#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rjc s TRP 206 N 0.00 3.41 -0.01 0.00 -0.00 -1.26 -5.04 118.94 116.05 2rjc s TRP 206 Ca 0.00 1.34 -0.05 0.00 -0.00 0.00 0.00 56.10 57.39 2rjc s TRP 206 Cb 0.00 -3.46 -0.00 0.00 -0.00 0.00 0.00 33.47 30.01 2rjc s TRP 206 CO 0.00 -1.35 0.10 -1.54 -0.00 0.00 0.00 176.95 174.15 2rjc s SER 207 N 0.48 0.04 0.18 5.86 1.04 -1.26 -5.06 113.70 114.97 2rjc s SER 207 Ca 0.56 -0.16 -0.14 0.00 0.48 0.00 0.00 55.95 56.69 2rjc s SER 207 Cb -0.32 0.19 0.15 0.00 0.10 0.00 0.00 66.02 66.14 2rjc s SER 207 CO 0.34 -0.27 1.73 -0.50 0.98 0.00 0.00 173.24 175.52 2rjc h TRP 208 N 4.78 0.20 -0.67 5.02 4.06 -1.98 -1.31 115.95 126.05 2rjc h TRP 208 Ca -0.30 0.03 0.10 0.00 2.06 0.00 0.00 58.89 60.78 2rjc h TRP 208 Cb 1.20 -0.02 -0.08 0.00 -1.00 0.00 0.00 29.16 29.26 2rjc h TRP 208 CO 0.56 0.04 0.28 1.49 -3.56 0.00 0.00 178.44 177.25 2rjc h GLU 209 N 0.26 0.46 -0.27 0.49 4.81 -1.99 -0.84 114.58 117.50 2rjc h GLU 209 Ca 0.22 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.23 2rjc h GLU 209 Cb 0.26 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2rjc h GLU 209 CO -0.26 0.30 -0.58 0.77 -0.73 0.00 0.00 179.01 178.51 2rjc h SER 210 N 0.47 0.98 -0.39 1.04 0.02 -1.91 -2.93 113.55 110.83 2rjc h SER 210 Ca 0.34 -0.55 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 2rjc h SER 210 Cb 0.42 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 2rjc h SER 210 CO -0.31 1.35 0.11 0.22 -1.14 0.00 0.00 176.83 177.05 2rjc h TYR 211 N 0.66 0.71 -0.13 3.45 3.20 -0.98 -0.53 116.97 123.34 2rjc h TYR 211 Ca 0.01 -0.06 -0.21 0.00 3.14 0.00 0.00 58.73 61.61 2rjc h TYR 211 Cb 1.19 -0.21 0.01 0.00 1.54 0.00 0.00 36.73 39.26 2rjc h TYR 211 CO 0.08 0.61 -0.74 -0.07 -1.64 0.00 0.00 178.16 176.39 2rjc h LEU 212 N 0.67 0.87 -0.21 2.82 3.38 -1.14 0.35 115.31 122.06 2rjc h LEU 212 Ca 0.15 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 2rjc h LEU 212 Cb 0.26 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2rjc h LEU 212 CO -0.00 1.38 0.09 1.05 0.09 0.00 0.00 178.44 181.04 2rjc h GLU 213 N 0.43 0.31 -0.17 1.13 4.11 -1.36 0.84 114.58 119.87 2rjc h GLU 213 Ca -0.06 -0.05 -0.03 0.00 0.07 0.00 0.00 59.36 59.29 2rjc h GLU 213 Cb 1.38 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 2rjc h GLU 213 CO 0.15 0.36 -0.05 1.05 0.07 0.00 0.00 179.01 180.59 2rjc h GLU 214 N 0.18 0.26 -0.00 1.06 4.11 -0.96 -2.54 114.58 116.69 2rjc h GLU 214 Ca 0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.45 2rjc h GLU 214 Cb 0.17 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2rjc h GLU 214 CO -0.01 0.33 -0.61 1.04 0.07 0.00 0.00 179.01 179.83 2rjc n GLN 215 N -4.34 0.23 -3.60 1.06 1.13 0.10 -4.98 117.38 106.99 2rjc n GLN 215 Ca -0.00 -0.16 -0.21 0.00 -1.94 0.00 0.00 57.00 54.69 2rjc n GLN 215 Cb 0.21 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 29.11 2rjc n GLN 215 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2rjc n LYS 216 N -1.24 -4.61 -4.41 -1.09 5.02 0.21 -5.00 118.16 107.03 2rjc n LYS 216 Ca 0.06 0.68 -0.21 0.00 -2.02 0.00 0.00 58.31 56.82 2rjc n LYS 216 Cb 0.35 -5.29 -0.10 0.00 -0.02 0.00 0.00 35.03 29.97 2rjc n LYS 216 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2rjc s ALA 217 N -3.56 2.25 0.10 7.82 0.00 -0.70 -5.05 121.76 122.61 2rjc s ALA 217 Ca 0.09 -1.79 0.07 0.00 0.00 0.00 0.00 51.96 50.33 2rjc s ALA 217 Cb -0.02 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 2rjc s ALA 217 CO 0.79 -0.38 -0.17 0.96 0.00 0.00 0.00 175.76 176.96 2rjc s ILE 218 N -3.45 1.40 0.24 0.00 -4.36 -1.26 -4.73 121.20 109.04 2rjc s ILE 218 Ca 0.34 -1.49 -0.16 0.00 -0.26 0.00 0.00 60.65 59.08 2rjc s ILE 218 Cb 0.07 -1.36 -0.08 0.00 1.25 0.00 0.00 42.46 42.33 2rjc s ILE 218 CO 0.15 -0.20 0.67 0.42 0.24 0.00 0.00 174.94 176.22 2rjc s THR 219 N -1.41 4.70 -0.10 8.37 -4.23 -1.26 -1.53 115.64 120.17 2rjc s THR 219 Ca 0.04 1.00 -0.34 0.00 -1.18 0.00 0.00 61.69 61.21 2rjc s THR 219 Cb -0.09 -3.73 -0.12 0.00 1.34 0.00 0.00 72.50 69.91 2rjc s THR 219 CO 0.03 0.06 1.90 0.00 -0.54 0.00 0.00 174.62 176.08 2rjc n ALA 220 N 0.30 0.91 -1.62 3.99 0.00 0.27 -4.70 120.51 119.67 2rjc n ALA 220 Ca -0.01 0.26 -0.38 0.00 0.00 0.00 0.00 53.44 53.31 2rjc n ALA 220 Cb 0.52 -2.51 0.04 0.00 0.00 0.00 0.00 19.45 17.50 2rjc n ALA 220 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2rjc n PRO 221 N 6.78 1.03 -0.26 0.00 -0.02 -1.26 -4.64 135.00 136.63 2rjc n PRO 221 Ca 0.23 0.39 0.20 0.00 -2.02 0.00 0.00 63.50 62.30 2rjc n PRO 221 Cb 0.30 -2.16 0.52 0.00 -0.02 0.00 0.00 33.50 32.14 2rjc n PRO 221 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2rjc h VAL 222 N 0.74 0.64 0.00 -1.45 2.07 -1.96 -1.64 116.25 114.66 2rjc h VAL 222 Ca -0.48 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.91 2rjc h VAL 222 Cb 1.36 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2rjc h VAL 222 CO 0.52 0.07 0.00 0.77 0.02 0.00 0.00 177.57 178.95 2rjc h SER 223 N 0.39 0.00 1.23 0.57 4.64 -2.00 -1.87 113.55 116.52 2rjc h SER 223 Ca 0.49 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.77 2rjc h SER 223 Cb 1.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 2rjc h SER 223 CO -0.19 0.00 -0.20 -0.07 -0.87 0.00 0.00 176.83 175.49 2rjc h LEU 224 N 0.00 0.00-10.27 5.97 3.38 -1.64 -3.46 115.31 109.29 2rjc h LEU 224 Ca 0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 2rjc h LEU 224 Cb 0.08 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.85 2rjc h LEU 224 CO 0.00 0.20 -0.08 -0.36 0.09 0.00 0.00 178.44 178.30 2rjc s PHE 225 N -3.45 3.50 0.38 1.13 0.08 -0.70 -4.83 117.98 114.09 2rjc s PHE 225 Ca 0.02 0.50 -0.27 0.00 0.12 0.00 0.00 56.93 57.31 2rjc s PHE 225 Cb 0.09 -2.07 -0.09 0.00 -0.57 0.00 0.00 43.02 40.38 2rjc s PHE 225 CO 0.65 -0.05 1.24 -0.65 -0.10 0.00 0.00 175.22 176.31 2rjc s GLN 226 N -4.48 4.15 0.31 0.44 -1.52 -1.26 -4.94 119.66 112.35 2rjc s GLN 226 Ca 0.43 2.03 0.04 0.00 -1.95 0.00 0.00 55.36 55.91 2rjc s GLN 226 Cb -0.10 -2.84 0.80 0.00 -0.22 0.00 0.00 33.01 30.65 2rjc s GLN 226 CO 0.39 -0.30 1.59 -0.44 -0.25 0.00 0.00 175.29 176.28 2rjc h ASP 227 N 2.93 -0.28 0.07 5.90 5.19 -1.97 -1.34 116.42 126.91 2rjc h ASP 227 Ca -0.49 0.26 -0.06 0.00 -0.62 0.00 0.00 57.03 56.11 2rjc h ASP 227 Cb 1.23 0.41 -0.01 0.00 0.18 0.00 0.00 39.33 41.14 2rjc h ASP 227 CO 0.64 -0.32 -0.20 0.77 -3.12 0.00 0.00 179.24 177.01 2rjc h SER 228 N 0.05 0.24 0.35 6.45 4.64 -1.96 -1.67 113.55 121.65 2rjc h SER 228 Ca 0.61 -0.06 -0.12 0.00 -0.47 0.00 0.00 61.79 61.75 2rjc h SER 228 Cb 1.31 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2rjc h SER 228 CO -0.84 0.45 -0.51 1.56 -0.87 0.00 0.00 176.83 176.63 2rjc h GLN 229 N 0.23 0.18 0.00 4.77 4.20 -1.56 -3.36 115.11 119.56 2rjc h GLN 229 Ca 0.04 -0.10 -0.25 0.00 0.06 0.00 0.00 58.65 58.39 2rjc h GLN 229 Cb 0.49 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.23 2rjc h GLN 229 CO 0.03 0.65 -1.95 0.00 -0.67 0.00 0.00 178.83 176.89 2rjc n ALA 230 N -2.46 1.78 -2.07 3.87 0.00 -1.05 -4.48 120.51 116.09 2rjc n ALA 230 Ca -0.02 -0.91 -0.42 0.00 0.00 0.00 0.00 53.44 52.09 2rjc n ALA 230 Cb 0.54 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.37 2rjc n ALA 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2rjc s VAL 231 N -2.76 3.40 -0.19 0.00 0.11 -0.65 -4.88 120.40 115.43 2rjc s VAL 231 Ca -0.07 0.79 0.06 0.00 -2.93 0.00 0.00 61.98 59.83 2rjc s VAL 231 Cb 0.08 -3.51 -0.08 0.00 -1.53 0.00 0.00 36.38 31.34 2rjc s VAL 231 CO 0.83 -0.01 0.22 0.35 -3.33 0.00 0.00 175.10 173.16 2rjc n THR 232 N 4.78 0.00 0.75 5.04 -2.24 -1.26 -4.74 114.28 116.61 2rjc n THR 232 Ca 0.15 -0.28 0.13 0.00 -2.27 0.00 0.00 64.05 61.78 2rjc n THR 232 Cb 0.42 0.77 0.43 0.00 -2.10 0.00 0.00 70.33 69.85 2rjc n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2rjc n HIS 233 N -1.35 0.56 -2.28 4.78 1.44 -1.26 -4.67 115.22 112.43 2rjc n HIS 233 Ca 0.00 0.16 -0.42 0.00 -2.01 0.00 0.00 57.72 55.46 2rjc n HIS 233 Cb 0.12 -0.74 -0.03 0.00 0.12 0.00 0.00 29.99 29.46 2rjc n HIS 233 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 2rjc s ASN 234 N -3.95 6.94 0.43 4.39 0.01 -1.26 -5.01 114.94 116.50 2rjc s ASN 234 Ca 0.11 2.21 -0.18 0.00 -0.71 0.00 0.00 52.86 54.30 2rjc s ASN 234 Cb 0.15 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 39.13 2rjc s ASN 234 CO 0.60 -0.56 0.91 -0.54 -1.51 0.00 0.00 177.10 176.00 2rjc s LYS 235 N 0.92 4.07 -0.55 -0.60 -0.14 -1.26 -5.00 119.74 117.19 2rjc s LYS 235 Ca 0.61 0.94 -0.24 0.00 -1.36 0.00 0.00 55.97 55.93 2rjc s LYS 235 Cb -0.34 -2.23 0.04 0.00 -1.68 0.00 0.00 37.83 33.63 2rjc s LYS 235 CO 0.31 -0.07 0.92 1.21 -0.76 0.00 0.00 175.35 176.96 2rjc s ASN 236 N -2.53 6.33 0.00 2.83 3.84 -1.26 -4.89 114.94 119.25 2rjc s ASN 236 Ca 0.59 -0.39 0.27 0.00 0.21 0.00 0.00 52.86 53.54 2rjc s ASN 236 Cb -0.10 -2.43 0.75 0.00 -0.55 0.00 0.00 41.25 38.93 2rjc s ASN 236 CO 0.21 -1.20 1.57 0.61 -2.79 0.00 0.00 177.10 175.50 2rjc n GLY 237 N 5.12 0.22 3.74 1.21 0.00 -1.26 -4.92 105.19 109.30 2rjc n GLY 237 Ca 0.01 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 2rjc n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rjc s PHE 238 N -2.06 2.85 0.14 1.61 0.08 -1.26 -5.00 117.98 114.34 2rjc s PHE 238 Ca 0.33 0.73 0.07 0.00 0.12 0.00 0.00 56.93 58.19 2rjc s PHE 238 Cb 0.20 -4.03 -0.04 0.00 -0.57 0.00 0.00 43.02 38.59 2rjc s PHE 238 CO 0.35 -3.55 -0.17 0.15 -0.10 0.00 0.00 175.22 171.90 2rjc s LYS 239 N -0.03 1.15 0.28 0.44 -0.14 -1.26 -4.97 119.74 115.21 2rjc s LYS 239 Ca 0.65 -1.31 -0.30 0.00 -1.36 0.00 0.00 55.97 53.65 2rjc s LYS 239 Cb -0.47 -1.17 -0.12 0.00 -1.68 0.00 0.00 37.83 34.39 2rjc s LYS 239 CO 0.43 0.24 1.46 1.28 -0.76 0.00 0.00 175.35 178.00 2rjc n LEU 240 N 0.49 3.69 0.00 3.17 4.77 -1.26 -2.12 117.00 125.74 2rjc n LEU 240 Ca -0.15 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.99 2rjc n LEU 240 Cb 0.57 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.15 2rjc n LEU 240 CO 0.27 -0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2rjc n GLY 241 N 1.88 2.57 3.77 -0.72 0.00 0.30 -4.98 105.19 108.01 2rjc n GLY 241 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2rjc n GLY 241 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rjc s MET 242 N -0.14 4.12 0.04 1.61 -1.94 -0.90 -4.49 119.30 117.59 2rjc s MET 242 Ca 0.00 2.06 0.03 0.00 -1.71 0.00 0.00 55.69 56.06 2rjc s MET 242 Cb 0.00 -2.83 -0.04 0.00 2.01 0.00 0.00 34.83 33.97 2rjc s MET 242 CO 0.00 -0.33 0.00 0.15 -0.01 0.00 0.00 175.02 174.83 2rjc s LYS 243 N -2.11 2.70 0.14 2.03 1.02 -0.36 -1.19 119.74 121.97 2rjc s LYS 243 Ca 0.54 -0.70 -0.07 0.00 0.02 0.00 0.00 55.97 55.76 2rjc s LYS 243 Cb -0.36 -2.62 0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2rjc s LYS 243 CO 0.46 0.59 0.34 1.47 -0.92 0.00 0.00 175.35 177.29 2rjc n LEU 244 N 1.04 0.00 -4.37 3.17 -0.00 -0.25 -0.91 117.00 115.68 2rjc n LEU 244 Ca -0.13 -0.93 -0.26 0.00 -0.00 0.00 0.00 56.01 54.69 2rjc n LEU 244 Cb 0.52 1.45 -0.12 0.00 -0.00 0.00 0.00 43.42 45.27 2rjc n LEU 244 CO 0.36 -0.31 -0.53 -1.61 -0.00 0.00 0.00 177.39 175.30 2rjc s GLU 245 N -2.03 1.35 -0.10 1.47 2.02 -0.40 -0.39 118.70 120.61 2rjc s GLU 245 Ca 0.07 -1.36 -0.32 0.00 0.02 0.00 0.00 54.97 53.37 2rjc s GLU 245 Cb -0.02 -1.67 0.12 0.00 0.10 0.00 0.00 34.13 32.66 2rjc s GLU 245 CO 0.04 0.38 1.12 0.20 0.02 0.00 0.00 175.26 177.02 2rjc s GLY 246 N -2.29 -0.35 0.56 -1.39 0.00 -0.69 -0.58 107.32 102.57 2rjc s GLY 246 Ca 0.14 1.24 -0.18 0.00 0.00 0.00 0.00 44.72 45.93 2rjc s GLY 246 CO 0.07 0.40 1.08 -0.26 0.00 0.00 0.00 173.10 174.38 2rjc s ILE 247 N -2.65 3.57 -0.29 0.90 -4.36 -0.47 -1.03 121.20 116.87 2rjc s ILE 247 Ca 0.09 0.86 -0.28 0.00 -0.26 0.00 0.00 60.65 61.06 2rjc s ILE 247 Cb -0.00 -3.34 0.01 0.00 1.25 0.00 0.00 42.46 40.38 2rjc s ILE 247 CO -0.05 -0.32 1.01 -0.62 0.24 0.00 0.00 174.94 175.19 2rjc s ASP 248 N -2.27 6.94 0.59 4.36 -1.08 -0.91 -4.87 116.67 119.42 2rjc s ASP 248 Ca 0.67 1.09 0.29 0.00 -0.52 0.00 0.00 52.55 54.09 2rjc s ASP 248 Cb -0.19 -2.52 1.62 0.00 -1.46 0.00 0.00 42.92 40.38 2rjc s ASP 248 CO 0.30 -0.76 2.05 -0.65 0.52 0.00 0.00 175.17 176.64 2rjc h PRO 249 N 7.87 0.00 0.00 4.34 0.10 -1.95 -0.04 132.00 142.32 2rjc h PRO 249 Ca -0.21 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.89 2rjc h PRO 249 Cb 1.07 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.17 2rjc h PRO 249 CO 0.99 0.00 -0.74 1.96 0.10 0.00 0.00 178.00 180.30 2rjc h GLN 250 N 0.00 0.00 -2.26 1.05 4.20 -1.97 -3.40 115.11 112.73 2rjc h GLN 250 Ca 0.11 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.24 2rjc h GLN 250 Cb 0.64 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.03 2rjc h GLN 250 CO -0.00 0.00 -0.95 0.72 -0.67 0.00 0.00 178.83 177.93 2rjc n HIS 251 N -2.40 0.17 1.45 2.96 8.25 -0.06 -4.55 115.22 121.03 2rjc n HIS 251 Ca 0.02 -3.59 0.09 0.00 -0.26 0.00 0.00 57.72 53.97 2rjc n HIS 251 Cb 0.49 -0.16 0.53 0.00 1.12 0.00 0.00 29.99 31.97 2rjc n HIS 251 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2rjc n PRO 252 N 1.96 0.72 0.09 -0.41 -0.05 -1.00 -0.86 135.00 135.45 2rjc n PRO 252 Ca 0.25 0.00 0.12 0.00 -0.05 0.00 0.00 63.50 63.82 2rjc n PRO 252 Cb 0.48 -1.38 0.09 0.00 -0.05 0.00 0.00 33.50 32.64 2rjc n PRO 252 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 175.50 176.11 2rjc h SER 253 N 0.00 0.00 -3.19 3.54 4.64 -1.85 -3.46 113.55 113.23 2rjc h SER 253 Ca 0.00 -0.11 -0.66 0.00 -0.47 0.00 0.00 61.79 60.54 2rjc h SER 253 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 2rjc h SER 253 CO 0.00 0.06 -0.59 -0.04 -0.87 0.00 0.00 176.83 175.39 2rjc s MET 254 N -3.25 3.28 -0.14 4.77 -1.94 -0.04 -4.98 119.30 117.00 2rjc s MET 254 Ca 0.03 -0.35 -0.03 0.00 -1.71 0.00 0.00 55.69 53.63 2rjc s MET 254 Cb 0.11 -2.94 -0.03 0.00 2.01 0.00 0.00 34.83 33.98 2rjc s MET 254 CO 0.75 0.61 -0.02 0.71 -0.01 0.00 0.00 175.02 177.06 2rjc s TYR 255 N -0.61 3.07 0.19 -0.03 2.02 -1.25 -2.14 117.35 118.59 2rjc s TYR 255 Ca 0.11 -0.13 0.08 0.00 -0.37 0.00 0.00 57.07 56.77 2rjc s TYR 255 Cb -0.12 -1.92 -0.04 0.00 -0.40 0.00 0.00 41.96 39.48 2rjc s TYR 255 CO 0.02 0.12 -0.17 -0.06 -1.57 0.00 0.00 175.55 173.89 2rjc s PHE 256 N 0.01 1.82 -0.06 2.71 0.08 -0.19 -0.26 117.98 122.08 2rjc s PHE 256 Ca 0.02 -0.49 -0.30 0.00 0.12 0.00 0.00 56.93 56.28 2rjc s PHE 256 Cb -0.13 -0.87 -0.04 0.00 -0.57 0.00 0.00 43.02 41.40 2rjc s PHE 256 CO 0.02 0.37 1.40 0.42 -0.10 0.00 0.00 175.22 177.33 2rjc s ILE 257 N -2.38 3.89 0.13 0.64 -1.09 -1.25 -1.71 121.20 119.43 2rjc s ILE 257 Ca 0.19 1.18 0.08 0.00 -2.23 0.00 0.00 60.65 59.87 2rjc s ILE 257 Cb -0.04 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 2rjc s ILE 257 CO 0.07 -0.05 -0.18 -0.76 -1.23 0.00 0.00 174.94 172.79 2rjc s LEU 258 N 3.03 2.39 -0.00 2.97 1.43 0.47 -2.23 118.68 126.73 2rjc s LEU 258 Ca 0.63 -0.79 0.05 0.00 -1.03 0.00 0.00 54.13 52.98 2rjc s LEU 258 Cb -0.28 -0.75 -0.01 0.00 0.03 0.00 0.00 46.19 45.17 2rjc s LEU 258 CO 0.23 -0.04 -0.16 -0.89 0.23 0.00 0.00 176.35 175.72 2rjc s THR 259 N -1.81 1.26 -0.31 5.49 2.01 -0.40 -1.09 115.64 120.78 2rjc s THR 259 Ca 0.11 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 61.08 2rjc s THR 259 Cb -0.07 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.37 2rjc s THR 259 CO 0.05 0.31 1.75 -0.69 -0.69 0.00 0.00 174.62 175.34 2rjc s VAL 260 N -0.45 3.53 -0.12 3.82 1.01 -0.33 -0.37 120.40 127.50 2rjc s VAL 260 Ca 0.06 0.55 0.20 0.00 0.00 0.00 0.00 61.98 62.79 2rjc s VAL 260 Cb -0.06 -3.68 -0.21 0.00 0.00 0.00 0.00 36.38 32.42 2rjc s VAL 260 CO -0.00 -0.41 0.57 0.00 0.00 0.00 0.00 175.10 175.26 2rjc n ALA 261 N 9.83 2.22 -3.59 5.51 0.00 0.02 -0.54 120.51 133.96 2rjc n ALA 261 Ca 0.22 -0.67 -0.10 0.00 0.00 0.00 0.00 53.44 52.89 2rjc n ALA 261 Cb 0.46 -0.74 -0.06 0.00 0.00 0.00 0.00 19.45 19.12 2rjc n ALA 261 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2rjc s GLU 262 N -3.09 0.58 -0.02 0.00 2.12 -1.17 -4.95 118.70 112.16 2rjc s GLU 262 Ca -0.06 0.23 0.06 0.00 0.36 0.00 0.00 54.97 55.56 2rjc s GLU 262 Cb 0.10 0.28 -0.01 0.00 0.26 0.00 0.00 34.13 34.75 2rjc s GLU 262 CO 0.85 -0.16 -0.20 0.08 -0.54 0.00 0.00 175.26 175.29 2rjc s VAL 263 N -0.85 1.56 -0.22 3.70 1.01 -1.26 -0.49 120.40 123.84 2rjc s VAL 263 Ca -0.01 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.10 2rjc s VAL 263 Cb -0.01 -1.30 0.10 0.00 0.00 0.00 0.00 36.38 35.16 2rjc s VAL 263 CO 0.00 0.44 0.22 0.00 0.00 0.00 0.00 175.10 175.76 2rjc n GLY 265 N 5.31 3.72 1.00 0.00 0.00 -1.24 -1.45 105.19 112.53 2rjc n GLY 265 Ca -0.05 -0.04 0.05 0.00 0.00 0.00 0.00 46.02 45.98 2rjc n GLY 265 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2rjc n TYR 266 N 14.00 0.84 -4.39 1.61 9.36 -1.25 -4.72 117.16 132.61 2rjc n TYR 266 Ca 0.00 -0.33 -0.24 0.00 3.32 0.00 0.00 57.90 60.66 2rjc n TYR 266 Cb 0.00 -0.17 -0.09 0.00 -0.63 0.00 0.00 39.34 38.45 2rjc n TYR 266 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2rjc s ARG 267 N -1.72 1.96 -0.04 2.98 0.52 -0.53 -0.19 118.95 121.94 2rjc s ARG 267 Ca 0.27 -1.63 -0.08 0.00 -0.52 0.00 0.00 55.73 53.77 2rjc s ARG 267 Cb 0.18 -1.94 0.01 0.00 0.52 0.00 0.00 34.95 33.73 2rjc s ARG 267 CO 0.13 0.32 0.20 -0.48 0.02 0.00 0.00 175.30 175.48 2rjc s LEU 268 N -3.60 1.29 -0.23 2.53 2.34 -0.40 -1.78 118.68 118.84 2rjc s LEU 268 Ca 0.31 0.11 -0.10 0.00 0.06 0.00 0.00 54.13 54.51 2rjc s LEU 268 Cb -0.05 0.79 -0.05 0.00 -0.56 0.00 0.00 46.19 46.32 2rjc s LEU 268 CO 0.17 -0.25 0.14 -0.60 -1.06 0.00 0.00 176.35 174.75 2rjc s ARG 269 N -0.73 4.05 -0.08 1.48 3.52 0.35 -1.40 118.95 126.14 2rjc s ARG 269 Ca -0.08 -0.28 -0.00 0.00 -0.13 0.00 0.00 55.73 55.23 2rjc s ARG 269 Cb -0.05 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 2rjc s ARG 269 CO 0.01 0.10 -0.04 -0.51 -0.81 0.00 0.00 175.30 174.06 2rjc s LEU 270 N 0.92 3.35 -0.10 -0.88 1.43 0.14 -0.80 118.68 122.73 2rjc s LEU 270 Ca 0.07 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2rjc s LEU 270 Cb -0.13 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2rjc s LEU 270 CO 0.03 0.37 -0.14 -2.28 0.23 0.00 0.00 176.35 174.56 2rjc s HIS 271 N -0.84 2.77 -0.46 0.29 5.65 0.51 -1.67 115.29 121.52 2rjc s HIS 271 Ca 0.13 -0.48 -0.29 0.00 0.25 0.00 0.00 55.06 54.67 2rjc s HIS 271 Cb -0.11 -1.76 0.02 0.00 -1.18 0.00 0.00 32.58 29.55 2rjc s HIS 271 CO 0.02 -0.08 1.21 -0.06 -0.65 0.00 0.00 174.74 175.18 2rjc s PHE 272 N -0.03 2.70 -0.11 3.88 0.08 -1.26 -1.27 117.98 121.97 2rjc s PHE 272 Ca -0.03 0.70 -0.38 0.00 0.12 0.00 0.00 56.93 57.33 2rjc s PHE 272 Cb -0.14 -4.42 -0.16 0.00 -0.57 0.00 0.00 43.02 37.74 2rjc s PHE 272 CO 0.04 -1.46 1.59 -0.25 -0.10 0.00 0.00 175.22 175.04 2rjc n ASP 273 N 8.12 2.21 0.00 1.36 9.92 -0.95 -1.77 116.55 135.44 2rjc n ASP 273 Ca 0.13 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.48 2rjc n ASP 273 Cb 0.49 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.78 2rjc n ASP 273 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2rjc n GLY 274 N 3.54 3.27 4.01 0.44 0.00 -1.26 -2.98 105.19 112.20 2rjc n GLY 274 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 2rjc n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2rjc s TYR 275 N -2.30 2.03 0.49 1.61 2.02 -0.73 -4.52 117.35 115.95 2rjc s TYR 275 Ca 0.00 -0.46 -0.20 0.00 -0.37 0.00 0.00 57.07 56.04 2rjc s TYR 275 Cb 0.00 -2.47 -0.08 0.00 -0.40 0.00 0.00 41.96 39.01 2rjc s TYR 275 CO 0.00 -1.00 1.05 0.45 -1.57 0.00 0.00 175.55 174.48 2rjc s SER 276 N -4.56 6.28 0.35 2.29 0.15 -1.26 -4.85 113.70 112.10 2rjc s SER 276 Ca 0.60 1.97 0.27 0.00 0.70 0.00 0.00 55.95 59.48 2rjc s SER 276 Cb -0.07 -2.56 1.09 0.00 -1.71 0.00 0.00 66.02 62.76 2rjc s SER 276 CO 0.38 -0.82 1.79 1.05 1.20 0.00 0.00 173.24 176.84 2rjc h GLU 277 N 1.56 0.00 0.00 5.44 9.09 -1.98 -2.34 114.58 126.35 2rjc h GLU 277 Ca -0.50 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.91 2rjc h GLU 277 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 2rjc h GLU 277 CO 0.59 0.00 0.08 0.00 0.05 0.00 0.00 179.01 179.73 2rjc n HIS 279 N -2.69 0.13 -1.85 0.00 8.25 -0.88 -4.97 115.22 113.21 2rjc n HIS 279 Ca -0.02 -0.07 -0.38 0.00 -0.26 0.00 0.00 57.72 56.99 2rjc n HIS 279 Cb 0.13 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.28 2rjc n HIS 279 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2rjc s ASP 280 N -1.78 5.25 0.15 0.41 1.11 -0.76 -4.80 116.67 116.24 2rjc s ASP 280 Ca 0.35 2.65 -0.02 0.00 0.18 0.00 0.00 52.55 55.71 2rjc s ASP 280 Cb 0.20 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.52 2rjc s ASP 280 CO 0.30 -1.57 0.09 0.72 1.18 0.00 0.00 175.17 175.88 2rjc s PHE 281 N -1.38 0.88 -0.07 4.23 -0.12 -0.67 -4.93 117.98 115.92 2rjc s PHE 281 Ca 0.73 -1.23 -0.00 0.00 -0.05 0.00 0.00 56.93 56.38 2rjc s PHE 281 Cb -0.38 -0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 41.52 2rjc s PHE 281 CO 0.43 -0.56 -0.03 -1.58 -0.05 0.00 0.00 175.22 173.44 2rjc s TRP 282 N -4.06 3.06 0.13 3.49 0.52 -1.26 0.25 118.94 121.06 2rjc s TRP 282 Ca 0.26 0.12 0.01 0.00 0.02 0.00 0.00 56.10 56.50 2rjc s TRP 282 Cb 0.07 -1.75 -0.04 0.00 -1.15 0.00 0.00 33.47 30.60 2rjc s TRP 282 CO 0.03 0.41 0.00 0.14 0.02 0.00 0.00 176.95 177.56 2rjc s VAL 283 N -0.87 0.44 0.48 4.03 -7.23 -0.49 -5.00 120.40 111.76 2rjc s VAL 283 Ca 0.13 -1.93 -0.09 0.00 -1.81 0.00 0.00 61.98 58.28 2rjc s VAL 283 Cb -0.11 -1.94 -0.05 0.00 0.56 0.00 0.00 36.38 34.83 2rjc s VAL 283 CO 0.02 -0.61 0.84 0.20 -0.31 0.00 0.00 175.10 175.24 2rjc s ASN 284 N -3.08 6.40 0.59 4.85 0.01 -1.26 -1.27 114.94 121.18 2rjc s ASN 284 Ca 0.20 1.16 0.32 0.00 -0.71 0.00 0.00 52.86 53.82 2rjc s ASN 284 Cb 0.07 -2.34 1.85 0.00 0.41 0.00 0.00 41.25 41.23 2rjc s ASN 284 CO -0.00 -0.56 2.24 0.00 -1.51 0.00 0.00 177.10 177.27 2rjc h ALA 285 N 0.62 1.39 -0.71 0.60 0.00 -0.90 -0.16 119.26 120.09 2rjc h ALA 285 Ca -0.47 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.24 2rjc h ALA 285 Cb 1.19 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.87 2rjc h ALA 285 CO 0.63 0.03 0.23 0.27 0.00 0.00 0.00 179.25 180.41 2rjc n ASN 286 N -3.67 4.90 -4.67 0.00 6.94 -1.26 -4.75 115.26 112.75 2rjc n ASN 286 Ca -0.03 -3.14 -0.46 0.00 -0.02 0.00 0.00 54.58 50.93 2rjc n ASN 286 Cb 0.11 -0.74 -0.04 0.00 -2.36 0.00 0.00 39.78 36.76 2rjc n ASN 286 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2rjc n SER 287 N -0.02 2.97 -0.18 0.53 2.88 -0.08 -4.82 113.62 114.91 2rjc n SER 287 Ca 0.38 1.10 0.15 0.00 -1.33 0.00 0.00 58.87 59.17 2rjc n SER 287 Cb 1.34 -1.42 0.78 0.00 -0.75 0.00 0.00 64.21 64.16 2rjc n SER 287 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2rjc n PRO 288 N 3.08 1.25 -0.34 -1.46 -0.04 -1.26 -4.03 135.00 132.20 2rjc n PRO 288 Ca 0.16 -0.37 0.09 0.00 -0.04 0.00 0.00 63.50 63.34 2rjc n PRO 288 Cb 0.29 -1.49 0.27 0.00 -0.04 0.00 0.00 33.50 32.53 2rjc n PRO 288 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2rjc n ASP 289 N -0.55 3.33 -4.19 3.54 8.00 -1.26 -4.78 116.55 120.65 2rjc n ASP 289 Ca 0.22 -2.07 -0.16 0.00 0.71 0.00 0.00 54.79 53.49 2rjc n ASP 289 Cb 0.20 -0.42 -0.11 0.00 -0.02 0.00 0.00 41.12 40.77 2rjc n ASP 289 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2rjc s ILE 290 N -1.32 1.05 0.01 0.53 -4.36 -1.26 -1.37 121.20 114.48 2rjc s ILE 290 Ca 0.40 -1.58 -0.12 0.00 -0.26 0.00 0.00 60.65 59.09 2rjc s ILE 290 Cb 0.22 -1.32 0.02 0.00 1.25 0.00 0.00 42.46 42.62 2rjc s ILE 290 CO 0.26 -0.46 0.26 -1.00 0.24 0.00 0.00 174.94 174.23 2rjc s HIS 291 N -2.13 -0.09 0.60 1.37 3.76 0.25 -4.60 115.29 114.45 2rjc s HIS 291 Ca 0.04 0.06 -0.18 0.00 -0.15 0.00 0.00 55.06 54.83 2rjc s HIS 291 Cb -0.05 0.05 -0.03 0.00 1.11 0.00 0.00 32.58 33.66 2rjc s HIS 291 CO 0.01 -0.39 1.19 -1.25 -0.85 0.00 0.00 174.74 173.45 2rjc s PRO 292 N -1.71 2.96 -0.03 8.40 0.04 -1.26 -1.27 135.00 142.13 2rjc s PRO 292 Ca -0.11 1.78 -0.39 0.00 0.04 0.00 0.00 61.00 62.31 2rjc s PRO 292 Cb -0.04 -1.93 -0.18 0.00 0.04 0.00 0.00 34.50 32.38 2rjc s PRO 292 CO 0.01 -1.20 1.29 0.00 0.04 0.00 0.00 177.00 177.15 2rjc n ALA 293 N -1.66 -1.96 0.00 8.56 0.00 -1.26 -1.29 120.51 122.90 2rjc n ALA 293 Ca 0.13 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.11 2rjc n ALA 293 Cb 0.50 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.99 2rjc n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rjc n GLY 294 N 2.40 2.27 0.24 0.00 0.00 -1.26 -4.95 105.19 103.89 2rjc n GLY 294 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 2rjc n GLY 294 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2rjc h TRP 295 N 0.00 0.53 -0.59 1.61 7.01 -1.55 -2.93 115.95 120.02 2rjc h TRP 295 Ca 0.00 0.03 0.03 0.00 2.11 0.00 0.00 58.89 61.06 2rjc h TRP 295 Cb 0.00 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 26.88 2rjc h TRP 295 CO 0.00 0.20 0.36 0.27 -2.79 0.00 0.00 178.44 176.48 2rjc h PHE 296 N 0.53 0.67 0.00 2.65 -5.15 -1.85 -2.48 116.94 111.31 2rjc h PHE 296 Ca 0.30 0.02 -0.06 0.00 -0.20 0.00 0.00 57.97 58.03 2rjc h PHE 296 Cb 0.30 -0.22 -0.01 0.00 0.22 0.00 0.00 35.95 36.25 2rjc h PHE 296 CO -0.12 0.38 -0.31 1.05 -2.00 0.00 0.00 178.31 177.31 2rjc h GLU 297 N 0.71 0.00 0.00 6.09 4.11 -1.75 -0.08 114.58 123.66 2rjc h GLU 297 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.67 2rjc h GLU 297 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2rjc h GLU 297 CO -0.10 0.31 0.00 0.87 0.07 0.00 0.00 179.01 180.15 2rjc h LYS 298 N 0.00 0.00 0.00 1.06 1.57 -1.28 -3.38 116.57 114.54 2rjc h LYS 298 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2rjc h LYS 298 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2rjc h LYS 298 CO 0.04 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.17 2rjc n THR 299 N -2.30 0.41 -2.02 -0.16 -2.24 -0.99 -5.02 114.28 101.95 2rjc n THR 299 Ca 0.05 -0.45 -0.02 0.00 -2.27 0.00 0.00 64.05 61.35 2rjc n THR 299 Cb 0.39 0.89 -0.00 0.00 -2.10 0.00 0.00 70.33 69.51 2rjc n THR 299 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rjc n GLY 300 N -0.20 0.29 3.63 3.38 0.00 -1.05 -5.05 105.19 106.18 2rjc n GLY 300 Ca 0.00 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.87 2rjc n GLY 300 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2rjc s HIS 301 N -2.10 3.07 0.22 1.61 3.76 -0.07 -5.06 115.29 116.72 2rjc s HIS 301 Ca 0.00 0.09 -0.30 0.00 -0.15 0.00 0.00 55.06 54.70 2rjc s HIS 301 Cb 0.00 -1.78 -0.08 0.00 1.11 0.00 0.00 32.58 31.83 2rjc s HIS 301 CO 0.00 0.38 1.02 0.15 -0.85 0.00 0.00 174.74 175.44 2rjc s LYS 302 N -0.75 4.72 -0.18 1.40 1.02 -1.26 -4.42 119.74 120.28 2rjc s LYS 302 Ca 0.11 1.63 -0.05 0.00 0.02 0.00 0.00 55.97 57.68 2rjc s LYS 302 Cb -0.11 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 2rjc s LYS 302 CO 0.02 0.30 0.01 -1.17 -0.92 0.00 0.00 175.35 173.58 2rjc s LEU 303 N -0.93 3.45 -0.17 3.17 2.96 -1.26 -3.84 118.68 122.06 2rjc s LEU 303 Ca 0.45 -0.07 -0.22 0.00 -0.22 0.00 0.00 54.13 54.06 2rjc s LEU 303 Cb -0.28 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 2rjc s LEU 303 CO 0.35 0.14 0.70 -1.10 -1.32 0.00 0.00 176.35 175.12 2rjc s GLN 304 N 0.52 4.27 0.89 1.98 -1.52 0.64 -5.02 119.66 121.42 2rjc s GLN 304 Ca -0.00 0.77 -0.12 0.00 -1.95 0.00 0.00 55.36 54.05 2rjc s GLN 304 Cb -0.14 -3.56 0.13 0.00 -0.22 0.00 0.00 33.01 29.22 2rjc s GLN 304 CO 0.02 -0.22 1.13 -1.25 -0.25 0.00 0.00 175.29 174.72 2rjc s PRO 305 N 1.82 1.30 0.82 2.91 0.04 -1.26 -3.88 135.00 136.75 2rjc s PRO 305 Ca 0.33 0.34 -0.12 0.00 0.04 0.00 0.00 61.00 61.58 2rjc s PRO 305 Cb -0.16 -1.85 0.09 0.00 0.04 0.00 0.00 34.50 32.61 2rjc s PRO 305 CO 0.12 -2.09 1.18 -2.14 0.04 0.00 0.00 177.00 174.10 2rjc s PRO 306 N -5.27 1.63 0.24 0.56 0.02 -1.26 -4.86 135.00 126.06 2rjc s PRO 306 Ca 0.63 1.64 -0.31 0.00 0.02 0.00 0.00 61.00 62.98 2rjc s PRO 306 Cb -0.15 -1.79 -0.14 0.00 0.02 0.00 0.00 34.50 32.45 2rjc s PRO 306 CO 0.53 -2.20 1.33 1.17 -0.33 0.00 0.00 177.00 177.50 2rjc n LYS 307 N -3.46 1.85 -0.85 5.54 4.81 -1.16 -1.57 118.16 123.33 2rjc n LYS 307 Ca 0.13 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.22 2rjc n LYS 307 Cb 0.51 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.30 2rjc n LYS 307 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2rjc n GLY 308 N 1.93 0.93 0.00 3.14 0.00 -1.26 -4.87 105.19 105.07 2rjc n GLY 308 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2rjc n GLY 308 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2rjc n TYR 309 N -2.00 0.00 -3.63 1.61 -0.00 -0.61 -5.22 117.16 107.31 2rjc n TYR 309 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.91 2rjc n TYR 309 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.28 2rjc n TYR 309 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.86 176.98 2rjc s PHE 314 N 0.05 -0.27 -0.06 2.98 5.36 -1.26 -4.89 117.98 119.89 2rjc s PHE 314 Ca 0.00 0.54 0.04 0.00 -0.96 0.00 0.00 56.93 56.56 2rjc s PHE 314 Cb 0.00 0.16 -0.00 0.00 -0.34 0.00 0.00 43.02 42.84 2rjc s PHE 314 CO 0.00 -0.14 -0.19 -1.54 -1.46 0.00 0.00 175.22 171.90 2rjc s SER 315 N 1.20 2.38 0.20 6.13 1.04 -1.26 -5.05 113.70 118.34 2rjc s SER 315 Ca -0.08 -0.40 -0.11 0.00 0.48 0.00 0.00 55.95 55.84 2rjc s SER 315 Cb -0.03 -0.79 0.22 0.00 0.10 0.00 0.00 66.02 65.52 2rjc s SER 315 CO -0.12 0.15 1.76 -0.50 0.98 0.00 0.00 173.24 175.51 2rjc h TRP 316 N 6.40 0.40 -0.52 5.02 4.06 -2.02 -0.55 115.95 128.74 2rjc h TRP 316 Ca -0.30 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.66 2rjc h TRP 316 Cb 1.19 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 29.23 2rjc h TRP 316 CO 0.45 0.13 0.28 0.66 -3.56 0.00 0.00 178.44 176.41 2rjc h SER 317 N 0.42 0.66 -0.48 -3.49 4.64 -1.99 0.31 113.55 113.62 2rjc h SER 317 Ca 0.27 -0.09 -0.08 0.00 -0.47 0.00 0.00 61.79 61.42 2rjc h SER 317 Cb 0.29 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2rjc h SER 317 CO -0.26 0.56 -0.03 -0.61 -0.87 0.00 0.00 176.83 175.63 2rjc h GLN 318 N 0.70 0.87 -0.61 4.77 4.15 -1.98 -2.21 115.11 120.80 2rjc h GLN 318 Ca 0.18 -0.29 -0.03 0.00 0.77 0.00 0.00 58.65 59.28 2rjc h GLN 318 Cb 0.05 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 2rjc h GLN 318 CO -0.03 0.92 0.26 -0.92 -1.93 0.00 0.00 178.83 177.13 2rjc h TYR 319 N 0.72 0.91 -0.02 3.99 3.20 -0.75 -0.13 116.97 124.89 2rjc h TYR 319 Ca 0.13 -0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.86 2rjc h TYR 319 Cb 0.55 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2rjc h TYR 319 CO 0.04 0.71 -0.39 -0.07 -1.64 0.00 0.00 178.16 176.82 2rjc h LEU 320 N 0.84 0.04 0.31 2.82 3.38 -0.97 -1.41 115.31 120.33 2rjc h LEU 320 Ca 0.20 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2rjc h LEU 320 Cb 0.17 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2rjc h LEU 320 CO -0.02 0.43 -0.15 0.03 0.09 0.00 0.00 178.44 178.82 2rjc h ARG 321 N 0.04 -0.40 -0.49 1.13 3.08 -1.05 -1.49 114.38 115.19 2rjc h ARG 321 Ca 0.00 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.18 2rjc h ARG 321 Cb 0.70 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.74 2rjc h ARG 321 CO 0.05 -0.07 -0.19 0.77 -1.07 0.00 0.00 179.97 179.46 2rjc h SER 322 N -0.80 -0.66 1.60 7.04 0.02 -0.88 -2.98 113.55 116.89 2rjc h SER 322 Ca -0.04 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2rjc h SER 322 Cb 0.51 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.43 2rjc h SER 322 CO 0.07 -0.22 -0.14 0.71 -1.14 0.00 0.00 176.83 176.11 2rjc h THR 323 N -0.08 0.00 -3.95 -2.27 1.35 -1.35 -3.48 112.91 103.13 2rjc h THR 323 Ca 0.23 -0.73 -0.27 0.00 -0.55 0.00 0.00 66.41 65.09 2rjc h THR 323 Cb 0.44 1.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.50 2rjc h THR 323 CO -0.55 0.00 -0.35 0.54 -0.25 0.00 0.00 175.52 174.91 2rjc n ARG 324 N -2.63 -2.38 -2.88 4.72 5.12 -0.57 -4.98 116.66 113.07 2rjc n ARG 324 Ca 0.04 0.61 -0.24 0.00 -1.93 0.00 0.00 57.85 56.33 2rjc n ARG 324 Cb 0.48 -5.23 0.01 0.00 -1.16 0.00 0.00 32.46 26.57 2rjc n ARG 324 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2rjc s ALA 325 N -2.67 3.65 -0.06 7.54 0.00 -1.19 -5.06 121.76 123.98 2rjc s ALA 325 Ca 0.04 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.06 2rjc s ALA 325 Cb -0.02 -2.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.83 2rjc s ALA 325 CO 0.05 -0.43 -0.08 1.14 0.00 0.00 0.00 175.76 176.44 2rjc s GLN 326 N -4.63 2.71 0.18 0.00 -2.07 -1.26 -4.84 119.66 109.75 2rjc s GLN 326 Ca 0.49 -0.58 -0.30 0.00 -1.82 0.00 0.00 55.36 53.15 2rjc s GLN 326 Cb -0.10 -2.56 -0.08 0.00 -1.09 0.00 0.00 33.01 29.18 2rjc s GLN 326 CO 0.39 0.66 1.13 0.00 -1.32 0.00 0.00 175.29 176.15 2rjc s ALA 327 N -0.82 3.39 0.12 2.60 0.00 -1.26 -1.22 121.76 124.57 2rjc s ALA 327 Ca 0.13 0.86 -0.35 0.00 0.00 0.00 0.00 51.96 52.60 2rjc s ALA 327 Cb -0.11 -3.37 -0.14 0.00 0.00 0.00 0.00 23.12 19.49 2rjc s ALA 327 CO 0.02 -0.26 1.55 0.00 0.00 0.00 0.00 175.76 177.06 2rjc n ALA 328 N 2.37 0.75 -1.73 0.00 0.00 -0.09 -4.76 120.51 117.05 2rjc n ALA 328 Ca 0.03 0.45 -0.38 0.00 0.00 0.00 0.00 53.44 53.54 2rjc n ALA 328 Cb 0.46 -2.29 0.06 0.00 0.00 0.00 0.00 19.45 17.67 2rjc n ALA 328 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2rjc n PRO 329 N 3.46 1.37 -0.27 0.00 -0.02 -1.26 -4.70 135.00 133.57 2rjc n PRO 329 Ca 0.18 0.52 0.01 0.00 -2.02 0.00 0.00 63.50 62.19 2rjc n PRO 329 Cb 0.26 -2.53 0.22 0.00 -0.02 0.00 0.00 33.50 31.43 2rjc n PRO 329 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2rjc h LYS 330 N 0.94 1.06 0.00 -0.52 1.57 -1.98 -2.63 116.57 115.01 2rjc h LYS 330 Ca -0.51 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2rjc h LYS 330 Cb 1.33 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2rjc h LYS 330 CO 0.55 0.70 0.00 1.12 -0.57 0.00 0.00 179.45 181.25 2rjc h HIS 331 N 1.09 0.00 0.00 -1.35 2.07 -2.03 -1.93 115.15 113.00 2rjc h HIS 331 Ca 0.33 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.83 2rjc h HIS 331 Cb -0.03 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.94 2rjc h HIS 331 CO -0.00 0.00 -0.09 -0.07 -3.07 0.00 0.00 177.93 174.70 2rjc h LEU 332 N 0.00 0.00 -9.02 6.12 3.38 -1.84 -3.45 115.31 110.51 2rjc h LEU 332 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 2rjc h LEU 332 Cb 0.14 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.75 2rjc h LEU 332 CO 0.00 0.09 -0.30 -0.36 0.09 0.00 0.00 178.44 177.96 2rjc s PHE 333 N -4.01 3.29 0.40 1.13 0.08 -0.73 -4.88 117.98 113.26 2rjc s PHE 333 Ca -0.02 0.41 0.10 0.00 0.12 0.00 0.00 56.93 57.54 2rjc s PHE 333 Cb 0.12 -2.49 0.82 0.00 -0.57 0.00 0.00 43.02 40.89 2rjc s PHE 333 CO 0.55 -0.11 1.93 -0.39 -0.10 0.00 0.00 175.22 177.10 2rjc h VAL 334 N 5.22 1.17 -3.72 -0.44 -1.51 -1.86 -3.41 116.25 111.70 2rjc h VAL 334 Ca -0.34 -0.75 -0.68 0.00 -1.23 0.00 0.00 66.70 63.70 2rjc h VAL 334 Cb 1.17 1.22 -0.35 0.00 -2.13 0.00 0.00 31.29 31.19 2rjc h VAL 334 CO 0.66 0.23 -0.70 -0.55 -1.23 0.00 0.00 177.57 175.98 2rjc s SER 335 N -6.90 4.84 -0.09 4.19 0.15 -1.26 -4.90 113.70 109.73 2rjc s SER 335 Ca -0.05 -1.63 0.13 0.00 0.70 0.00 0.00 55.95 55.11 2rjc s SER 335 Cb 0.15 -1.68 0.21 0.00 -1.71 0.00 0.00 66.02 62.99 2rjc s SER 335 CO 0.73 -0.32 1.10 0.00 1.20 0.00 0.00 173.24 175.94 2rjc n GLN 336 N 4.50 1.14 -2.50 5.44 6.02 -1.26 -4.58 117.38 126.14 2rjc n GLN 336 Ca -0.08 -2.15 -0.17 0.00 -0.01 0.00 0.00 57.00 54.59 2rjc n GLN 336 Cb 0.42 -1.25 0.01 0.00 1.02 0.00 0.00 30.24 30.44 2rjc n GLN 336 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2rjc n SER 337 N -1.06 -4.95 -0.26 1.08 7.64 -1.26 -4.94 113.62 109.87 2rjc n SER 337 Ca 0.11 -0.09 0.08 0.00 1.01 0.00 0.00 58.87 59.99 2rjc n SER 337 Cb 0.62 -3.97 -0.04 0.00 -1.01 0.00 0.00 64.21 59.81 2rjc n SER 337 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2rjc n HIS 338 N -4.10 0.00 -3.27 1.43 8.25 -1.26 -4.81 115.22 111.46 2rjc n HIS 338 Ca -0.16 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.11 2rjc n HIS 338 Cb 0.63 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.74 2rjc n HIS 338 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2rjc s SER 339 N -2.23 5.87 -0.03 0.41 1.04 -1.26 -5.04 113.70 112.45 2rjc s SER 339 Ca 0.12 -0.11 -0.39 0.00 0.48 0.00 0.00 55.95 56.05 2rjc s SER 339 Cb 0.14 -1.21 -0.18 0.00 0.10 0.00 0.00 66.02 64.87 2rjc s SER 339 CO 0.53 -0.57 1.29 -2.65 0.98 0.00 0.00 173.24 172.83 2rjc n PRO 340 N -1.79 0.61 -1.53 4.02 -0.02 -1.26 -4.68 135.00 130.36 2rjc n PRO 340 Ca 0.02 0.22 -0.29 0.00 -2.02 0.00 0.00 63.50 61.43 2rjc n PRO 340 Cb 0.58 -1.80 0.13 0.00 -0.02 0.00 0.00 33.50 32.39 2rjc n PRO 340 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2rjc s PRO 341 N 0.78 1.23 -0.32 0.52 0.04 -1.26 -3.74 135.00 132.25 2rjc s PRO 341 Ca 0.90 0.34 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 2rjc s PRO 341 Cb -1.13 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 31.56 2rjc s PRO 341 CO 0.55 -2.14 1.52 -1.25 0.04 0.00 0.00 177.00 175.72 2rjc s PRO 342 N -5.25 3.66 0.18 0.56 0.04 -1.25 -4.89 135.00 128.05 2rjc s PRO 342 Ca 0.63 1.30 -0.32 0.00 0.04 0.00 0.00 61.00 62.66 2rjc s PRO 342 Cb -0.15 -4.03 -0.11 0.00 0.04 0.00 0.00 34.50 30.25 2rjc s PRO 342 CO 0.54 -1.45 1.70 -0.51 0.04 0.00 0.00 177.00 177.31 2rjc s LEU 343 N 5.41 4.37 0.00 -3.56 1.43 -1.26 -1.96 118.68 123.12 2rjc s LEU 343 Ca 0.67 2.77 0.00 0.00 -1.03 0.00 0.00 54.13 56.53 2rjc s LEU 343 Cb -0.19 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.44 2rjc s LEU 343 CO 0.30 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.55 2rjc n GLY 344 N 3.96 3.32 3.37 -3.19 0.00 -1.26 -4.73 105.19 106.66 2rjc n GLY 344 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 2rjc n GLY 344 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2rjc s PHE 345 N -2.32 3.15 0.05 1.61 0.08 -0.83 -4.44 117.98 115.29 2rjc s PHE 345 Ca 0.00 -0.98 0.03 0.00 0.12 0.00 0.00 56.93 56.10 2rjc s PHE 345 Cb 0.00 -3.62 -0.04 0.00 -0.57 0.00 0.00 43.02 38.79 2rjc s PHE 345 CO 0.00 -1.02 0.04 -0.65 -0.10 0.00 0.00 175.22 173.49 2rjc s GLN 346 N 2.04 2.79 0.26 0.44 -1.52 -1.26 -4.77 119.66 117.64 2rjc s GLN 346 Ca 0.07 -0.68 -0.30 0.00 -1.95 0.00 0.00 55.36 52.50 2rjc s GLN 346 Cb -0.25 -2.68 -0.14 0.00 -0.22 0.00 0.00 33.01 29.72 2rjc s GLN 346 CO 0.06 0.59 1.23 0.28 -0.25 0.00 0.00 175.29 177.20 2rjc n VAL 347 N 0.85 1.40 -0.05 1.09 0.31 -1.26 -1.86 118.33 118.80 2rjc n VAL 347 Ca -0.11 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 2rjc n VAL 347 Cb 0.52 -1.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 2rjc n VAL 347 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rjc n GLY 348 N 1.63 1.92 3.79 2.92 0.00 0.18 -5.02 105.19 110.62 2rjc n GLY 348 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2rjc n GLY 348 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2rjc s MET 349 N -0.33 3.71 0.27 1.61 -1.94 -0.78 -4.43 119.30 117.43 2rjc s MET 349 Ca 0.00 1.38 0.10 0.00 -1.71 0.00 0.00 55.69 55.46 2rjc s MET 349 Cb 0.00 -2.08 -0.05 0.00 2.01 0.00 0.00 34.83 34.72 2rjc s MET 349 CO 0.00 -0.51 -0.06 0.15 -0.01 0.00 0.00 175.02 174.59 2rjc s LYS 350 N -3.30 2.11 0.21 2.03 1.02 -0.57 -0.40 119.74 120.83 2rjc s LYS 350 Ca 0.68 -1.53 -0.22 0.00 0.02 0.00 0.00 55.97 54.91 2rjc s LYS 350 Cb -0.17 -2.04 0.07 0.00 -0.52 0.00 0.00 37.83 35.16 2rjc s LYS 350 CO 0.22 0.34 0.95 -0.48 -0.92 0.00 0.00 175.35 175.47 2rjc s LEU 351 N -3.63 -0.08 -0.07 3.17 2.34 -0.40 -0.41 118.68 119.60 2rjc s LEU 351 Ca 0.31 -0.64 0.01 0.00 0.06 0.00 0.00 54.13 53.87 2rjc s LEU 351 Cb -0.06 2.27 -0.03 0.00 -0.56 0.00 0.00 46.19 47.81 2rjc s LEU 351 CO 0.18 -1.08 -0.07 -1.61 -1.06 0.00 0.00 176.35 172.71 2rjc s GLU 352 N -2.72 2.80 -0.03 1.48 2.02 -0.14 -1.24 118.70 120.86 2rjc s GLU 352 Ca 0.17 -0.55 -0.04 0.00 0.02 0.00 0.00 54.97 54.57 2rjc s GLU 352 Cb -0.03 -2.61 0.01 0.00 0.10 0.00 0.00 34.13 31.60 2rjc s GLU 352 CO 0.05 0.64 0.10 0.00 0.02 0.00 0.00 175.26 176.07 2rjc s ALA 353 N -0.74 -0.24 0.14 5.21 0.00 0.21 -0.98 121.76 125.36 2rjc s ALA 353 Ca 0.11 0.24 -0.31 0.00 0.00 0.00 0.00 51.96 52.00 2rjc s ALA 353 Cb -0.11 -0.14 -0.11 0.00 0.00 0.00 0.00 23.12 22.76 2rjc s ALA 353 CO 0.02 -0.06 1.76 0.08 0.00 0.00 0.00 175.76 177.56 2rjc s VAL 354 N -0.05 2.46 -0.47 0.00 1.01 0.76 -0.16 120.40 123.94 2rjc s VAL 354 Ca -0.01 0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.81 2rjc s VAL 354 Cb -0.01 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.30 2rjc s VAL 354 CO 0.00 0.00 1.41 -0.62 0.00 0.00 0.00 175.10 175.90 2rjc s ASP 355 N 2.12 6.25 0.41 3.32 2.15 -0.12 -4.87 116.67 125.93 2rjc s ASP 355 Ca 0.77 0.61 0.29 0.00 0.43 0.00 0.00 52.55 54.66 2rjc s ASP 355 Cb -0.46 -2.54 1.27 0.00 -0.30 0.00 0.00 42.92 40.88 2rjc s ASP 355 CO 0.34 -1.55 1.87 0.03 -0.17 0.00 0.00 175.17 175.69 2rjc h ARG 356 N 10.87 0.00 0.00 4.34 2.47 -1.89 -0.61 114.38 129.56 2rjc h ARG 356 Ca -0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2rjc h ARG 356 Cb 1.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.42 2rjc h ARG 356 CO 1.12 0.00 -0.60 0.52 0.56 0.00 0.00 179.97 181.57 2rjc h MET 357 N 0.00 0.00 -1.43 0.04 2.86 -1.92 -3.38 114.93 111.09 2rjc h MET 357 Ca 0.00 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 57.18 2rjc h MET 357 Cb 0.36 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 31.70 2rjc h MET 357 CO 0.00 0.00 -0.94 0.09 1.06 0.00 0.00 176.91 177.12 2rjc n ASN 358 N -2.18 -0.64 0.00 1.22 3.02 -0.34 -5.03 115.26 111.30 2rjc n ASN 358 Ca 0.03 -2.90 0.04 0.00 -0.03 0.00 0.00 54.58 51.72 2rjc n ASN 358 Cb 0.45 0.07 0.21 0.00 -0.61 0.00 0.00 39.78 39.90 2rjc n ASN 358 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2rjc n PRO 359 N 1.35 0.05 0.22 3.52 -0.02 -0.59 -1.39 135.00 138.13 2rjc n PRO 359 Ca 0.18 0.29 0.15 0.00 -2.02 0.00 0.00 63.50 62.10 2rjc n PRO 359 Cb 0.57 -1.50 0.59 0.00 -0.02 0.00 0.00 33.50 33.14 2rjc n PRO 359 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2rjc h SER 360 N 0.00 0.00 -3.53 2.55 4.64 -1.96 -3.44 113.55 111.81 2rjc h SER 360 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 2rjc h SER 360 Cb 0.13 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.09 2rjc h SER 360 CO 0.00 0.00 -0.32 -0.76 -0.87 0.00 0.00 176.83 174.88 2rjc s LEU 361 N -5.49 4.13 -0.18 5.97 1.43 -0.49 -5.04 118.68 119.01 2rjc s LEU 361 Ca 0.03 0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 2rjc s LEU 361 Cb 0.09 -2.35 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 2rjc s LEU 361 CO 0.49 -0.03 -0.04 -0.69 0.23 0.00 0.00 176.35 176.31 2rjc s VAL 362 N 1.25 3.64 0.20 -1.59 1.01 -1.26 -0.95 120.40 122.69 2rjc s VAL 362 Ca 0.14 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.75 2rjc s VAL 362 Cb -0.14 -2.62 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 2rjc s VAL 362 CO 0.07 0.46 -0.08 0.00 0.00 0.00 0.00 175.10 175.55 2rjc s VAL 364 N -3.26 3.49 0.11 0.00 1.01 -0.60 -0.62 120.40 120.53 2rjc s VAL 364 Ca 0.23 0.98 -0.09 0.00 0.00 0.00 0.00 61.98 63.10 2rjc s VAL 364 Cb 0.03 -3.63 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 2rjc s VAL 364 CO 0.05 0.03 0.21 0.00 0.00 0.00 0.00 175.10 175.39 2rjc s ALA 365 N 1.89 -0.17 0.08 5.51 0.00 -0.37 -3.22 121.76 125.47 2rjc s ALA 365 Ca 0.65 -0.68 0.05 0.00 0.00 0.00 0.00 51.96 51.98 2rjc s ALA 365 Cb -0.34 0.58 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 2rjc s ALA 365 CO 0.29 -0.54 -0.14 -1.12 0.00 0.00 0.00 175.76 174.24 2rjc s SER 366 N -2.89 1.77 -0.23 0.00 0.01 -0.22 -1.27 113.70 110.87 2rjc s SER 366 Ca 0.08 -0.65 -0.28 0.00 1.31 0.00 0.00 55.95 56.41 2rjc s SER 366 Cb 0.05 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.22 2rjc s SER 366 CO -0.08 -0.08 0.98 -0.69 0.41 0.00 0.00 173.24 173.77 2rjc s VAL 367 N -1.42 4.73 -0.39 3.43 1.01 0.46 -0.72 120.40 127.50 2rjc s VAL 367 Ca 0.00 1.89 0.04 0.00 0.00 0.00 0.00 61.98 63.92 2rjc s VAL 367 Cb -0.09 -4.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.04 2rjc s VAL 367 CO 0.02 -0.14 0.42 0.35 0.00 0.00 0.00 175.10 175.76 2rjc n THR 368 N 5.27 0.00 -3.59 3.92 -2.24 -0.82 -0.64 114.28 116.18 2rjc n THR 368 Ca 0.10 -0.46 -0.16 0.00 -2.27 0.00 0.00 64.05 61.27 2rjc n THR 368 Cb 0.47 1.05 -0.07 0.00 -2.10 0.00 0.00 70.33 69.68 2rjc n THR 368 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2rjc s ASP 369 N -0.84 -0.65 -0.05 3.42 -1.08 -1.26 -4.92 116.67 111.29 2rjc s ASP 369 Ca 0.04 0.98 -0.01 0.00 -0.52 0.00 0.00 52.55 53.04 2rjc s ASP 369 Cb 0.03 0.91 0.03 0.00 -1.46 0.00 0.00 42.92 42.43 2rjc s ASP 369 CO 0.11 -0.43 -0.00 -0.69 0.52 0.00 0.00 175.17 174.68 2rjc s VAL 370 N -0.49 0.31 -0.12 1.11 1.01 -1.26 -0.68 120.40 120.28 2rjc s VAL 370 Ca -0.06 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 2rjc s VAL 370 Cb -0.02 -0.44 0.05 0.00 0.00 0.00 0.00 36.38 35.96 2rjc s VAL 370 CO 0.05 0.22 0.10 -0.69 0.00 0.00 0.00 175.10 174.78 2rjc s VAL 371 N 1.59 -0.13 0.00 2.92 1.01 -0.37 -5.01 120.40 120.40 2rjc s VAL 371 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2rjc s VAL 371 Cb -0.13 -0.42 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2rjc s VAL 371 CO -0.03 -0.09 0.00 0.47 0.00 0.00 0.00 175.10 175.45 2rjc n ASP 372 N 5.29 0.00 -0.00 3.32 8.00 -1.26 -1.50 116.55 130.40 2rjc n ASP 372 Ca -0.05 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.60 2rjc n ASP 372 Cb 0.49 0.00 0.85 0.00 -0.02 0.00 0.00 41.12 42.44 2rjc n ASP 372 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2rjc n SER 373 N 5.15 0.01 -4.56 -2.24 3.41 -1.25 -3.74 113.62 110.40 2rjc n SER 373 Ca 0.00 -0.54 -0.24 0.00 -0.26 0.00 0.00 58.87 57.84 2rjc n SER 373 Cb 0.00 -0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 63.71 2rjc n SER 373 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2rjc s ARG 374 N -2.31 2.00 0.08 4.33 0.52 -0.56 -4.25 118.95 118.75 2rjc s ARG 374 Ca 0.37 -1.60 0.01 0.00 -0.52 0.00 0.00 55.73 54.00 2rjc s ARG 374 Cb 0.21 -1.97 -0.04 0.00 0.52 0.00 0.00 34.95 33.68 2rjc s ARG 374 CO 0.42 0.34 -0.06 -0.59 0.02 0.00 0.00 175.30 175.42 2rjc s PHE 375 N -2.42 0.79 -0.21 -0.53 -0.12 0.17 -1.24 117.98 114.42 2rjc s PHE 375 Ca 0.31 -0.84 -0.10 0.00 -0.05 0.00 0.00 56.93 56.25 2rjc s PHE 375 Cb -0.05 -0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 41.82 2rjc s PHE 375 CO 0.18 -0.16 0.13 -1.17 -0.05 0.00 0.00 175.22 174.15 2rjc s LEU 376 N -2.71 4.15 -0.21 -1.99 2.96 0.15 -1.01 118.68 120.02 2rjc s LEU 376 Ca 0.06 0.18 -0.18 0.00 -0.22 0.00 0.00 54.13 53.98 2rjc s LEU 376 Cb 0.02 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.59 2rjc s LEU 376 CO -0.04 0.15 0.49 -0.69 -1.32 0.00 0.00 176.35 174.93 2rjc s VAL 377 N 0.57 5.13 -0.05 1.68 1.01 0.76 -1.94 120.40 127.56 2rjc s VAL 377 Ca 0.08 0.88 0.06 0.00 0.00 0.00 0.00 61.98 62.99 2rjc s VAL 377 Cb -0.12 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2rjc s VAL 377 CO 0.00 0.18 -0.21 -2.28 0.00 0.00 0.00 175.10 172.79 2rjc s HIS 378 N 1.64 2.50 -0.38 5.22 2.46 0.11 -2.10 115.29 124.74 2rjc s HIS 378 Ca 0.22 -0.43 -0.21 0.00 0.47 0.00 0.00 55.06 55.11 2rjc s HIS 378 Cb -0.15 -1.59 0.01 0.00 -0.13 0.00 0.00 32.58 30.72 2rjc s HIS 378 CO 0.09 -0.02 0.66 -0.06 -2.47 0.00 0.00 174.74 172.94 2rjc s PHE 379 N -0.48 3.12 0.12 3.88 0.08 -1.26 -1.05 117.98 122.38 2rjc s PHE 379 Ca 0.06 0.26 -0.36 0.00 0.12 0.00 0.00 56.93 57.02 2rjc s PHE 379 Cb -0.11 -3.24 -0.16 0.00 -0.57 0.00 0.00 43.02 38.94 2rjc s PHE 379 CO 0.01 -0.71 1.40 -0.25 -0.10 0.00 0.00 175.22 175.56 2rjc n ASP 380 N 6.16 2.05 0.00 1.36 9.92 -1.20 -1.42 116.55 133.42 2rjc n ASP 380 Ca -0.01 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.36 2rjc n ASP 380 Cb 0.48 -1.26 0.00 0.00 -0.64 0.00 0.00 41.12 39.70 2rjc n ASP 380 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2rjc n ASN 381 N 2.72 -4.88 -4.97 -2.24 5.15 -1.26 -2.78 115.26 107.00 2rjc n ASN 381 Ca 0.18 0.00 -0.18 0.00 -0.60 0.00 0.00 54.58 53.97 2rjc n ASN 381 Cb 0.22 -2.67 -0.00 0.00 -0.53 0.00 0.00 39.78 36.80 2rjc n ASN 381 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 2rjc s TRP 382 N -1.29 2.79 0.54 1.20 0.52 -0.51 -4.51 118.94 117.69 2rjc s TRP 382 Ca 0.00 -0.42 -0.09 0.00 0.02 0.00 0.00 56.10 55.61 2rjc s TRP 382 Cb 0.00 -2.31 0.13 0.00 -1.15 0.00 0.00 33.47 30.14 2rjc s TRP 382 CO 0.00 -0.32 0.73 -0.40 0.02 0.00 0.00 176.95 176.98 2rjc n ASP 383 N -1.76 -0.01 -0.56 2.95 5.68 -1.26 -4.89 116.55 116.70 2rjc n ASP 383 Ca 0.06 -1.25 0.12 0.00 -0.50 0.00 0.00 54.79 53.23 2rjc n ASP 383 Cb 0.60 -0.56 0.43 0.00 -1.14 0.00 0.00 41.12 40.44 2rjc n ASP 383 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2rjc n ASP 384 N -3.50 1.73 0.18 -1.12 5.75 -1.26 -3.98 116.55 114.35 2rjc n ASP 384 Ca 0.09 -1.63 0.14 0.00 -0.01 0.00 0.00 54.79 53.38 2rjc n ASP 384 Cb 0.32 -0.06 0.71 0.00 -1.03 0.00 0.00 41.12 41.07 2rjc n ASP 384 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2rjc h THR 385 N 2.50 0.78 -0.01 2.12 1.35 -1.94 -1.80 112.91 115.91 2rjc h THR 385 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2rjc h THR 385 Cb 0.54 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 2rjc h THR 385 CO 0.00 0.00 -0.27 -1.22 -0.25 0.00 0.00 175.52 173.78 2rjc n TYR 386 N -4.29 0.00 -1.83 4.73 4.01 -1.26 -4.95 117.16 113.57 2rjc n TYR 386 Ca 0.02 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.38 2rjc n TYR 386 Cb 0.29 -0.08 0.05 0.00 -0.31 0.00 0.00 39.34 39.28 2rjc n TYR 386 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2rjc s ASP 387 N -2.43 5.10 -0.03 7.72 1.11 -0.68 -4.79 116.67 122.66 2rjc s ASP 387 Ca 0.24 2.64 -0.13 0.00 0.18 0.00 0.00 52.55 55.48 2rjc s ASP 387 Cb 0.19 -2.62 0.02 0.00 1.07 0.00 0.00 42.92 41.58 2rjc s ASP 387 CO 0.51 -1.68 0.29 -0.72 1.18 0.00 0.00 175.17 174.75 2rjc s TYR 388 N -1.38 -0.18 0.05 4.23 -0.85 -0.89 -4.82 117.35 113.51 2rjc s TYR 388 Ca 0.75 0.32 -0.22 0.00 -0.52 0.00 0.00 57.07 57.40 2rjc s TYR 388 Cb -0.37 0.08 -0.06 0.00 0.38 0.00 0.00 41.96 41.99 2rjc s TYR 388 CO 0.42 -0.34 0.66 -1.58 -1.52 0.00 0.00 175.55 173.20 2rjc s TRP 389 N -1.07 3.76 0.36 -3.49 0.52 -1.26 -0.17 118.94 117.59 2rjc s TRP 389 Ca -0.11 1.36 -0.13 0.00 0.02 0.00 0.00 56.10 57.23 2rjc s TRP 389 Cb -0.05 -2.67 0.04 0.00 -1.15 0.00 0.00 33.47 29.64 2rjc s TRP 389 CO 0.03 0.41 0.71 0.00 0.02 0.00 0.00 176.95 178.12 2rjc s ASP 391 N -3.09 4.22 0.53 0.00 1.47 -1.26 -0.65 116.67 117.88 2rjc s ASP 391 Ca 0.18 -1.30 0.31 0.00 1.18 0.00 0.00 52.55 52.93 2rjc s ASP 391 Cb -0.04 -0.17 1.71 0.00 -0.34 0.00 0.00 42.92 44.08 2rjc s ASP 391 CO 0.13 -0.63 1.95 -0.65 0.68 0.00 0.00 175.17 176.65 2rjc h PRO 392 N 1.45 0.00 -0.01 2.11 0.11 -1.87 -1.50 132.00 132.30 2rjc h PRO 392 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2rjc h PRO 392 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2rjc h PRO 392 CO 0.73 0.00 -0.18 -1.13 -0.21 0.00 0.00 178.00 177.21 2rjc n SER 393 N -2.68 1.12 -4.59 -2.05 3.41 -1.26 -1.80 113.62 105.76 2rjc n SER 393 Ca -0.02 -1.03 -0.50 0.00 -0.26 0.00 0.00 58.87 57.06 2rjc n SER 393 Cb 0.15 0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.14 2rjc n SER 393 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2rjc n SER 394 N -0.45 1.57 0.02 4.04 2.88 -0.57 -3.59 113.62 117.52 2rjc n SER 394 Ca 0.14 1.13 0.07 0.00 -1.33 0.00 0.00 58.87 58.88 2rjc n SER 394 Cb 0.35 -1.22 0.29 0.00 -0.75 0.00 0.00 64.21 62.87 2rjc n SER 394 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2rjc n PRO 395 N 2.09 0.03 -0.02 -1.46 -0.02 -1.26 -3.65 135.00 130.71 2rjc n PRO 395 Ca 0.16 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 62.06 2rjc n PRO 395 Cb 0.23 -1.55 0.10 0.00 -0.02 0.00 0.00 33.50 32.26 2rjc n PRO 395 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2rjc n TYR 396 N -1.60 0.05 -4.80 6.00 4.01 -1.26 -4.94 117.16 114.62 2rjc n TYR 396 Ca 0.03 -0.03 -0.29 0.00 -0.16 0.00 0.00 57.90 57.45 2rjc n TYR 396 Cb 0.15 -0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.03 2rjc n TYR 396 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2rjc s ILE 397 N -1.71 2.07 0.05 -0.72 -4.36 -1.24 -0.17 121.20 115.12 2rjc s ILE 397 Ca 0.26 -1.41 -0.05 0.00 -0.26 0.00 0.00 60.65 59.19 2rjc s ILE 397 Cb 0.18 -1.79 -0.02 0.00 1.25 0.00 0.00 42.46 42.09 2rjc s ILE 397 CO 0.27 0.30 0.08 -1.00 0.24 0.00 0.00 174.94 174.83 2rjc s HIS 398 N -0.84 0.26 0.62 1.37 3.76 -0.15 -4.97 115.29 115.35 2rjc s HIS 398 Ca 0.11 -0.64 -0.18 0.00 -0.15 0.00 0.00 55.06 54.20 2rjc s HIS 398 Cb -0.10 -0.18 -0.02 0.00 1.11 0.00 0.00 32.58 33.39 2rjc s HIS 398 CO 0.02 -0.40 1.25 -2.14 -0.85 0.00 0.00 174.74 172.63 2rjc s PRO 399 N -3.09 2.75 -0.08 8.40 0.02 -1.26 -0.97 135.00 140.76 2rjc s PRO 399 Ca -0.01 1.94 -0.40 0.00 0.02 0.00 0.00 61.00 62.55 2rjc s PRO 399 Cb 0.02 -1.89 -0.18 0.00 0.02 0.00 0.00 34.50 32.47 2rjc s PRO 399 CO -0.07 -1.41 1.33 0.28 -0.33 0.00 0.00 177.00 176.80 2rjc n VAL 400 N -1.78 0.04 0.00 3.83 0.31 -1.26 -1.71 118.33 117.77 2rjc n VAL 400 Ca 0.15 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 2rjc n VAL 400 Cb 0.49 -0.51 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 2rjc n VAL 400 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2rjc n GLY 401 N 2.56 1.07 0.08 2.92 0.00 -1.26 -4.99 105.19 105.57 2rjc n GLY 401 Ca 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 2rjc n GLY 401 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2rjc h TRP 402 N 0.00 0.12 -0.38 1.61 7.01 -1.69 -1.53 115.95 121.08 2rjc h TRP 402 Ca 0.00 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.04 2rjc h TRP 402 Cb 0.00 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 26.99 2rjc h TRP 402 CO 0.00 0.07 0.17 0.00 -2.79 0.00 0.00 178.44 175.89 2rjc h GLN 404 N 0.35 0.76 0.00 0.00 -0.00 -1.69 0.13 115.11 114.66 2rjc h GLN 404 Ca 0.17 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.65 58.76 2rjc h GLN 404 Cb 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 27.48 27.41 2rjc h GLN 404 CO -0.14 0.50 -0.05 0.87 0.00 0.00 0.00 178.83 180.01 2rjc h LYS 405 N 0.78 0.00 -0.02 1.69 1.57 -0.77 -2.89 116.57 116.92 2rjc h LYS 405 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2rjc h LYS 405 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2rjc h LYS 405 CO -0.06 0.05 0.00 1.04 -0.57 0.00 0.00 179.45 179.91 2rjc n GLN 406 N -4.35 1.83 -1.32 3.15 1.13 -0.04 -4.95 117.38 112.83 2rjc n GLN 406 Ca -0.03 -1.20 -0.11 0.00 -1.94 0.00 0.00 57.00 53.72 2rjc n GLN 406 Cb 0.14 -1.47 -0.05 0.00 0.11 0.00 0.00 30.24 28.97 2rjc n GLN 406 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2rjc n GLY 407 N 1.22 1.20 3.81 1.08 0.00 -0.65 -5.04 105.19 106.81 2rjc n GLY 407 Ca 0.18 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 2rjc n GLY 407 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2rjc s LYS 408 N -2.94 3.17 0.21 1.61 1.02 0.36 -5.01 119.74 118.16 2rjc s LYS 408 Ca 0.00 -0.40 -0.31 0.00 0.02 0.00 0.00 55.97 55.28 2rjc s LYS 408 Cb 0.00 -2.94 -0.10 0.00 -0.52 0.00 0.00 37.83 34.27 2rjc s LYS 408 CO 0.00 0.68 1.53 -2.14 -0.92 0.00 0.00 175.35 174.50 2rjc s PRO 409 N -1.58 4.22 -0.09 -1.68 0.02 -1.26 -4.09 135.00 130.53 2rjc s PRO 409 Ca 0.22 2.37 -0.16 0.00 0.02 0.00 0.00 61.00 63.44 2rjc s PRO 409 Cb -0.12 -3.13 -0.05 0.00 0.02 0.00 0.00 34.50 31.23 2rjc s PRO 409 CO 0.12 -0.55 0.41 -1.17 -0.33 0.00 0.00 177.00 175.48 2rjc s LEU 410 N 0.48 4.34 -0.39 -5.54 2.96 -1.26 -4.55 118.68 114.71 2rjc s LEU 410 Ca 0.66 0.79 -0.23 0.00 -0.22 0.00 0.00 54.13 55.12 2rjc s LEU 410 Cb -0.44 -2.57 0.02 0.00 0.50 0.00 0.00 46.19 43.70 2rjc s LEU 410 CO 0.37 0.14 0.79 -0.89 -1.32 0.00 0.00 176.35 175.44 2rjc s THR 411 N -0.01 4.69 0.87 3.68 2.01 -0.10 -5.01 115.64 121.77 2rjc s THR 411 Ca 0.23 0.75 -0.12 0.00 0.31 0.00 0.00 61.69 62.85 2rjc s THR 411 Cb -0.15 -4.26 0.11 0.00 0.01 0.00 0.00 72.50 68.21 2rjc s THR 411 CO 0.10 -0.54 1.13 -2.16 -0.69 0.00 0.00 174.62 172.46 2rjc s PRO 412 N 3.20 1.51 0.64 4.92 0.04 -1.26 -1.55 135.00 142.50 2rjc s PRO 412 Ca 0.31 0.37 -0.17 0.00 0.04 0.00 0.00 61.00 61.55 2rjc s PRO 412 Cb -0.13 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 2rjc s PRO 412 CO 0.19 -1.96 0.77 -2.30 0.04 0.00 0.00 177.00 173.75 2rjc n PRO 413 N -3.62 0.62 -1.59 0.56 -0.02 -1.26 -4.79 135.00 124.90 2rjc n PRO 413 Ca 0.07 0.25 -0.47 0.00 -2.02 0.00 0.00 63.50 61.33 2rjc n PRO 413 Cb 0.59 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 2rjc n PRO 413 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2rjc n GLN 414 N -0.89 1.28 -4.49 -0.52 7.27 -1.12 -1.57 117.38 117.35 2rjc n GLN 414 Ca 0.13 0.45 -0.41 0.00 0.07 0.00 0.00 57.00 57.24 2rjc n GLN 414 Cb 0.48 -1.91 -0.08 0.00 2.41 0.00 0.00 30.24 31.15 2rjc n GLN 414 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 2rjc n ASP 415 N 1.73 -1.59 -4.72 1.69 5.68 -1.26 -4.89 116.55 113.18 2rjc n ASP 415 Ca 0.13 -1.23 -0.42 0.00 -0.50 0.00 0.00 54.79 52.77 2rjc n ASP 415 Cb 0.28 -1.71 -0.03 0.00 -1.14 0.00 0.00 41.12 38.52 2rjc n ASP 415 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2rjc s TYR 416 N -3.40 3.17 0.32 2.11 5.04 -0.61 -4.98 117.35 119.00 2rjc s TYR 416 Ca 0.72 0.93 -0.29 0.00 -2.44 0.00 0.00 57.07 55.99 2rjc s TYR 416 Cb -0.42 -3.75 -0.10 0.00 0.35 0.00 0.00 41.96 38.04 2rjc s TYR 416 CO 1.02 -2.60 1.30 -2.14 -1.34 0.00 0.00 175.55 171.79 2rjc s PRO 417 N 0.68 4.37 -0.64 4.97 0.02 -1.26 -3.23 135.00 139.91 2rjc s PRO 417 Ca 0.64 2.18 -0.00 0.00 0.02 0.00 0.00 61.00 63.84 2rjc s PRO 417 Cb -0.39 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.04 2rjc s PRO 417 CO 0.34 -0.18 0.47 -3.47 -0.33 0.00 0.00 177.00 173.83 2rjc n ASP 418 N 1.00 -3.72 0.00 2.53 2.03 -1.26 -4.80 116.55 112.33 2rjc n ASP 418 Ca 0.01 -0.77 0.05 0.00 0.52 0.00 0.00 54.79 54.60 2rjc n ASP 418 Cb 0.42 -1.24 0.23 0.00 -0.72 0.00 0.00 41.12 39.81 2rjc n ASP 418 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2rjc n PRO 419 N -2.16 0.05 0.05 -0.67 -0.04 -1.20 -2.47 135.00 128.57 2rjc n PRO 419 Ca -0.26 0.28 -0.07 0.00 -0.04 0.00 0.00 63.50 63.41 2rjc n PRO 419 Cb 0.54 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 2rjc n PRO 419 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2rjc h ASP 420 N 0.00 0.00 -0.70 3.54 3.45 -1.91 -3.24 116.42 117.56 2rjc h ASP 420 Ca 0.00 -0.00 -0.47 0.00 0.43 0.00 0.00 57.03 56.99 2rjc h ASP 420 Cb 0.14 -0.00 -0.29 0.00 -0.56 0.00 0.00 39.33 38.62 2rjc h ASP 420 CO 0.00 1.00 -0.10 0.59 -1.57 0.00 0.00 179.24 179.16 2rjc n ASN 421 N -3.32 4.88 -4.70 6.45 3.02 -1.03 -5.01 115.26 115.55 2rjc n ASN 421 Ca -0.02 -3.77 -0.43 0.00 -0.03 0.00 0.00 54.58 50.33 2rjc n ASN 421 Cb 0.95 -0.62 -0.02 0.00 -0.61 0.00 0.00 39.78 39.49 2rjc n ASN 421 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2rjc n PHE 422 N -0.91 2.35 -3.73 3.10 7.35 -1.22 -4.98 117.46 119.42 2rjc n PHE 422 Ca 0.46 0.45 -0.25 0.00 -0.76 0.00 0.00 57.45 57.35 2rjc n PHE 422 Cb 0.93 -2.47 -0.17 0.00 0.35 0.00 0.00 39.48 38.12 2rjc n PHE 422 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2rjc h TRP 424 N 8.30 0.27 -0.91 0.00 -0.00 -1.99 -0.94 115.95 120.68 2rjc h TRP 424 Ca -0.17 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.72 2rjc h TRP 424 Cb 1.13 -0.06 -0.04 0.00 -0.00 0.00 0.00 29.16 30.18 2rjc h TRP 424 CO 0.35 0.12 0.53 0.93 -0.00 0.00 0.00 178.44 180.36 2rjc h GLU 425 N 0.32 1.26 -0.58 0.49 4.39 -1.99 0.84 114.58 119.31 2rjc h GLU 425 Ca 0.18 -0.13 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 2rjc h GLU 425 Cb 0.14 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.51 2rjc h GLU 425 CO -0.17 0.90 0.09 0.87 -1.16 0.00 0.00 179.01 179.54 2rjc h LYS 426 N 1.27 0.97 -0.25 2.33 1.57 -1.93 -2.24 116.57 118.29 2rjc h LYS 426 Ca 0.33 -0.26 -0.12 0.00 -1.87 0.00 0.00 60.65 58.73 2rjc h LYS 426 Cb -0.01 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 2rjc h LYS 426 CO -0.06 0.92 -0.30 -0.92 -0.57 0.00 0.00 179.45 178.52 2rjc h TYR 427 N 0.87 0.79 -0.16 -1.35 3.20 -0.64 -1.30 116.97 118.39 2rjc h TYR 427 Ca 0.18 -0.25 0.02 0.00 3.14 0.00 0.00 58.73 61.82 2rjc h TYR 427 Cb 0.42 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 2rjc h TYR 427 CO 0.03 0.99 0.01 -0.07 -1.64 0.00 0.00 178.16 177.48 2rjc h LEU 428 N 0.37 -0.04 -0.43 2.82 3.38 -0.89 -1.83 115.31 118.69 2rjc h LEU 428 Ca 0.03 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.10 2rjc h LEU 428 Cb 0.88 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.63 2rjc h LEU 428 CO 0.07 0.00 0.11 -0.08 0.09 0.00 0.00 178.44 178.64 2rjc h GLU 429 N 0.06 0.25 -0.61 1.13 4.81 -1.38 -1.09 114.58 117.75 2rjc h GLU 429 Ca 0.07 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.19 2rjc h GLU 429 Cb 0.08 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2rjc h GLU 429 CO -0.12 0.17 0.01 1.49 -0.73 0.00 0.00 179.01 179.82 2rjc h GLU 430 N 0.26 1.06 -0.10 1.92 4.81 -1.08 -2.75 114.58 118.71 2rjc h GLU 430 Ca 0.21 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2rjc h GLU 430 Cb 0.23 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.51 2rjc h GLU 430 CO -0.24 1.03 0.00 0.25 -0.73 0.00 0.00 179.01 179.32 2rjc n THR 431 N -4.18 0.11 -2.78 0.32 -2.24 -0.70 -4.93 114.28 99.88 2rjc n THR 431 Ca 0.03 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.38 2rjc n THR 431 Cb 0.34 0.35 0.02 0.00 -2.10 0.00 0.00 70.33 68.94 2rjc n THR 431 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rjc n GLY 432 N 1.12 -0.16 3.36 3.38 0.00 -0.69 -5.00 105.19 107.21 2rjc n GLY 432 Ca 0.17 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2rjc n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2rjc s ALA 433 N -2.98 2.18 0.14 4.61 0.00 -0.50 -5.05 121.76 120.16 2rjc s ALA 433 Ca 0.21 -1.49 0.05 0.00 0.00 0.00 0.00 51.96 50.73 2rjc s ALA 433 Cb -0.09 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 2rjc s ALA 433 CO 0.26 0.35 0.06 -1.12 0.00 0.00 0.00 175.76 175.31 2rjc s SER 434 N -2.47 5.21 0.32 0.00 0.01 -1.26 -4.51 113.70 111.00 2rjc s SER 434 Ca 0.15 -0.20 -0.28 0.00 1.31 0.00 0.00 55.95 56.93 2rjc s SER 434 Cb -0.08 -1.28 -0.10 0.00 0.21 0.00 0.00 66.02 64.78 2rjc s SER 434 CO 0.07 0.10 1.18 0.00 0.41 0.00 0.00 173.24 175.00 2rjc s ALA 435 N -1.63 3.38 -0.04 1.44 0.00 -1.26 -1.52 121.76 122.14 2rjc s ALA 435 Ca 0.29 1.02 -0.36 0.00 0.00 0.00 0.00 51.96 52.91 2rjc s ALA 435 Cb -0.10 -3.38 -0.14 0.00 0.00 0.00 0.00 23.12 19.49 2rjc s ALA 435 CO 0.21 -0.38 1.65 0.28 0.00 0.00 0.00 175.76 177.52 2rjc n VAL 436 N 0.83 0.25 -1.72 0.00 0.31 0.45 -4.75 118.33 113.70 2rjc n VAL 436 Ca 0.00 -0.04 -0.39 0.00 -0.01 0.00 0.00 64.34 63.89 2rjc n VAL 436 Cb 0.44 -1.39 0.03 0.00 -0.91 0.00 0.00 33.84 32.01 2rjc n VAL 436 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2rjc n PRO 437 N 4.64 1.77 0.06 5.55 -0.04 -1.26 -4.70 135.00 141.02 2rjc n PRO 437 Ca 0.21 0.64 0.03 0.00 -0.04 0.00 0.00 63.50 64.35 2rjc n PRO 437 Cb 0.23 -2.48 0.42 0.00 -0.04 0.00 0.00 33.50 31.63 2rjc n PRO 437 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2rjc h THR 438 N 1.68 1.12 0.00 0.52 2.02 -1.98 -2.29 112.91 113.98 2rjc h THR 438 Ca -0.50 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.30 2rjc h THR 438 Cb 1.30 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 2rjc h THR 438 CO 0.58 0.15 0.00 4.11 0.37 0.00 0.00 175.52 180.72 2rjc h TRP 439 N 0.40 0.00 0.00 3.16 5.08 -2.00 -3.04 115.95 119.55 2rjc h TRP 439 Ca 0.10 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 60.03 2rjc h TRP 439 Cb 0.10 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.25 2rjc h TRP 439 CO 0.00 0.00 -0.19 0.00 -1.28 0.00 0.00 178.44 176.97 2rjc h ALA 440 N 2.00 0.91 -2.57 0.11 0.00 -1.70 -3.44 119.26 114.57 2rjc h ALA 440 Ca 0.00 -0.18 -0.52 0.00 0.00 0.00 0.00 54.91 54.21 2rjc h ALA 440 Cb 0.26 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2rjc h ALA 440 CO 0.00 0.24 0.47 -0.06 0.00 0.00 0.00 179.25 179.90 2rjc s PHE 441 N -3.30 3.59 0.14 0.00 0.08 -1.15 -4.80 117.98 112.55 2rjc s PHE 441 Ca 0.04 1.57 0.10 0.00 0.12 0.00 0.00 56.93 58.76 2rjc s PHE 441 Cb 0.07 -3.26 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 2rjc s PHE 441 CO 0.67 -0.59 -0.25 0.15 -0.10 0.00 0.00 175.22 175.10 2rjc s LYS 442 N 0.20 1.37 -0.21 0.44 -0.14 -0.75 -5.02 119.74 115.62 2rjc s LYS 442 Ca 0.52 -1.35 -0.23 0.00 -1.36 0.00 0.00 55.97 53.54 2rjc s LYS 442 Cb -0.28 -1.77 -0.01 0.00 -1.68 0.00 0.00 37.83 34.09 2rjc s LYS 442 CO 0.32 0.41 0.75 0.08 -0.76 0.00 0.00 175.35 176.15 2rjc s VAL 443 N -1.25 4.92 -0.10 3.17 1.01 -1.26 -4.34 120.40 122.55 2rjc s VAL 443 Ca 0.14 1.42 -0.30 0.00 0.00 0.00 0.00 61.98 63.25 2rjc s VAL 443 Cb -0.09 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.22 2rjc s VAL 443 CO 0.06 0.02 1.02 -0.60 0.00 0.00 0.00 175.10 175.60 2rjc s ARG 444 N 2.36 4.42 0.48 2.72 3.52 -1.24 -4.99 118.95 126.22 2rjc s ARG 444 Ca 0.33 1.40 -0.24 0.00 -0.13 0.00 0.00 55.73 57.10 2rjc s ARG 444 Cb -0.16 -3.54 -0.07 0.00 -1.56 0.00 0.00 34.95 29.62 2rjc s ARG 444 CO 0.10 -0.32 1.33 -1.25 -0.81 0.00 0.00 175.30 174.34 2rjc s PRO 445 N 2.02 3.57 0.57 5.12 0.04 -1.26 -4.97 135.00 140.09 2rjc s PRO 445 Ca 0.49 2.18 -0.21 0.00 0.04 0.00 0.00 61.00 63.50 2rjc s PRO 445 Cb -0.19 -2.49 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 2rjc s PRO 445 CO 0.18 -0.83 1.33 -2.14 0.04 0.00 0.00 177.00 175.58 2rjc s PRO 446 N -2.61 3.01 0.98 0.56 0.02 -1.26 -4.99 135.00 130.71 2rjc s PRO 446 Ca 0.64 2.15 -0.12 0.00 0.02 0.00 0.00 61.00 63.69 2rjc s PRO 446 Cb -0.38 -2.14 0.18 0.00 0.02 0.00 0.00 34.50 32.17 2rjc s PRO 446 CO 0.48 -1.27 1.10 -3.38 -0.33 0.00 0.00 177.00 173.59 2rjc s HIS 447 N -1.35 2.17 -0.16 6.54 -3.43 -0.88 -5.01 115.29 113.16 2rjc s HIS 447 Ca 0.74 0.99 0.17 0.00 -0.80 0.00 0.00 55.06 56.16 2rjc s HIS 447 Cb -0.39 -3.27 0.37 0.00 -1.43 0.00 0.00 32.58 27.86 2rjc s HIS 447 CO 0.44 -2.80 1.23 0.43 -2.00 0.00 0.00 174.74 172.05 2rjc n SER 448 N -4.11 2.54 -4.77 7.38 7.64 -1.26 -4.99 113.62 116.05 2rjc n SER 448 Ca 0.05 -3.26 -0.41 0.00 1.01 0.00 0.00 58.87 56.27 2rjc n SER 448 Cb 0.57 -0.48 -0.01 0.00 -1.01 0.00 0.00 64.21 63.28 2rjc n SER 448 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2rjc s PHE 449 N -2.96 2.85 0.13 1.43 0.08 -1.26 -5.03 117.98 113.23 2rjc s PHE 449 Ca 0.36 1.34 0.08 0.00 0.12 0.00 0.00 56.93 58.82 2rjc s PHE 449 Cb 0.32 -3.79 -0.04 0.00 -0.57 0.00 0.00 43.02 38.94 2rjc s PHE 449 CO 0.02 -2.27 -0.09 -0.51 -0.10 0.00 0.00 175.22 172.28 2rjc s LEU 450 N -2.02 3.06 0.31 -0.37 1.43 -1.26 -4.99 118.68 114.84 2rjc s LEU 450 Ca 0.52 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.89 2rjc s LEU 450 Cb -0.42 -1.81 -0.12 0.00 0.03 0.00 0.00 46.19 43.87 2rjc s LEU 450 CO 0.55 0.15 1.50 0.52 0.23 0.00 0.00 176.35 179.30 2rjc n VAL 451 N 0.43 1.33 -0.26 -1.59 0.31 -1.26 -2.15 118.33 115.14 2rjc n VAL 451 Ca -0.12 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 2rjc n VAL 451 Cb 0.53 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 2rjc n VAL 451 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2rjc n ASN 452 N 1.64 0.00 -4.76 4.52 3.02 0.37 -4.97 115.26 115.07 2rjc n ASN 452 Ca 0.07 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.21 2rjc n ASN 452 Cb 0.36 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.52 2rjc n ASN 452 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2rjc s MET 453 N -0.22 4.19 0.10 3.52 -1.94 -0.92 -4.60 119.30 119.44 2rjc s MET 453 Ca 0.00 2.45 0.03 0.00 -1.71 0.00 0.00 55.69 56.46 2rjc s MET 453 Cb 0.00 -3.04 -0.04 0.00 2.01 0.00 0.00 34.83 33.76 2rjc s MET 453 CO 0.00 -0.48 0.12 0.15 -0.01 0.00 0.00 175.02 174.80 2rjc s LYS 454 N -1.13 2.99 0.04 2.03 1.02 -0.58 -0.47 119.74 123.63 2rjc s LYS 454 Ca 0.57 -0.70 -0.01 0.00 0.02 0.00 0.00 55.97 55.84 2rjc s LYS 454 Cb -0.45 -2.76 0.01 0.00 -0.52 0.00 0.00 37.83 34.11 2rjc s LYS 454 CO 0.52 0.55 0.08 1.47 -0.92 0.00 0.00 175.35 177.04 2rjc n LEU 455 N 0.15 0.00 -4.32 3.17 -0.00 0.14 -0.56 117.00 115.58 2rjc n LEU 455 Ca -0.08 -0.23 -0.31 0.00 -0.00 0.00 0.00 56.01 55.39 2rjc n LEU 455 Cb 0.52 0.35 -0.16 0.00 -0.00 0.00 0.00 43.42 44.14 2rjc n LEU 455 CO 0.45 -0.08 -0.57 -1.61 -0.00 0.00 0.00 177.39 175.59 2rjc s GLU 456 N -2.01 2.10 -0.04 1.47 2.02 -0.17 -0.88 118.70 121.19 2rjc s GLU 456 Ca 0.02 -0.94 -0.04 0.00 0.02 0.00 0.00 54.97 54.02 2rjc s GLU 456 Cb -0.00 -2.04 0.01 0.00 0.10 0.00 0.00 34.13 32.19 2rjc s GLU 456 CO 0.01 0.56 0.12 0.00 0.02 0.00 0.00 175.26 175.97 2rjc s ALA 457 N -0.63 -0.29 0.27 5.21 0.00 -0.78 -0.85 121.76 124.69 2rjc s ALA 457 Ca 0.10 0.27 -0.31 0.00 0.00 0.00 0.00 51.96 52.03 2rjc s ALA 457 Cb -0.10 -0.16 -0.12 0.00 0.00 0.00 0.00 23.12 22.74 2rjc s ALA 457 CO -0.01 -0.07 1.61 0.28 0.00 0.00 0.00 175.76 177.57 2rjc n VAL 458 N 2.84 0.79 -2.62 0.00 0.31 -0.73 -0.45 118.33 118.48 2rjc n VAL 458 Ca -0.14 -0.20 -0.42 0.00 -0.01 0.00 0.00 64.34 63.57 2rjc n VAL 458 Cb 0.59 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 31.57 2rjc n VAL 458 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2rjc s ASP 459 N 0.63 6.46 0.53 4.52 -1.08 0.56 -4.88 116.67 123.40 2rjc s ASP 459 Ca 0.67 0.10 0.26 0.00 -0.52 0.00 0.00 52.55 53.06 2rjc s ASP 459 Cb -0.51 -2.54 1.47 0.00 -1.46 0.00 0.00 42.92 39.88 2rjc s ASP 459 CO 0.45 -1.42 2.10 0.08 0.52 0.00 0.00 175.17 176.90 2rjc h ARG 460 N 9.47 0.00 0.00 4.34 0.11 -1.92 -1.40 114.38 124.98 2rjc h ARG 460 Ca -0.25 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.77 2rjc h ARG 460 Cb 1.06 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.13 2rjc h ARG 460 CO 1.17 0.10 -0.32 0.00 0.10 0.00 0.00 179.97 181.02 2rjc h ARG 461 N 0.00 0.00 -1.55 0.08 -0.00 -1.97 -3.37 114.38 107.56 2rjc h ARG 461 Ca -0.00 0.00 -0.46 0.00 -0.50 0.00 0.00 59.98 59.02 2rjc h ARG 461 Cb 0.27 0.00 -0.31 0.00 0.00 0.00 0.00 29.97 29.92 2rjc h ARG 461 CO 0.01 0.32 -0.90 -1.71 0.00 0.00 0.00 179.97 177.69 2rjc n ASN 462 N -3.84 -0.93 0.00 7.04 2.85 -0.75 -5.05 115.26 114.58 2rjc n ASN 462 Ca -0.01 -2.78 0.08 0.00 -0.11 0.00 0.00 54.58 51.75 2rjc n ASN 462 Cb 0.40 0.12 0.38 0.00 1.24 0.00 0.00 39.78 41.91 2rjc n ASN 462 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2rjc n PRO 463 N 1.86 0.10 -0.16 1.20 -0.05 -0.60 -1.06 135.00 136.30 2rjc n PRO 463 Ca 0.20 0.18 0.23 0.00 -0.05 0.00 0.00 63.50 64.06 2rjc n PRO 463 Cb 0.54 -1.50 0.64 0.00 -0.05 0.00 0.00 33.50 33.13 2rjc n PRO 463 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2rjc h ALA 464 N 2.66 2.53 -2.71 0.55 0.00 -1.97 -3.44 119.26 116.88 2rjc h ALA 464 Ca 0.00 -0.01 -0.65 0.00 0.00 0.00 0.00 54.91 54.24 2rjc h ALA 464 Cb 0.23 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 2rjc h ALA 464 CO 0.00 -0.77 -0.47 -0.51 0.00 0.00 0.00 179.25 177.50 2rjc s LEU 465 N -8.90 4.38 -0.07 0.00 1.43 -0.22 -5.02 118.68 110.27 2rjc s LEU 465 Ca -0.06 0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.52 2rjc s LEU 465 Cb 0.21 -2.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.12 2rjc s LEU 465 CO 0.77 0.35 -0.21 -0.63 0.23 0.00 0.00 176.35 176.85 2rjc s ILE 466 N -1.16 1.77 0.17 -0.59 1.01 -1.26 -0.32 121.20 120.83 2rjc s ILE 466 Ca 0.20 -0.87 0.11 0.00 0.00 0.00 0.00 60.65 60.09 2rjc s ILE 466 Cb -0.12 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 2rjc s ILE 466 CO 0.10 0.50 -0.24 -0.13 0.00 0.00 0.00 174.94 175.17 2rjc s ARG 467 N 0.24 1.44 0.05 2.79 0.52 0.40 -0.63 118.95 123.76 2rjc s ARG 467 Ca -0.12 -1.45 -0.33 0.00 -0.52 0.00 0.00 55.73 53.31 2rjc s ARG 467 Cb -0.16 -1.78 -0.11 0.00 0.52 0.00 0.00 34.95 33.42 2rjc s ARG 467 CO 0.06 0.39 1.82 0.28 0.02 0.00 0.00 175.30 177.87 2rjc n VAL 468 N 0.47 0.42 -4.25 3.52 0.31 -1.02 -1.87 118.33 115.91 2rjc n VAL 468 Ca -0.14 -0.08 -0.17 0.00 -0.01 0.00 0.00 64.34 63.94 2rjc n VAL 468 Cb 0.55 -1.95 -0.11 0.00 -0.91 0.00 0.00 33.84 31.43 2rjc n VAL 468 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2rjc s ALA 469 N 3.05 1.50 0.10 3.52 0.00 -0.06 -2.72 121.76 127.16 2rjc s ALA 469 Ca 0.86 -1.34 0.08 0.00 0.00 0.00 0.00 51.96 51.56 2rjc s ALA 469 Cb -0.59 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2rjc s ALA 469 CO 0.43 0.06 -0.20 -1.12 0.00 0.00 0.00 175.76 174.93 2rjc s SER 470 N -2.62 2.39 -0.26 0.00 0.01 -0.11 -0.68 113.70 112.42 2rjc s SER 470 Ca 0.11 -0.68 -0.29 0.00 1.31 0.00 0.00 55.95 56.40 2rjc s SER 470 Cb -0.03 -0.12 -0.02 0.00 0.21 0.00 0.00 66.02 66.05 2rjc s SER 470 CO 0.03 0.03 1.67 -0.69 0.41 0.00 0.00 173.24 174.69 2rjc s VAL 471 N -1.21 3.62 -0.02 3.43 1.01 0.38 -1.10 120.40 126.51 2rjc s VAL 471 Ca 0.05 0.67 -0.03 0.00 0.00 0.00 0.00 61.98 62.68 2rjc s VAL 471 Cb -0.10 -3.70 -0.27 0.00 0.00 0.00 0.00 36.38 32.31 2rjc s VAL 471 CO 0.04 -0.35 0.75 -0.08 0.00 0.00 0.00 175.10 175.46 2rjc h GLU 472 N 11.46 0.24 -2.89 2.72 4.57 -0.75 0.11 114.58 130.04 2rjc h GLU 472 Ca -0.34 -0.41 0.05 0.00 -1.18 0.00 0.00 59.36 57.48 2rjc h GLU 472 Cb 1.16 0.15 -0.08 0.00 -0.16 0.00 0.00 28.75 29.82 2rjc h GLU 472 CO 1.01 1.09 0.27 0.34 -1.18 0.00 0.00 179.01 180.54 2rjc s ASP 473 N -6.93 -0.36 0.02 1.04 -1.08 -1.23 -4.87 116.67 103.26 2rjc s ASP 473 Ca -0.11 -0.35 -0.02 0.00 -0.52 0.00 0.00 52.55 51.55 2rjc s ASP 473 Cb 0.07 0.64 -0.02 0.00 -1.46 0.00 0.00 42.92 42.15 2rjc s ASP 473 CO 0.84 -1.13 0.01 0.68 0.52 0.00 0.00 175.17 176.09 2rjc s VAL 474 N -3.75 0.11 0.37 1.11 -7.23 -1.26 -0.84 120.40 108.91 2rjc s VAL 474 Ca 0.07 -0.91 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 2rjc s VAL 474 Cb -0.04 -0.38 -0.01 0.00 0.56 0.00 0.00 36.38 36.52 2rjc s VAL 474 CO -0.01 -0.50 0.05 -0.62 -0.31 0.00 0.00 175.10 173.71 2rjc n GLU 475 N 1.46 0.87 -0.34 4.82 1.02 0.17 -4.99 120.64 123.65 2rjc n GLU 475 Ca -0.23 -2.85 0.08 0.00 -0.02 0.00 0.00 57.16 54.14 2rjc n GLU 475 Cb 0.56 1.08 0.27 0.00 -0.02 0.00 0.00 31.44 33.33 2rjc n GLU 475 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2rjc h ASP 476 N 1.10 0.87 0.00 1.62 3.32 -2.01 -3.30 116.42 118.02 2rjc h ASP 476 Ca -0.30 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.79 2rjc h ASP 476 Cb 0.99 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2rjc h ASP 476 CO 0.49 0.47 0.00 1.41 -1.72 0.00 0.00 179.24 179.89 2rjc n HIS 477 N -4.59 0.00 -4.22 4.55 8.25 -1.26 -2.08 115.22 115.88 2rjc n HIS 477 Ca 0.18 -0.14 -0.18 0.00 -0.26 0.00 0.00 57.72 57.32 2rjc n HIS 477 Cb 0.36 -0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.35 2rjc n HIS 477 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2rjc s ARG 478 N -0.28 0.95 0.03 -0.41 0.52 -1.25 -1.17 118.95 117.35 2rjc s ARG 478 Ca 0.00 -1.15 0.08 0.00 -0.52 0.00 0.00 55.73 54.14 2rjc s ARG 478 Cb 0.00 -0.86 -0.03 0.00 0.52 0.00 0.00 34.95 34.58 2rjc s ARG 478 CO 0.00 0.17 -0.24 0.96 0.02 0.00 0.00 175.30 176.21 2rjc s ILE 479 N -1.90 1.94 -0.34 1.52 -4.36 0.07 -0.66 121.20 117.47 2rjc s ILE 479 Ca 0.06 -1.25 -0.17 0.00 -0.26 0.00 0.00 60.65 59.03 2rjc s ILE 479 Cb -0.06 -1.66 -0.01 0.00 1.25 0.00 0.00 42.46 41.98 2rjc s ILE 479 CO 0.03 0.35 0.43 -0.75 0.24 0.00 0.00 174.94 175.24 2rjc s LYS 480 N -1.08 3.60 -0.01 0.37 2.20 -0.02 -0.72 119.74 124.09 2rjc s LYS 480 Ca 0.10 -0.29 -0.29 0.00 -0.36 0.00 0.00 55.97 55.14 2rjc s LYS 480 Cb -0.09 -3.80 -0.03 0.00 -1.51 0.00 0.00 37.83 32.39 2rjc s LYS 480 CO 0.01 -0.57 0.92 0.42 -0.36 0.00 0.00 175.35 175.77 2rjc s ILE 481 N 2.19 4.89 -0.13 5.43 -1.09 0.76 0.00 121.20 133.25 2rjc s ILE 481 Ca 0.15 1.93 0.01 0.00 -2.23 0.00 0.00 60.65 60.51 2rjc s ILE 481 Cb -0.16 -4.26 -0.01 0.00 -1.58 0.00 0.00 42.46 36.45 2rjc s ILE 481 CO 0.12 0.19 -0.16 -2.28 -1.23 0.00 0.00 174.94 171.58 2rjc s HIS 482 N 0.91 2.75 -0.37 3.97 5.65 -0.26 -1.92 115.29 126.03 2rjc s HIS 482 Ca 0.49 -0.79 -0.28 0.00 0.25 0.00 0.00 55.06 54.73 2rjc s HIS 482 Cb -0.20 -1.82 0.02 0.00 -1.18 0.00 0.00 32.58 29.39 2rjc s HIS 482 CO 0.26 -0.29 1.03 -0.06 -0.65 0.00 0.00 174.74 175.03 2rjc s PHE 483 N 0.41 3.06 -0.03 3.88 0.08 -1.26 -0.93 117.98 123.19 2rjc s PHE 483 Ca -0.12 0.94 -0.38 0.00 0.12 0.00 0.00 56.93 57.50 2rjc s PHE 483 Cb -0.16 -3.81 -0.17 0.00 -0.57 0.00 0.00 43.02 38.31 2rjc s PHE 483 CO 0.06 -0.88 1.46 -0.25 -0.10 0.00 0.00 175.22 175.50 2rjc n ASP 484 N 7.01 1.82 0.00 1.36 9.92 -1.10 -0.96 116.55 134.59 2rjc n ASP 484 Ca 0.10 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.47 2rjc n ASP 484 Cb 0.48 -1.17 0.00 0.00 -0.64 0.00 0.00 41.12 39.79 2rjc n ASP 484 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2rjc n GLY 485 N 3.00 2.11 3.90 0.44 0.00 -1.26 -3.17 105.19 110.21 2rjc n GLY 485 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 2rjc n GLY 485 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2rjc s TRP 486 N -2.53 3.48 0.81 1.61 0.52 -0.14 -4.64 118.94 118.06 2rjc s TRP 486 Ca 0.00 0.69 -0.13 0.00 0.02 0.00 0.00 56.10 56.69 2rjc s TRP 486 Cb 0.00 -2.15 0.08 0.00 -1.15 0.00 0.00 33.47 30.25 2rjc s TRP 486 CO 0.00 0.10 1.17 -1.54 0.02 0.00 0.00 176.95 176.71 2rjc s SER 487 N -3.26 3.69 0.02 2.95 1.04 -1.26 -4.85 113.70 112.03 2rjc s SER 487 Ca 0.45 2.24 0.22 0.00 0.48 0.00 0.00 55.95 59.34 2rjc s SER 487 Cb -0.11 -2.57 0.91 0.00 0.10 0.00 0.00 66.02 64.35 2rjc s SER 487 CO 0.31 -2.59 1.69 1.41 0.98 0.00 0.00 173.24 175.04 2rjc n HIS 488 N -3.42 0.08 0.28 5.02 -0.00 -1.26 -2.23 115.22 113.69 2rjc n HIS 488 Ca 0.12 0.03 0.17 0.00 -0.00 0.00 0.00 57.72 58.04 2rjc n HIS 488 Cb 0.51 -0.54 0.95 0.00 -0.00 0.00 0.00 29.99 30.91 2rjc n HIS 488 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 2rjc h GLY 489 N 3.63 0.00 1.52 -1.41 0.00 -2.01 -1.58 103.07 103.22 2rjc h GLY 489 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2rjc h GLY 489 CO 0.00 0.00 -0.17 -1.72 0.00 0.00 0.00 176.54 174.65 2rjc n TYR 490 N -3.66 0.00 -1.85 5.60 4.02 -0.95 -4.90 117.16 115.42 2rjc n TYR 490 Ca -0.02 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.52 2rjc n TYR 490 Cb 0.15 -0.37 0.05 0.00 -0.02 0.00 0.00 39.34 39.15 2rjc n TYR 490 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2rjc s ASP 491 N -2.91 4.95 -0.14 7.72 1.11 -0.60 -4.81 116.67 122.00 2rjc s ASP 491 Ca 0.16 2.34 -0.21 0.00 0.18 0.00 0.00 52.55 55.02 2rjc s ASP 491 Cb 0.19 -2.59 0.05 0.00 1.07 0.00 0.00 42.92 41.64 2rjc s ASP 491 CO 0.57 -1.75 0.53 0.72 1.18 0.00 0.00 175.17 176.42 2rjc s PHE 492 N -1.76 -0.53 0.32 4.23 -0.12 -0.81 -4.99 117.98 114.33 2rjc s PHE 492 Ca 0.76 1.17 -0.25 0.00 -0.05 0.00 0.00 56.93 58.56 2rjc s PHE 492 Cb -0.29 0.23 -0.10 0.00 -0.63 0.00 0.00 43.02 42.23 2rjc s PHE 492 CO 0.37 -0.37 0.92 -1.58 -0.05 0.00 0.00 175.22 174.51 2rjc s TRP 493 N -0.30 3.65 -0.12 3.49 0.52 -1.26 -0.17 118.94 124.74 2rjc s TRP 493 Ca -0.05 1.72 -0.12 0.00 0.02 0.00 0.00 56.10 57.68 2rjc s TRP 493 Cb -0.03 -2.88 0.03 0.00 -1.15 0.00 0.00 33.47 29.44 2rjc s TRP 493 CO 0.03 0.19 0.34 -1.50 0.02 0.00 0.00 176.95 176.03 2rjc s ILE 494 N -1.67 0.00 0.35 2.03 2.07 0.10 -4.93 121.20 119.15 2rjc s ILE 494 Ca 0.51 -0.03 -0.28 0.00 -1.41 0.00 0.00 60.65 59.43 2rjc s ILE 494 Cb -0.17 -0.48 -0.12 0.00 0.13 0.00 0.00 42.46 41.81 2rjc s ILE 494 CO 0.22 -0.02 1.34 0.47 -1.91 0.00 0.00 174.94 175.05 2rjc n ASP 495 N 2.78 3.03 0.29 4.50 8.00 -1.26 -0.75 116.55 133.13 2rjc n ASP 495 Ca -0.14 1.21 0.15 0.00 0.71 0.00 0.00 54.79 56.72 2rjc n ASP 495 Cb 0.58 -1.52 0.86 0.00 -0.02 0.00 0.00 41.12 41.01 2rjc n ASP 495 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2rjc h ALA 496 N 2.70 1.39 -0.61 2.24 0.00 -1.48 -1.88 119.26 121.62 2rjc h ALA 496 Ca -0.47 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2rjc h ALA 496 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2rjc h ALA 496 CO 0.63 0.06 0.00 -0.40 0.00 0.00 0.00 179.25 179.54 2rjc n ASP 497 N -3.71 3.29 -4.76 0.00 5.75 -1.26 -4.83 116.55 111.04 2rjc n ASP 497 Ca -0.02 -2.02 -0.41 0.00 -0.01 0.00 0.00 54.79 52.32 2rjc n ASP 497 Cb 0.15 -0.41 -0.01 0.00 -1.03 0.00 0.00 41.12 39.81 2rjc n ASP 497 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2rjc s HIS 498 N -1.22 2.71 -0.33 2.11 2.46 -0.71 -4.87 115.29 115.44 2rjc s HIS 498 Ca 0.41 0.84 0.20 0.00 0.47 0.00 0.00 55.06 56.99 2rjc s HIS 498 Cb 0.21 -4.07 1.04 0.00 -0.13 0.00 0.00 32.58 29.63 2rjc s HIS 498 CO 0.27 -3.51 1.62 -0.35 -2.47 0.00 0.00 174.74 170.30 2rjc n PRO 499 N 1.86 0.14 -0.54 2.88 -0.04 -1.26 -3.37 135.00 134.68 2rjc n PRO 499 Ca 0.07 0.57 0.08 0.00 -0.04 0.00 0.00 63.50 64.18 2rjc n PRO 499 Cb 0.38 -1.90 0.31 0.00 -0.04 0.00 0.00 33.50 32.25 2rjc n PRO 499 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2rjc n ASP 500 N -2.19 4.39 -4.42 3.54 8.00 -1.26 -4.88 116.55 119.73 2rjc n ASP 500 Ca -0.00 -2.56 -0.30 0.00 0.71 0.00 0.00 54.79 52.64 2rjc n ASP 500 Cb 0.08 -0.53 -0.13 0.00 -0.02 0.00 0.00 41.12 40.52 2rjc n ASP 500 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2rjc s ILE 501 N -2.03 2.52 0.03 0.53 -4.36 -1.22 -1.77 121.20 114.90 2rjc s ILE 501 Ca 0.45 -1.42 -0.14 0.00 -0.26 0.00 0.00 60.65 59.28 2rjc s ILE 501 Cb 0.31 -2.07 0.02 0.00 1.25 0.00 0.00 42.46 41.97 2rjc s ILE 501 CO 0.19 0.25 0.30 -1.00 0.24 0.00 0.00 174.94 174.91 2rjc s HIS 502 N -0.96 -0.12 0.65 1.37 3.76 -0.03 -4.81 115.29 115.15 2rjc s HIS 502 Ca 0.14 0.04 -0.18 0.00 -0.15 0.00 0.00 55.06 54.91 2rjc s HIS 502 Cb -0.10 0.09 -0.01 0.00 1.11 0.00 0.00 32.58 33.66 2rjc s HIS 502 CO 0.05 -0.46 1.27 -2.30 -0.85 0.00 0.00 174.74 172.45 2rjc n PRO 503 N 0.79 1.10 -1.56 8.40 -0.02 -1.26 -1.00 135.00 141.44 2rjc n PRO 503 Ca -0.19 0.43 -0.51 0.00 -2.02 0.00 0.00 63.50 61.20 2rjc n PRO 503 Cb 0.58 -2.51 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 2rjc n PRO 503 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2rjc n ALA 504 N -1.91 -1.29 0.00 3.55 0.00 -1.26 -1.92 120.51 117.68 2rjc n ALA 504 Ca 0.16 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.10 2rjc n ALA 504 Cb 0.48 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 17.94 2rjc n ALA 504 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2rjc n GLY 505 N 2.12 2.33 0.06 0.00 0.00 -1.26 -4.97 105.19 103.48 2rjc n GLY 505 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 2rjc n GLY 505 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2rjc h TRP 506 N 0.00 0.03 0.01 1.61 7.01 -1.74 0.19 115.95 123.06 2rjc h TRP 506 Ca 0.00 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.02 2rjc h TRP 506 Cb 0.00 -0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.04 2rjc h TRP 506 CO 0.00 0.02 -0.09 0.00 -2.79 0.00 0.00 178.44 175.58 2rjc h SER 508 N -0.16 0.22 1.01 0.00 0.87 -1.68 0.14 113.55 113.95 2rjc h SER 508 Ca 0.03 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.56 2rjc h SER 508 Cb 0.20 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2rjc h SER 508 CO -0.09 0.16 -0.23 0.11 -0.53 0.00 0.00 176.83 176.26 2rjc h LYS 509 N 0.31 0.00 0.00 2.24 1.57 -0.54 -3.21 116.57 116.93 2rjc h LYS 509 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2rjc h LYS 509 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2rjc h LYS 509 CO -0.08 0.23 -0.94 0.25 -0.57 0.00 0.00 179.45 178.33 2rjc n THR 510 N -3.35 0.03 -1.01 -0.16 -2.24 -0.34 -4.92 114.28 102.28 2rjc n THR 510 Ca 0.00 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2rjc n THR 510 Cb 0.45 0.62 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 2rjc n THR 510 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2rjc n GLY 511 N 1.46 0.80 3.73 3.38 0.00 0.30 -3.84 105.19 111.02 2rjc n GLY 511 Ca 0.04 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 2rjc n GLY 511 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2rjc s HIS 512 N -2.00 3.35 0.41 1.61 5.04 -0.00 -3.68 115.29 120.01 2rjc s HIS 512 Ca 0.00 0.27 -0.26 0.00 -1.54 0.00 0.00 55.06 53.52 2rjc s HIS 512 Cb 0.00 -1.96 -0.09 0.00 0.04 0.00 0.00 32.58 30.57 2rjc s HIS 512 CO 0.00 0.44 1.36 -2.14 -2.34 0.00 0.00 174.74 172.06 2rjc s PRO 513 N -0.43 3.93 -0.15 2.88 0.02 -1.26 -4.22 135.00 135.77 2rjc s PRO 513 Ca 0.10 2.30 -0.05 0.00 0.02 0.00 0.00 61.00 63.36 2rjc s PRO 513 Cb -0.12 -2.78 -0.03 0.00 0.02 0.00 0.00 34.50 31.59 2rjc s PRO 513 CO 0.02 -0.57 0.02 -1.17 -0.33 0.00 0.00 177.00 174.96 2rjc s LEU 514 N -2.42 3.59 -0.16 -5.54 2.96 -1.26 -4.50 118.68 111.34 2rjc s LEU 514 Ca 0.57 0.03 -0.26 0.00 -0.22 0.00 0.00 54.13 54.25 2rjc s LEU 514 Cb -0.41 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.39 2rjc s LEU 514 CO 0.53 0.22 0.86 -1.10 -1.32 0.00 0.00 176.35 175.54 2rjc s GLN 515 N 0.11 4.31 0.94 1.98 -1.52 0.20 -5.00 119.66 120.68 2rjc s GLN 515 Ca 0.02 1.08 -0.13 0.00 -1.95 0.00 0.00 55.36 54.39 2rjc s GLN 515 Cb -0.13 -3.57 0.16 0.00 -0.22 0.00 0.00 33.01 29.25 2rjc s GLN 515 CO 0.02 -0.34 1.14 -1.25 -0.25 0.00 0.00 175.29 174.61 2rjc s PRO 516 N 2.16 0.86 0.54 2.91 0.04 -1.26 -2.43 135.00 137.82 2rjc s PRO 516 Ca 0.40 0.27 -0.21 0.00 0.04 0.00 0.00 61.00 61.50 2rjc s PRO 516 Cb -0.17 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 2rjc s PRO 516 CO 0.13 -2.38 1.08 -2.30 0.04 0.00 0.00 177.00 173.56 2rjc n PRO 517 N -3.89 1.24 -1.69 0.56 -0.02 -1.26 -4.78 135.00 125.16 2rjc n PRO 517 Ca 0.07 0.46 -0.44 0.00 -2.02 0.00 0.00 63.50 61.56 2rjc n PRO 517 Cb 0.59 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 2rjc n PRO 517 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2rjc n LEU 518 N -0.46 3.43 -4.81 2.45 4.77 -1.19 -4.96 117.00 116.23 2rjc n LEU 518 Ca 0.12 1.09 -0.32 0.00 -0.03 0.00 0.00 56.01 56.87 2rjc n LEU 518 Cb 0.44 -1.48 0.02 0.00 -2.33 0.00 0.00 43.42 40.08 2rjc n LEU 518 CO 0.52 -0.17 0.71 -0.83 -1.33 0.00 0.00 177.39 176.30 2rjc s GLY 519 N 0.83 1.94 0.44 -0.72 0.00 -1.26 -4.73 107.32 103.81 2rjc s GLY 519 Ca 0.75 0.26 0.22 0.00 0.00 0.00 0.00 44.72 45.95 2rjc s GLY 519 CO 0.39 0.57 1.81 -0.56 0.00 0.00 0.00 173.10 175.32 2rjc h PRO 520 N -0.01 0.29 -0.31 2.90 0.13 -1.99 -1.56 132.00 131.46 2rjc h PRO 520 Ca -0.46 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 2rjc h PRO 520 Cb 1.21 -0.07 -0.08 0.00 0.13 0.00 0.00 31.00 32.20 2rjc h PRO 520 CO 0.57 0.19 -0.06 0.54 -0.23 0.00 0.00 178.00 179.01 2rjc n ARG 521 N -4.50 2.05 0.00 0.86 1.74 -1.26 -5.30 116.66 110.25 2rjc n ARG 521 Ca 0.23 -3.08 0.03 0.00 -0.77 0.00 0.00 57.85 54.26 2rjc n ARG 521 Cb 0.89 -1.81 0.15 0.00 -1.02 0.00 0.00 32.46 30.68 2rjc n ARG 521 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20