N 0.70 0.42 -0.32 -2.05 3.32 -1.85 -1.33 116.42 115.31 2raj h ASP 505 Ca 0.46 -0.31 -0.16 0.00 0.02 0.00 0.00 57.03 57.04 2raj h ASP 505 Cb 0.58 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2raj h ASP 505 CO -0.33 1.08 -0.39 0.40 -1.72 0.00 0.00 179.24 178.28 2raj h ILE 506 N 0.21 1.28 -0.25 0.35 2.04 -1.23 -1.52 117.51 118.38 2raj h ILE 506 Ca -0.05 -1.56 -0.16 0.00 1.00 0.00 0.00 64.86 64.09 2raj h ILE 506 Cb 1.43 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 2raj h ILE 506 CO 0.14 0.52 -0.50 0.40 0.00 0.00 0.00 178.15 178.71 2raj h ILE 507 N 0.71 1.30 -0.61 -0.67 2.04 -0.64 -2.09 117.51 117.55 2raj h ILE 507 Ca 0.06 -1.70 0.05 0.00 1.00 0.00 0.00 64.86 64.26 2raj h ILE 507 Cb 0.97 1.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.63 2raj h ILE 507 CO 0.09 0.54 0.34 1.23 0.00 0.00 0.00 178.15 180.35 2raj h GLY 508 N 0.92 0.88 0.97 5.37 0.00 -1.05 0.49 103.07 110.65 2raj h GLY 508 Ca 0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 2raj h GLY 508 CO 0.10 0.15 0.16 -0.84 0.00 0.00 0.00 176.54 176.12 2raj h THR 509 N 0.63 1.22 -0.38 4.70 2.02 -1.13 0.17 112.91 120.14 2raj h THR 509 Ca 0.27 -0.74 -0.10 0.00 0.77 0.00 0.00 66.41 66.61 2raj h THR 509 Cb 0.15 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 2raj h THR 509 CO -0.17 0.27 -0.15 0.45 0.37 0.00 0.00 175.52 176.29 2raj h HIS 510 N 0.65 0.89 -0.52 3.16 -0.00 -0.65 -1.77 115.15 116.91 2raj h HIS 510 Ca 0.16 -0.21 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2raj h HIS 510 Cb 0.25 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.43 2raj h HIS 510 CO 0.01 0.94 0.27 0.87 -0.00 0.00 0.00 177.93 180.02 2raj h LYS 511 N 0.58 0.74 -0.64 2.45 1.57 0.10 -1.64 116.57 119.73 2raj h LYS 511 Ca 0.09 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2raj h LYS 511 Cb 0.69 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 2raj h LYS 511 CO 0.05 0.59 0.42 0.78 -0.57 0.00 0.00 179.45 180.72 2raj h GLY 512 N 0.69 0.88 1.04 3.86 0.00 -0.53 -1.64 103.07 107.38 2raj h GLY 512 Ca 0.18 -0.32 -0.12 0.00 0.00 0.00 0.00 47.33 47.07 2raj h GLY 512 CO -0.03 0.30 -0.20 0.00 0.00 0.00 0.00 176.54 176.62 2raj h ALA 513 N 1.61 0.58 -0.49 3.60 0.00 -0.65 -2.71 119.26 121.20 2raj h ALA 513 Ca 0.24 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 2raj h ALA 513 Cb -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2raj h ALA 513 CO -0.06 0.54 0.03 0.82 0.00 0.00 0.00 179.25 180.58 2raj h ILE 514 N 0.67 1.24 -0.34 0.00 2.04 -0.81 -2.48 117.51 117.83 2raj h ILE 514 Ca 0.09 -0.95 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 2raj h ILE 514 Cb 0.76 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2raj h ILE 514 CO 0.06 0.34 0.18 -0.33 0.00 0.00 0.00 178.15 178.40 2raj h GLU 515 N 0.75 0.48 -0.35 2.37 4.39 -1.17 -0.71 114.58 120.35 2raj h GLU 515 Ca 0.15 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.82 2raj h GLU 515 Cb 0.41 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 2raj h GLU 515 CO 0.01 0.42 0.15 0.87 -1.16 0.00 0.00 179.01 179.30 2raj h LYS 516 N 0.42 0.31 -0.65 2.33 1.79 -1.26 -1.26 116.57 118.25 2raj h LYS 516 Ca 0.12 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.54 2raj h LYS 516 Cb 0.08 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 2raj h LYS 516 CO -0.02 0.21 0.30 0.28 -1.08 0.00 0.00 179.45 179.14 2raj h VAL 517 N 0.32 1.21 0.00 0.50 2.07 -1.28 -1.02 116.25 118.06 2raj h VAL 517 Ca 0.15 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2raj h VAL 517 Cb 0.09 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2raj h VAL 517 CO -0.13 0.26 0.00 0.29 0.02 0.00 0.00 177.57 178.01 2raj n LYS 518 N -4.34 0.12 -0.00 1.57 5.02 -0.29 -0.58 118.16 119.67 2raj n LYS 518 Ca 0.06 0.10 0.02 0.00 -2.02 0.00 0.00 58.31 56.46 2raj n LYS 518 Cb 0.14 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 2raj n LYS 518 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2raj n GLU 519 N -1.12 -0.40 -0.18 1.97 1.02 -0.40 -4.67 120.64 116.86 2raj n GLU 519 Ca 0.03 -0.73 0.00 0.00 -0.02 0.00 0.00 57.16 56.45 2raj n GLU 519 Cb 0.03 -1.06 0.26 0.00 -0.02 0.00 0.00 31.44 30.65 2raj n GLU 519 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2raj h SER 520 N 0.59 0.81 -0.01 1.62 4.64 -0.72 -1.45 113.55 119.02 2raj h SER 520 Ca 0.00 -0.04 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2raj h SER 520 Cb 0.15 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2raj h SER 520 CO 0.00 0.61 0.01 0.44 -0.87 0.00 0.00 176.83 177.02 2raj h ASP 521 N 0.94 0.02 -0.83 4.97 3.32 -1.83 0.17 116.42 123.17 2raj h ASP 521 Ca 0.25 -0.14 0.07 0.00 0.02 0.00 0.00 57.03 57.23 2raj h ASP 521 Cb -0.06 -0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.42 2raj h ASP 521 CO -0.05 0.15 0.50 0.50 -1.72 0.00 0.00 179.24 178.63 2raj h LYS 522 N -0.12 0.86 -0.61 3.56 3.64 -1.80 0.45 116.57 122.54 2raj h LYS 522 Ca 0.00 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 2raj h LYS 522 Cb 0.14 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2raj h LYS 522 CO -0.00 0.57 0.23 -0.07 -2.27 0.00 0.00 179.45 177.91 2raj h LEU 523 N 0.88 0.83 -0.32 5.20 3.38 -0.86 0.21 115.31 124.63 2raj h LEU 523 Ca 0.38 -0.12 -0.20 0.00 0.09 0.00 0.00 57.88 58.04 2raj h LEU 523 Cb 0.25 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2raj h LEU 523 CO -0.20 0.75 -0.70 0.58 0.09 0.00 0.00 178.44 178.96 2raj h VAL 524 N 0.89 1.32 -0.25 1.22 2.07 -0.06 0.48 116.25 121.92 2raj h VAL 524 Ca 0.21 -1.98 -0.03 0.00 0.82 0.00 0.00 66.70 65.72 2raj h VAL 524 Cb 0.20 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 2raj h VAL 524 CO -0.02 0.62 0.05 0.00 0.02 0.00 0.00 177.57 178.24 2raj h ALA 525 N 0.77 0.33 -0.19 1.67 0.00 -0.55 -2.43 119.26 118.86 2raj h ALA 525 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2raj h ALA 525 Cb 1.30 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2raj h ALA 525 CO 0.14 -0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.63 2raj n THR 526 N -4.70 0.62 -1.28 0.00 -2.24 0.03 -4.88 114.28 101.82 2raj n THR 526 Ca -0.03 -0.36 -0.12 0.00 -2.27 0.00 0.00 64.05 61.27 2raj n THR 526 Cb 0.19 -0.22 -0.05 0.00 -2.10 0.00 0.00 70.33 68.15 2raj n THR 526 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2raj n SER 527 N 0.16 -4.51 0.26 3.42 7.64 -0.92 -4.82 113.62 114.86 2raj n SER 527 Ca 0.08 0.29 0.12 0.00 1.01 0.00 0.00 58.87 60.37 2raj n SER 527 Cb 0.40 -3.65 0.68 0.00 -1.01 0.00 0.00 64.21 60.63 2raj n SER 527 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2raj h LYS 528 N 0.00 0.00 -3.86 1.43 1.63 -0.31 -3.44 116.57 112.02 2raj h LYS 528 Ca -0.24 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.46 2raj h LYS 528 Cb 1.00 0.00 -0.13 0.00 -0.60 0.00 0.00 32.23 32.50 2raj h LYS 528 CO 0.35 0.14 -0.33 0.96 -3.45 0.00 0.00 179.45 177.12 2raj s ILE 529 N -4.11 0.08 0.65 2.00 -4.36 -1.01 -5.01 121.20 109.44 2raj s ILE 529 Ca -0.02 -1.32 -0.02 0.00 -0.26 0.00 0.00 60.65 59.02 2raj s ILE 529 Cb 0.13 -1.71 0.07 0.00 1.25 0.00 0.00 42.46 42.20 2raj s ILE 529 CO 0.60 -0.38 0.92 0.42 0.24 0.00 0.00 174.94 176.74 2raj s THR 530 N -3.94 2.39 0.34 8.37 -4.23 -1.26 -4.22 115.64 113.09 2raj s THR 530 Ca 0.14 -0.51 0.10 0.00 -1.18 0.00 0.00 61.69 60.23 2raj s THR 530 Cb 0.04 -2.88 0.07 0.00 1.34 0.00 0.00 72.50 71.07 2raj s THR 530 CO -0.03 0.00 1.77 0.25 -0.54 0.00 0.00 174.62 176.08 2raj h LEU 531 N -0.33 0.13 -0.02 4.79 5.85 -1.99 -2.45 115.31 121.29 2raj h LEU 531 Ca -0.41 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 2raj h LEU 531 Cb 1.29 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.28 2raj h LEU 531 CO 0.51 0.50 0.00 -0.61 -0.34 0.00 0.00 178.44 178.50 2raj h GLN 532 N 0.11 0.04 -1.01 1.25 5.75 -2.00 -2.68 115.11 116.58 2raj h GLN 532 Ca 0.01 -0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.61 2raj h GLN 532 Cb 0.71 -0.00 -0.08 0.00 1.07 0.00 0.00 27.48 29.18 2raj h GLN 532 CO 0.05 0.29 0.64 -0.44 -2.65 0.00 0.00 178.83 176.72 2raj h ASP 533 N -0.22 0.97 -0.62 -0.69 3.32 -1.89 -0.20 116.42 117.09 2raj h ASP 533 Ca 0.01 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 2raj h ASP 533 Cb 0.27 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 2raj h ASP 533 CO 0.00 0.54 0.29 0.50 -1.72 0.00 0.00 179.24 178.85 2raj h LYS 534 N 1.05 0.89 -0.42 3.56 3.64 -1.30 -1.77 116.57 122.23 2raj h LYS 534 Ca 0.48 -0.14 -0.12 0.00 -1.27 0.00 0.00 60.65 59.61 2raj h LYS 534 Cb 0.40 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 2raj h LYS 534 CO -0.24 0.73 -0.22 1.96 -2.27 0.00 0.00 179.45 179.41 2raj h GLN 535 N 0.85 0.84 -1.00 1.90 4.20 -0.94 -1.66 115.11 119.29 2raj h GLN 535 Ca 0.21 -0.34 0.01 0.00 0.06 0.00 0.00 58.65 58.59 2raj h GLN 535 Cb 0.13 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 2raj h GLN 535 CO -0.02 0.97 0.66 -0.91 -0.67 0.00 0.00 178.83 178.86 2raj h ASN 536 N 0.73 1.14 0.05 1.46 2.35 -0.77 0.32 115.58 120.86 2raj h ASN 536 Ca 0.10 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2raj h ASN 536 Cb 0.74 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.83 2raj h ASN 536 CO 0.06 0.82 -0.02 0.24 -1.65 0.00 0.00 177.43 176.88 2raj h MET 537 N 1.35 -0.06 -0.72 0.81 2.86 -0.96 0.13 114.93 118.33 2raj h MET 537 Ca 0.37 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 58.03 2raj h MET 537 Cb -0.14 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.49 2raj h MET 537 CO -0.08 -0.02 0.48 0.28 1.06 0.00 0.00 176.91 178.63 2raj h VAL 538 N -0.09 1.14 -0.16 -2.22 2.07 -0.39 0.06 116.25 116.66 2raj h VAL 538 Ca -0.01 -0.32 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 2raj h VAL 538 Cb 0.07 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 2raj h VAL 538 CO 0.01 0.17 -0.34 0.11 0.02 0.00 0.00 177.57 177.54 2raj h LYS 539 N 0.92 0.52 -0.49 1.57 1.57 0.04 -2.88 116.57 117.82 2raj h LYS 539 Ca 0.28 -0.34 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 2raj h LYS 539 Cb -0.02 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2raj h LYS 539 CO -0.07 0.95 -0.20 0.00 -0.57 0.00 0.00 179.45 179.55 2raj h ARG 540 N 0.15 1.00 0.00 3.15 3.08 -0.36 -2.65 114.38 118.76 2raj h ARG 540 Ca 0.00 -0.42 -0.06 0.00 0.07 0.00 0.00 59.98 59.57 2raj h ARG 540 Cb 0.94 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 2raj h ARG 540 CO 0.07 1.10 -0.31 -0.24 -1.07 0.00 0.00 179.97 179.53 2raj h VAL 541 N 0.86 1.15 -0.52 2.04 3.04 -1.07 -1.72 116.25 120.03 2raj h VAL 541 Ca 0.11 -1.07 -0.05 0.00 -1.01 0.00 0.00 66.70 64.69 2raj h VAL 541 Cb 0.79 1.59 -0.02 0.00 -2.01 0.00 0.00 31.29 31.63 2raj h VAL 541 CO 0.07 0.30 0.15 -1.28 -1.01 0.00 0.00 177.57 175.79 2raj h SER 542 N 0.00 0.76 -0.88 3.17 0.87 -1.26 -2.18 113.55 114.04 2raj h SER 542 Ca -0.00 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.32 2raj h SER 542 Cb 0.57 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 2raj h SER 542 CO 0.04 0.78 0.49 0.40 -0.53 0.00 0.00 176.83 178.01 2raj h ILE 543 N 0.71 1.25 -0.82 2.23 2.04 -0.99 -1.75 117.51 120.18 2raj h ILE 543 Ca 0.16 -0.62 0.05 0.00 1.00 0.00 0.00 64.86 65.45 2raj h ILE 543 Cb 0.30 0.06 -0.06 0.00 -0.74 0.00 0.00 36.82 36.39 2raj h ILE 543 CO -0.00 0.28 0.51 0.24 0.00 0.00 0.00 178.15 179.19 2raj h MET 544 N 1.23 0.94 -0.67 2.37 2.86 -1.02 -1.25 114.93 119.39 2raj h MET 544 Ca 0.31 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2raj h MET 544 Cb 0.02 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.44 2raj h MET 544 CO -0.05 0.62 0.42 1.03 1.06 0.00 0.00 176.91 179.99 2raj h SER 545 N 0.97 0.78 -0.88 1.22 0.87 -0.73 -0.67 113.55 115.12 2raj h SER 545 Ca 0.35 -0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.84 2raj h SER 545 Cb 0.10 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 61.82 2raj h SER 545 CO -0.15 0.59 0.47 1.88 -0.53 0.00 0.00 176.83 179.10 2raj h TYR 546 N 0.90 1.22 -0.55 2.24 -1.99 -0.52 -1.10 116.97 117.18 2raj h TYR 546 Ca 0.24 -0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.82 2raj h TYR 546 Cb -0.06 -0.39 -0.02 0.00 2.00 0.00 0.00 36.73 38.26 2raj h TYR 546 CO -0.02 0.85 -0.11 0.00 -0.00 0.00 0.00 178.16 178.88 2raj h ALA 547 N 1.26 0.76 -0.37 3.88 0.00 -0.65 -0.63 119.26 123.51 2raj h ALA 547 Ca 0.31 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2raj h ALA 547 Cb 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2raj h ALA 547 CO -0.05 0.68 0.17 1.25 0.00 0.00 0.00 179.25 181.29 2raj h LEU 548 N 0.92 0.49 -1.10 0.00 5.85 -0.79 -0.72 115.31 119.96 2raj h LEU 548 Ca 0.14 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 2raj h LEU 548 Cb 0.68 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2raj h LEU 548 CO 0.05 0.49 -0.24 1.56 -0.34 0.00 0.00 178.44 179.96 2raj h GLN 549 N 0.45 0.34 -0.21 1.25 4.20 -1.04 0.13 115.11 120.23 2raj h GLN 549 Ca 0.12 -0.12 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 2raj h GLN 549 Cb 0.14 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2raj h GLN 549 CO -0.01 0.57 -0.64 0.00 -0.67 0.00 0.00 178.83 178.07 2raj h ALA 550 N 1.44 0.47 -0.49 3.87 0.00 -0.75 -1.55 119.26 122.25 2raj h ALA 550 Ca 0.05 -0.55 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 2raj h ALA 550 Cb 0.60 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2raj h ALA 550 CO 0.04 0.69 -0.19 1.49 0.00 0.00 0.00 179.25 181.28 2raj h GLU 551 N 0.55 0.99 0.00 0.00 4.57 -0.85 -1.95 114.58 117.89 2raj h GLU 551 Ca -0.01 -0.41 -0.04 0.00 -1.18 0.00 0.00 59.36 57.71 2raj h GLU 551 Cb 1.24 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 2raj h GLU 551 CO 0.13 1.09 -0.20 1.98 -1.18 0.00 0.00 179.01 180.83 2raj h MET 552 N 0.86 0.00 -0.08 1.92 4.05 -0.90 -0.14 114.93 120.65 2raj h MET 552 Ca 0.12 0.00 -0.24 0.00 -0.28 0.00 0.00 59.70 59.30 2raj h MET 552 Cb 0.77 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 31.58 2raj h MET 552 CO 0.06 0.20 -0.89 -0.97 0.23 0.00 0.00 176.91 175.55 2raj h ASN 553 N 0.00 0.91 -0.80 1.39 -1.24 -0.84 -1.51 115.58 113.50 2raj h ASN 553 Ca -0.00 -0.68 -0.04 0.00 0.71 0.00 0.00 56.30 56.28 2raj h ASN 553 Cb 0.42 -0.27 -0.04 0.00 0.73 0.00 0.00 38.32 39.15 2raj h ASN 553 CO 0.03 1.47 0.35 -0.74 -1.29 0.00 0.00 177.43 177.24 2raj h HIS 554 N 0.44 1.19 0.33 0.67 2.76 -0.64 -1.84 115.15 118.07 2raj h HIS 554 Ca -0.09 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 57.99 2raj h HIS 554 Cb 1.54 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 30.14 2raj h HIS 554 CO 0.10 0.89 -0.16 0.35 -1.30 0.00 0.00 177.93 177.80 2raj h PHE 555 N 1.15 -0.41 -0.47 5.26 3.57 -1.02 -2.60 116.94 122.42 2raj h PHE 555 Ca 0.27 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.78 2raj h PHE 555 Cb 0.18 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 2raj h PHE 555 CO 0.02 -0.13 0.28 0.45 -2.23 0.00 0.00 178.31 176.70 2raj h HIS 556 N -0.66 0.53 -0.19 0.41 3.86 -1.22 0.15 115.15 118.03 2raj h HIS 556 Ca -0.05 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.23 2raj h HIS 556 Cb 0.47 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.70 2raj h HIS 556 CO -0.00 0.31 -0.26 1.03 0.86 0.00 0.00 177.93 179.87 2raj h SER 557 N 0.56 -0.81 0.35 2.45 0.87 -1.37 -0.89 113.55 114.72 2raj h SER 557 Ca 0.19 0.13 -0.12 0.00 -1.23 0.00 0.00 61.79 60.77 2raj h SER 557 Cb 0.01 0.37 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 2raj h SER 557 CO -0.08 -0.30 -0.49 0.78 -0.53 0.00 0.00 176.83 176.21 2raj h ASN 558 N -0.29 0.17 -0.27 6.23 2.35 -1.19 -2.78 115.58 119.81 2raj h ASN 558 Ca 0.12 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2raj h ASN 558 Cb 0.47 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2raj h ASN 558 CO -0.36 0.63 0.11 -0.09 -1.65 0.00 0.00 177.43 176.08 2raj h ARG 559 N 0.13 0.39 -0.04 0.81 2.43 -0.20 0.34 114.38 118.25 2raj h ARG 559 Ca 0.00 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2raj h ARG 559 Cb 0.91 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2raj h ARG 559 CO 0.07 0.41 0.02 0.82 -1.51 0.00 0.00 179.97 179.79 2raj h ILE 560 N 0.29 1.07 -0.43 1.20 2.04 -1.14 -0.56 117.51 119.98 2raj h ILE 560 Ca 0.09 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2raj h ILE 560 Cb 0.16 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2raj h ILE 560 CO -0.01 0.06 0.21 0.22 0.00 0.00 0.00 178.15 178.63 2raj h TYR 561 N -0.02 0.62 -0.63 1.37 3.20 -1.32 -1.82 116.97 118.37 2raj h TYR 561 Ca 0.01 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.79 2raj h TYR 561 Cb 0.08 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 2raj h TYR 561 CO -0.05 0.50 0.14 -0.44 -1.64 0.00 0.00 178.16 176.68 2raj h ASP 562 N 0.55 0.97 0.69 -2.11 3.45 -0.13 -1.91 116.42 117.94 2raj h ASP 562 Ca 0.15 -0.24 -0.18 0.00 0.43 0.00 0.00 57.03 57.18 2raj h ASP 562 Cb 0.11 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 2raj h ASP 562 CO -0.02 0.96 -0.84 1.88 -1.57 0.00 0.00 179.24 179.65 2raj h TYR 563 N 0.94 0.15 -0.39 4.55 -1.99 -1.06 -1.72 116.97 117.46 2raj h TYR 563 Ca 0.20 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.79 2raj h TYR 563 Cb 0.38 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.07 2raj h TYR 563 CO 0.03 0.89 0.04 -0.97 -0.00 0.00 0.00 178.16 178.15 2raj h ASN 564 N 0.06 0.64 -0.04 3.88 -1.24 -1.24 -1.78 115.58 115.86 2raj h ASN 564 Ca -0.03 -0.28 -0.01 0.00 0.71 0.00 0.00 56.30 56.70 2raj h ASN 564 Cb 1.46 -0.17 -0.00 0.00 0.73 0.00 0.00 38.32 40.34 2raj h ASN 564 CO 0.12 0.76 -0.01 0.28 -1.29 0.00 0.00 177.43 177.29 2raj h SER 565 N 0.49 0.07 0.29 1.15 0.02 -1.29 -2.00 113.55 112.28 2raj h SER 565 Ca 0.11 -0.35 -0.10 0.00 -0.84 0.00 0.00 61.79 60.62 2raj h SER 565 Cb 0.41 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 2raj h SER 565 CO 0.01 0.40 -0.40 1.62 -1.14 0.00 0.00 176.83 177.32 2raj h VAL 566 N -0.27 1.30 0.02 2.27 3.04 -1.34 -0.14 116.25 121.12 2raj h VAL 566 Ca 0.01 -1.45 -0.24 0.00 -1.01 0.00 0.00 66.70 64.01 2raj h VAL 566 Cb 0.37 1.69 0.01 0.00 -2.01 0.00 0.00 31.29 31.35 2raj h VAL 566 CO 0.00 0.42 -1.00 0.40 -1.01 0.00 0.00 177.57 176.39 2raj h ILE 567 N 0.12 1.38 -0.27 3.17 2.04 -1.34 -0.90 117.51 121.72 2raj h ILE 567 Ca 0.01 -2.46 -0.01 0.00 1.00 0.00 0.00 64.86 63.40 2raj h ILE 567 Cb 0.76 2.47 -0.01 0.00 -0.74 0.00 0.00 36.82 39.30 2raj h ILE 567 CO 0.06 0.74 0.12 0.03 0.00 0.00 0.00 178.15 179.09 2raj h ARG 568 N 0.25 0.39 -0.21 2.37 3.08 -1.14 -0.72 114.38 118.40 2raj h ARG 568 Ca -0.10 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 59.93 2raj h ARG 568 Cb 1.65 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 31.59 2raj h ARG 568 CO 0.18 0.40 -0.06 1.25 -1.07 0.00 0.00 179.97 180.68 2raj h LEU 569 N 0.29 -0.21 -0.23 3.04 5.85 -0.99 -0.38 115.31 122.68 2raj h LEU 569 Ca 0.09 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.89 2raj h LEU 569 Cb 0.15 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 2raj h LEU 569 CO -0.01 -0.07 0.11 0.22 -0.34 0.00 0.00 178.44 178.34 2raj h TYR 570 N -0.00 0.20 -0.22 1.25 3.20 -0.96 -1.73 116.97 118.69 2raj h TYR 570 Ca 0.10 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2raj h TYR 570 Cb 0.16 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2raj h TYR 570 CO -0.23 0.11 0.14 -0.07 -1.64 0.00 0.00 178.16 176.47 2raj h LEU 571 N 0.23 0.26 -0.59 2.82 3.38 -0.83 -1.72 115.31 118.87 2raj h LEU 571 Ca 0.10 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.10 2raj h LEU 571 Cb 0.03 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 2raj h LEU 571 CO -0.07 0.22 0.26 -0.33 0.09 0.00 0.00 178.44 178.61 2raj h GLU 572 N 0.28 0.47 -0.54 1.13 5.08 -0.89 -0.49 114.58 119.64 2raj h GLU 572 Ca 0.08 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2raj h GLU 572 Cb 0.00 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2raj h GLU 572 CO -0.02 0.31 0.04 1.96 -1.00 0.00 0.00 179.01 180.31 2raj h GLN 573 N 0.49 0.92 -0.53 2.33 1.08 -1.16 -2.09 115.11 116.14 2raj h GLN 573 Ca 0.28 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 2raj h GLN 573 Cb 0.27 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.58 2raj h GLN 573 CO -0.24 0.91 0.31 1.96 -0.95 0.00 0.00 178.83 180.83 2raj h GLN 574 N 0.80 0.73 -0.47 1.46 1.08 -0.74 0.78 115.11 118.75 2raj h GLN 574 Ca 0.16 -0.07 0.03 0.00 -1.45 0.00 0.00 58.65 57.32 2raj h GLN 574 Cb 0.47 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.71 2raj h GLN 574 CO 0.02 0.54 0.26 0.28 -0.95 0.00 0.00 178.83 178.98 2raj h VAL 575 N 0.71 1.00 -0.80 -0.54 2.07 -0.98 -0.99 116.25 116.73 2raj h VAL 575 Ca 0.19 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 2raj h VAL 575 Cb 0.01 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 2raj h VAL 575 CO -0.03 0.09 0.37 -0.61 0.02 0.00 0.00 177.57 177.41 2raj h GLN 576 N 0.51 1.15 0.24 1.57 4.15 -0.90 -1.66 115.11 120.18 2raj h GLN 576 Ca 0.20 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 2raj h GLN 576 Cb 0.07 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 2raj h GLN 576 CO -0.12 0.90 -0.17 0.35 -1.93 0.00 0.00 178.83 177.86 2raj h PHE 577 N 1.13 -0.45 -0.21 3.99 3.57 -0.05 -0.98 116.94 123.94 2raj h PHE 577 Ca 0.27 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.68 2raj h PHE 577 Cb 0.13 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2raj h PHE 577 CO 0.01 -0.27 -0.24 1.88 -2.23 0.00 0.00 178.31 177.46 2raj h TYR 578 N -0.42 0.44 -0.46 0.41 -1.99 -1.09 -1.51 116.97 112.35 2raj h TYR 578 Ca -0.02 -0.09 -0.10 0.00 2.00 0.00 0.00 58.73 60.53 2raj h TYR 578 Cb 0.36 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 38.96 2raj h TYR 578 CO -0.11 0.61 -0.11 0.93 -0.00 0.00 0.00 178.16 179.49 2raj h GLU 579 N 0.35 0.83 -0.49 4.88 5.08 -1.15 -0.85 114.58 123.23 2raj h GLU 579 Ca 0.05 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 2raj h GLU 579 Cb 0.62 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2raj h GLU 579 CO 0.04 0.90 0.11 1.15 -1.00 0.00 0.00 179.01 180.21 2raj h THR 580 N 0.75 1.24 -0.53 1.13 2.02 -0.81 0.26 112.91 116.98 2raj h THR 580 Ca 0.12 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 2raj h THR 580 Cb 0.61 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2raj h THR 580 CO 0.04 0.31 0.30 0.40 0.37 0.00 0.00 175.52 176.95 2raj h ILE 581 N 0.68 1.17 -0.82 3.11 2.04 -0.99 -1.47 117.51 121.23 2raj h ILE 581 Ca 0.15 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 2raj h ILE 581 Cb 0.35 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2raj h ILE 581 CO 0.00 0.18 0.41 0.00 0.00 0.00 0.00 178.15 178.75 2raj h ALA 582 N 1.14 1.18 -0.48 1.87 0.00 -0.83 -1.35 119.26 120.79 2raj h ALA 582 Ca 0.19 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2raj h ALA 582 Cb 0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2raj h ALA 582 CO -0.03 0.64 -0.18 1.49 0.00 0.00 0.00 179.25 181.17 2raj h GLU 583 N 1.16 0.95 -0.55 0.00 4.57 -0.58 0.70 114.58 120.84 2raj h GLU 583 Ca 0.28 -0.38 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 2raj h GLU 583 Cb 0.09 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 2raj h GLU 583 CO -0.04 1.04 0.01 0.87 -1.18 0.00 0.00 179.01 179.71 2raj h LYS 584 N 0.83 0.94 -0.32 1.92 1.57 -0.92 -1.15 116.57 119.44 2raj h LYS 584 Ca 0.12 -0.27 -0.15 0.00 -1.87 0.00 0.00 60.65 58.48 2raj h LYS 584 Cb 0.73 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 2raj h LYS 584 CO 0.06 0.93 -0.39 -0.07 -0.57 0.00 0.00 179.45 179.40 2raj h LEU 585 N 0.87 0.81 -1.26 2.94 3.38 -0.99 -2.36 115.31 118.69 2raj h LEU 585 Ca 0.16 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 2raj h LEU 585 Cb 0.50 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2raj h LEU 585 CO 0.02 1.11 0.04 -0.09 0.09 0.00 0.00 178.44 179.62 2raj h ARG 586 N 0.63 0.55 -0.36 1.13 2.43 -0.50 -1.47 114.38 116.78 2raj h ARG 586 Ca 0.05 -0.10 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 2raj h ARG 586 Cb 0.95 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.41 2raj h ARG 586 CO 0.09 0.54 -0.43 1.96 -1.51 0.00 0.00 179.97 180.62 2raj h GLN 587 N 0.53 0.92 -0.20 0.20 4.20 -0.97 -1.97 115.11 117.81 2raj h GLN 587 Ca 0.12 -0.51 -0.09 0.00 0.06 0.00 0.00 58.65 58.23 2raj h GLN 587 Cb 0.28 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2raj h GLN 587 CO 0.00 1.16 -0.25 0.00 -0.67 0.00 0.00 178.83 179.07 2raj h ALA 588 N 0.74 1.19 -0.14 3.87 0.00 -1.13 -3.10 119.26 120.69 2raj h ALA 588 Ca 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2raj h ALA 588 Cb 1.03 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2raj h ALA 588 CO 0.10 0.52 0.01 1.25 0.00 0.00 0.00 179.25 181.13 2raj h LEU 589 N 0.34 0.24 -0.60 0.00 5.85 -1.01 -2.92 115.31 117.21 2raj h LEU 589 Ca 0.05 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.48 2raj h LEU 589 Cb 0.63 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.60 2raj h LEU 589 CO 0.05 0.47 0.10 -1.54 -0.34 0.00 0.00 178.44 177.18 2raj n SER 590 N -4.78 0.23 -0.24 1.25 3.41 -0.77 -0.77 113.62 111.95 2raj n SER 590 Ca -0.05 0.55 0.13 0.00 -0.26 0.00 0.00 58.87 59.23 2raj n SER 590 Cb 0.20 -0.56 0.30 0.00 -0.26 0.00 0.00 64.21 63.89 2raj n SER 590 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2raj n ARG 591 N -1.79 0.76 -3.21 4.33 1.74 -1.10 -4.87 116.66 112.51 2raj n ARG 591 Ca -0.01 -0.48 -0.39 0.00 -0.77 0.00 0.00 57.85 56.21 2raj n ARG 591 Cb 0.12 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.01 2raj n ARG 591 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2raj s PHE 592 N -2.57 3.56 0.48 -1.55 0.40 0.05 -4.62 117.98 113.71 2raj s PHE 592 Ca 0.22 1.06 -0.23 0.00 -0.60 0.00 0.00 56.93 57.37 2raj s PHE 592 Cb 0.19 -2.65 -0.07 0.00 0.51 0.00 0.00 43.02 41.00 2raj s PHE 592 CO 0.56 0.16 1.22 -1.25 0.70 0.00 0.00 175.22 176.61 2raj s PRO 593 N 0.58 3.63 -0.64 0.24 0.04 -1.26 -4.91 135.00 132.67 2raj s PRO 593 Ca 0.31 1.92 -0.26 0.00 0.04 0.00 0.00 61.00 63.00 2raj s PRO 593 Cb -0.16 -2.40 0.04 0.00 0.04 0.00 0.00 34.50 32.01 2raj s PRO 593 CO 0.14 -0.70 1.13 0.08 0.04 0.00 0.00 177.00 177.69 2raj s VAL 594 N -1.46 4.04 0.00 -0.36 1.01 -1.26 -5.08 120.40 117.30 2raj s VAL 594 Ca 0.65 0.38 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2raj s VAL 594 Cb -0.32 -4.75 0.00 0.00 0.00 0.00 0.00 36.38 31.31 2raj s VAL 594 CO 0.39 -1.50 0.00 0.23 0.00 0.00 0.00 175.10 174.22