#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oz3 s SER 207 N 0.00 0.38 0.15 -0.67 1.04 -1.26 -5.03 113.70 108.31 1oz3 s SER 207 Ca 0.00 -0.04 -0.17 0.00 0.48 0.00 0.00 55.95 56.22 1oz3 s SER 207 Cb 0.00 -0.15 0.06 0.00 0.10 0.00 0.00 66.02 66.02 1oz3 s SER 207 CO 0.00 -0.05 1.70 -0.50 0.98 0.00 0.00 173.24 175.37 1oz3 h TRP 208 N 6.83 -0.03 -0.40 5.02 4.06 -2.03 -1.76 115.95 127.64 1oz3 h TRP 208 Ca -0.37 0.02 0.08 0.00 2.06 0.00 0.00 58.89 60.68 1oz3 h TRP 208 Cb 1.16 0.06 -0.09 0.00 -1.00 0.00 0.00 29.16 29.29 1oz3 h TRP 208 CO 0.47 -0.07 -0.37 1.05 -3.56 0.00 0.00 178.44 175.97 1oz3 h GLU 209 N 0.08 -0.28 -0.18 0.49 4.11 -2.00 0.62 114.58 117.43 1oz3 h GLU 209 Ca 0.16 0.02 -0.13 0.00 0.07 0.00 0.00 59.36 59.47 1oz3 h GLU 209 Cb 0.22 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1oz3 h GLU 209 CO -0.27 -0.18 -0.46 0.77 0.07 0.00 0.00 179.01 178.93 1oz3 h SER 210 N -0.29 0.48 -0.30 3.06 0.02 -1.95 -2.80 113.55 111.76 1oz3 h SER 210 Ca 0.16 -0.23 0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1oz3 h SER 210 Cb 0.56 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1oz3 h SER 210 CO -0.55 0.87 0.15 0.22 -1.14 0.00 0.00 176.83 176.38 1oz3 h TYR 211 N 0.36 0.28 -0.67 3.45 3.20 -0.43 -1.97 116.97 121.20 1oz3 h TYR 211 Ca 0.02 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1oz3 h TYR 211 Cb 0.95 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.10 1oz3 h TYR 211 CO 0.03 0.16 0.35 -0.07 -1.64 0.00 0.00 178.16 176.99 1oz3 h LEU 212 N 0.32 0.85 -0.13 2.82 3.38 -0.80 -1.19 115.31 120.55 1oz3 h LEU 212 Ca 0.12 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1oz3 h LEU 212 Cb 0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1oz3 h LEU 212 CO -0.08 0.72 0.01 -0.33 0.09 0.00 0.00 178.44 178.85 1oz3 h GLU 213 N 0.92 0.06 -0.07 1.13 5.08 -1.39 0.70 114.58 121.00 1oz3 h GLU 213 Ca 0.23 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.49 1oz3 h GLU 213 Cb 0.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1oz3 h GLU 213 CO -0.03 0.04 -0.41 1.05 -1.00 0.00 0.00 179.01 178.66 1oz3 h GLU 214 N 0.07 0.16 0.00 2.33 4.11 -1.20 -2.98 114.58 117.06 1oz3 h GLU 214 Ca 0.06 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1oz3 h GLU 214 Cb 0.06 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1oz3 h GLU 214 CO -0.09 0.54 -0.78 1.04 0.07 0.00 0.00 179.01 179.80 1oz3 n GLN 215 N -4.03 0.24 -3.62 1.06 1.13 -0.46 -4.98 117.38 106.71 1oz3 n GLN 215 Ca -0.02 0.03 -0.25 0.00 -1.94 0.00 0.00 57.00 54.82 1oz3 n GLN 215 Cb 0.46 -1.62 0.04 0.00 0.11 0.00 0.00 30.24 29.24 1oz3 n GLN 215 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1oz3 n LYS 216 N -1.94 -2.50 -4.27 -1.09 5.02 0.19 -5.01 118.16 108.56 1oz3 n LYS 216 Ca 0.03 0.57 -0.15 0.00 -2.02 0.00 0.00 58.31 56.75 1oz3 n LYS 216 Cb 0.42 -4.75 -0.10 0.00 -0.02 0.00 0.00 35.03 30.58 1oz3 n LYS 216 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1oz3 s ALA 217 N -3.54 1.49 0.18 7.82 0.00 -0.89 -5.06 121.76 121.77 1oz3 s ALA 217 Ca 0.32 -1.64 0.11 0.00 0.00 0.00 0.00 51.96 50.75 1oz3 s ALA 217 Cb -0.09 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 1oz3 s ALA 217 CO 0.83 -0.29 -0.23 0.96 0.00 0.00 0.00 175.76 177.02 1oz3 s ILE 218 N -3.58 2.23 0.20 0.00 -4.36 -1.26 -4.72 121.20 109.71 1oz3 s ILE 218 Ca 0.25 -1.98 -0.13 0.00 -0.26 0.00 0.00 60.65 58.53 1oz3 s ILE 218 Cb 0.06 -2.05 -0.07 0.00 1.25 0.00 0.00 42.46 41.65 1oz3 s ILE 218 CO 0.05 -0.14 0.58 0.42 0.24 0.00 0.00 174.94 176.09 1oz3 s THR 219 N -1.70 4.85 -0.17 8.37 -4.23 -1.26 -1.79 115.64 119.71 1oz3 s THR 219 Ca 0.19 0.74 -0.32 0.00 -1.18 0.00 0.00 61.69 61.12 1oz3 s THR 219 Cb -0.08 -3.68 -0.09 0.00 1.34 0.00 0.00 72.50 69.99 1oz3 s THR 219 CO 0.09 0.07 2.07 0.00 -0.54 0.00 0.00 174.62 176.31 1oz3 n ALA 220 N 0.31 1.28 -1.31 3.99 0.00 0.10 -4.75 120.51 120.13 1oz3 n ALA 220 Ca -0.02 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.11 1oz3 n ALA 220 Cb 0.52 -2.66 0.10 0.00 0.00 0.00 0.00 19.45 17.40 1oz3 n ALA 220 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1oz3 n PRO 221 N 7.74 0.46 -0.22 0.00 -0.02 -1.26 -4.63 135.00 137.06 1oz3 n PRO 221 Ca 0.29 0.22 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 1oz3 n PRO 221 Cb 0.34 -2.28 0.35 0.00 -0.02 0.00 0.00 33.50 31.89 1oz3 n PRO 221 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1oz3 h VAL 222 N -0.37 0.96 0.00 -1.45 2.07 -1.97 -0.98 116.25 114.51 1oz3 h VAL 222 Ca -0.47 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 1oz3 h VAL 222 Cb 1.32 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1oz3 h VAL 222 CO 0.47 0.14 -0.02 0.77 0.02 0.00 0.00 177.57 178.95 1oz3 h SER 223 N 0.76 0.00 1.14 0.57 4.64 -1.99 -1.46 113.55 117.21 1oz3 h SER 223 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1oz3 h SER 223 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1oz3 h SER 223 CO -0.14 0.02 0.00 -0.07 -0.87 0.00 0.00 176.83 175.77 1oz3 h LEU 224 N 0.00 0.00-10.08 5.97 3.38 -1.52 -3.45 115.31 109.60 1oz3 h LEU 224 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1oz3 h LEU 224 Cb 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1oz3 h LEU 224 CO 0.00 0.00 -0.40 -0.36 0.09 0.00 0.00 178.44 177.77 1oz3 s PHE 225 N -3.48 3.48 0.63 1.13 0.40 -0.55 -4.84 117.98 114.75 1oz3 s PHE 225 Ca 0.03 0.19 -0.18 0.00 -0.60 0.00 0.00 56.93 56.37 1oz3 s PHE 225 Cb 0.09 -1.73 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 1oz3 s PHE 225 CO 0.53 0.44 1.27 -0.65 0.70 0.00 0.00 175.22 177.51 1oz3 s GLN 226 N -3.41 2.67 0.28 0.44 -1.52 -1.26 -4.89 119.66 111.97 1oz3 s GLN 226 Ca 0.36 1.99 -0.01 0.00 -1.95 0.00 0.00 55.36 55.75 1oz3 s GLN 226 Cb -0.11 -1.87 0.45 0.00 -0.22 0.00 0.00 33.01 31.26 1oz3 s GLN 226 CO 0.29 -1.49 1.90 -0.44 -0.25 0.00 0.00 175.29 175.30 1oz3 h ASP 227 N 0.63 1.00 -0.17 5.90 3.45 -1.97 -1.20 116.42 124.05 1oz3 h ASP 227 Ca -0.51 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 56.92 1oz3 h ASP 227 Cb 1.33 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 39.87 1oz3 h ASP 227 CO 0.54 0.65 0.01 0.77 -1.57 0.00 0.00 179.24 179.63 1oz3 h SER 228 N 1.13 0.39 1.21 6.45 4.64 -1.97 -0.47 113.55 124.94 1oz3 h SER 228 Ca 0.41 -0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.58 1oz3 h SER 228 Cb 0.15 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1oz3 h SER 228 CO -0.15 0.45 -0.44 1.56 -0.87 0.00 0.00 176.83 177.37 1oz3 h GLN 229 N 0.41 0.00 0.00 4.77 4.20 -1.58 -3.36 115.11 119.55 1oz3 h GLN 229 Ca 0.09 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.70 1oz3 h GLN 229 Cb 0.26 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1oz3 h GLN 229 CO 0.01 0.44 -1.74 0.00 -0.67 0.00 0.00 178.83 176.86 1oz3 n ALA 230 N -2.25 2.34 -2.03 3.87 0.00 -0.77 -4.48 120.51 117.19 1oz3 n ALA 230 Ca 0.01 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.42 1oz3 n ALA 230 Cb 0.63 -0.77 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 1oz3 n ALA 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1oz3 s VAL 231 N -3.18 3.34 -0.16 0.00 0.11 -0.24 -4.87 120.40 115.40 1oz3 s VAL 231 Ca -0.06 0.71 0.06 0.00 -2.93 0.00 0.00 61.98 59.76 1oz3 s VAL 231 Cb 0.11 -3.45 -0.08 0.00 -1.53 0.00 0.00 36.38 31.43 1oz3 s VAL 231 CO 0.85 -0.01 0.20 0.35 -3.33 0.00 0.00 175.10 173.16 1oz3 n THR 232 N 4.86 0.00 1.40 5.04 -2.24 -1.26 -4.75 114.28 117.33 1oz3 n THR 232 Ca 0.15 -0.27 0.14 0.00 -2.27 0.00 0.00 64.05 61.80 1oz3 n THR 232 Cb 0.42 0.74 0.45 0.00 -2.10 0.00 0.00 70.33 69.84 1oz3 n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oz3 n HIS 233 N -1.37 0.00 -3.05 4.78 1.44 -1.26 -4.58 115.22 111.18 1oz3 n HIS 233 Ca 0.00 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.32 1oz3 n HIS 233 Cb 0.12 -0.03 -0.06 0.00 0.12 0.00 0.00 29.99 30.14 1oz3 n HIS 233 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1oz3 s ASN 234 N -2.12 7.23 0.46 4.39 0.01 -1.26 -5.06 114.94 118.59 1oz3 s ASN 234 Ca 0.34 1.47 -0.09 0.00 -0.71 0.00 0.00 52.86 53.87 1oz3 s ASN 234 Cb 0.20 -2.45 -0.05 0.00 0.41 0.00 0.00 41.25 39.36 1oz3 s ASN 234 CO 0.38 0.14 0.81 -0.54 -1.51 0.00 0.00 177.10 176.38 1oz3 s LYS 235 N -0.64 3.67 -0.43 -0.60 -0.14 -1.26 -5.00 119.74 115.33 1oz3 s LYS 235 Ca 0.35 0.41 -0.19 0.00 -1.36 0.00 0.00 55.97 55.18 1oz3 s LYS 235 Cb -0.21 -2.34 0.02 0.00 -1.68 0.00 0.00 37.83 33.62 1oz3 s LYS 235 CO 0.23 -0.17 0.56 1.21 -0.76 0.00 0.00 175.35 176.42 1oz3 s ASN 236 N -3.65 6.27 0.00 2.83 3.84 -1.26 -4.91 114.94 118.07 1oz3 s ASN 236 Ca 0.50 -0.46 0.25 0.00 0.21 0.00 0.00 52.86 53.36 1oz3 s ASN 236 Cb -0.10 -2.28 0.51 0.00 -0.55 0.00 0.00 41.25 38.83 1oz3 s ASN 236 CO 0.39 -0.70 1.44 0.61 -2.79 0.00 0.00 177.10 176.06 1oz3 n GLY 237 N 5.06 0.80 3.76 1.21 0.00 -1.26 -4.90 105.19 109.86 1oz3 n GLY 237 Ca -0.04 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 1oz3 n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oz3 s PHE 238 N -1.89 3.43 0.07 1.61 0.40 -1.26 -5.00 117.98 115.34 1oz3 s PHE 238 Ca 0.33 1.59 0.07 0.00 -0.60 0.00 0.00 56.93 58.32 1oz3 s PHE 238 Cb 0.20 -3.40 -0.03 0.00 0.51 0.00 0.00 43.02 40.31 1oz3 s PHE 238 CO 0.31 -0.96 -0.20 0.15 0.70 0.00 0.00 175.22 175.21 1oz3 s LYS 239 N -1.30 1.24 0.06 0.44 -0.14 -1.26 -4.98 119.74 113.80 1oz3 s LYS 239 Ca 0.47 -1.02 -0.37 0.00 -1.36 0.00 0.00 55.97 53.69 1oz3 s LYS 239 Cb -0.34 -1.41 -0.17 0.00 -1.68 0.00 0.00 37.83 34.23 1oz3 s LYS 239 CO 0.43 0.35 1.36 1.28 -0.76 0.00 0.00 175.35 178.00 1oz3 n LEU 240 N 1.54 1.62 -0.83 3.17 4.32 -1.26 -4.72 117.00 120.84 1oz3 n LEU 240 Ca -0.18 1.12 0.00 0.00 -0.02 0.00 0.00 56.01 56.93 1oz3 n LEU 240 Cb 0.53 -1.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.16 1oz3 n LEU 240 CO 0.23 -1.04 0.00 0.61 -1.22 0.00 0.00 177.39 175.96 1oz3 n GLY 241 N 2.59 -0.89 3.34 -0.72 0.00 -0.33 -4.99 105.19 104.19 1oz3 n GLY 241 Ca 0.19 -0.41 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 1oz3 n GLY 241 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oz3 s LYS 243 N -0.49 0.78 0.09 1.61 1.02 -0.16 -4.57 119.74 118.02 1oz3 s LYS 243 Ca 0.00 0.03 -0.03 0.00 0.02 0.00 0.00 55.97 55.99 1oz3 s LYS 243 Cb 0.00 0.36 0.01 0.00 -0.52 0.00 0.00 37.83 37.68 1oz3 s LYS 243 CO 0.00 -0.22 0.17 1.47 -0.92 0.00 0.00 175.35 175.85 1oz3 n LEU 244 N 1.31 0.00 -4.38 3.17 -0.00 0.23 -0.74 117.00 116.59 1oz3 n LEU 244 Ca -0.20 -0.58 -0.26 0.00 -0.00 0.00 0.00 56.01 54.97 1oz3 n LEU 244 Cb 0.56 0.84 -0.12 0.00 -0.00 0.00 0.00 43.42 44.70 1oz3 n LEU 244 CO 0.21 -0.19 -0.53 -1.61 -0.00 0.00 0.00 177.39 175.28 1oz3 s GLU 245 N -2.03 1.40 0.05 1.47 2.02 -0.34 -0.75 118.70 120.52 1oz3 s GLU 245 Ca 0.04 -1.43 -0.28 0.00 0.02 0.00 0.00 54.97 53.32 1oz3 s GLU 245 Cb -0.01 -1.70 0.09 0.00 0.10 0.00 0.00 34.13 32.61 1oz3 s GLU 245 CO 0.03 0.37 1.06 0.20 0.02 0.00 0.00 175.26 176.94 1oz3 s GLY 246 N -2.47 -0.32 0.52 -1.39 0.00 -0.65 -0.35 107.32 102.65 1oz3 s GLY 246 Ca 0.17 0.54 -0.19 0.00 0.00 0.00 0.00 44.72 45.25 1oz3 s GLY 246 CO 0.08 0.13 1.04 -0.26 0.00 0.00 0.00 173.10 174.09 1oz3 s ILE 247 N -2.95 3.86 -0.31 0.90 -4.36 -0.59 -1.04 121.20 116.71 1oz3 s ILE 247 Ca 0.11 1.06 -0.28 0.00 -0.26 0.00 0.00 60.65 61.28 1oz3 s ILE 247 Cb 0.00 -3.45 0.01 0.00 1.25 0.00 0.00 42.46 40.28 1oz3 s ILE 247 CO -0.02 -0.35 1.04 -0.62 0.24 0.00 0.00 174.94 175.23 1oz3 s ASP 248 N -2.30 6.92 0.55 4.36 3.68 -1.26 -4.88 116.67 123.74 1oz3 s ASP 248 Ca 0.65 1.05 0.24 0.00 2.13 0.00 0.00 52.55 56.62 1oz3 s ASP 248 Cb -0.16 -2.53 1.46 0.00 -1.45 0.00 0.00 42.92 40.25 1oz3 s ASP 248 CO 0.25 -0.82 2.08 -0.65 0.13 0.00 0.00 175.17 176.17 1oz3 h PRO 249 N 8.00 0.00 0.00 4.34 0.11 -1.95 -1.00 132.00 141.50 1oz3 h PRO 249 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1oz3 h PRO 249 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1oz3 h PRO 249 CO 1.01 0.00 -0.32 1.96 -0.21 0.00 0.00 178.00 180.44 1oz3 h GLN 250 N 0.00 0.00 -2.29 1.05 7.50 -1.99 -3.38 115.11 116.01 1oz3 h GLN 250 Ca 0.12 0.00 -0.58 0.00 0.50 0.00 0.00 58.65 58.69 1oz3 h GLN 250 Cb 0.53 0.00 -0.39 0.00 0.05 0.00 0.00 27.48 27.67 1oz3 h GLN 250 CO -0.00 0.00 -0.93 0.72 -1.50 0.00 0.00 178.83 177.12 1oz3 n HIS 251 N -2.85 0.38 0.04 2.96 8.25 -0.42 -4.67 115.22 118.91 1oz3 n HIS 251 Ca 0.03 -3.63 0.00 0.00 -0.26 0.00 0.00 57.72 53.86 1oz3 n HIS 251 Cb 0.52 -0.18 0.02 0.00 1.12 0.00 0.00 29.99 31.47 1oz3 n HIS 251 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1oz3 n PRO 252 N 1.93 0.00 -0.89 -0.41 -0.04 -0.95 -4.08 135.00 130.56 1oz3 n PRO 252 Ca 0.25 0.42 -0.14 0.00 -0.04 0.00 0.00 63.50 64.00 1oz3 n PRO 252 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 1oz3 n PRO 252 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1oz3 n SER 253 N -1.43 6.11 -3.64 3.54 3.41 -1.26 -4.84 113.62 115.52 1oz3 n SER 253 Ca 0.00 -2.88 -0.11 0.00 -0.26 0.00 0.00 58.87 55.62 1oz3 n SER 253 Cb 0.01 -1.13 -0.07 0.00 -0.26 0.00 0.00 64.21 62.76 1oz3 n SER 253 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1oz3 s TYR 255 N -1.16 -0.66 0.18 7.33 2.02 -1.26 -4.99 117.35 118.82 1oz3 s TYR 255 Ca 0.30 1.56 0.05 0.00 -0.37 0.00 0.00 57.07 58.61 1oz3 s TYR 255 Cb 0.21 0.34 -0.05 0.00 -0.40 0.00 0.00 41.96 42.07 1oz3 s TYR 255 CO -0.03 -0.32 -0.08 -0.06 -1.57 0.00 0.00 175.55 173.49 1oz3 s PHE 256 N 0.47 1.40 -0.02 2.71 0.40 -0.20 -1.12 117.98 121.62 1oz3 s PHE 256 Ca 0.00 -0.79 -0.30 0.00 -0.60 0.00 0.00 56.93 55.24 1oz3 s PHE 256 Cb -0.05 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.71 1oz3 s PHE 256 CO -0.05 0.07 1.04 0.42 0.70 0.00 0.00 175.22 177.41 1oz3 s ILE 257 N -3.32 4.65 0.12 0.64 -1.09 -1.26 -1.64 121.20 119.31 1oz3 s ILE 257 Ca 0.21 1.91 0.07 0.00 -2.23 0.00 0.00 60.65 60.61 1oz3 s ILE 257 Cb 0.03 -4.22 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 1oz3 s ILE 257 CO 0.04 0.11 -0.17 -0.76 -1.23 0.00 0.00 174.94 172.92 1oz3 s LEU 258 N 1.33 2.36 -0.01 2.97 1.43 0.07 -2.36 118.68 124.46 1oz3 s LEU 258 Ca 0.53 -0.75 0.06 0.00 -1.03 0.00 0.00 54.13 52.94 1oz3 s LEU 258 Cb -0.22 -0.72 -0.02 0.00 0.03 0.00 0.00 46.19 45.26 1oz3 s LEU 258 CO 0.26 -0.04 -0.20 -0.89 0.23 0.00 0.00 176.35 175.71 1oz3 s THR 259 N -1.66 1.58 -0.27 5.49 2.01 -0.51 -0.60 115.64 121.69 1oz3 s THR 259 Ca 0.08 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 1oz3 s THR 259 Cb -0.08 -1.31 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 1oz3 s THR 259 CO 0.04 0.44 1.67 -0.69 -0.69 0.00 0.00 174.62 175.39 1oz3 s VAL 260 N -0.48 3.62 -0.11 3.82 1.01 -1.26 -0.86 120.40 126.14 1oz3 s VAL 260 Ca 0.08 0.68 0.20 0.00 0.00 0.00 0.00 61.98 62.93 1oz3 s VAL 260 Cb -0.08 -3.71 -0.27 0.00 0.00 0.00 0.00 36.38 32.32 1oz3 s VAL 260 CO -0.01 -0.36 0.39 0.00 0.00 0.00 0.00 175.10 175.12 1oz3 n ALA 261 N 9.11 2.22 -3.57 5.51 0.00 0.65 -1.18 120.51 133.24 1oz3 n ALA 261 Ca 0.20 -0.81 -0.16 0.00 0.00 0.00 0.00 53.44 52.67 1oz3 n ALA 261 Cb 0.46 -0.58 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 1oz3 n ALA 261 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1oz3 s GLU 262 N -3.07 0.93 -0.06 0.00 2.12 -1.15 -4.93 118.70 112.54 1oz3 s GLU 262 Ca -0.08 0.54 0.03 0.00 0.36 0.00 0.00 54.97 55.82 1oz3 s GLU 262 Cb 0.10 0.45 0.00 0.00 0.26 0.00 0.00 34.13 34.94 1oz3 s GLU 262 CO 0.86 -0.23 -0.16 0.08 -0.54 0.00 0.00 175.26 175.28 1oz3 s VAL 263 N -0.56 1.41 -0.24 3.70 1.01 -1.26 -0.80 120.40 123.66 1oz3 s VAL 263 Ca -0.06 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 1oz3 s VAL 263 Cb -0.02 -1.24 0.08 0.00 0.00 0.00 0.00 36.38 35.20 1oz3 s VAL 263 CO 0.06 0.41 0.08 0.00 0.00 0.00 0.00 175.10 175.65 1oz3 n GLY 265 N 5.11 3.92 1.33 0.00 0.00 -1.25 -1.21 105.19 113.09 1oz3 n GLY 265 Ca -0.06 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.03 1oz3 n GLY 265 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1oz3 n TYR 266 N 13.85 1.24 -4.44 1.61 9.36 -1.25 -4.69 117.16 132.84 1oz3 n TYR 266 Ca 0.00 -0.47 -0.24 0.00 3.32 0.00 0.00 57.90 60.51 1oz3 n TYR 266 Cb 0.00 -0.26 -0.10 0.00 -0.63 0.00 0.00 39.34 38.35 1oz3 n TYR 266 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1oz3 s ARG 267 N -1.93 1.85 -0.00 2.98 0.52 -0.35 -0.16 118.95 121.86 1oz3 s ARG 267 Ca 0.38 -1.75 -0.12 0.00 -0.52 0.00 0.00 55.73 53.72 1oz3 s ARG 267 Cb 0.26 -1.83 0.02 0.00 0.52 0.00 0.00 34.95 33.92 1oz3 s ARG 267 CO 0.16 0.27 0.26 -0.48 0.02 0.00 0.00 175.30 175.53 1oz3 s LEU 268 N -3.58 1.07 -0.19 2.53 2.34 0.14 -1.47 118.68 119.52 1oz3 s LEU 268 Ca 0.31 -0.04 -0.06 0.00 0.06 0.00 0.00 54.13 54.41 1oz3 s LEU 268 Cb -0.03 1.10 -0.03 0.00 -0.56 0.00 0.00 46.19 46.67 1oz3 s LEU 268 CO 0.17 -0.44 0.02 -0.60 -1.06 0.00 0.00 176.35 174.43 1oz3 s ARG 269 N -1.49 3.75 -0.09 1.48 3.52 0.02 -0.89 118.95 125.24 1oz3 s ARG 269 Ca -0.13 -0.46 -0.02 0.00 -0.13 0.00 0.00 55.73 54.99 1oz3 s ARG 269 Cb -0.05 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 30.20 1oz3 s ARG 269 CO 0.03 0.14 0.00 -0.51 -0.81 0.00 0.00 175.30 174.15 1oz3 s LEU 270 N 0.69 3.59 -0.09 -0.88 1.43 0.39 -0.25 118.68 123.56 1oz3 s LEU 270 Ca 0.01 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1oz3 s LEU 270 Cb -0.14 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1oz3 s LEU 270 CO 0.02 0.36 -0.12 -2.28 0.23 0.00 0.00 176.35 174.57 1oz3 s HIS 271 N -0.77 2.82 -0.51 0.29 5.65 -0.04 -1.83 115.29 120.89 1oz3 s HIS 271 Ca 0.12 -0.33 -0.28 0.00 0.25 0.00 0.00 55.06 54.82 1oz3 s HIS 271 Cb -0.12 -1.76 0.03 0.00 -1.18 0.00 0.00 32.58 29.56 1oz3 s HIS 271 CO 0.02 0.03 1.14 -0.06 -0.65 0.00 0.00 174.74 175.22 1oz3 s PHE 272 N -0.21 2.76 -0.06 3.88 0.40 -1.26 -1.42 117.98 122.06 1oz3 s PHE 272 Ca 0.01 0.58 -0.37 0.00 -0.60 0.00 0.00 56.93 56.55 1oz3 s PHE 272 Cb -0.13 -4.43 -0.15 0.00 0.51 0.00 0.00 43.02 38.82 1oz3 s PHE 272 CO 0.03 -1.36 1.60 -0.25 0.70 0.00 0.00 175.22 175.94 1oz3 n ASP 273 N 7.98 2.39 0.00 1.36 9.92 -0.99 -1.60 116.55 135.60 1oz3 n ASP 273 Ca 0.10 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.44 1oz3 n ASP 273 Cb 0.49 -1.24 0.00 0.00 -0.64 0.00 0.00 41.12 39.73 1oz3 n ASP 273 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1oz3 n GLY 274 N 3.52 3.19 4.02 0.44 0.00 -1.26 -3.11 105.19 111.99 1oz3 n GLY 274 Ca 0.22 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 1oz3 n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oz3 s TYR 275 N -1.97 1.42 0.42 1.61 1.51 -0.63 -4.64 117.35 115.07 1oz3 s TYR 275 Ca 0.00 -0.60 -0.24 0.00 -1.01 0.00 0.00 57.07 55.22 1oz3 s TYR 275 Cb 0.00 -2.45 -0.08 0.00 -0.11 0.00 0.00 41.96 39.32 1oz3 s TYR 275 CO 0.00 -1.35 1.10 0.45 -1.11 0.00 0.00 175.55 174.64 1oz3 s SER 276 N -4.70 6.52 0.19 2.29 0.15 -1.26 -4.85 113.70 112.04 1oz3 s SER 276 Ca 0.63 2.15 0.18 0.00 0.70 0.00 0.00 55.95 59.61 1oz3 s SER 276 Cb -0.05 -2.59 0.83 0.00 -1.71 0.00 0.00 66.02 62.50 1oz3 s SER 276 CO 0.41 -0.66 1.56 -1.84 1.20 0.00 0.00 173.24 173.91 1oz3 n GLU 277 N -0.24 0.12 0.28 5.44 0.00 -1.26 -2.56 120.64 122.42 1oz3 n GLU 277 Ca 0.06 0.45 0.18 0.00 0.00 0.00 0.00 57.16 57.86 1oz3 n GLU 277 Cb 0.49 -1.77 0.83 0.00 0.00 0.00 0.00 31.44 30.99 1oz3 n GLU 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1oz3 n HIS 279 N -2.99 0.00 -1.62 0.00 8.25 -1.06 -4.96 115.22 112.84 1oz3 n HIS 279 Ca -0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 1oz3 n HIS 279 Cb 0.22 -0.02 0.08 0.00 1.12 0.00 0.00 29.99 31.38 1oz3 n HIS 279 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1oz3 s ASP 280 N -2.08 4.45 0.08 0.41 -0.00 -0.85 -4.84 116.67 113.84 1oz3 s ASP 280 Ca 0.37 2.47 -0.09 0.00 -0.00 0.00 0.00 52.55 55.31 1oz3 s ASP 280 Cb 0.21 -2.60 -0.00 0.00 -0.00 0.00 0.00 42.92 40.52 1oz3 s ASP 280 CO 0.37 -2.10 0.19 0.72 -0.00 0.00 0.00 175.17 174.34 1oz3 s PHE 281 N -1.69 0.14 -0.11 4.23 -0.12 -0.76 -4.95 117.98 114.72 1oz3 s PHE 281 Ca 0.78 -0.53 -0.05 0.00 -0.05 0.00 0.00 56.93 57.09 1oz3 s PHE 281 Cb -0.33 -0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 41.96 1oz3 s PHE 281 CO 0.42 -0.51 0.08 -1.58 -0.05 0.00 0.00 175.22 173.57 1oz3 s TRP 282 N -3.58 3.39 0.23 3.49 0.52 -1.26 -0.46 118.94 121.27 1oz3 s TRP 282 Ca 0.03 0.36 0.02 0.00 0.02 0.00 0.00 56.10 56.53 1oz3 s TRP 282 Cb 0.04 -1.88 -0.05 0.00 -1.15 0.00 0.00 33.47 30.43 1oz3 s TRP 282 CO -0.09 0.60 0.05 0.14 0.02 0.00 0.00 176.95 177.66 1oz3 s VAL 283 N -0.91 0.70 0.46 4.03 -7.23 -0.07 -4.99 120.40 112.39 1oz3 s VAL 283 Ca 0.14 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.20 1oz3 s VAL 283 Cb -0.12 -2.42 -0.06 0.00 0.56 0.00 0.00 36.38 34.35 1oz3 s VAL 283 CO 0.03 -0.22 0.84 0.20 -0.31 0.00 0.00 175.10 175.65 1oz3 s ASN 284 N -3.27 6.46 0.56 4.85 0.02 -1.26 -0.68 114.94 121.62 1oz3 s ASN 284 Ca 0.31 1.21 0.36 0.00 -1.02 0.00 0.00 52.86 53.73 1oz3 s ASN 284 Cb 0.07 -2.36 1.65 0.00 0.02 0.00 0.00 41.25 40.63 1oz3 s ASN 284 CO 0.10 -0.52 2.07 0.00 0.02 0.00 0.00 177.10 178.76 1oz3 h ALA 285 N 0.82 1.00 -0.54 0.60 0.00 -0.88 -1.62 119.26 118.65 1oz3 h ALA 285 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1oz3 h ALA 285 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1oz3 h ALA 285 CO 0.63 0.00 0.00 0.27 0.00 0.00 0.00 179.25 180.15 1oz3 n ASN 286 N -3.00 5.35 -4.69 0.00 6.94 -1.26 -4.78 115.26 113.82 1oz3 n ASN 286 Ca -0.00 -2.84 -0.44 0.00 -0.02 0.00 0.00 54.58 51.27 1oz3 n ASN 286 Cb 0.22 -0.67 -0.03 0.00 -2.36 0.00 0.00 39.78 36.94 1oz3 n ASN 286 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1oz3 n SER 287 N 0.60 3.28 -0.27 0.53 2.88 -0.61 -4.83 113.62 115.20 1oz3 n SER 287 Ca 0.26 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 59.02 1oz3 n SER 287 Cb 1.12 -1.48 0.56 0.00 -0.75 0.00 0.00 64.21 63.66 1oz3 n SER 287 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1oz3 n PRO 288 N 3.02 1.36 -0.26 -1.46 -0.04 -1.26 -3.98 135.00 132.38 1oz3 n PRO 288 Ca 0.14 -0.54 0.11 0.00 -0.04 0.00 0.00 63.50 63.17 1oz3 n PRO 288 Cb 0.32 -1.40 0.27 0.00 -0.04 0.00 0.00 33.50 32.65 1oz3 n PRO 288 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1oz3 n ASP 289 N -0.28 3.24 -4.26 3.54 8.00 -1.26 -4.80 116.55 120.73 1oz3 n ASP 289 Ca 0.17 -1.97 -0.20 0.00 0.71 0.00 0.00 54.79 53.50 1oz3 n ASP 289 Cb 0.21 -0.35 -0.12 0.00 -0.02 0.00 0.00 41.12 40.85 1oz3 n ASP 289 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1oz3 s ILE 290 N -1.30 1.50 0.05 0.53 -4.36 -1.26 -1.55 121.20 114.81 1oz3 s ILE 290 Ca 0.40 -1.68 -0.11 0.00 -0.26 0.00 0.00 60.65 59.01 1oz3 s ILE 290 Cb 0.22 -1.55 0.01 0.00 1.25 0.00 0.00 42.46 42.38 1oz3 s ILE 290 CO 0.29 -0.30 0.23 -1.00 0.24 0.00 0.00 174.94 174.41 1oz3 s HIS 291 N -1.81 0.02 0.66 1.37 3.76 0.53 -4.65 115.29 115.17 1oz3 s HIS 291 Ca 0.09 -0.26 -0.15 0.00 -0.15 0.00 0.00 55.06 54.58 1oz3 s HIS 291 Cb -0.07 0.01 0.00 0.00 1.11 0.00 0.00 32.58 33.64 1oz3 s HIS 291 CO 0.04 -0.49 1.13 -1.25 -0.85 0.00 0.00 174.74 173.32 1oz3 s PRO 292 N -2.88 2.71 0.04 8.40 0.04 -1.26 -1.20 135.00 140.85 1oz3 s PRO 292 Ca -0.03 1.48 -0.37 0.00 0.04 0.00 0.00 61.00 62.12 1oz3 s PRO 292 Cb 0.00 -1.93 -0.16 0.00 0.04 0.00 0.00 34.50 32.45 1oz3 s PRO 292 CO -0.06 -1.33 1.43 0.00 0.04 0.00 0.00 177.00 177.08 1oz3 n ALA 293 N -2.39 -0.64 0.00 8.56 0.00 -1.26 -1.31 120.51 123.47 1oz3 n ALA 293 Ca 0.11 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1oz3 n ALA 293 Cb 0.52 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.84 1oz3 n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oz3 n GLY 294 N 2.86 2.11 0.19 0.00 0.00 -1.26 -4.96 105.19 104.13 1oz3 n GLY 294 Ca 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 1oz3 n GLY 294 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1oz3 h TRP 295 N 0.00 0.42 -0.75 1.61 7.01 -1.55 -3.00 115.95 119.69 1oz3 h TRP 295 Ca 0.00 0.02 0.10 0.00 2.11 0.00 0.00 58.89 61.12 1oz3 h TRP 295 Cb 0.00 -0.12 -0.08 0.00 -2.10 0.00 0.00 29.16 26.86 1oz3 h TRP 295 CO 0.00 0.21 0.38 0.27 -2.79 0.00 0.00 178.44 176.50 1oz3 h PHE 296 N 0.45 0.67 -0.19 2.65 -0.00 -1.86 -2.04 116.94 116.62 1oz3 h PHE 296 Ca 0.20 0.03 -0.13 0.00 -0.00 0.00 0.00 57.97 58.07 1oz3 h PHE 296 Cb 0.12 -0.19 -0.01 0.00 -0.00 0.00 0.00 35.95 35.87 1oz3 h PHE 296 CO -0.11 0.22 -0.45 0.93 -0.00 0.00 0.00 178.31 178.91 1oz3 h GLU 297 N 0.62 0.47 0.00 6.09 5.08 -1.73 -0.75 114.58 124.36 1oz3 h GLU 297 Ca 0.38 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1oz3 h GLU 297 Cb 0.43 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1oz3 h GLU 297 CO -0.29 0.83 -0.14 1.63 -1.00 0.00 0.00 179.01 180.04 1oz3 n LYS 298 N -4.00 0.01 0.00 2.33 5.02 -0.83 -4.13 118.16 116.56 1oz3 n LYS 298 Ca -0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1oz3 n LYS 298 Cb 0.54 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1oz3 n LYS 298 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1oz3 n THR 299 N -1.53 0.47 -2.35 -0.18 -2.24 -0.84 -5.03 114.28 102.58 1oz3 n THR 299 Ca 0.07 -0.48 -0.04 0.00 -2.27 0.00 0.00 64.05 61.33 1oz3 n THR 299 Cb 0.34 0.78 0.01 0.00 -2.10 0.00 0.00 70.33 69.36 1oz3 n THR 299 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oz3 n GLY 300 N -0.24 0.46 3.56 3.38 0.00 -0.96 -5.05 105.19 106.33 1oz3 n GLY 300 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 45.11 1oz3 n GLY 300 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1oz3 s HIS 301 N -2.58 2.60 0.03 1.61 3.76 -0.33 -5.06 115.29 115.32 1oz3 s HIS 301 Ca 0.04 -0.23 -0.19 0.00 -0.15 0.00 0.00 55.06 54.53 1oz3 s HIS 301 Cb -0.02 -1.28 -0.06 0.00 1.11 0.00 0.00 32.58 32.33 1oz3 s HIS 301 CO 0.05 0.51 0.55 0.15 -0.85 0.00 0.00 174.74 175.15 1oz3 s LYS 302 N -2.80 4.19 -0.21 1.40 1.02 -1.26 -4.36 119.74 117.72 1oz3 s LYS 302 Ca 0.24 0.67 -0.05 0.00 0.02 0.00 0.00 55.97 56.86 1oz3 s LYS 302 Cb -0.09 -3.27 -0.02 0.00 -0.52 0.00 0.00 37.83 33.93 1oz3 s LYS 302 CO 0.15 0.56 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.96 1oz3 s LEU 303 N -0.79 3.16 -0.22 3.17 1.98 -1.26 -4.00 118.68 120.72 1oz3 s LEU 303 Ca 0.28 -0.26 -0.29 0.00 -2.89 0.00 0.00 54.13 50.97 1oz3 s LEU 303 Cb -0.19 -1.81 0.01 0.00 0.66 0.00 0.00 46.19 44.86 1oz3 s LEU 303 CO 0.17 0.02 1.03 -1.58 -1.89 0.00 0.00 176.35 174.11 1oz3 s GLN 304 N 1.23 4.28 0.88 1.98 2.00 -0.28 -4.78 119.66 124.97 1oz3 s GLN 304 Ca 0.03 1.36 -0.13 0.00 -2.00 0.00 0.00 55.36 54.62 1oz3 s GLN 304 Cb -0.15 -3.63 0.14 0.00 0.80 0.00 0.00 33.01 30.18 1oz3 s GLN 304 CO 0.01 -0.60 1.23 -1.25 -0.50 0.00 0.00 175.29 174.18 1oz3 s PRO 305 N 3.07 1.27 0.61 1.67 0.04 -1.26 -4.01 135.00 136.39 1oz3 s PRO 305 Ca 0.44 -0.25 -0.19 0.00 0.04 0.00 0.00 61.00 61.04 1oz3 s PRO 305 Cb -0.15 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1oz3 s PRO 305 CO 0.07 -1.99 1.29 -2.14 0.04 0.00 0.00 177.00 174.27 1oz3 s PRO 306 N -5.70 2.81 -0.30 0.56 0.02 -1.26 -4.79 135.00 126.35 1oz3 s PRO 306 Ca 0.68 2.06 -0.41 0.00 0.02 0.00 0.00 61.00 63.35 1oz3 s PRO 306 Cb -0.07 -1.98 -0.17 0.00 0.02 0.00 0.00 34.50 32.30 1oz3 s PRO 306 CO 0.51 -1.39 1.68 1.17 -0.33 0.00 0.00 177.00 178.63 1oz3 n LYS 307 N -1.58 0.90 0.00 5.54 4.81 -1.18 -1.18 118.16 125.47 1oz3 n LYS 307 Ca 0.14 0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 1oz3 n LYS 307 Cb 0.47 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.55 1oz3 n LYS 307 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1oz3 n GLY 308 N 4.01 0.19 3.99 3.14 0.00 -1.26 -4.87 105.19 110.39 1oz3 n GLY 308 Ca 0.27 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 1oz3 n GLY 308 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oz3 s TYR 309 N -2.00 1.26 -0.01 1.61 1.51 -0.33 -5.14 117.35 114.25 1oz3 s TYR 309 Ca 0.00 -0.29 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1oz3 s TYR 309 Cb 0.00 -3.19 -0.01 0.00 -0.11 0.00 0.00 41.96 38.65 1oz3 s TYR 309 CO 0.00 -2.02 -0.14 0.15 -1.11 0.00 0.00 175.55 172.43 1oz3 s LYS 310 N -5.32 1.15 0.29 -0.62 -0.14 -1.26 -4.89 119.74 108.95 1oz3 s LYS 310 Ca 0.69 -0.49 0.01 0.00 -1.36 0.00 0.00 55.97 54.83 1oz3 s LYS 310 Cb -0.04 -1.10 0.70 0.00 -1.68 0.00 0.00 37.83 35.71 1oz3 s LYS 310 CO 0.47 0.28 1.47 -1.91 -0.76 0.00 0.00 175.35 174.89 1oz3 n GLU 311 N 2.81 -0.08 0.01 1.68 0.00 -1.26 0.53 120.64 124.33 1oz3 n GLU 311 Ca -0.15 1.41 0.11 0.00 0.00 0.00 0.00 57.16 58.53 1oz3 n GLU 311 Cb 0.55 -2.23 0.09 0.00 0.00 0.00 0.00 31.44 29.85 1oz3 n GLU 311 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1oz3 n GLU 312 N -5.39 0.12 0.25 5.31 1.02 -1.26 -3.14 120.64 117.55 1oz3 n GLU 312 Ca 0.22 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.47 1oz3 n GLU 312 Cb 0.71 -1.54 0.66 0.00 -0.02 0.00 0.00 31.44 31.25 1oz3 n GLU 312 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1oz3 h GLU 313 N 0.00 0.00 -6.08 3.49 5.08 -0.32 -3.46 114.58 113.29 1oz3 h GLU 313 Ca 0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 1oz3 h GLU 313 Cb 0.59 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1oz3 h GLU 313 CO 0.00 0.15 0.18 0.12 -1.00 0.00 0.00 179.01 178.46 1oz3 s PHE 314 N -4.15 3.57 -0.07 4.33 5.36 -1.13 -4.93 117.98 120.95 1oz3 s PHE 314 Ca -0.02 1.33 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 1oz3 s PHE 314 Cb 0.13 -2.89 0.02 0.00 -0.34 0.00 0.00 43.02 39.94 1oz3 s PHE 314 CO 0.60 0.02 -0.07 0.45 -1.46 0.00 0.00 175.22 174.76 1oz3 s SER 315 N 0.90 1.63 0.20 6.13 0.15 -1.26 -5.06 113.70 116.38 1oz3 s SER 315 Ca 0.40 -0.22 -0.12 0.00 0.70 0.00 0.00 55.95 56.71 1oz3 s SER 315 Cb -0.18 -0.68 0.13 0.00 -1.71 0.00 0.00 66.02 63.58 1oz3 s SER 315 CO 0.19 -0.06 1.86 -0.50 1.20 0.00 0.00 173.24 175.92 1oz3 h TRP 316 N 7.54 0.80 -0.42 3.44 4.06 -1.98 -0.31 115.95 129.08 1oz3 h TRP 316 Ca -0.31 0.02 0.08 0.00 2.06 0.00 0.00 58.89 60.74 1oz3 h TRP 316 Cb 1.15 -0.27 -0.09 0.00 -1.00 0.00 0.00 29.16 28.95 1oz3 h TRP 316 CO 0.49 0.49 -0.30 0.77 -3.56 0.00 0.00 178.44 176.33 1oz3 h SER 317 N 0.86 -0.99 0.38 -3.49 0.02 -1.99 -0.74 113.55 107.60 1oz3 h SER 317 Ca 0.25 0.19 -0.21 0.00 -0.84 0.00 0.00 61.79 61.17 1oz3 h SER 317 Cb -0.06 0.48 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 1oz3 h SER 317 CO -0.07 -0.30 -0.89 -0.61 -1.14 0.00 0.00 176.83 173.83 1oz3 h GLN 318 N -0.22 0.36 -0.43 3.45 5.75 -1.93 -2.40 115.11 119.70 1oz3 h GLN 318 Ca 0.19 -0.37 -0.03 0.00 -0.15 0.00 0.00 58.65 58.29 1oz3 h GLN 318 Cb 0.52 0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 1oz3 h GLN 318 CO -0.54 1.04 0.14 -0.92 -2.65 0.00 0.00 178.83 175.90 1oz3 h TYR 319 N 0.21 0.67 -0.58 3.99 3.20 -0.64 -0.51 116.97 123.32 1oz3 h TYR 319 Ca -0.06 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.70 1oz3 h TYR 319 Cb 1.51 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.55 1oz3 h TYR 319 CO 0.05 0.61 0.17 -0.07 -1.64 0.00 0.00 178.16 177.28 1oz3 h LEU 320 N 0.54 0.81 -0.45 2.82 3.38 -1.11 -0.88 115.31 120.42 1oz3 h LEU 320 Ca 0.14 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1oz3 h LEU 320 Cb 0.24 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1oz3 h LEU 320 CO -0.01 0.77 -0.07 0.03 0.09 0.00 0.00 178.44 179.25 1oz3 h ARG 321 N 0.84 0.84 -0.05 1.13 3.08 -1.04 0.36 114.38 119.54 1oz3 h ARG 321 Ca 0.19 -0.30 -0.16 0.00 0.07 0.00 0.00 59.98 59.78 1oz3 h ARG 321 Cb 0.26 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1oz3 h ARG 321 CO -0.01 0.93 -0.68 1.03 -1.07 0.00 0.00 179.97 180.17 1oz3 h SER 322 N 0.67 0.26 0.80 7.04 0.87 -0.94 -3.12 113.55 119.14 1oz3 h SER 322 Ca 0.12 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1oz3 h SER 322 Cb 0.60 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1oz3 h SER 322 CO 0.04 0.87 -0.88 0.35 -0.53 0.00 0.00 176.83 176.67 1oz3 n THR 323 N -3.81 0.40 -2.31 2.23 -2.24 -0.35 -4.96 114.28 103.24 1oz3 n THR 323 Ca -0.03 -0.37 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 1oz3 n THR 323 Cb 0.67 -0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.76 1oz3 n THR 323 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oz3 n ARG 324 N -2.28 -2.04 -2.59 -0.78 1.74 0.11 -5.00 116.66 105.82 1oz3 n ARG 324 Ca 0.02 0.69 -0.25 0.00 -0.77 0.00 0.00 57.85 57.53 1oz3 n ARG 324 Cb 0.48 -5.26 0.03 0.00 -1.02 0.00 0.00 32.46 26.69 1oz3 n ARG 324 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1oz3 s ALA 325 N -2.63 3.48 -0.18 7.54 0.00 -1.16 -5.05 121.76 123.76 1oz3 s ALA 325 Ca 0.00 -0.86 -0.06 0.00 0.00 0.00 0.00 51.96 51.04 1oz3 s ALA 325 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 1oz3 s ALA 325 CO 0.00 -0.68 0.03 -1.14 0.00 0.00 0.00 175.76 173.96 1oz3 s GLN 326 N -4.85 3.84 0.22 0.00 0.74 -1.26 -4.88 119.66 113.47 1oz3 s GLN 326 Ca 0.53 -0.42 -0.30 0.00 0.05 0.00 0.00 55.36 55.22 1oz3 s GLN 326 Cb -0.10 -3.12 -0.09 0.00 1.10 0.00 0.00 33.01 30.80 1oz3 s GLN 326 CO 0.42 0.21 1.19 0.00 -0.55 0.00 0.00 175.29 176.57 1oz3 s ALA 327 N 0.50 3.44 0.19 1.58 0.00 -1.26 -0.98 121.76 125.22 1oz3 s ALA 327 Ca 0.01 0.97 -0.33 0.00 0.00 0.00 0.00 51.96 52.61 1oz3 s ALA 327 Cb -0.13 -3.40 -0.13 0.00 0.00 0.00 0.00 23.12 19.46 1oz3 s ALA 327 CO 0.02 -0.35 1.66 0.00 0.00 0.00 0.00 175.76 177.08 1oz3 n ALA 328 N 2.07 2.20 -1.77 0.00 0.00 0.08 -4.75 120.51 118.34 1oz3 n ALA 328 Ca 0.03 0.42 -0.40 0.00 0.00 0.00 0.00 53.44 53.49 1oz3 n ALA 328 Cb 0.44 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1oz3 n ALA 328 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1oz3 s PRO 329 N 1.04 3.94 0.38 0.00 0.02 -1.26 -4.63 135.00 134.50 1oz3 s PRO 329 Ca 0.77 2.33 0.14 0.00 0.02 0.00 0.00 61.00 64.26 1oz3 s PRO 329 Cb -0.58 -2.80 0.99 0.00 0.02 0.00 0.00 34.50 32.13 1oz3 s PRO 329 CO 0.35 -0.58 1.82 0.87 -0.33 0.00 0.00 177.00 179.13 1oz3 h LYS 330 N 2.70 0.50 0.00 5.54 1.57 -1.97 -2.51 116.57 122.40 1oz3 h LYS 330 Ca -0.50 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1oz3 h LYS 330 Cb 1.25 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1oz3 h LYS 330 CO 0.63 0.33 0.00 -2.39 -0.57 0.00 0.00 179.45 177.45 1oz3 n HIS 331 N -4.59 0.85 0.25 -1.35 1.44 -1.26 -2.11 115.22 108.44 1oz3 n HIS 331 Ca 0.21 0.35 0.13 0.00 -2.01 0.00 0.00 57.72 56.41 1oz3 n HIS 331 Cb 0.68 -1.07 0.63 0.00 0.12 0.00 0.00 29.99 30.35 1oz3 n HIS 331 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 1oz3 h LEU 332 N 0.00 0.00 -9.36 2.39 3.38 -1.82 -3.45 115.31 106.44 1oz3 h LEU 332 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 1oz3 h LEU 332 Cb 0.29 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.95 1oz3 h LEU 332 CO 0.00 0.12 -0.29 -0.36 0.09 0.00 0.00 178.44 178.00 1oz3 s PHE 333 N -3.80 3.50 -0.26 1.13 0.40 -0.90 -4.89 117.98 113.16 1oz3 s PHE 333 Ca -0.00 0.68 0.19 0.00 -0.60 0.00 0.00 56.93 57.19 1oz3 s PHE 333 Cb 0.11 -2.35 0.14 0.00 0.51 0.00 0.00 43.02 41.43 1oz3 s PHE 333 CO 0.58 0.29 1.40 -0.39 0.70 0.00 0.00 175.22 177.81 1oz3 h VAL 334 N 4.55 0.43 -3.68 -0.44 -1.51 -1.86 -3.41 116.25 110.33 1oz3 h VAL 334 Ca -0.43 -1.63 -0.68 0.00 -1.23 0.00 0.00 66.70 62.73 1oz3 h VAL 334 Cb 1.18 2.14 -0.35 0.00 -2.13 0.00 0.00 31.29 32.12 1oz3 h VAL 334 CO 0.73 0.24 -0.67 -0.55 -1.23 0.00 0.00 177.57 176.10 1oz3 s SER 335 N -6.19 4.94 -0.01 4.19 0.15 -1.26 -4.93 113.70 110.60 1oz3 s SER 335 Ca 0.04 -1.68 0.01 0.00 0.70 0.00 0.00 55.95 55.02 1oz3 s SER 335 Cb 0.07 -1.72 0.01 0.00 -1.71 0.00 0.00 66.02 62.67 1oz3 s SER 335 CO 0.73 -0.36 0.83 1.67 1.20 0.00 0.00 173.24 177.30 1oz3 n GLN 336 N 4.53 1.77 -3.22 5.44 7.27 -1.26 -4.59 117.38 127.32 1oz3 n GLN 336 Ca -0.07 -1.17 -0.23 0.00 0.07 0.00 0.00 57.00 55.60 1oz3 n GLN 336 Cb 0.42 -0.83 0.05 0.00 2.41 0.00 0.00 30.24 32.29 1oz3 n GLN 336 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1oz3 n SER 337 N -0.35 -6.19 -0.64 1.69 7.64 -1.26 -4.90 113.62 109.62 1oz3 n SER 337 Ca 0.01 -0.38 0.08 0.00 1.01 0.00 0.00 58.87 59.59 1oz3 n SER 337 Cb 0.37 -4.96 0.06 0.00 -1.01 0.00 0.00 64.21 58.68 1oz3 n SER 337 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1oz3 n HIS 338 N -4.68 0.00 -3.82 1.43 8.25 -1.26 -4.92 115.22 110.22 1oz3 n HIS 338 Ca -0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.03 1oz3 n HIS 338 Cb 0.60 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.65 1oz3 n HIS 338 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1oz3 s SER 339 N -1.43 6.45 0.23 0.41 0.15 -1.26 -5.11 113.70 113.14 1oz3 s SER 339 Ca 0.19 0.51 -0.31 0.00 0.70 0.00 0.00 55.95 57.04 1oz3 s SER 339 Cb 0.14 -2.08 -0.11 0.00 -1.71 0.00 0.00 66.02 62.25 1oz3 s SER 339 CO 0.23 0.34 1.66 -2.84 1.20 0.00 0.00 173.24 173.82 1oz3 s PRO 340 N -1.39 4.14 1.03 5.44 0.02 -1.26 -4.52 135.00 138.46 1oz3 s PRO 340 Ca 0.21 2.56 -0.25 0.00 0.02 0.00 0.00 61.00 63.54 1oz3 s PRO 340 Cb -0.13 -3.07 -0.12 0.00 0.02 0.00 0.00 34.50 31.21 1oz3 s PRO 340 CO 0.11 -0.69 -1.11 -2.30 -0.33 0.00 0.00 177.00 172.68 1oz3 n PRO 341 N 3.37 -0.42 -2.25 5.54 -0.02 -1.26 -4.75 135.00 135.21 1oz3 n PRO 341 Ca 0.13 -0.12 -0.43 0.00 -2.02 0.00 0.00 63.50 61.07 1oz3 n PRO 341 Cb 0.36 -1.19 -0.02 0.00 -0.02 0.00 0.00 33.50 32.63 1oz3 n PRO 341 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1oz3 s PRO 342 N -2.39 4.13 -0.40 0.52 0.04 -1.23 -4.91 135.00 130.77 1oz3 s PRO 342 Ca 0.42 1.79 -0.41 0.00 0.04 0.00 0.00 61.00 62.83 1oz3 s PRO 342 Cb 0.03 -3.88 -0.16 0.00 0.04 0.00 0.00 34.50 30.53 1oz3 s PRO 342 CO 0.67 -0.86 1.92 1.28 0.04 0.00 0.00 177.00 180.05 1oz3 n LEU 343 N 7.10 1.67 0.00 -3.56 4.32 -1.26 -2.11 117.00 123.16 1oz3 n LEU 343 Ca 0.16 0.85 0.00 0.00 -0.02 0.00 0.00 56.01 57.00 1oz3 n LEU 343 Cb 0.44 -1.05 0.00 0.00 -1.62 0.00 0.00 43.42 41.19 1oz3 n LEU 343 CO 0.60 -0.66 0.00 0.61 -1.22 0.00 0.00 177.39 176.71 1oz3 n GLY 344 N 5.55 0.94 3.25 -0.72 0.00 -1.26 -4.74 105.19 108.20 1oz3 n GLY 344 Ca 0.38 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.97 1oz3 n GLY 344 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oz3 s PHE 345 N -2.48 3.61 0.05 1.61 0.40 -0.90 -4.42 117.98 115.84 1oz3 s PHE 345 Ca 0.00 -2.18 0.00 0.00 -0.60 0.00 0.00 56.93 54.15 1oz3 s PHE 345 Cb 0.00 -3.60 -0.04 0.00 0.51 0.00 0.00 43.02 39.89 1oz3 s PHE 345 CO 0.00 -0.94 0.16 -0.65 0.70 0.00 0.00 175.22 174.49 1oz3 s GLN 346 N 0.23 3.26 0.31 0.44 1.11 -1.26 -4.77 119.66 118.98 1oz3 s GLN 346 Ca 0.16 -0.48 -0.28 0.00 0.01 0.00 0.00 55.36 54.77 1oz3 s GLN 346 Cb -0.15 -2.96 -0.13 0.00 -1.01 0.00 0.00 33.01 28.76 1oz3 s GLN 346 CO -0.06 0.62 1.14 1.55 0.01 0.00 0.00 175.29 178.54 1oz3 n VAL 347 N 0.54 1.94 -0.59 1.09 3.14 -1.26 -4.76 118.33 118.44 1oz3 n VAL 347 Ca -0.08 -0.49 0.00 0.00 -2.96 0.00 0.00 64.34 60.82 1oz3 n VAL 347 Cb 0.52 -1.25 0.00 0.00 -1.06 0.00 0.00 33.84 32.05 1oz3 n VAL 347 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1oz3 n GLY 348 N 1.08 0.56 3.40 7.55 0.00 0.31 -5.02 105.19 113.08 1oz3 n GLY 348 Ca 0.08 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 1oz3 n GLY 348 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oz3 s LYS 350 N -0.57 1.02 0.31 1.61 -0.14 -0.60 -4.53 119.74 116.84 1oz3 s LYS 350 Ca 0.00 -0.17 -0.19 0.00 -1.36 0.00 0.00 55.97 54.25 1oz3 s LYS 350 Cb 0.00 0.47 0.05 0.00 -1.68 0.00 0.00 37.83 36.67 1oz3 s LYS 350 CO 0.00 -0.36 0.81 -0.48 -0.76 0.00 0.00 175.35 174.56 1oz3 s LEU 351 N -1.84 -0.09 -0.10 3.17 0.05 -0.19 -0.68 118.68 118.99 1oz3 s LEU 351 Ca -0.06 -0.87 -0.00 0.00 0.05 0.00 0.00 54.13 53.25 1oz3 s LEU 351 Cb -0.01 2.67 -0.03 0.00 -2.05 0.00 0.00 46.19 46.77 1oz3 s LEU 351 CO 0.00 -1.44 -0.07 -1.61 -0.55 0.00 0.00 176.35 172.68 1oz3 s GLU 352 N -2.87 3.08 0.01 1.48 2.02 0.11 -2.08 118.70 120.46 1oz3 s GLU 352 Ca 0.14 -0.56 -0.00 0.00 0.02 0.00 0.00 54.97 54.57 1oz3 s GLU 352 Cb -0.05 -2.68 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 1oz3 s GLU 352 CO 0.09 0.49 -0.02 0.00 0.02 0.00 0.00 175.26 175.84 1oz3 s ALA 353 N -0.34 0.08 0.08 5.21 0.00 -0.05 0.03 121.76 126.77 1oz3 s ALA 353 Ca 0.05 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.31 1oz3 s ALA 353 Cb -0.12 0.11 -0.06 0.00 0.00 0.00 0.00 23.12 23.05 1oz3 s ALA 353 CO 0.02 -0.12 0.79 0.14 0.00 0.00 0.00 175.76 176.59 1oz3 s VAL 354 N -1.12 4.61 -0.70 0.00 -7.23 -0.07 -0.02 120.40 115.86 1oz3 s VAL 354 Ca -0.12 1.71 -0.27 0.00 -1.81 0.00 0.00 61.98 61.49 1oz3 s VAL 354 Cb -0.08 -4.15 0.02 0.00 0.56 0.00 0.00 36.38 32.73 1oz3 s VAL 354 CO -0.01 0.40 1.45 -0.62 -0.31 0.00 0.00 175.10 176.01 1oz3 s ASP 355 N -0.33 5.90 0.00 4.85 3.68 -0.90 -4.95 116.67 124.92 1oz3 s ASP 355 Ca 0.39 -0.22 0.00 0.00 2.13 0.00 0.00 52.55 54.85 1oz3 s ASP 355 Cb -0.22 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.70 1oz3 s ASP 355 CO 0.25 -2.00 0.00 0.54 0.13 0.00 0.00 175.17 174.09 1oz3 n ARG 356 N 9.32 0.00 -0.48 4.34 1.74 -1.26 -1.63 116.66 128.69 1oz3 n ARG 356 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1oz3 n ARG 356 Cb 0.50 -1.33 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1oz3 n ARG 356 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1oz3 n ASN 358 N 1.51 -0.58 0.29 0.55 4.13 -1.26 -5.09 115.26 114.81 1oz3 n ASN 358 Ca 0.00 -0.33 0.16 0.00 1.68 0.00 0.00 54.58 56.09 1oz3 n ASN 358 Cb 0.00 -0.06 0.79 0.00 -1.54 0.00 0.00 39.78 38.97 1oz3 n ASN 358 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1oz3 h PRO 359 N 3.55 0.00 0.00 3.52 0.11 -1.71 -0.69 132.00 136.78 1oz3 h PRO 359 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1oz3 h PRO 359 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1oz3 h PRO 359 CO 0.29 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.95 1oz3 n SER 360 N -3.05 0.00 -4.41 -2.05 3.41 -1.26 -4.77 113.62 101.49 1oz3 n SER 360 Ca -0.00 -0.46 -0.33 0.00 -0.26 0.00 0.00 58.87 57.82 1oz3 n SER 360 Cb 0.44 -0.05 -0.14 0.00 -0.26 0.00 0.00 64.21 64.20 1oz3 n SER 360 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1oz3 s LEU 361 N -2.10 2.81 -0.11 1.04 1.43 -0.27 -5.06 118.68 116.42 1oz3 s LEU 361 Ca 0.25 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1oz3 s LEU 361 Cb 0.12 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 1oz3 s LEU 361 CO 0.22 0.19 -0.20 -0.69 0.23 0.00 0.00 176.35 176.10 1oz3 s VAL 362 N 0.19 2.44 0.07 -1.59 1.01 -1.26 -2.11 120.40 119.15 1oz3 s VAL 362 Ca -0.07 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1oz3 s VAL 362 Cb -0.15 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1oz3 s VAL 362 CO 0.05 0.55 -0.05 0.00 0.00 0.00 0.00 175.10 175.65 1oz3 s VAL 364 N -3.78 3.17 0.09 0.00 1.01 -0.88 -0.88 120.40 119.13 1oz3 s VAL 364 Ca 0.09 0.75 -0.16 0.00 0.00 0.00 0.00 61.98 62.66 1oz3 s VAL 364 Cb 0.07 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 33.00 1oz3 s VAL 364 CO -0.07 0.03 0.37 0.00 0.00 0.00 0.00 175.10 175.43 1oz3 s ALA 365 N 1.74 -0.85 0.11 5.51 0.00 -0.88 -2.96 121.76 124.44 1oz3 s ALA 365 Ca 0.68 0.01 0.05 0.00 0.00 0.00 0.00 51.96 52.70 1oz3 s ALA 365 Cb -0.38 0.51 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1oz3 s ALA 365 CO 0.30 -0.54 -0.13 -1.12 0.00 0.00 0.00 175.76 174.27 1oz3 s SER 366 N -2.47 1.85 -0.23 0.00 0.01 0.72 -1.02 113.70 112.56 1oz3 s SER 366 Ca -0.00 -0.80 -0.25 0.00 1.31 0.00 0.00 55.95 56.21 1oz3 s SER 366 Cb 0.01 -0.05 -0.00 0.00 0.21 0.00 0.00 66.02 66.19 1oz3 s SER 366 CO -0.08 -0.17 0.85 -0.69 0.41 0.00 0.00 173.24 173.56 1oz3 s VAL 367 N -2.16 4.83 -0.18 3.43 1.01 -1.26 -0.45 120.40 125.63 1oz3 s VAL 367 Ca 0.07 1.62 0.03 0.00 0.00 0.00 0.00 61.98 63.71 1oz3 s VAL 367 Cb -0.05 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1oz3 s VAL 367 CO 0.02 -0.07 0.17 0.35 0.00 0.00 0.00 175.10 175.57 1oz3 n THR 368 N 5.19 0.00 -3.76 3.92 -2.24 -0.78 -0.53 114.28 116.08 1oz3 n THR 368 Ca 0.06 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1oz3 n THR 368 Cb 0.48 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.60 1oz3 n THR 368 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1oz3 s ASP 369 N -1.25 -0.32 -0.05 3.42 -1.08 -1.26 -4.93 116.67 111.21 1oz3 s ASP 369 Ca 0.01 0.61 0.01 0.00 -0.52 0.00 0.00 52.55 52.67 1oz3 s ASP 369 Cb 0.03 0.60 0.02 0.00 -1.46 0.00 0.00 42.92 42.10 1oz3 s ASP 369 CO 0.13 -0.12 -0.07 -0.69 0.52 0.00 0.00 175.17 174.94 1oz3 s VAL 370 N 0.34 0.76 -0.17 1.11 1.01 -1.26 -0.63 120.40 121.56 1oz3 s VAL 370 Ca -0.01 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 1oz3 s VAL 370 Cb -0.03 -0.74 0.08 0.00 0.00 0.00 0.00 36.38 35.69 1oz3 s VAL 370 CO -0.01 0.27 0.23 -0.69 0.00 0.00 0.00 175.10 174.90 1oz3 s VAL 371 N 0.81 -0.36 0.00 2.92 1.01 -0.45 -5.01 120.40 119.32 1oz3 s VAL 371 Ca -0.13 0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1oz3 s VAL 371 Cb -0.15 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1oz3 s VAL 371 CO 0.01 -0.05 0.00 0.47 0.00 0.00 0.00 175.10 175.54 1oz3 n ASP 372 N 5.33 0.00 -0.54 3.32 9.92 -1.26 -1.81 116.55 131.51 1oz3 n ASP 372 Ca -0.05 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 54.27 1oz3 n ASP 372 Cb 0.50 0.00 0.20 0.00 -0.64 0.00 0.00 41.12 41.18 1oz3 n ASP 372 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1oz3 n SER 373 N 4.47 1.58 -4.42 -2.24 7.64 -1.26 -3.55 113.62 115.84 1oz3 n SER 373 Ca 0.00 -1.92 -0.21 0.00 1.01 0.00 0.00 58.87 57.75 1oz3 n SER 373 Cb 0.00 -0.18 -0.10 0.00 -1.01 0.00 0.00 64.21 62.92 1oz3 n SER 373 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1oz3 s ARG 374 N -1.65 1.53 0.07 1.43 0.52 -0.75 -4.57 118.95 115.54 1oz3 s ARG 374 Ca 0.23 -1.72 -0.09 0.00 -0.52 0.00 0.00 55.73 53.63 1oz3 s ARG 374 Cb 0.12 -1.38 -0.00 0.00 0.52 0.00 0.00 34.95 34.21 1oz3 s ARG 374 CO 0.17 0.19 0.19 -0.59 0.02 0.00 0.00 175.30 175.27 1oz3 s PHE 375 N -2.81 0.13 -0.22 -0.53 -0.12 -0.27 -1.34 117.98 112.82 1oz3 s PHE 375 Ca 0.27 -0.50 -0.12 0.00 -0.05 0.00 0.00 56.93 56.53 1oz3 s PHE 375 Cb -0.01 -0.05 -0.05 0.00 -0.63 0.00 0.00 43.02 42.28 1oz3 s PHE 375 CO 0.11 -0.51 0.21 -1.17 -0.05 0.00 0.00 175.22 173.82 1oz3 s LEU 376 N -2.64 4.15 -0.25 -1.99 2.96 0.20 -1.15 118.68 119.95 1oz3 s LEU 376 Ca 0.02 0.24 -0.15 0.00 -0.22 0.00 0.00 54.13 54.02 1oz3 s LEU 376 Cb 0.03 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 1oz3 s LEU 376 CO -0.09 0.06 0.36 -0.69 -1.32 0.00 0.00 176.35 174.67 1oz3 s VAL 377 N 0.95 5.20 -0.07 1.68 1.01 -0.13 -1.86 120.40 127.18 1oz3 s VAL 377 Ca 0.11 0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.70 1oz3 s VAL 377 Cb -0.13 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 1oz3 s VAL 377 CO 0.04 0.20 -0.21 -2.28 0.00 0.00 0.00 175.10 172.85 1oz3 s HIS 378 N 1.80 2.55 -0.29 5.22 2.46 0.40 -2.23 115.29 125.20 1oz3 s HIS 378 Ca 0.15 -0.61 -0.25 0.00 0.47 0.00 0.00 55.06 54.83 1oz3 s HIS 378 Cb -0.15 -1.65 0.00 0.00 -0.13 0.00 0.00 32.58 30.65 1oz3 s HIS 378 CO 0.09 -0.14 0.84 -0.06 -2.47 0.00 0.00 174.74 173.00 1oz3 s PHE 379 N -0.18 3.22 -0.11 3.88 0.40 -1.26 -0.20 117.98 123.73 1oz3 s PHE 379 Ca -0.02 0.95 -0.37 0.00 -0.60 0.00 0.00 56.93 56.89 1oz3 s PHE 379 Cb -0.14 -3.24 -0.15 0.00 0.51 0.00 0.00 43.02 40.01 1oz3 s PHE 379 CO 0.03 -0.55 1.68 -0.25 0.70 0.00 0.00 175.22 176.84 1oz3 n ASP 380 N 6.25 2.61 -0.03 1.36 10.43 -1.16 -1.05 116.55 134.97 1oz3 n ASP 380 Ca 0.05 1.06 -0.00 0.00 2.57 0.00 0.00 54.79 58.47 1oz3 n ASP 380 Cb 0.48 -1.25 -0.00 0.00 1.84 0.00 0.00 41.12 42.19 1oz3 n ASP 380 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1oz3 n ASN 381 N 4.94 -3.37 -4.46 -2.24 4.13 -1.26 -3.17 115.26 109.84 1oz3 n ASN 381 Ca 0.23 0.01 -0.27 0.00 1.68 0.00 0.00 54.58 56.23 1oz3 n ASN 381 Cb 0.20 -0.90 -0.11 0.00 -1.54 0.00 0.00 39.78 37.43 1oz3 n ASN 381 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1oz3 s TRP 382 N -1.90 2.39 0.43 3.10 0.51 -0.21 -4.51 118.94 118.74 1oz3 s TRP 382 Ca 0.00 -0.32 -0.20 0.00 -2.12 0.00 0.00 56.10 53.45 1oz3 s TRP 382 Cb 0.00 -1.17 -0.15 0.00 -0.81 0.00 0.00 33.47 31.33 1oz3 s TRP 382 CO 0.00 0.51 0.04 -3.47 -0.51 0.00 0.00 176.95 173.52 1oz3 n ASP 383 N 0.18 -3.06 0.11 2.95 4.64 -1.26 -4.80 116.55 115.30 1oz3 n ASP 383 Ca -0.12 0.77 0.11 0.00 -1.38 0.00 0.00 54.79 54.17 1oz3 n ASP 383 Cb 0.56 -0.88 0.46 0.00 -1.04 0.00 0.00 41.12 40.22 1oz3 n ASP 383 CO 0.00 0.00 0.00 -0.90 -0.82 0.00 0.00 177.20 175.48 1oz3 n ASP 384 N 2.37 0.54 -0.19 1.67 5.75 -1.26 -3.30 116.55 122.13 1oz3 n ASP 384 Ca 0.10 0.64 0.30 0.00 -0.01 0.00 0.00 54.79 55.83 1oz3 n ASP 384 Cb 0.42 -0.75 0.70 0.00 -1.03 0.00 0.00 41.12 40.46 1oz3 n ASP 384 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 1oz3 h THR 385 N 0.00 0.33 -0.13 2.12 2.02 -1.91 -0.33 112.91 115.01 1oz3 h THR 385 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1oz3 h THR 385 Cb 0.32 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1oz3 h THR 385 CO 0.00 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.67 1oz3 n TYR 386 N -3.90 0.14 -1.50 3.16 4.01 -1.21 -4.97 117.16 112.90 1oz3 n TYR 386 Ca 0.20 -0.07 -0.32 0.00 -0.16 0.00 0.00 57.90 57.55 1oz3 n TYR 386 Cb 1.12 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 40.21 1oz3 n TYR 386 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1oz3 s ASP 387 N -1.83 4.91 -0.01 7.72 1.01 -0.14 -4.82 116.67 123.52 1oz3 s ASP 387 Ca 0.31 1.82 -0.24 0.00 0.71 0.00 0.00 52.55 55.15 1oz3 s ASP 387 Cb 0.21 -2.52 0.05 0.00 1.01 0.00 0.00 42.92 41.66 1oz3 s ASP 387 CO 0.30 -1.76 0.52 -0.72 0.21 0.00 0.00 175.17 173.72 1oz3 s TYR 388 N -2.77 -0.44 0.19 4.23 -0.85 -0.95 -4.85 117.35 111.91 1oz3 s TYR 388 Ca 0.62 0.67 -0.22 0.00 -0.52 0.00 0.00 57.07 57.62 1oz3 s TYR 388 Cb -0.17 0.29 -0.08 0.00 0.38 0.00 0.00 41.96 42.38 1oz3 s TYR 388 CO 0.51 -0.56 0.74 -1.58 -1.52 0.00 0.00 175.55 173.14 1oz3 s TRP 389 N -1.63 3.77 0.14 -3.49 0.52 -1.26 -0.96 118.94 116.03 1oz3 s TRP 389 Ca -0.10 1.49 -0.05 0.00 0.02 0.00 0.00 56.10 57.47 1oz3 s TRP 389 Cb -0.02 -2.68 0.02 0.00 -1.15 0.00 0.00 33.47 29.64 1oz3 s TRP 389 CO 0.05 0.43 0.26 0.00 0.02 0.00 0.00 176.95 177.71 1oz3 s ASP 391 N -1.72 2.85 0.61 0.00 1.47 -1.26 -1.12 116.67 117.51 1oz3 s ASP 391 Ca 0.06 -1.45 0.39 0.00 1.18 0.00 0.00 52.55 52.73 1oz3 s ASP 391 Cb -0.02 0.01 1.97 0.00 -0.34 0.00 0.00 42.92 44.54 1oz3 s ASP 391 CO 0.04 -0.65 2.22 1.55 0.68 0.00 0.00 175.17 179.01 1oz3 h PRO 392 N 1.94 0.00 -0.05 2.11 0.13 -1.89 -1.50 132.00 132.74 1oz3 h PRO 392 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1oz3 h PRO 392 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1oz3 h PRO 392 CO 0.70 0.02 0.00 -1.13 -0.23 0.00 0.00 178.00 177.36 1oz3 n SER 393 N -3.18 0.63 -4.65 1.44 3.41 -1.26 -1.89 113.62 108.12 1oz3 n SER 393 Ca -0.02 -1.43 -0.48 0.00 -0.26 0.00 0.00 58.87 56.68 1oz3 n SER 393 Cb 0.16 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.04 1oz3 n SER 393 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1oz3 n SER 394 N -0.41 2.80 0.00 4.04 2.88 -0.57 -3.41 113.62 118.95 1oz3 n SER 394 Ca 0.17 1.08 0.12 0.00 -1.33 0.00 0.00 58.87 58.91 1oz3 n SER 394 Cb 0.18 -1.37 0.61 0.00 -0.75 0.00 0.00 64.21 62.88 1oz3 n SER 394 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1oz3 n PRO 395 N 3.50 0.42 0.00 -1.46 -0.04 -1.26 -3.35 135.00 132.81 1oz3 n PRO 395 Ca 0.18 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 1oz3 n PRO 395 Cb 0.26 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.58 1oz3 n PRO 395 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1oz3 n TYR 396 N -1.22 0.00 -4.39 0.54 4.02 -1.26 -4.94 117.16 109.90 1oz3 n TYR 396 Ca 0.12 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.75 1oz3 n TYR 396 Cb 0.16 -0.07 -0.11 0.00 -0.02 0.00 0.00 39.34 39.31 1oz3 n TYR 396 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1oz3 s ILE 397 N -2.34 2.61 -0.00 -0.72 -4.36 -1.21 -0.89 121.20 114.28 1oz3 s ILE 397 Ca 0.27 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.52 1oz3 s ILE 397 Cb 0.20 -2.29 0.02 0.00 1.25 0.00 0.00 42.46 41.64 1oz3 s ILE 397 CO 0.47 -0.17 0.30 -1.00 0.24 0.00 0.00 174.94 174.78 1oz3 s HIS 398 N -1.83 -0.15 0.81 1.37 3.76 0.10 -5.00 115.29 114.35 1oz3 s HIS 398 Ca 0.24 0.19 -0.10 0.00 -0.15 0.00 0.00 55.06 55.23 1oz3 s HIS 398 Cb -0.08 0.09 0.08 0.00 1.11 0.00 0.00 32.58 33.78 1oz3 s HIS 398 CO 0.12 -0.40 1.11 -1.25 -0.85 0.00 0.00 174.74 173.47 1oz3 s PRO 399 N -1.54 1.92 0.25 8.40 0.04 -1.26 0.10 135.00 142.91 1oz3 s PRO 399 Ca -0.12 1.28 -0.31 0.00 0.04 0.00 0.00 61.00 61.89 1oz3 s PRO 399 Cb -0.05 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 1oz3 s PRO 399 CO 0.03 -1.91 1.54 0.28 0.04 0.00 0.00 177.00 176.98 1oz3 n VAL 400 N -3.71 0.77 0.00 -0.36 0.31 -1.26 -2.49 118.33 111.59 1oz3 n VAL 400 Ca 0.10 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1oz3 n VAL 400 Cb 0.53 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1oz3 n VAL 400 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1oz3 n GLY 401 N 2.50 1.87 0.37 2.92 0.00 -1.26 -4.96 105.19 106.62 1oz3 n GLY 401 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1oz3 n GLY 401 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1oz3 h TRP 402 N 0.00 1.04 0.37 1.61 7.01 -1.84 -1.29 115.95 122.85 1oz3 h TRP 402 Ca 0.00 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 1oz3 h TRP 402 Cb 0.00 -0.34 0.00 0.00 -2.10 0.00 0.00 29.16 26.73 1oz3 h TRP 402 CO 0.00 0.48 -0.18 0.00 -2.79 0.00 0.00 178.44 175.95 1oz3 h GLN 404 N -0.72 0.50 0.00 0.00 4.20 -1.64 -0.17 115.11 117.28 1oz3 h GLN 404 Ca -0.05 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1oz3 h GLN 404 Cb 0.50 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1oz3 h GLN 404 CO 0.08 0.33 0.00 1.17 -0.67 0.00 0.00 178.83 179.75 1oz3 n LYS 405 N -4.94 0.08 -0.00 1.46 4.81 -0.51 -3.27 118.16 115.77 1oz3 n LYS 405 Ca 0.15 0.10 0.07 0.00 -0.87 0.00 0.00 58.31 57.76 1oz3 n LYS 405 Cb 0.41 -1.60 -0.10 0.00 0.02 0.00 0.00 35.03 33.77 1oz3 n LYS 405 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1oz3 n GLN 406 N -1.73 1.12 0.00 1.64 -0.06 -0.56 -5.03 117.38 112.77 1oz3 n GLN 406 Ca 0.06 -0.09 0.00 0.00 -2.00 0.00 0.00 57.00 54.97 1oz3 n GLN 406 Cb 0.34 -1.28 0.00 0.00 -4.06 0.00 0.00 30.24 25.24 1oz3 n GLN 406 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1oz3 n GLY 407 N 1.55 3.08 3.87 1.69 0.00 -0.18 -5.07 105.19 110.13 1oz3 n GLY 407 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1oz3 n GLY 407 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oz3 s LYS 408 N -0.98 3.80 0.38 1.61 2.47 -0.82 -4.94 119.74 121.27 1oz3 s LYS 408 Ca 0.00 0.46 -0.24 0.00 -1.56 0.00 0.00 55.97 54.63 1oz3 s LYS 408 Cb 0.00 -2.43 -0.09 0.00 -1.46 0.00 0.00 37.83 33.85 1oz3 s LYS 408 CO 0.00 0.03 1.02 -1.25 0.16 0.00 0.00 175.35 175.30 1oz3 s PRO 409 N -3.64 4.28 -0.16 4.03 0.04 -1.26 -4.11 135.00 134.17 1oz3 s PRO 409 Ca 0.51 1.44 -0.06 0.00 0.04 0.00 0.00 61.00 62.93 1oz3 s PRO 409 Cb -0.10 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 1oz3 s PRO 409 CO 0.28 -0.03 0.05 -1.17 0.04 0.00 0.00 177.00 176.18 1oz3 s LEU 410 N -2.53 3.78 -0.31 -3.56 0.20 -1.26 -4.50 118.68 110.50 1oz3 s LEU 410 Ca 0.56 0.11 -0.25 0.00 0.69 0.00 0.00 54.13 55.23 1oz3 s LEU 410 Cb -0.20 -1.93 0.01 0.00 -0.43 0.00 0.00 46.19 43.63 1oz3 s LEU 410 CO 0.26 0.23 0.89 -0.89 -0.29 0.00 0.00 176.35 176.54 1oz3 s THR 411 N 0.05 4.69 0.86 3.68 2.01 -0.43 -5.01 115.64 121.50 1oz3 s THR 411 Ca 0.05 1.36 -0.12 0.00 0.31 0.00 0.00 61.69 63.29 1oz3 s THR 411 Cb -0.12 -4.24 0.11 0.00 0.01 0.00 0.00 72.50 68.25 1oz3 s THR 411 CO 0.01 -0.34 1.11 -2.16 -0.69 0.00 0.00 174.62 172.55 1oz3 s PRO 412 N 3.20 1.53 0.29 4.92 0.04 -1.26 -2.06 135.00 141.66 1oz3 s PRO 412 Ca 0.37 0.53 -0.26 0.00 0.04 0.00 0.00 61.00 61.68 1oz3 s PRO 412 Cb -0.13 -1.86 -0.16 0.00 0.04 0.00 0.00 34.50 32.39 1oz3 s PRO 412 CO 0.14 -1.98 0.53 -2.30 0.04 0.00 0.00 177.00 173.43 1oz3 n PRO 413 N -3.66 0.32 -1.62 0.56 -0.02 -1.26 -4.83 135.00 124.49 1oz3 n PRO 413 Ca 0.07 0.11 -0.49 0.00 -2.02 0.00 0.00 63.50 61.17 1oz3 n PRO 413 Cb 0.57 -1.22 -0.05 0.00 -0.02 0.00 0.00 33.50 32.78 1oz3 n PRO 413 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1oz3 n GLN 414 N 0.95 1.49 -3.36 -0.52 -0.06 -1.19 -2.39 117.38 112.29 1oz3 n GLN 414 Ca 0.14 0.54 -0.24 0.00 -2.00 0.00 0.00 57.00 55.44 1oz3 n GLN 414 Cb 0.31 -2.19 0.03 0.00 -4.06 0.00 0.00 30.24 24.33 1oz3 n GLN 414 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1oz3 n ASP 415 N 2.63 -5.27 -4.80 1.69 8.00 -1.26 -4.85 116.55 112.69 1oz3 n ASP 415 Ca 0.17 -0.44 -0.35 0.00 0.71 0.00 0.00 54.79 54.88 1oz3 n ASP 415 Cb 0.24 -4.25 -0.04 0.00 -0.02 0.00 0.00 41.12 37.05 1oz3 n ASP 415 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1oz3 s TYR 416 N -3.15 3.11 -0.28 1.24 5.04 -1.01 -5.00 117.35 117.30 1oz3 s TYR 416 Ca 0.44 1.60 -0.29 0.00 -2.44 0.00 0.00 57.07 56.38 1oz3 s TYR 416 Cb -0.21 -3.05 -0.01 0.00 0.35 0.00 0.00 41.96 39.03 1oz3 s TYR 416 CO 0.54 -0.69 1.45 -1.25 -1.34 0.00 0.00 175.55 174.26 1oz3 s PRO 417 N -3.03 3.83 0.00 4.97 0.04 -1.26 -4.34 135.00 135.21 1oz3 s PRO 417 Ca 0.64 1.39 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1oz3 s PRO 417 Cb -0.17 -3.96 0.00 0.00 0.04 0.00 0.00 34.50 30.41 1oz3 s PRO 417 CO 0.21 -1.24 0.00 -0.25 0.04 0.00 0.00 177.00 175.76 1oz3 n ASP 418 N 8.11 -1.90 -0.02 6.66 8.00 -1.26 -4.98 116.55 131.15 1oz3 n ASP 418 Ca 0.17 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.56 1oz3 n ASP 418 Cb 0.46 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 40.98 1oz3 n ASP 418 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1oz3 h PRO 419 N 0.00 0.19 -0.28 -0.24 0.13 -1.99 -1.64 132.00 128.16 1oz3 h PRO 419 Ca 0.00 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1oz3 h PRO 419 Cb 0.95 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1oz3 h PRO 419 CO 0.00 0.15 0.19 -0.44 -0.23 0.00 0.00 178.00 177.67 1oz3 h ASP 420 N 0.18 0.27 -0.22 1.44 5.19 -1.97 -2.86 116.42 118.45 1oz3 h ASP 420 Ca 0.05 -0.01 -0.15 0.00 -0.62 0.00 0.00 57.03 56.31 1oz3 h ASP 420 Cb 0.00 -0.07 -0.06 0.00 0.18 0.00 0.00 39.33 39.39 1oz3 h ASP 420 CO -0.01 0.19 0.17 -3.20 -3.12 0.00 0.00 179.24 173.27 1oz3 n ASN 421 N -4.49 5.84 -4.64 6.45 5.15 -0.62 -4.93 115.26 118.01 1oz3 n ASN 421 Ca 0.02 -2.70 -0.41 0.00 -0.60 0.00 0.00 54.58 50.89 1oz3 n ASN 421 Cb 0.12 -1.11 -0.05 0.00 -0.53 0.00 0.00 39.78 38.21 1oz3 n ASN 421 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1oz3 s PHE 422 N -0.77 3.32 -0.21 1.20 5.36 -1.08 -5.02 117.98 120.78 1oz3 s PHE 422 Ca 0.16 0.97 0.02 0.00 -0.96 0.00 0.00 56.93 57.12 1oz3 s PHE 422 Cb 0.12 -2.90 0.04 0.00 -0.34 0.00 0.00 43.02 39.93 1oz3 s PHE 422 CO -0.01 -0.30 -0.15 0.00 -1.46 0.00 0.00 175.22 173.30 1oz3 h TRP 424 N 7.88 -0.86 -0.19 0.00 -0.00 -1.98 -1.16 115.95 119.63 1oz3 h TRP 424 Ca -0.33 -0.02 0.05 0.00 -0.00 0.00 0.00 58.89 58.59 1oz3 h TRP 424 Cb 1.10 0.29 -0.01 0.00 -0.00 0.00 0.00 29.16 30.53 1oz3 h TRP 424 CO 0.54 -0.52 0.20 1.49 -0.00 0.00 0.00 178.44 180.16 1oz3 h GLU 425 N -1.01 0.00 0.00 0.49 4.81 -1.99 0.45 114.58 117.33 1oz3 h GLU 425 Ca -0.10 0.00 -0.26 0.00 -0.13 0.00 0.00 59.36 58.87 1oz3 h GLU 425 Cb 0.73 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.07 1oz3 h GLU 425 CO 0.16 0.00 -1.80 1.63 -0.73 0.00 0.00 179.01 178.27 1oz3 n LYS 426 N -3.83 0.64 -0.06 1.92 4.76 -1.23 -2.71 118.16 117.66 1oz3 n LYS 426 Ca 0.02 0.18 -0.09 0.00 -2.87 0.00 0.00 58.31 55.55 1oz3 n LYS 426 Cb 0.33 -1.72 -0.02 0.00 -1.84 0.00 0.00 35.03 31.77 1oz3 n LYS 426 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 1oz3 h TYR 427 N 0.00 0.25 0.30 2.13 3.20 -0.36 -2.00 116.97 120.49 1oz3 h TYR 427 Ca -0.30 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.58 1oz3 h TYR 427 Cb 1.90 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 40.06 1oz3 h TYR 427 CO 0.00 0.15 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.22 1oz3 h LEU 428 N 0.28 -1.05 -1.03 2.82 3.38 -1.08 -0.51 115.31 118.12 1oz3 h LEU 428 Ca 0.09 0.10 0.06 0.00 0.09 0.00 0.00 57.88 58.22 1oz3 h LEU 428 Cb 0.00 0.37 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 1oz3 h LEU 428 CO -0.05 -0.50 0.64 -0.08 0.09 0.00 0.00 178.44 178.54 1oz3 h GLU 429 N -0.73 1.13 0.00 1.13 4.81 -1.58 -1.01 114.58 118.33 1oz3 h GLU 429 Ca -0.01 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.05 1oz3 h GLU 429 Cb 0.68 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1oz3 h GLU 429 CO -0.11 0.75 -0.49 1.49 -0.73 0.00 0.00 179.01 179.92 1oz3 h GLU 430 N 1.17 0.00 -0.43 1.92 4.57 -1.17 -3.08 114.58 117.56 1oz3 h GLU 430 Ca 0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.61 1oz3 h GLU 430 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1oz3 h GLU 430 CO -0.17 0.49 0.00 0.25 -1.18 0.00 0.00 179.01 178.40 1oz3 n THR 431 N -3.88 0.55 -2.39 0.32 -2.24 -0.22 -4.92 114.28 101.51 1oz3 n THR 431 Ca -0.01 -0.78 -0.19 0.00 -2.27 0.00 0.00 64.05 60.80 1oz3 n THR 431 Cb 0.52 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 69.69 1oz3 n THR 431 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oz3 n GLY 432 N 1.54 -0.44 3.71 3.38 0.00 -0.78 -4.96 105.19 107.63 1oz3 n GLY 432 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1oz3 n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oz3 s ALA 433 N -2.93 3.32 0.07 4.61 0.00 -0.45 -5.04 121.76 121.33 1oz3 s ALA 433 Ca 0.00 -1.39 0.04 0.00 0.00 0.00 0.00 51.96 50.61 1oz3 s ALA 433 Cb 0.00 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 1oz3 s ALA 433 CO 0.00 0.42 0.02 -1.54 0.00 0.00 0.00 175.76 174.66 1oz3 s SER 434 N -3.20 5.15 0.39 0.00 1.04 -1.26 -4.43 113.70 111.39 1oz3 s SER 434 Ca 0.29 -0.10 -0.24 0.00 0.48 0.00 0.00 55.95 56.38 1oz3 s SER 434 Cb -0.09 -1.29 -0.09 0.00 0.10 0.00 0.00 66.02 64.65 1oz3 s SER 434 CO 0.21 0.20 1.05 0.00 0.98 0.00 0.00 173.24 175.67 1oz3 s ALA 435 N -1.27 3.11 0.08 5.32 0.00 -1.26 -1.56 121.76 126.17 1oz3 s ALA 435 Ca 0.25 0.71 -0.36 0.00 0.00 0.00 0.00 51.96 52.56 1oz3 s ALA 435 Cb -0.12 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.58 1oz3 s ALA 435 CO 0.17 -0.19 1.48 0.28 0.00 0.00 0.00 175.76 177.50 1oz3 n VAL 436 N 0.03 0.05 -2.17 0.00 0.31 0.14 -4.72 118.33 111.98 1oz3 n VAL 436 Ca 0.04 -0.01 -0.40 0.00 -0.01 0.00 0.00 64.34 63.97 1oz3 n VAL 436 Cb 0.49 -1.16 -0.02 0.00 -0.91 0.00 0.00 33.84 32.24 1oz3 n VAL 436 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1oz3 s PRO 437 N 1.05 4.16 0.51 5.55 0.04 -1.26 -4.59 135.00 140.46 1oz3 s PRO 437 Ca 0.84 2.07 0.18 0.00 0.04 0.00 0.00 61.00 64.12 1oz3 s PRO 437 Cb -0.85 -2.87 1.28 0.00 0.04 0.00 0.00 34.50 32.10 1oz3 s PRO 437 CO 0.45 -0.30 2.12 1.79 0.04 0.00 0.00 177.00 181.10 1oz3 h THR 438 N 2.65 0.96 0.00 1.26 1.35 -1.97 -0.50 112.91 116.66 1oz3 h THR 438 Ca -0.49 -0.20 -0.01 0.00 -0.55 0.00 0.00 66.41 65.17 1oz3 h THR 438 Cb 1.23 1.11 -0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1oz3 h THR 438 CO 0.64 0.06 -0.03 4.11 -0.25 0.00 0.00 175.52 180.04 1oz3 h TRP 439 N 0.00 0.00 -0.14 4.73 5.08 -2.00 -2.83 115.95 120.79 1oz3 h TRP 439 Ca -0.00 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.87 1oz3 h TRP 439 Cb 0.10 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.25 1oz3 h TRP 439 CO 0.00 0.03 -0.34 0.00 -1.28 0.00 0.00 178.44 176.85 1oz3 h ALA 440 N 1.97 1.17 -1.80 0.11 0.00 -1.37 -3.43 119.26 115.90 1oz3 h ALA 440 Ca -0.00 -0.37 -0.57 0.00 0.00 0.00 0.00 54.91 53.97 1oz3 h ALA 440 Cb 0.23 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1oz3 h ALA 440 CO 0.00 0.54 0.83 -0.06 0.00 0.00 0.00 179.25 180.57 1oz3 s PHE 441 N -4.30 2.88 0.41 0.00 0.08 -1.07 -4.84 117.98 111.14 1oz3 s PHE 441 Ca -0.05 0.70 0.01 0.00 0.12 0.00 0.00 56.93 57.70 1oz3 s PHE 441 Cb 0.14 -4.22 -0.01 0.00 -0.57 0.00 0.00 43.02 38.35 1oz3 s PHE 441 CO 0.77 -1.16 0.62 0.15 -0.10 0.00 0.00 175.22 175.50 1oz3 s LYS 442 N 4.18 3.23 -0.42 0.44 -0.14 -0.79 -5.02 119.74 121.21 1oz3 s LYS 442 Ca 0.45 -0.45 -0.14 0.00 -1.36 0.00 0.00 55.97 54.47 1oz3 s LYS 442 Cb -0.08 -2.61 0.04 0.00 -1.68 0.00 0.00 37.83 33.50 1oz3 s LYS 442 CO 0.28 -0.10 0.31 0.08 -0.76 0.00 0.00 175.35 175.16 1oz3 s VAL 443 N -2.45 5.08 -0.01 3.17 1.01 -1.26 -4.37 120.40 121.57 1oz3 s VAL 443 Ca 0.45 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1oz3 s VAL 443 Cb -0.10 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1oz3 s VAL 443 CO 0.37 -0.39 1.10 -0.60 0.00 0.00 0.00 175.10 175.58 1oz3 s ARG 444 N 1.63 4.46 0.57 2.72 3.52 -1.22 -5.02 118.95 125.61 1oz3 s ARG 444 Ca 0.04 1.57 -0.16 0.00 -0.13 0.00 0.00 55.73 57.05 1oz3 s ARG 444 Cb -0.21 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.68 1oz3 s ARG 444 CO 0.08 -0.24 1.05 -1.25 -0.81 0.00 0.00 175.30 174.13 1oz3 s PRO 445 N 1.44 3.45 0.52 5.12 0.04 -1.26 -4.98 135.00 139.32 1oz3 s PRO 445 Ca 0.54 1.20 -0.22 0.00 0.04 0.00 0.00 61.00 62.56 1oz3 s PRO 445 Cb -0.24 -2.05 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 1oz3 s PRO 445 CO 0.25 -0.71 1.28 -0.35 0.04 0.00 0.00 177.00 177.52 1oz3 n PRO 446 N -1.85 1.65 -0.92 0.56 -0.04 -1.26 -4.98 135.00 128.17 1oz3 n PRO 446 Ca 0.09 0.60 -0.29 0.00 -0.04 0.00 0.00 63.50 63.86 1oz3 n PRO 446 Cb 0.53 -2.47 0.18 0.00 -0.04 0.00 0.00 33.50 31.71 1oz3 n PRO 446 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1oz3 s HIS 447 N -1.29 1.87 -0.20 0.54 -3.43 -0.85 -4.98 115.29 106.94 1oz3 s HIS 447 Ca 0.69 1.27 0.15 0.00 -0.80 0.00 0.00 55.06 56.38 1oz3 s HIS 447 Cb -0.44 -3.18 0.34 0.00 -1.43 0.00 0.00 32.58 27.87 1oz3 s HIS 447 CO 0.51 -3.00 1.24 0.43 -2.00 0.00 0.00 174.74 171.92 1oz3 n SER 448 N -4.31 2.90 -4.77 7.38 7.64 -1.26 -4.98 113.62 116.22 1oz3 n SER 448 Ca 0.06 -2.84 -0.40 0.00 1.01 0.00 0.00 58.87 56.70 1oz3 n SER 448 Cb 0.55 -0.40 -0.01 0.00 -1.01 0.00 0.00 64.21 63.34 1oz3 n SER 448 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1oz3 s PHE 449 N -2.47 2.83 0.10 1.43 0.40 -1.26 -5.04 117.98 113.97 1oz3 s PHE 449 Ca 0.31 1.38 0.10 0.00 -0.60 0.00 0.00 56.93 58.11 1oz3 s PHE 449 Cb 0.25 -3.73 -0.04 0.00 0.51 0.00 0.00 43.02 40.02 1oz3 s PHE 449 CO 0.06 -2.18 -0.25 -0.51 0.70 0.00 0.00 175.22 173.04 1oz3 s LEU 450 N -2.24 2.28 0.27 -0.37 1.43 -1.26 -4.96 118.68 113.83 1oz3 s LEU 450 Ca 0.55 -0.69 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 1oz3 s LEU 450 Cb -0.40 -1.14 -0.13 0.00 0.03 0.00 0.00 46.19 44.56 1oz3 s LEU 450 CO 0.52 0.16 1.34 0.52 0.23 0.00 0.00 176.35 179.13 1oz3 n VAL 451 N 1.16 1.35 -0.85 -1.59 0.31 -1.26 -4.71 118.33 112.74 1oz3 n VAL 451 Ca -0.18 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 1oz3 n VAL 451 Cb 0.53 -1.47 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 1oz3 n VAL 451 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1oz3 n ASN 452 N 1.65 -1.13 -3.72 4.52 5.03 0.11 -4.98 115.26 116.74 1oz3 n ASN 452 Ca 0.09 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.42 1oz3 n ASN 452 Cb 0.33 -0.57 -0.07 0.00 -1.02 0.00 0.00 39.78 38.45 1oz3 n ASN 452 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1oz3 s LYS 454 N -0.63 0.84 0.05 3.52 1.02 -0.74 -4.66 119.74 119.14 1oz3 s LYS 454 Ca 0.00 -0.42 -0.02 0.00 0.02 0.00 0.00 55.97 55.55 1oz3 s LYS 454 Cb 0.00 0.37 0.01 0.00 -0.52 0.00 0.00 37.83 37.68 1oz3 s LYS 454 CO 0.00 -0.27 0.09 1.47 -0.92 0.00 0.00 175.35 175.72 1oz3 n LEU 455 N 0.61 0.00 -4.30 3.17 -0.00 -0.07 -0.72 117.00 115.69 1oz3 n LEU 455 Ca -0.19 -0.32 -0.31 0.00 -0.00 0.00 0.00 56.01 55.19 1oz3 n LEU 455 Cb 0.59 0.45 -0.16 0.00 -0.00 0.00 0.00 43.42 44.30 1oz3 n LEU 455 CO 0.21 -0.10 -0.57 -1.61 -0.00 0.00 0.00 177.39 175.32 1oz3 s GLU 456 N -2.02 2.25 -0.08 1.47 2.02 -0.43 -0.82 118.70 121.09 1oz3 s GLU 456 Ca 0.02 -0.92 -0.07 0.00 0.02 0.00 0.00 54.97 54.02 1oz3 s GLU 456 Cb -0.01 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.16 1oz3 s GLU 456 CO 0.02 0.51 0.21 0.00 0.02 0.00 0.00 175.26 176.01 1oz3 s ALA 457 N -0.47 -0.51 0.38 5.21 0.00 -0.51 -0.72 121.76 125.13 1oz3 s ALA 457 Ca 0.06 0.60 -0.27 0.00 0.00 0.00 0.00 51.96 52.34 1oz3 s ALA 457 Cb -0.11 -0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.56 1oz3 s ALA 457 CO 0.00 -0.10 1.35 0.14 0.00 0.00 0.00 175.76 177.15 1oz3 s VAL 458 N 0.18 2.51 -0.35 0.00 -7.23 -0.52 -0.89 120.40 114.09 1oz3 s VAL 458 Ca -0.01 0.49 -0.21 0.00 -1.81 0.00 0.00 61.98 60.44 1oz3 s VAL 458 Cb -0.02 -3.30 0.00 0.00 0.56 0.00 0.00 36.38 33.62 1oz3 s VAL 458 CO -0.00 0.10 0.65 -0.62 -0.31 0.00 0.00 175.10 174.91 1oz3 s ASP 459 N -0.51 6.44 0.51 4.85 3.68 -0.30 -4.90 116.67 126.43 1oz3 s ASP 459 Ca 0.53 0.18 0.25 0.00 2.13 0.00 0.00 52.55 55.64 1oz3 s ASP 459 Cb -0.41 -2.33 1.36 0.00 -1.45 0.00 0.00 42.92 40.09 1oz3 s ASP 459 CO 0.54 -0.60 2.05 0.03 0.13 0.00 0.00 175.17 177.32 1oz3 h ARG 460 N 8.45 0.00 -0.11 4.34 3.08 -1.93 -1.83 114.38 126.38 1oz3 h ARG 460 Ca -0.26 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.73 1oz3 h ARG 460 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 1oz3 h ARG 460 CO 0.84 0.14 -0.21 0.00 -1.07 0.00 0.00 179.97 179.67 1oz3 h ARG 461 N 0.00 0.18 -1.74 0.04 3.08 -1.98 -3.38 114.38 110.58 1oz3 h ARG 461 Ca -0.00 -0.05 -0.32 0.00 0.07 0.00 0.00 59.98 59.68 1oz3 h ARG 461 Cb 0.34 -0.02 -0.28 0.00 0.08 0.00 0.00 29.97 30.09 1oz3 h ARG 461 CO 0.02 0.39 -0.66 1.21 -1.07 0.00 0.00 179.97 179.85 1oz3 s ASN 462 N -6.90 0.50 0.22 7.04 3.04 -0.76 -5.05 114.94 113.03 1oz3 s ASN 462 Ca -0.05 -1.64 0.15 0.00 0.04 0.00 0.00 52.86 51.36 1oz3 s ASN 462 Cb 0.15 0.82 0.80 0.00 -1.54 0.00 0.00 41.25 41.47 1oz3 s ASN 462 CO 0.73 -0.21 1.45 -2.65 -3.04 0.00 0.00 177.10 173.38 1oz3 n PRO 463 N 3.98 0.10 0.27 0.43 -0.02 -0.79 -1.17 135.00 137.79 1oz3 n PRO 463 Ca 0.14 0.59 0.17 0.00 -2.02 0.00 0.00 63.50 62.37 1oz3 n PRO 463 Cb 0.48 -1.81 0.92 0.00 -0.02 0.00 0.00 33.50 33.07 1oz3 n PRO 463 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oz3 h ALA 464 N 2.01 1.56 -2.67 3.55 0.00 -1.97 -3.45 119.26 118.30 1oz3 h ALA 464 Ca 0.00 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 1oz3 h ALA 464 Cb 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 1oz3 h ALA 464 CO 0.00 -0.11 -0.48 -0.51 0.00 0.00 0.00 179.25 178.15 1oz3 s LEU 465 N -7.45 4.38 0.02 0.00 1.43 -0.31 -5.02 118.68 111.73 1oz3 s LEU 465 Ca -0.05 0.45 0.08 0.00 -1.03 0.00 0.00 54.13 53.58 1oz3 s LEU 465 Cb 0.15 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 1oz3 s LEU 465 CO 0.53 0.39 -0.24 -0.63 0.23 0.00 0.00 176.35 176.63 1oz3 s ILE 466 N -1.06 1.90 0.10 -0.59 1.01 -1.26 -1.15 121.20 120.14 1oz3 s ILE 466 Ca 0.16 -1.18 0.05 0.00 0.00 0.00 0.00 60.65 59.68 1oz3 s ILE 466 Cb -0.12 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1oz3 s ILE 466 CO 0.06 0.38 -0.12 -0.13 0.00 0.00 0.00 174.94 175.13 1oz3 s ARG 467 N -0.95 0.88 0.23 2.79 0.52 -0.07 -0.70 118.95 121.66 1oz3 s ARG 467 Ca 0.10 -1.12 -0.32 0.00 -0.52 0.00 0.00 55.73 53.86 1oz3 s ARG 467 Cb -0.09 -0.70 -0.12 0.00 0.52 0.00 0.00 34.95 34.55 1oz3 s ARG 467 CO 0.01 0.13 1.66 0.28 0.02 0.00 0.00 175.30 177.40 1oz3 n VAL 468 N 0.74 0.33 -4.10 3.52 0.31 -0.93 -1.43 118.33 116.77 1oz3 n VAL 468 Ca -0.17 -0.08 -0.09 0.00 -0.01 0.00 0.00 64.34 63.98 1oz3 n VAL 468 Cb 0.57 -1.91 -0.09 0.00 -0.91 0.00 0.00 33.84 31.49 1oz3 n VAL 468 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1oz3 s ALA 469 N 0.76 0.62 0.07 3.52 0.00 -0.00 -2.99 121.76 123.74 1oz3 s ALA 469 Ca 0.72 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 51.42 1oz3 s ALA 469 Cb -0.53 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 1oz3 s ALA 469 CO 0.38 -0.50 -0.12 -1.12 0.00 0.00 0.00 175.76 174.40 1oz3 s SER 470 N -3.01 1.46 -0.39 0.00 0.01 0.17 -0.89 113.70 111.05 1oz3 s SER 470 Ca 0.20 -0.61 -0.28 0.00 1.31 0.00 0.00 55.95 56.57 1oz3 s SER 470 Cb 0.07 -0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.29 1oz3 s SER 470 CO -0.01 -0.12 1.06 -0.69 0.41 0.00 0.00 173.24 173.90 1oz3 s VAL 471 N -1.37 4.41 -0.10 3.43 1.01 -1.26 -0.68 120.40 125.84 1oz3 s VAL 471 Ca -0.04 1.41 0.09 0.00 0.00 0.00 0.00 61.98 63.44 1oz3 s VAL 471 Cb -0.10 -4.47 -0.24 0.00 0.00 0.00 0.00 36.38 31.58 1oz3 s VAL 471 CO 0.02 -0.70 0.43 1.21 0.00 0.00 0.00 175.10 176.06 1oz3 n GLU 472 N 7.21 0.67 -3.81 2.72 4.07 0.36 0.04 120.64 131.90 1oz3 n GLU 472 Ca 0.11 0.22 -0.09 0.00 -0.06 0.00 0.00 57.16 57.34 1oz3 n GLU 472 Cb 0.48 -1.71 -0.03 0.00 -0.06 0.00 0.00 31.44 30.12 1oz3 n GLU 472 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1oz3 s ASP 473 N -6.22 -0.24 0.01 4.31 3.68 -1.22 -4.88 116.67 112.10 1oz3 s ASP 473 Ca -0.12 -0.59 0.00 0.00 2.13 0.00 0.00 52.55 53.98 1oz3 s ASP 473 Cb 0.07 0.63 -0.01 0.00 -1.45 0.00 0.00 42.92 42.16 1oz3 s ASP 473 CO 0.80 -1.15 -0.01 0.68 0.13 0.00 0.00 175.17 175.61 1oz3 s VAL 474 N -3.91 0.05 0.20 1.11 -7.23 -1.26 -1.18 120.40 108.18 1oz3 s VAL 474 Ca 0.12 -0.36 0.00 0.00 -1.81 0.00 0.00 61.98 59.93 1oz3 s VAL 474 Cb -0.02 -0.12 0.00 0.00 0.56 0.00 0.00 36.38 36.80 1oz3 s VAL 474 CO 0.02 -0.19 0.04 -0.62 -0.31 0.00 0.00 175.10 174.04 1oz3 n GLU 475 N 2.50 1.44 -0.28 4.82 1.02 -0.28 -5.01 120.64 124.84 1oz3 n GLU 475 Ca -0.17 -1.40 -0.03 0.00 -0.02 0.00 0.00 57.16 55.54 1oz3 n GLU 475 Cb 0.58 0.32 0.09 0.00 -0.02 0.00 0.00 31.44 32.41 1oz3 n GLU 475 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1oz3 h ASP 476 N 0.42 0.85 0.00 1.62 3.32 -2.00 -3.30 116.42 117.32 1oz3 h ASP 476 Ca -0.16 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1oz3 h ASP 476 Cb 0.49 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1oz3 h ASP 476 CO 0.26 0.60 0.00 1.41 -1.72 0.00 0.00 179.24 179.78 1oz3 n HIS 477 N -4.58 0.00 -4.17 4.55 8.25 -1.26 -2.01 115.22 116.00 1oz3 n HIS 477 Ca 0.09 -0.21 -0.15 0.00 -0.26 0.00 0.00 57.72 57.19 1oz3 n HIS 477 Cb 0.06 -0.02 -0.11 0.00 1.12 0.00 0.00 29.99 31.04 1oz3 n HIS 477 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1oz3 s ARG 478 N -0.42 0.81 0.08 -0.41 0.52 -1.25 -1.43 118.95 116.86 1oz3 s ARG 478 Ca 0.00 -1.08 0.07 0.00 -0.52 0.00 0.00 55.73 54.21 1oz3 s ARG 478 Cb 0.00 -0.58 -0.03 0.00 0.52 0.00 0.00 34.95 34.86 1oz3 s ARG 478 CO 0.00 0.10 -0.20 0.96 0.02 0.00 0.00 175.30 176.18 1oz3 s ILE 479 N -2.08 1.60 -0.25 1.52 -4.36 0.30 -1.13 121.20 116.80 1oz3 s ILE 479 Ca 0.02 -1.36 -0.12 0.00 -0.26 0.00 0.00 60.65 58.92 1oz3 s ILE 479 Cb -0.05 -1.44 -0.05 0.00 1.25 0.00 0.00 42.46 42.18 1oz3 s ILE 479 CO 0.01 0.02 0.25 -0.75 0.24 0.00 0.00 174.94 174.71 1oz3 s LYS 480 N -1.59 4.04 -0.11 0.37 2.20 -0.33 -0.46 119.74 123.87 1oz3 s LYS 480 Ca 0.06 -0.14 -0.11 0.00 -0.36 0.00 0.00 55.97 55.42 1oz3 s LYS 480 Cb -0.09 -3.60 -0.05 0.00 -1.51 0.00 0.00 37.83 32.58 1oz3 s LYS 480 CO 0.03 -0.09 0.25 0.42 -0.36 0.00 0.00 175.35 175.59 1oz3 s ILE 481 N 1.51 5.32 -0.10 5.43 -1.09 0.65 -0.49 121.20 132.44 1oz3 s ILE 481 Ca 0.11 0.46 0.04 0.00 -2.23 0.00 0.00 60.65 59.02 1oz3 s ILE 481 Cb -0.15 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.18 1oz3 s ILE 481 CO 0.08 0.52 -0.22 -2.28 -1.23 0.00 0.00 174.94 171.80 1oz3 s HIS 482 N -0.40 2.43 -0.38 3.97 5.65 0.14 -1.74 115.29 124.97 1oz3 s HIS 482 Ca 0.17 -1.02 -0.23 0.00 0.25 0.00 0.00 55.06 54.22 1oz3 s HIS 482 Cb -0.13 -1.64 0.01 0.00 -1.18 0.00 0.00 32.58 29.64 1oz3 s HIS 482 CO 0.05 -0.43 0.78 -0.06 -0.65 0.00 0.00 174.74 174.44 1oz3 s PHE 483 N 0.45 3.09 0.03 3.88 2.99 -1.26 0.45 117.98 127.61 1oz3 s PHE 483 Ca -0.17 0.49 -0.35 0.00 0.00 0.00 0.00 56.93 56.91 1oz3 s PHE 483 Cb -0.17 -3.44 -0.13 0.00 0.00 0.00 0.00 43.02 39.28 1oz3 s PHE 483 CO 0.07 -0.77 1.69 -0.25 -0.00 0.00 0.00 175.22 175.96 1oz3 n ASP 484 N 6.46 3.05 0.00 1.36 9.92 -1.16 -1.34 116.55 134.84 1oz3 n ASP 484 Ca 0.03 1.04 0.00 0.00 -0.53 0.00 0.00 54.79 55.33 1oz3 n ASP 484 Cb 0.48 -1.36 0.00 0.00 -0.64 0.00 0.00 41.12 39.60 1oz3 n ASP 484 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1oz3 n GLY 485 N 3.77 0.83 3.82 0.44 0.00 -1.26 -2.71 105.19 110.09 1oz3 n GLY 485 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 1oz3 n GLY 485 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1oz3 s TRP 486 N -2.56 2.83 0.54 1.61 0.52 -0.45 -4.46 118.94 116.97 1oz3 s TRP 486 Ca 0.00 -0.34 -0.22 0.00 0.02 0.00 0.00 56.10 55.56 1oz3 s TRP 486 Cb 0.00 -1.79 -0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1oz3 s TRP 486 CO 0.00 0.20 1.34 0.45 0.02 0.00 0.00 176.95 178.96 1oz3 s SER 487 N -3.97 5.32 0.11 2.95 0.15 -1.26 -4.85 113.70 112.15 1oz3 s SER 487 Ca 0.41 2.72 0.16 0.00 0.70 0.00 0.00 55.95 59.94 1oz3 s SER 487 Cb -0.04 -2.63 0.72 0.00 -1.71 0.00 0.00 66.02 62.35 1oz3 s SER 487 CO 0.26 -1.53 1.51 1.41 1.20 0.00 0.00 173.24 176.08 1oz3 n HIS 488 N -1.02 0.34 0.31 3.44 8.25 -1.26 -2.17 115.22 123.10 1oz3 n HIS 488 Ca 0.10 0.14 0.18 0.00 -0.26 0.00 0.00 57.72 57.88 1oz3 n HIS 488 Cb 0.45 -0.73 1.02 0.00 1.12 0.00 0.00 29.99 31.86 1oz3 n HIS 488 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1oz3 h GLY 489 N 1.92 0.00 -1.43 -1.41 0.00 -2.01 -1.72 103.07 98.42 1oz3 h GLY 489 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1oz3 h GLY 489 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1oz3 n TYR 490 N -3.50 0.16 -1.77 5.60 4.01 -0.92 -4.95 117.16 115.78 1oz3 n TYR 490 Ca -0.03 -0.08 -0.41 0.00 -0.16 0.00 0.00 57.90 57.22 1oz3 n TYR 490 Cb 0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1oz3 n TYR 490 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1oz3 n ASP 491 N 0.89 3.81 -3.82 7.72 9.92 -0.65 -4.89 116.55 129.53 1oz3 n ASP 491 Ca 0.17 1.22 -0.12 0.00 -0.53 0.00 0.00 54.79 55.53 1oz3 n ASP 491 Cb 0.49 -1.62 -0.09 0.00 -0.64 0.00 0.00 41.12 39.25 1oz3 n ASP 491 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 1oz3 s PHE 492 N -1.05 -0.07 0.22 1.24 -0.71 -0.71 -4.94 117.98 111.96 1oz3 s PHE 492 Ca 0.54 0.06 -0.26 0.00 -1.04 0.00 0.00 56.93 56.23 1oz3 s PHE 492 Cb -0.48 0.02 -0.09 0.00 -1.21 0.00 0.00 43.02 41.27 1oz3 s PHE 492 CO 0.63 -0.33 0.84 -1.58 -1.34 0.00 0.00 175.22 173.43 1oz3 s TRP 493 N -1.35 3.86 -0.04 3.49 0.52 -1.26 -0.25 118.94 123.92 1oz3 s TRP 493 Ca -0.14 1.70 -0.12 0.00 0.02 0.00 0.00 56.10 57.55 1oz3 s TRP 493 Cb -0.06 -2.83 0.02 0.00 -1.15 0.00 0.00 33.47 29.45 1oz3 s TRP 493 CO 0.03 0.43 0.28 -1.50 0.02 0.00 0.00 176.95 176.21 1oz3 s ILE 494 N -1.28 0.05 0.28 2.03 2.07 0.39 -4.96 121.20 119.79 1oz3 s ILE 494 Ca 0.40 -0.38 -0.29 0.00 -1.41 0.00 0.00 60.65 58.96 1oz3 s ILE 494 Cb -0.22 -0.54 -0.10 0.00 0.13 0.00 0.00 42.46 41.73 1oz3 s ILE 494 CO 0.27 -0.21 1.25 -1.81 -1.91 0.00 0.00 174.94 172.53 1oz3 s ASP 495 N -0.94 6.94 0.54 4.50 1.01 -1.26 -0.54 116.67 126.90 1oz3 s ASP 495 Ca -0.10 2.50 0.25 0.00 0.71 0.00 0.00 52.55 55.91 1oz3 s ASP 495 Cb -0.05 -2.63 1.41 0.00 1.01 0.00 0.00 42.92 42.66 1oz3 s ASP 495 CO 0.03 -0.43 2.01 0.00 0.21 0.00 0.00 175.17 176.99 1oz3 h ALA 496 N 4.00 2.41 -0.53 5.23 0.00 -1.57 -1.80 119.26 127.00 1oz3 h ALA 496 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1oz3 h ALA 496 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1oz3 h ALA 496 CO 0.69 -0.59 0.00 -0.40 0.00 0.00 0.00 179.25 178.94 1oz3 n ASP 497 N -4.32 3.97 -4.76 0.00 5.75 -1.26 -4.87 116.55 111.07 1oz3 n ASP 497 Ca 0.08 -2.36 -0.41 0.00 -0.01 0.00 0.00 54.79 52.09 1oz3 n ASP 497 Cb 0.56 -0.52 -0.02 0.00 -1.03 0.00 0.00 41.12 40.11 1oz3 n ASP 497 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1oz3 s HIS 498 N -1.79 3.09 -0.39 2.11 2.46 -0.68 -4.90 115.29 115.19 1oz3 s HIS 498 Ca 0.42 1.30 0.21 0.00 0.47 0.00 0.00 55.06 57.46 1oz3 s HIS 498 Cb 0.27 -3.69 1.00 0.00 -0.13 0.00 0.00 32.58 30.03 1oz3 s HIS 498 CO 0.20 -2.01 1.63 -2.30 -2.47 0.00 0.00 174.74 169.80 1oz3 n PRO 499 N 1.45 0.15 -0.73 2.88 -0.02 -1.26 -3.20 135.00 134.27 1oz3 n PRO 499 Ca 0.02 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 62.11 1oz3 n PRO 499 Cb 0.42 -1.88 0.35 0.00 -0.02 0.00 0.00 33.50 32.37 1oz3 n PRO 499 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1oz3 n ASP 500 N -2.18 5.06 -4.39 2.55 8.00 -1.26 -4.86 116.55 119.47 1oz3 n ASP 500 Ca 0.00 -2.94 -0.30 0.00 0.71 0.00 0.00 54.79 52.26 1oz3 n ASP 500 Cb 0.11 -0.63 -0.14 0.00 -0.02 0.00 0.00 41.12 40.44 1oz3 n ASP 500 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1oz3 s ILE 501 N -2.74 2.41 0.05 0.53 -4.36 -1.19 -1.43 121.20 114.47 1oz3 s ILE 501 Ca 0.50 -1.29 -0.09 0.00 -0.26 0.00 0.00 60.65 59.51 1oz3 s ILE 501 Cb 0.39 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 42.13 1oz3 s ILE 501 CO 0.14 0.37 0.20 -1.00 0.24 0.00 0.00 174.94 174.88 1oz3 s HIS 502 N -0.84 0.07 0.59 1.37 3.76 0.10 -4.84 115.29 115.50 1oz3 s HIS 502 Ca 0.13 -0.34 -0.17 0.00 -0.15 0.00 0.00 55.06 54.53 1oz3 s HIS 502 Cb -0.10 -0.03 -0.03 0.00 1.11 0.00 0.00 32.58 33.52 1oz3 s HIS 502 CO 0.03 -0.46 1.10 -1.25 -0.85 0.00 0.00 174.74 173.31 1oz3 s PRO 503 N -2.88 3.17 0.17 8.40 0.04 -1.26 -1.32 135.00 141.33 1oz3 s PRO 503 Ca -0.03 1.43 -0.33 0.00 0.04 0.00 0.00 61.00 62.11 1oz3 s PRO 503 Cb 0.00 -2.00 -0.15 0.00 0.04 0.00 0.00 34.50 32.39 1oz3 s PRO 503 CO -0.06 -0.96 1.25 0.00 0.04 0.00 0.00 177.00 177.27 1oz3 n ALA 504 N -1.83 -0.40 -0.15 8.56 0.00 -1.26 -1.93 120.51 123.49 1oz3 n ALA 504 Ca 0.10 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1oz3 n ALA 504 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1oz3 n ALA 504 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oz3 n GLY 505 N 2.17 0.77 0.09 0.00 0.00 -1.26 -4.98 105.19 101.97 1oz3 n GLY 505 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 1oz3 n GLY 505 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1oz3 h TRP 506 N 0.00 0.17 -0.63 1.61 7.01 -1.75 -0.89 115.95 121.47 1oz3 h TRP 506 Ca 0.00 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.03 1oz3 h TRP 506 Cb 0.00 -0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 26.96 1oz3 h TRP 506 CO 0.00 0.23 0.37 0.00 -2.79 0.00 0.00 178.44 176.25 1oz3 h SER 508 N 0.72 0.54 0.98 0.00 0.87 -1.68 -0.17 113.55 114.82 1oz3 h SER 508 Ca 0.27 -0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 1oz3 h SER 508 Cb 0.09 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1oz3 h SER 508 CO -0.13 0.68 -0.27 0.11 -0.53 0.00 0.00 176.83 176.68 1oz3 h LYS 509 N 0.39 0.00 0.00 2.24 1.57 -0.91 -3.19 116.57 116.67 1oz3 h LYS 509 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1oz3 h LYS 509 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1oz3 h LYS 509 CO 0.01 0.27 -0.99 0.25 -0.57 0.00 0.00 179.45 178.42 1oz3 n THR 510 N -3.40 0.01 -1.70 -0.16 -2.24 -0.57 -4.90 114.28 101.31 1oz3 n THR 510 Ca 0.00 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1oz3 n THR 510 Cb 0.48 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 1oz3 n THR 510 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oz3 n GLY 511 N 1.48 0.64 3.70 3.38 0.00 -0.38 -3.79 105.19 110.21 1oz3 n GLY 511 Ca 0.04 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 1oz3 n GLY 511 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1oz3 s HIS 512 N -2.03 3.28 0.52 1.61 5.04 -0.21 -3.87 115.29 119.62 1oz3 s HIS 512 Ca 0.00 0.19 -0.22 0.00 -1.54 0.00 0.00 55.06 53.49 1oz3 s HIS 512 Cb 0.00 -1.94 -0.07 0.00 0.04 0.00 0.00 32.58 30.61 1oz3 s HIS 512 CO 0.00 0.38 1.22 -2.30 -2.34 0.00 0.00 174.74 171.70 1oz3 n PRO 513 N 2.72 1.54 -4.36 2.88 -0.02 -1.26 -4.24 135.00 132.25 1oz3 n PRO 513 Ca -0.18 0.56 -0.34 0.00 -2.02 0.00 0.00 63.50 61.53 1oz3 n PRO 513 Cb 0.53 -2.39 -0.14 0.00 -0.02 0.00 0.00 33.50 31.48 1oz3 n PRO 513 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1oz3 s LEU 514 N -2.44 2.82 -0.15 2.45 0.20 -1.26 -4.52 118.68 115.79 1oz3 s LEU 514 Ca 0.69 -0.34 -0.29 0.00 0.69 0.00 0.00 54.13 54.88 1oz3 s LEU 514 Cb -0.45 -1.68 -0.02 0.00 -0.43 0.00 0.00 46.19 43.62 1oz3 s LEU 514 CO 0.51 0.09 1.26 -1.10 -0.29 0.00 0.00 176.35 176.83 1oz3 s GLN 515 N 0.83 4.25 0.81 1.98 -1.52 0.12 -4.83 119.66 121.30 1oz3 s GLN 515 Ca -0.03 1.68 -0.11 0.00 -1.95 0.00 0.00 55.36 54.95 1oz3 s GLN 515 Cb -0.15 -3.74 0.07 0.00 -0.22 0.00 0.00 33.01 28.98 1oz3 s GLN 515 CO 0.01 -0.67 1.10 -1.25 -0.25 0.00 0.00 175.29 174.22 1oz3 s PRO 516 N 3.32 2.02 0.40 2.91 0.04 -1.26 -2.19 135.00 140.24 1oz3 s PRO 516 Ca 0.55 0.64 -0.27 0.00 0.04 0.00 0.00 61.00 61.96 1oz3 s PRO 516 Cb -0.22 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 1oz3 s PRO 516 CO 0.16 -1.67 1.39 -0.35 0.04 0.00 0.00 177.00 176.58 1oz3 n PRO 517 N -3.46 2.31 0.00 0.56 -0.04 -1.26 -4.80 135.00 128.31 1oz3 n PRO 517 Ca 0.07 0.82 0.14 0.00 -0.04 0.00 0.00 63.50 64.48 1oz3 n PRO 517 Cb 0.56 -2.54 0.44 0.00 -0.04 0.00 0.00 33.50 31.93 1oz3 n PRO 517 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35