#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qtz s ASN 218 N 0.00 6.33 -0.25 4.04 0.01 -1.26 -5.09 114.94 118.72 2qtz s ASN 218 Ca 0.00 0.17 -0.29 0.00 -0.71 0.00 0.00 52.86 52.03 2qtz s ASN 218 Cb 0.00 -1.91 0.01 0.00 0.41 0.00 0.00 41.25 39.76 2qtz s ASN 218 CO 0.00 -0.07 1.03 -0.69 -1.51 0.00 0.00 177.10 175.87 2qtz s VAL 219 N -1.96 4.65 -0.12 1.60 1.01 -1.26 -5.03 120.40 119.29 2qtz s VAL 219 Ca 0.35 1.93 0.02 0.00 0.00 0.00 0.00 61.98 64.28 2qtz s VAL 219 Cb -0.10 -4.32 0.01 0.00 0.00 0.00 0.00 36.38 31.97 2qtz s VAL 219 CO 0.30 -0.24 -0.20 -0.69 0.00 0.00 0.00 175.10 174.27 2qtz s VAL 220 N 3.28 1.86 -0.09 2.92 1.01 -1.26 -5.13 120.40 122.99 2qtz s VAL 220 Ca 0.44 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.59 2qtz s VAL 220 Cb -0.14 -1.66 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2qtz s VAL 220 CO 0.08 0.51 -0.21 -0.63 0.00 0.00 0.00 175.10 174.86 2qtz s ILE 221 N 0.81 2.38 0.61 2.22 1.01 -1.26 -5.13 121.20 121.84 2qtz s ILE 221 Ca -0.08 -0.93 -0.11 0.00 0.00 0.00 0.00 60.65 59.53 2qtz s ILE 221 Cb -0.16 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 2qtz s ILE 221 CO -0.00 0.56 1.02 -1.61 0.00 0.00 0.00 174.94 174.90 2qtz s GLU 222 N 0.06 3.61 0.36 2.79 2.02 -1.26 -4.96 118.70 121.33 2qtz s GLU 222 Ca -0.09 0.74 0.06 0.00 0.02 0.00 0.00 54.97 55.70 2qtz s GLU 222 Cb -0.15 -2.10 0.75 0.00 0.10 0.00 0.00 34.13 32.73 2qtz s GLU 222 CO 0.06 -0.54 1.95 0.22 0.02 0.00 0.00 175.26 176.96 2qtz h ASP 223 N -0.23 0.67 0.72 -0.19 3.58 -2.05 -1.98 116.42 116.93 2qtz h ASP 223 Ca -0.44 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.01 2qtz h ASP 223 Cb 1.19 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.11 2qtz h ASP 223 CO 0.62 0.42 0.00 2.22 -2.88 0.00 0.00 179.24 179.62 2qtz n PHE 224 N -4.49 0.00 -2.79 0.28 1.16 -1.26 -4.79 117.46 105.57 2qtz n PHE 224 Ca 0.12 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.27 2qtz n PHE 224 Cb 0.26 -0.43 -0.04 0.00 -1.61 0.00 0.00 39.48 37.66 2qtz n PHE 224 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2qtz s GLU 225 N -2.86 3.42 0.37 3.97 2.02 -0.75 -4.96 118.70 119.91 2qtz s GLU 225 Ca 0.16 -0.06 -0.05 0.00 0.02 0.00 0.00 54.97 55.03 2qtz s GLU 225 Cb 0.16 -4.01 -0.05 0.00 0.10 0.00 0.00 34.13 30.33 2qtz s GLU 225 CO 0.43 -1.45 0.66 -1.54 0.02 0.00 0.00 175.26 173.37 2qtz s SER 226 N 2.71 6.40 0.31 -0.19 1.04 -1.26 -4.92 113.70 117.78 2qtz s SER 226 Ca 0.34 0.82 -0.15 0.00 0.48 0.00 0.00 55.95 57.44 2qtz s SER 226 Cb -0.11 -2.19 0.06 0.00 0.10 0.00 0.00 66.02 63.88 2qtz s SER 226 CO 0.22 -0.34 0.77 -1.54 0.98 0.00 0.00 173.24 173.33 2qtz n SER 227 N -1.45 -1.94 -0.33 7.02 3.41 -0.27 -4.97 113.62 115.09 2qtz n SER 227 Ca -0.01 -2.27 0.15 0.00 -0.26 0.00 0.00 58.87 56.48 2qtz n SER 227 Cb 0.55 3.22 0.31 0.00 -0.26 0.00 0.00 64.21 68.02 2qtz n SER 227 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2qtz h LEU 228 N 0.00 -0.36 -0.23 1.04 5.85 -1.96 -2.07 115.31 117.58 2qtz h LEU 228 Ca -0.29 0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2qtz h LEU 228 Cb 1.11 0.44 0.00 0.00 0.37 0.00 0.00 40.66 42.58 2qtz h LEU 228 CO 0.37 -0.33 -0.31 0.35 -0.34 0.00 0.00 178.44 178.18 2qtz n THR 229 N -5.44 0.00 -3.72 1.05 -2.24 -1.26 -4.89 114.28 97.78 2qtz n THR 229 Ca 0.24 -0.06 -0.14 0.00 -2.27 0.00 0.00 64.05 61.82 2qtz n THR 229 Cb 0.78 0.21 -0.14 0.00 -2.10 0.00 0.00 70.33 69.08 2qtz n THR 229 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2qtz s ARG 230 N -2.72 0.11 0.36 -0.78 3.52 -0.78 -4.91 118.95 113.74 2qtz s ARG 230 Ca 0.19 0.49 0.07 0.00 -0.13 0.00 0.00 55.73 56.35 2qtz s ARG 230 Cb 0.19 -0.17 -0.01 0.00 -1.56 0.00 0.00 34.95 33.39 2qtz s ARG 230 CO 0.58 -0.21 0.43 -1.54 -0.81 0.00 0.00 175.30 173.76 2qtz s SER 231 N 1.57 5.66 0.38 -2.12 1.04 -1.26 -1.12 113.70 117.85 2qtz s SER 231 Ca -0.05 -0.35 0.07 0.00 0.48 0.00 0.00 55.95 56.09 2qtz s SER 231 Cb -0.11 -1.01 -0.07 0.00 0.10 0.00 0.00 66.02 64.92 2qtz s SER 231 CO -0.07 -0.49 -0.01 0.68 0.98 0.00 0.00 173.24 174.33 2qtz s VAL 232 N -2.26 1.93 0.61 5.02 -7.23 -1.26 -4.75 120.40 112.45 2qtz s VAL 232 Ca 0.46 -2.05 -0.19 0.00 -1.81 0.00 0.00 61.98 58.38 2qtz s VAL 232 Cb -0.08 -2.86 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 2qtz s VAL 232 CO 0.30 -0.06 1.29 -2.65 -0.31 0.00 0.00 175.10 173.67 2qtz n PRO 233 N -0.87 1.32 0.22 4.82 -0.02 -1.26 -2.31 135.00 136.89 2qtz n PRO 233 Ca -0.05 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 2qtz n PRO 233 Cb 0.66 -2.52 0.26 0.00 -0.02 0.00 0.00 33.50 31.88 2qtz n PRO 233 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2qtz h PRO 234 N 0.87 0.00 -0.34 0.52 0.13 -2.01 -3.46 132.00 127.71 2qtz h PRO 234 Ca -0.51 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2qtz h PRO 234 Cb 1.33 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.43 2qtz h PRO 234 CO 0.54 0.00 0.19 1.25 -0.23 0.00 0.00 178.00 179.75 2qtz h LEU 235 N 0.00 0.29 -2.31 1.56 5.85 -1.84 -1.77 115.31 117.09 2qtz h LEU 235 Ca 0.00 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2qtz h LEU 235 Cb 0.91 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.88 2qtz h LEU 235 CO 0.00 0.21 0.22 0.77 -0.34 0.00 0.00 178.44 179.30 2qtz h SER 236 N 0.38 0.00 -0.01 1.25 4.64 -1.76 -1.57 113.55 116.49 2qtz h SER 236 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2qtz h SER 236 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2qtz h SER 236 CO -0.08 0.00 -0.43 0.00 -0.87 0.00 0.00 176.83 175.45 2qtz n GLN 237 N -3.30 2.20 -2.50 4.77 1.13 -0.81 -5.00 117.38 113.88 2qtz n GLN 237 Ca -0.00 -0.41 -0.35 0.00 -1.94 0.00 0.00 57.00 54.30 2qtz n GLN 237 Cb 0.30 -1.17 -0.03 0.00 0.11 0.00 0.00 30.24 29.46 2qtz n GLN 237 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2qtz s ALA 238 N -1.93 2.89 0.09 -1.58 0.00 -0.59 -5.03 121.76 115.60 2qtz s ALA 238 Ca 0.09 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.41 2qtz s ALA 238 Cb 0.11 -3.28 -0.06 0.00 0.00 0.00 0.00 23.12 19.89 2qtz s ALA 238 CO 0.43 -0.37 1.10 -1.12 0.00 0.00 0.00 175.76 175.80 2qtz s SER 239 N -1.86 7.24 -0.15 0.00 0.01 -1.26 -5.03 113.70 112.65 2qtz s SER 239 Ca 0.66 1.94 -0.05 0.00 1.31 0.00 0.00 55.95 59.81 2qtz s SER 239 Cb -0.19 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.42 2qtz s SER 239 CO 0.23 -0.31 0.03 -0.76 0.41 0.00 0.00 173.24 172.84 2qtz s LEU 240 N 0.50 3.67 -0.37 2.44 1.43 -1.26 -4.92 118.68 120.18 2qtz s LEU 240 Ca 0.53 0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.56 2qtz s LEU 240 Cb -0.27 -1.89 -0.00 0.00 0.03 0.00 0.00 46.19 44.06 2qtz s LEU 240 CO 0.31 0.25 0.35 0.20 0.23 0.00 0.00 176.35 177.68 2qtz s ASN 241 N -0.07 6.16 -0.12 2.29 -0.87 -1.26 -5.05 114.94 116.02 2qtz s ASN 241 Ca 0.05 -0.42 -0.00 0.00 -1.57 0.00 0.00 52.86 50.91 2qtz s ASN 241 Cb -0.12 -2.19 -0.02 0.00 -0.02 0.00 0.00 41.25 38.90 2qtz s ASN 241 CO 0.02 -0.38 -0.11 -0.63 -2.57 0.00 0.00 177.10 173.43 2qtz s ILE 242 N 1.96 3.29 0.95 0.60 1.01 -1.26 -1.75 121.20 125.99 2qtz s ILE 242 Ca 0.10 -0.59 -0.12 0.00 0.00 0.00 0.00 60.65 60.04 2qtz s ILE 242 Cb -0.17 -2.38 0.07 0.00 0.01 0.00 0.00 42.46 39.99 2qtz s ILE 242 CO 0.12 0.53 0.62 -0.81 0.00 0.00 0.00 174.94 175.40 2qtz n PRO 243 N 3.22 -0.37 -1.89 2.79 -0.04 -1.26 -4.96 135.00 132.48 2qtz n PRO 243 Ca -0.18 -0.06 -0.35 0.00 -0.04 0.00 0.00 63.50 62.87 2qtz n PRO 243 Cb 0.53 -2.01 0.04 0.00 -0.04 0.00 0.00 33.50 32.02 2qtz n PRO 243 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2qtz s GLY 244 N -2.20 2.50 0.05 0.55 0.00 -1.26 -4.97 107.32 102.00 2qtz s GLY 244 Ca 0.60 0.83 -0.31 0.00 0.00 0.00 0.00 44.72 45.85 2qtz s GLY 244 CO 0.65 1.21 1.36 -2.27 0.00 0.00 0.00 173.10 174.05 2qtz s LEU 245 N -4.41 4.34 0.35 0.66 2.96 -1.26 -4.96 118.68 116.36 2qtz s LEU 245 Ca 0.73 2.16 -0.28 0.00 -0.22 0.00 0.00 54.13 56.52 2qtz s LEU 245 Cb -0.26 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 42.75 2qtz s LEU 245 CO 0.36 -0.65 1.41 -2.84 -1.32 0.00 0.00 176.35 173.31 2qtz s PRO 246 N 1.73 4.22 -0.11 0.98 0.02 -1.26 -4.94 135.00 135.65 2qtz s PRO 246 Ca 0.63 2.41 -0.30 0.00 0.02 0.00 0.00 61.00 63.76 2qtz s PRO 246 Cb -0.33 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.14 2qtz s PRO 246 CO 0.28 -0.38 1.39 -1.25 -0.33 0.00 0.00 177.00 176.71 2qtz s PRO 247 N -1.88 4.23 0.59 5.54 0.04 -1.26 -5.00 135.00 137.25 2qtz s PRO 247 Ca 0.51 1.86 -0.18 0.00 0.04 0.00 0.00 61.00 63.23 2qtz s PRO 247 Cb -0.43 -3.79 -0.04 0.00 0.04 0.00 0.00 34.50 30.28 2qtz s PRO 247 CO 0.58 -0.72 1.15 -1.21 0.04 0.00 0.00 177.00 176.84 2qtz s GLU 248 N 3.44 3.08 0.00 4.56 2.02 -1.26 -4.71 118.70 125.83 2qtz s GLU 248 Ca 0.61 1.62 0.00 0.00 0.02 0.00 0.00 54.97 57.22 2qtz s GLU 248 Cb -0.26 -1.97 0.00 0.00 0.10 0.00 0.00 34.13 32.00 2qtz s GLU 248 CO 0.21 -1.07 0.00 2.48 0.02 0.00 0.00 175.26 176.90 2qtz n TYR 249 N -1.69 0.00 -3.35 1.61 0.18 -1.26 -4.34 117.16 108.31 2qtz n TYR 249 Ca 0.12 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.52 2qtz n TYR 249 Cb 0.51 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.41 2qtz n TYR 249 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2qtz s LEU 250 N 0.00 4.44 -0.19 -3.48 1.43 -1.26 -0.10 118.68 119.52 2qtz s LEU 250 Ca 0.00 1.05 -0.03 0.00 -1.03 0.00 0.00 54.13 54.13 2qtz s LEU 250 Cb 0.00 -2.75 -0.01 0.00 0.03 0.00 0.00 46.19 43.46 2qtz s LEU 250 CO 0.00 0.21 -0.08 -1.58 0.23 0.00 0.00 176.35 175.14 2qtz s GLN 251 N -0.62 3.35 -0.12 1.70 0.74 0.50 -4.72 119.66 120.50 2qtz s GLN 251 Ca 0.27 -0.65 0.01 0.00 0.05 0.00 0.00 55.36 55.04 2qtz s GLN 251 Cb -0.17 -2.88 -0.01 0.00 1.10 0.00 0.00 33.01 31.04 2qtz s GLN 251 CO 0.15 -0.09 -0.17 0.08 -0.55 0.00 0.00 175.29 174.71 2qtz s VAL 252 N 1.18 2.72 -0.09 1.34 1.01 -1.26 -1.39 120.40 123.91 2qtz s VAL 252 Ca 0.02 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2qtz s VAL 252 Cb -0.14 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 2qtz s VAL 252 CO -0.02 0.54 -0.23 -1.00 0.00 0.00 0.00 175.10 174.39 2qtz s HIS 253 N 0.28 2.55 -0.38 5.22 3.76 -0.37 -4.98 115.29 121.38 2qtz s HIS 253 Ca -0.12 -0.86 -0.19 0.00 -0.15 0.00 0.00 55.06 53.74 2qtz s HIS 253 Cb -0.16 -1.69 0.01 0.00 1.11 0.00 0.00 32.58 31.85 2qtz s HIS 253 CO 0.06 -0.30 0.55 -0.51 -0.85 0.00 0.00 174.74 173.70 2qtz s LEU 254 N 0.13 4.42 -0.28 0.89 1.43 -1.26 -0.98 118.68 123.02 2qtz s LEU 254 Ca -0.12 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.77 2qtz s LEU 254 Cb -0.16 -2.63 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 2qtz s LEU 254 CO 0.06 -0.58 0.11 -1.58 0.23 0.00 0.00 176.35 174.60 2qtz s GLN 255 N 2.52 3.43 0.24 1.70 2.00 -1.26 -5.04 119.66 123.25 2qtz s GLN 255 Ca 0.20 -0.64 -0.31 0.00 -2.00 0.00 0.00 55.36 52.61 2qtz s GLN 255 Cb -0.15 -3.44 -0.11 0.00 0.80 0.00 0.00 33.01 30.11 2qtz s GLN 255 CO 0.15 -0.33 1.55 -2.00 -0.50 0.00 0.00 175.29 174.16 2qtz s GLU 256 N 1.60 4.19 0.00 1.67 2.12 -1.26 -4.51 118.70 122.51 2qtz s GLU 256 Ca 0.05 2.44 0.00 0.00 0.36 0.00 0.00 54.97 57.82 2qtz s GLU 256 Cb -0.16 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.14 2qtz s GLU 256 CO 0.05 -0.57 0.00 -1.13 -0.54 0.00 0.00 175.26 173.07 2qtz n SER 257 N 2.82 0.00 -3.00 -1.70 3.41 -1.26 -5.07 113.62 108.81 2qtz n SER 257 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2qtz n SER 257 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 2qtz n SER 257 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2qtz n PRO 272 N 0.00 0.00 -4.28 4.33 -0.04 -1.26 -5.15 135.00 128.61 2qtz n PRO 272 Ca 0.00 -0.20 -0.31 0.00 -0.04 0.00 0.00 63.50 62.95 2qtz n PRO 272 Cb 0.00 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 31.91 2qtz n PRO 272 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2qtz s VAL 273 N 2.96 3.76 -0.14 0.52 1.01 -1.26 -4.63 120.40 122.61 2qtz s VAL 273 Ca 0.00 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.05 2qtz s VAL 273 Cb 0.00 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.67 2qtz s VAL 273 CO 0.00 0.23 -0.20 -0.36 0.00 0.00 0.00 175.10 174.77 2qtz s PHE 274 N -1.16 2.53 -0.27 5.22 0.40 0.66 -4.95 117.98 120.41 2qtz s PHE 274 Ca 0.21 -1.32 -0.20 0.00 -0.60 0.00 0.00 56.93 55.03 2qtz s PHE 274 Cb -0.11 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 2qtz s PHE 274 CO 0.13 -0.63 0.62 -0.65 0.70 0.00 0.00 175.22 175.39 2qtz s GLN 275 N 0.97 4.04 -0.01 0.44 -0.21 -1.26 -0.60 119.66 123.03 2qtz s GLN 275 Ca -0.04 0.45 0.04 0.00 0.02 0.00 0.00 55.36 55.83 2qtz s GLN 275 Cb -0.15 -3.68 -0.01 0.00 1.00 0.00 0.00 33.01 30.18 2qtz s GLN 275 CO -0.04 -0.46 -0.14 0.14 -2.12 0.00 0.00 175.29 172.67 2qtz s VAL 276 N 2.52 1.10 0.44 1.09 -7.23 0.16 -4.93 120.40 113.56 2qtz s VAL 276 Ca 0.25 -0.60 -0.21 0.00 -1.81 0.00 0.00 61.98 59.61 2qtz s VAL 276 Cb -0.15 -0.92 -0.09 0.00 0.56 0.00 0.00 36.38 35.77 2qtz s VAL 276 CO 0.10 0.31 1.00 -2.16 -0.31 0.00 0.00 175.10 174.04 2qtz s PRO 277 N -0.33 4.05 -0.35 4.82 0.04 -1.26 -1.24 135.00 140.74 2qtz s PRO 277 Ca 0.05 1.30 -0.27 0.00 0.04 0.00 0.00 61.00 62.12 2qtz s PRO 277 Cb -0.05 -2.23 0.02 0.00 0.04 0.00 0.00 34.50 32.27 2qtz s PRO 277 CO -0.01 -0.21 1.00 0.42 0.04 0.00 0.00 177.00 178.25 2qtz s ILE 278 N -1.98 4.54 -0.24 0.56 1.01 0.11 -1.27 121.20 123.93 2qtz s ILE 278 Ca 0.63 1.47 0.22 0.00 0.00 0.00 0.00 60.65 62.97 2qtz s ILE 278 Cb -0.15 -4.38 -0.23 0.00 0.01 0.00 0.00 42.46 37.72 2qtz s ILE 278 CO 0.19 -0.52 0.71 -1.54 0.00 0.00 0.00 174.94 173.78 2qtz n SER 279 N 6.85 0.35 -3.57 3.58 3.41 -0.39 -4.51 113.62 119.34 2qtz n SER 279 Ca 0.10 -0.04 -0.16 0.00 -0.26 0.00 0.00 58.87 58.50 2qtz n SER 279 Cb 0.48 1.42 -0.06 0.00 -0.26 0.00 0.00 64.21 65.78 2qtz n SER 279 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2qtz s LYS 280 N -3.40 0.99 -0.07 4.33 2.20 -1.21 -5.01 119.74 117.56 2qtz s LYS 280 Ca -0.03 0.09 -0.09 0.00 -0.36 0.00 0.00 55.97 55.57 2qtz s LYS 280 Cb 0.13 0.46 0.02 0.00 -1.51 0.00 0.00 37.83 36.93 2qtz s LYS 280 CO 0.87 -0.32 0.24 0.00 -0.36 0.00 0.00 175.35 175.78 2qtz s ALA 281 N -1.46 -0.60 -0.02 3.13 0.00 -1.26 -0.98 121.76 120.56 2qtz s ALA 281 Ca -0.10 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.42 2qtz s ALA 281 Cb -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.83 2qtz s ALA 281 CO 0.07 -0.15 -0.08 0.08 0.00 0.00 0.00 175.76 175.68 2qtz s VAL 282 N -0.26 0.72 -0.26 0.00 1.01 0.09 -4.43 120.40 117.27 2qtz s VAL 282 Ca -0.04 -0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.34 2qtz s VAL 282 Cb -0.03 -0.64 0.01 0.00 0.00 0.00 0.00 36.38 35.71 2qtz s VAL 282 CO 0.01 0.23 0.98 -1.58 0.00 0.00 0.00 175.10 174.74 2qtz s GLN 283 N 0.20 4.17 0.17 2.72 0.74 -1.26 -0.97 119.66 125.43 2qtz s GLN 283 Ca -0.03 1.13 0.23 0.00 0.05 0.00 0.00 55.36 56.74 2qtz s GLN 283 Cb -0.08 -3.67 0.02 0.00 1.10 0.00 0.00 33.01 30.38 2qtz s GLN 283 CO 0.00 -0.68 1.05 1.28 -0.55 0.00 0.00 175.29 176.39 2qtz n LEU 284 N 6.39 0.78 -4.86 3.68 4.77 -0.12 -4.92 117.00 122.72 2qtz n LEU 284 Ca 0.10 0.28 -0.23 0.00 -0.03 0.00 0.00 56.01 56.13 2qtz n LEU 284 Cb 0.47 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.44 2qtz n LEU 284 CO 0.53 -0.15 -0.15 0.42 -1.33 0.00 0.00 177.39 176.71 2qtz s THR 285 N -3.34 4.69 0.89 -5.08 -4.23 -1.25 -4.78 115.64 102.55 2qtz s THR 285 Ca 0.00 -1.18 -0.11 0.00 -1.18 0.00 0.00 61.69 59.22 2qtz s THR 285 Cb 0.10 -3.49 0.13 0.00 1.34 0.00 0.00 72.50 70.58 2qtz s THR 285 CO 0.79 -0.26 1.10 0.42 -0.54 0.00 0.00 174.62 176.12 2qtz s THR 286 N -1.97 2.67 0.52 3.99 -4.23 -0.64 -4.92 115.64 111.06 2qtz s THR 286 Ca 0.33 0.22 0.33 0.00 -1.18 0.00 0.00 61.69 61.39 2qtz s THR 286 Cb -0.09 -2.57 0.36 0.00 1.34 0.00 0.00 72.50 71.54 2qtz s THR 286 CO 0.26 -0.29 2.21 0.78 -0.54 0.00 0.00 174.62 177.04 2qtz h ASN 287 N -1.60 0.00 -0.71 3.99 2.35 -1.97 -2.23 115.58 115.41 2qtz h ASN 287 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2qtz h ASN 287 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 2qtz h ASN 287 CO 0.51 0.04 0.00 -0.90 -1.65 0.00 0.00 177.43 175.42 2qtz n ASP 288 N -3.53 3.76 -4.77 5.81 5.75 -1.26 -4.96 116.55 117.36 2qtz n ASP 288 Ca -0.02 -2.00 -0.39 0.00 -0.01 0.00 0.00 54.79 52.37 2qtz n ASP 288 Cb 0.14 -0.47 -0.00 0.00 -1.03 0.00 0.00 41.12 39.76 2qtz n ASP 288 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qtz s ALA 289 N -1.06 3.15 0.41 2.12 0.00 -0.84 -4.92 121.76 120.61 2qtz s ALA 289 Ca 0.47 1.17 0.10 0.00 0.00 0.00 0.00 51.96 53.70 2qtz s ALA 289 Cb 0.24 -3.47 0.87 0.00 0.00 0.00 0.00 23.12 20.76 2qtz s ALA 289 CO 0.32 -0.84 1.98 0.82 0.00 0.00 0.00 175.76 178.04 2qtz h ILE 290 N 2.22 1.14 -4.18 0.00 2.04 -1.92 -3.41 117.51 113.40 2qtz h ILE 290 Ca -0.50 -0.56 -0.56 0.00 1.00 0.00 0.00 64.86 64.24 2qtz h ILE 290 Cb 1.25 1.05 -0.30 0.00 -0.74 0.00 0.00 36.82 38.08 2qtz h ILE 290 CO 0.61 0.18 -0.84 -0.54 0.00 0.00 0.00 178.15 177.57 2qtz s LYS 291 N -4.92 1.59 -0.16 2.37 1.02 -1.26 -5.09 119.74 113.29 2qtz s LYS 291 Ca -0.06 -0.63 -0.20 0.00 0.02 0.00 0.00 55.97 55.10 2qtz s LYS 291 Cb 0.16 -1.47 -0.03 0.00 -0.52 0.00 0.00 37.83 35.97 2qtz s LYS 291 CO 0.72 0.33 0.57 0.99 -0.92 0.00 0.00 175.35 177.04 2qtz s THR 292 N -0.25 5.09 -0.17 2.17 2.01 -1.26 -4.93 115.64 118.30 2qtz s THR 292 Ca 0.03 1.09 -0.04 0.00 0.31 0.00 0.00 61.69 63.08 2qtz s THR 292 Cb -0.09 -3.89 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 2qtz s THR 292 CO 0.00 0.20 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.21 2qtz s THR 293 N 1.36 3.76 0.04 -0.82 2.01 -1.26 -0.41 115.64 120.32 2qtz s THR 293 Ca 0.28 -0.39 0.06 0.00 0.31 0.00 0.00 61.69 61.94 2qtz s THR 293 Cb -0.16 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.66 2qtz s THR 293 CO 0.11 0.48 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.62 2qtz s LEU 294 N 0.60 2.81 -0.19 4.42 1.43 0.03 -0.94 118.68 126.83 2qtz s LEU 294 Ca -0.03 -0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 52.64 2qtz s LEU 294 Cb -0.14 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 2qtz s LEU 294 CO 0.03 0.25 0.09 -0.22 0.23 0.00 0.00 176.35 176.72 2qtz s LEU 295 N -1.52 3.91 -0.08 1.79 0.20 -0.14 -1.13 118.68 121.71 2qtz s LEU 295 Ca 0.16 0.10 0.04 0.00 0.69 0.00 0.00 54.13 55.12 2qtz s LEU 295 Cb -0.11 -2.00 -0.01 0.00 -0.43 0.00 0.00 46.19 43.64 2qtz s LEU 295 CO 0.07 0.16 -0.21 -0.69 -0.29 0.00 0.00 176.35 175.38 2qtz s VAL 296 N 0.48 2.36 -0.19 1.68 1.01 0.17 -0.73 120.40 125.18 2qtz s VAL 296 Ca 0.05 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 61.03 2qtz s VAL 296 Cb -0.12 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 2qtz s VAL 296 CO 0.00 0.56 0.04 -0.70 0.00 0.00 0.00 175.10 175.00 2qtz s GLU 297 N 0.04 3.82 -0.08 2.72 2.12 -0.16 -1.41 118.70 125.75 2qtz s GLU 297 Ca -0.08 -0.42 -0.03 0.00 0.36 0.00 0.00 54.97 54.80 2qtz s GLU 297 Cb -0.15 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.05 2qtz s GLU 297 CO 0.05 0.17 0.04 -0.51 -0.54 0.00 0.00 175.26 174.47 2qtz s LEU 298 N 0.63 3.81 -0.52 2.70 1.43 0.07 -1.26 118.68 125.54 2qtz s LEU 298 Ca 0.02 0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 53.12 2qtz s LEU 298 Cb -0.13 -1.95 0.05 0.00 0.03 0.00 0.00 46.19 44.19 2qtz s LEU 298 CO 0.02 0.37 0.72 -0.62 0.23 0.00 0.00 176.35 177.07 2qtz s ASP 299 N -1.07 6.26 -0.09 2.29 2.15 -0.40 -1.09 116.67 124.72 2qtz s ASP 299 Ca 0.15 -0.76 0.17 0.00 0.43 0.00 0.00 52.55 52.55 2qtz s ASP 299 Cb -0.12 -2.33 0.67 0.00 -0.30 0.00 0.00 42.92 40.84 2qtz s ASP 299 CO 0.05 -1.00 1.57 2.30 -0.17 0.00 0.00 175.17 177.91 2qtz n ILE 300 N 5.79 1.62 0.05 4.11 -5.35 -0.13 -4.07 119.36 121.38 2qtz n ILE 300 Ca -0.04 -1.08 0.00 0.00 -0.27 0.00 0.00 62.75 61.37 2qtz n ILE 300 Cb 0.46 0.13 0.32 0.00 -1.74 0.00 0.00 39.64 38.81 2qtz n ILE 300 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2qtz h SER 301 N 3.86 0.38 -0.73 7.28 4.64 -1.87 -2.67 113.55 124.44 2qtz h SER 301 Ca 0.00 -0.08 -0.46 0.00 -0.47 0.00 0.00 61.79 60.78 2qtz h SER 301 Cb 1.33 -0.10 -0.22 0.00 -0.31 0.00 0.00 62.40 63.10 2qtz h SER 301 CO 0.20 0.51 0.59 -3.20 -0.87 0.00 0.00 176.83 174.07 2qtz n ASN 302 N -4.25 6.01 -4.26 4.97 5.15 -1.26 -4.87 115.26 116.74 2qtz n ASN 302 Ca 0.00 -3.34 -0.14 0.00 -0.60 0.00 0.00 54.58 50.49 2qtz n ASN 302 Cb 0.28 -0.94 -0.10 0.00 -0.53 0.00 0.00 39.78 38.49 2qtz n ASN 302 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2qtz s THR 303 N -3.19 0.36 -0.31 -0.44 -4.23 -1.01 -5.03 115.64 101.79 2qtz s THR 303 Ca 0.46 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.07 2qtz s THR 303 Cb 0.37 -2.53 0.71 0.00 1.34 0.00 0.00 72.50 72.39 2qtz s THR 303 CO 0.02 -0.06 1.75 -0.90 -0.54 0.00 0.00 174.62 174.89 2qtz n ASP 304 N -0.37 4.51 -4.73 3.99 5.68 -1.26 -4.99 116.55 119.38 2qtz n ASP 304 Ca -0.00 -3.27 -0.41 0.00 -0.50 0.00 0.00 54.79 50.60 2qtz n ASP 304 Cb 0.66 -0.72 -0.03 0.00 -1.14 0.00 0.00 41.12 39.88 2qtz n ASP 304 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 2qtz s PHE 305 N -3.02 3.44 0.12 2.11 5.36 -1.26 -5.05 117.98 119.68 2qtz s PHE 305 Ca 0.53 1.37 0.04 0.00 -0.96 0.00 0.00 56.93 57.91 2qtz s PHE 305 Cb 0.43 -3.43 -0.04 0.00 -0.34 0.00 0.00 43.02 39.64 2qtz s PHE 305 CO 0.12 -1.24 -0.10 -1.54 -1.46 0.00 0.00 175.22 171.00 2qtz s SER 306 N 0.47 1.57 0.07 6.13 1.04 -1.26 -5.04 113.70 116.69 2qtz s SER 306 Ca 0.55 -0.92 -0.17 0.00 0.48 0.00 0.00 55.95 55.88 2qtz s SER 306 Cb -0.31 0.01 0.03 0.00 0.10 0.00 0.00 66.02 65.85 2qtz s SER 306 CO 0.34 -0.32 0.40 -0.72 0.98 0.00 0.00 173.24 173.92 2qtz s TYR 307 N -2.97 -0.24 0.14 5.02 -0.85 -1.26 -5.05 117.35 112.14 2qtz s TYR 307 Ca 0.11 0.10 0.08 0.00 -0.52 0.00 0.00 57.07 56.84 2qtz s TYR 307 Cb 0.01 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.53 2qtz s TYR 307 CO -0.00 -0.61 -0.10 -0.65 -1.52 0.00 0.00 175.55 172.66 2qtz s GLN 308 N -2.94 2.07 0.25 -3.49 -0.21 -1.26 -4.71 119.66 109.37 2qtz s GLN 308 Ca -0.02 -1.15 -0.31 0.00 0.02 0.00 0.00 55.36 53.90 2qtz s GLN 308 Cb 0.00 -2.23 -0.13 0.00 1.00 0.00 0.00 33.01 31.65 2qtz s GLN 308 CO -0.06 0.47 1.33 -2.30 -2.12 0.00 0.00 175.29 172.62 2qtz n PRO 309 N 0.39 1.91 0.00 2.91 -0.02 -1.26 -1.69 135.00 137.24 2qtz n PRO 309 Ca -0.12 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2qtz n PRO 309 Cb 0.54 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2qtz n PRO 309 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qtz n GLY 310 N 1.84 2.77 3.67 -1.23 0.00 -1.25 -4.58 105.19 106.40 2qtz n GLY 310 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 2qtz n GLY 310 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qtz n ASP 311 N 0.00 1.09 -4.66 1.61 8.00 -0.68 -4.52 116.55 117.40 2qtz n ASP 311 Ca 0.00 0.68 -0.27 0.00 0.71 0.00 0.00 54.79 55.90 2qtz n ASP 311 Cb 0.00 -1.48 -0.08 0.00 -0.02 0.00 0.00 41.12 39.54 2qtz n ASP 311 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qtz s ALA 312 N -1.82 3.18 0.13 2.24 0.00 -1.26 -0.50 121.76 123.73 2qtz s ALA 312 Ca 0.76 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 51.42 2qtz s ALA 312 Cb -0.33 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 2qtz s ALA 312 CO 0.48 0.52 -0.09 -0.59 0.00 0.00 0.00 175.76 176.08 2qtz s PHE 313 N -1.63 1.12 -0.10 0.00 -0.12 -0.19 -3.21 117.98 113.84 2qtz s PHE 313 Ca 0.27 -0.81 -0.06 0.00 -0.05 0.00 0.00 56.93 56.28 2qtz s PHE 313 Cb -0.10 -0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 41.66 2qtz s PHE 313 CO 0.18 -0.01 0.13 -1.12 -0.05 0.00 0.00 175.22 174.35 2qtz s SER 314 N -3.08 6.27 -0.14 1.98 0.01 0.15 -0.33 113.70 118.56 2qtz s SER 314 Ca 0.14 0.42 -0.03 0.00 1.31 0.00 0.00 55.95 57.79 2qtz s SER 314 Cb 0.03 -2.00 -0.03 0.00 0.21 0.00 0.00 66.02 64.23 2qtz s SER 314 CO -0.01 0.39 -0.04 -0.69 0.41 0.00 0.00 173.24 173.30 2qtz s VAL 315 N -1.05 3.91 -0.39 3.43 1.01 0.15 -1.86 120.40 125.60 2qtz s VAL 315 Ca 0.16 -0.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.60 2qtz s VAL 315 Cb -0.12 -2.70 0.01 0.00 0.00 0.00 0.00 36.38 33.57 2qtz s VAL 315 CO 0.05 0.51 0.54 -0.63 0.00 0.00 0.00 175.10 175.58 2qtz s ILE 316 N 0.19 4.97 0.14 2.22 1.01 -0.68 -1.54 121.20 127.52 2qtz s ILE 316 Ca -0.02 0.13 0.11 0.00 0.00 0.00 0.00 60.65 60.87 2qtz s ILE 316 Cb -0.14 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.23 2qtz s ILE 316 CO 0.03 -0.38 -0.26 0.00 0.00 0.00 0.00 174.94 174.33 2qtz s PRO 318 N -2.22 3.17 0.85 0.00 0.04 -1.26 -4.86 135.00 130.73 2qtz s PRO 318 Ca 0.16 -0.61 -0.11 0.00 0.04 0.00 0.00 61.00 60.48 2qtz s PRO 318 Cb -0.10 -2.66 0.10 0.00 0.04 0.00 0.00 34.50 31.88 2qtz s PRO 318 CO 0.07 -0.07 1.09 -0.80 0.04 0.00 0.00 177.00 177.33 2qtz s ASN 319 N -4.16 3.87 0.36 6.66 0.02 0.63 -4.81 114.94 117.51 2qtz s ASN 319 Ca 0.45 1.56 -0.27 0.00 -1.02 0.00 0.00 52.86 53.58 2qtz s ASN 319 Cb -0.10 -2.25 -0.09 0.00 0.02 0.00 0.00 41.25 38.83 2qtz s ASN 319 CO 0.35 -2.40 1.18 -0.94 0.02 0.00 0.00 177.10 175.32 2qtz s SER 320 N -3.47 6.75 0.23 -1.22 1.04 -1.26 -4.92 113.70 110.85 2qtz s SER 320 Ca 0.62 2.41 -0.07 0.00 0.48 0.00 0.00 55.95 59.39 2qtz s SER 320 Cb -0.17 -2.62 0.25 0.00 0.10 0.00 0.00 66.02 63.58 2qtz s SER 320 CO 0.56 -0.52 1.88 0.44 0.98 0.00 0.00 173.24 176.58 2qtz h ASP 321 N 3.07 0.93 -0.71 7.02 3.32 -1.99 -1.87 116.42 126.19 2qtz h ASP 321 Ca -0.48 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 2qtz h ASP 321 Cb 1.23 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2qtz h ASP 321 CO 0.64 0.65 0.25 0.77 -1.72 0.00 0.00 179.24 179.83 2qtz h SER 322 N 1.09 1.03 -0.45 6.45 4.64 -1.99 0.22 113.55 124.55 2qtz h SER 322 Ca 0.34 -0.18 -0.13 0.00 -0.47 0.00 0.00 61.79 61.35 2qtz h SER 322 Cb -0.01 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 2qtz h SER 322 CO -0.11 0.94 -0.23 -0.33 -0.87 0.00 0.00 176.83 176.22 2qtz h GLU 323 N 1.07 0.95 -0.28 4.77 5.08 -1.87 -0.88 114.58 123.42 2qtz h GLU 323 Ca 0.24 -0.42 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2qtz h GLU 323 Cb 0.26 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2qtz h GLU 323 CO -0.01 1.09 0.15 0.28 -1.00 0.00 0.00 179.01 179.51 2qtz h VAL 324 N 0.79 1.13 -0.27 3.13 2.07 -1.07 -1.19 116.25 120.84 2qtz h VAL 324 Ca 0.10 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 2qtz h VAL 324 Cb 0.81 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2qtz h VAL 324 CO 0.07 0.13 0.15 -0.61 0.02 0.00 0.00 177.57 177.32 2qtz h GLN 325 N 0.33 0.38 -0.73 1.57 4.15 -0.88 -0.99 115.11 118.93 2qtz h GLN 325 Ca 0.10 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.54 2qtz h GLN 325 Cb 0.08 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.63 2qtz h GLN 325 CO -0.01 0.34 0.42 0.77 -1.93 0.00 0.00 178.83 178.42 2qtz h SER 326 N 0.32 0.64 -0.21 -0.69 0.02 -1.06 0.29 113.55 112.86 2qtz h SER 326 Ca 0.09 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 2qtz h SER 326 Cb 0.07 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2qtz h SER 326 CO -0.01 0.40 -0.10 0.25 -1.14 0.00 0.00 176.83 176.23 2qtz h LEU 327 N 0.77 0.44 -0.76 5.07 5.85 -0.93 -1.45 115.31 124.30 2qtz h LEU 327 Ca 0.33 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 2qtz h LEU 327 Cb 0.21 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2qtz h LEU 327 CO -0.19 0.75 0.33 -0.07 -0.34 0.00 0.00 178.44 178.92 2qtz h LEU 328 N 0.13 1.02 -0.69 2.25 3.38 -0.98 -1.51 115.31 118.90 2qtz h LEU 328 Ca 0.05 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.88 2qtz h LEU 328 Cb 0.58 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2qtz h LEU 328 CO 0.03 0.89 0.45 1.56 0.09 0.00 0.00 178.44 181.46 2qtz h GLN 329 N 1.08 0.86 0.00 1.13 4.20 -0.90 0.12 115.11 121.60 2qtz h GLN 329 Ca 0.26 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.89 2qtz h GLN 329 Cb 0.17 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 2qtz h GLN 329 CO -0.03 0.57 -0.14 -0.09 -0.67 0.00 0.00 178.83 178.48 2qtz h ARG 330 N 0.89 0.00 -0.13 1.46 9.65 -0.87 -2.21 114.38 123.17 2qtz h ARG 330 Ca 0.27 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.15 2qtz h ARG 330 Cb -0.04 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2qtz h ARG 330 CO -0.08 0.14 0.00 1.28 2.80 0.00 0.00 179.97 184.10 2qtz n LEU 331 N -3.92 2.11 -2.90 3.80 4.77 -0.60 -4.93 117.00 115.33 2qtz n LEU 331 Ca -0.02 -0.81 -0.18 0.00 -0.03 0.00 0.00 56.01 54.97 2qtz n LEU 331 Cb 0.23 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.30 2qtz n LEU 331 CO 0.32 0.40 0.18 0.00 -1.33 0.00 0.00 177.39 176.96 2qtz n GLN 332 N 0.63 -6.05 0.00 3.23 6.02 -0.82 -4.95 117.38 115.44 2qtz n GLN 332 Ca 0.17 0.64 0.00 0.00 -0.01 0.00 0.00 57.00 57.81 2qtz n GLN 332 Cb 0.42 -5.12 0.00 0.00 1.02 0.00 0.00 30.24 26.56 2qtz n GLN 332 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2qtz n LEU 333 N -3.92 0.75 -0.34 1.08 4.77 0.34 -4.80 117.00 114.88 2qtz n LEU 333 Ca -0.03 -0.75 0.06 0.00 -0.03 0.00 0.00 56.01 55.26 2qtz n LEU 333 Cb 0.56 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.89 2qtz n LEU 333 CO 0.50 0.19 1.24 -0.08 -1.33 0.00 0.00 177.39 177.91 2qtz h GLU 334 N 0.00 0.97 0.00 3.23 4.57 -1.85 0.24 114.58 121.75 2qtz h GLU 334 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2qtz h GLU 334 Cb 0.39 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2qtz h GLU 334 CO 0.00 0.64 0.00 -0.25 -1.18 0.00 0.00 179.01 178.22 2qtz n ASP 335 N -4.57 0.00 -0.90 1.04 8.00 -1.26 -2.33 116.55 116.53 2qtz n ASP 335 Ca 0.17 0.33 0.08 0.00 0.71 0.00 0.00 54.79 56.08 2qtz n ASP 335 Cb 0.31 -0.44 0.21 0.00 -0.02 0.00 0.00 41.12 41.19 2qtz n ASP 335 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2qtz n LYS 336 N -1.44 2.79 -0.01 -1.24 4.01 0.05 -4.75 118.16 117.57 2qtz n LYS 336 Ca 0.07 -2.26 0.21 0.00 -0.51 0.00 0.00 58.31 55.82 2qtz n LYS 336 Cb 0.24 -1.38 0.70 0.00 -0.51 0.00 0.00 35.03 34.08 2qtz n LYS 336 CO 0.00 0.00 0.00 0.07 -1.11 0.00 0.00 177.40 176.36 2qtz h ARG 337 N 2.87 0.00 -0.02 1.97 0.11 -1.16 -0.26 114.38 117.89 2qtz h ARG 337 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2qtz h ARG 337 Cb 0.82 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.90 2qtz h ARG 337 CO 0.00 0.00 -0.05 0.39 0.10 0.00 0.00 179.97 180.41 2qtz n GLU 338 N -4.35 1.83 0.00 0.08 -0.58 -1.26 -0.94 120.64 115.42 2qtz n GLU 338 Ca 0.10 -1.31 0.00 0.00 -0.42 0.00 0.00 57.16 55.53 2qtz n GLU 338 Cb 0.64 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 2qtz n GLU 338 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2qtz n HIS 339 N 0.56 0.00 -3.60 -0.32 8.25 -0.11 -4.65 115.22 115.36 2qtz n HIS 339 Ca 0.16 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.43 2qtz n HIS 339 Cb 0.46 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.42 2qtz n HIS 339 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2qtz s VAL 341 N 0.00 -0.27 -0.20 1.59 1.01 -0.02 -1.18 120.40 121.33 2qtz s VAL 341 Ca 0.00 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.04 2qtz s VAL 341 Cb 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 2qtz s VAL 341 CO 0.00 -0.03 0.03 -0.76 0.00 0.00 0.00 175.10 174.34 2qtz s LEU 342 N 2.29 3.49 -0.04 3.92 1.43 -0.16 -1.49 118.68 128.13 2qtz s LEU 342 Ca 0.04 -0.10 0.06 0.00 -1.03 0.00 0.00 54.13 53.11 2qtz s LEU 342 Cb -0.14 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 2qtz s LEU 342 CO -0.08 0.09 -0.21 -0.76 0.23 0.00 0.00 176.35 175.62 2qtz s LEU 343 N 0.84 2.32 0.15 1.79 1.43 -1.26 -1.23 118.68 122.72 2qtz s LEU 343 Ca 0.02 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.71 2qtz s LEU 343 Cb -0.14 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.62 2qtz s LEU 343 CO 0.02 0.31 0.16 -0.54 0.23 0.00 0.00 176.35 176.54 2qtz s LYS 344 N -0.57 1.06 -0.06 1.70 1.02 -0.49 -5.00 119.74 117.40 2qtz s LYS 344 Ca 0.08 -1.35 -0.21 0.00 0.02 0.00 0.00 55.97 54.51 2qtz s LYS 344 Cb -0.11 0.30 -0.04 0.00 -0.52 0.00 0.00 37.83 37.46 2qtz s LYS 344 CO 0.00 -0.35 0.59 0.42 -0.92 0.00 0.00 175.35 175.10 2qtz s ILE 345 N -4.03 5.05 0.28 2.17 -1.09 -1.26 -0.37 121.20 121.96 2qtz s ILE 345 Ca 0.23 1.22 -0.30 0.00 -2.23 0.00 0.00 60.65 59.57 2qtz s ILE 345 Cb 0.06 -3.93 -0.12 0.00 -1.58 0.00 0.00 42.46 36.89 2qtz s ILE 345 CO 0.02 0.33 1.62 0.29 -1.23 0.00 0.00 174.94 175.97 2qtz n LYS 346 N 3.42 2.74 -0.36 2.79 5.02 0.86 -4.81 118.16 127.82 2qtz n LYS 346 Ca -0.05 0.98 -0.02 0.00 -2.02 0.00 0.00 58.31 57.20 2qtz n LYS 346 Cb 0.51 -2.77 0.13 0.00 -0.02 0.00 0.00 35.03 32.88 2qtz n LYS 346 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qtz h ALA 347 N 5.08 1.30 -0.35 7.82 0.00 -1.95 -3.15 119.26 128.01 2qtz h ALA 347 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2qtz h ALA 347 Cb 1.22 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2qtz h ALA 347 CO 0.82 0.65 0.00 -0.40 0.00 0.00 0.00 179.25 180.32 2qtz n ASP 348 N -4.38 2.22 -4.75 0.00 5.68 -1.26 -4.97 116.55 109.08 2qtz n ASP 348 Ca 0.11 -2.09 -0.39 0.00 -0.50 0.00 0.00 54.79 51.93 2qtz n ASP 348 Cb 0.02 -0.31 0.03 0.00 -1.14 0.00 0.00 41.12 39.72 2qtz n ASP 348 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2qtz s THR 349 N -1.58 2.11 -2.23 2.12 -1.32 -1.19 -4.95 115.64 108.60 2qtz s THR 349 Ca 0.25 0.08 0.20 0.00 -1.21 0.00 0.00 61.69 61.01 2qtz s THR 349 Cb 0.14 -3.04 0.32 0.00 -1.51 0.00 0.00 72.50 68.40 2qtz s THR 349 CO 0.15 0.00 1.27 0.29 -2.21 0.00 0.00 174.62 174.12 2qtz n LYS 350 N -0.81 2.20 -2.85 7.08 4.76 -1.26 -4.91 118.16 122.36 2qtz n LYS 350 Ca 0.09 -2.03 -0.43 0.00 -2.87 0.00 0.00 58.31 53.07 2qtz n LYS 350 Cb 0.44 -1.43 -0.04 0.00 -1.84 0.00 0.00 35.03 32.16 2qtz n LYS 350 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2qtz s LYS 351 N -1.43 3.52 0.33 1.97 2.20 -1.26 -5.00 119.74 120.06 2qtz s LYS 351 Ca 0.31 0.12 -0.28 0.00 -0.36 0.00 0.00 55.97 55.76 2qtz s LYS 351 Cb 0.19 -3.92 -0.09 0.00 -1.51 0.00 0.00 37.83 32.49 2qtz s LYS 351 CO 0.27 -1.19 1.17 0.15 -0.36 0.00 0.00 175.35 175.39 2qtz s LYS 352 N 3.64 4.39 -0.31 4.03 3.01 -1.26 -3.34 119.74 129.91 2qtz s LYS 352 Ca 0.35 1.92 0.00 0.00 -1.01 0.00 0.00 55.97 57.23 2qtz s LYS 352 Cb -0.11 -3.00 0.00 0.00 -1.01 0.00 0.00 37.83 33.71 2qtz s LYS 352 CO 0.25 -0.05 0.00 0.41 0.51 0.00 0.00 175.35 176.47 2qtz n GLY 353 N 0.90 0.60 3.70 -3.33 0.00 -1.26 -4.97 105.19 100.83 2qtz n GLY 353 Ca 0.01 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2qtz n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtz s ALA 354 N -1.99 3.77 0.17 4.61 0.00 -1.21 -5.00 121.76 122.11 2qtz s ALA 354 Ca 0.00 1.41 0.05 0.00 0.00 0.00 0.00 51.96 53.42 2qtz s ALA 354 Cb 0.00 -3.73 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 2qtz s ALA 354 CO 0.00 -1.12 -0.09 0.95 0.00 0.00 0.00 175.76 175.49 2qtz s THR 355 N 2.39 1.23 0.16 0.00 -4.23 -1.26 -5.05 115.64 108.87 2qtz s THR 355 Ca 0.78 -2.08 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 2qtz s THR 355 Cb -0.45 -1.94 -0.07 0.00 1.34 0.00 0.00 72.50 71.37 2qtz s THR 355 CO 0.34 -0.67 1.11 -0.76 -0.54 0.00 0.00 174.62 174.10 2qtz s LEU 356 N -3.21 4.47 -0.21 4.79 1.43 -1.26 -4.96 118.68 119.74 2qtz s LEU 356 Ca 0.19 2.07 -0.36 0.00 -1.03 0.00 0.00 54.13 55.00 2qtz s LEU 356 Cb 0.03 -3.60 -0.12 0.00 0.03 0.00 0.00 46.19 42.52 2qtz s LEU 356 CO 0.03 -0.25 1.94 -0.81 0.23 0.00 0.00 176.35 177.48 2qtz n PRO 357 N 2.60 1.65 0.27 1.29 -0.04 -1.26 -4.86 135.00 134.65 2qtz n PRO 357 Ca 0.04 0.57 0.11 0.00 -0.04 0.00 0.00 63.50 64.18 2qtz n PRO 357 Cb 0.46 -2.49 0.74 0.00 -0.04 0.00 0.00 33.50 32.17 2qtz n PRO 357 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2qtz h GLN 358 N 9.71 0.00 -0.01 0.54 7.50 -2.01 -2.64 115.11 128.20 2qtz h GLN 358 Ca -0.43 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.72 2qtz h GLN 358 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.82 2qtz h GLN 358 CO 0.97 0.03 -0.00 -2.39 -1.50 0.00 0.00 178.83 175.94 2qtz n HIS 359 N -4.18 0.00 -3.73 2.96 1.44 -1.26 -4.57 115.22 105.88 2qtz n HIS 359 Ca -0.03 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.30 2qtz n HIS 359 Cb 0.12 -0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.10 2qtz n HIS 359 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2qtz s ILE 360 N -2.01 3.83 0.17 0.61 1.01 -1.00 -4.83 121.20 118.98 2qtz s ILE 360 Ca 0.41 -1.24 -0.30 0.00 0.00 0.00 0.00 60.65 59.52 2qtz s ILE 360 Cb 0.21 -3.23 -0.08 0.00 0.01 0.00 0.00 42.46 39.38 2qtz s ILE 360 CO 0.35 -0.27 1.15 -2.16 0.00 0.00 0.00 174.94 174.01 2qtz s PRO 361 N 1.39 4.53 0.21 2.79 0.04 -1.26 -4.91 135.00 137.79 2qtz s PRO 361 Ca -0.00 1.80 -0.31 0.00 0.04 0.00 0.00 61.00 62.53 2qtz s PRO 361 Cb -0.20 -3.26 -0.10 0.00 0.04 0.00 0.00 34.50 30.97 2qtz s PRO 361 CO 0.02 -0.03 1.55 0.00 0.04 0.00 0.00 177.00 178.59 2qtz s ALA 362 N -0.06 3.75 0.00 8.56 0.00 -1.26 -3.30 121.76 129.45 2qtz s ALA 362 Ca 0.52 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.89 2qtz s ALA 362 Cb -0.31 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2qtz s ALA 362 CO 0.35 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.71 2qtz n GLY 363 N 3.13 0.49 3.85 0.00 0.00 -0.55 -5.01 105.19 107.08 2qtz n GLY 363 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2qtz n GLY 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtz s SER 365 N -3.91 5.20 0.22 0.00 1.04 -1.26 -0.84 113.70 114.14 2qtz s SER 365 Ca 0.57 2.05 -0.08 0.00 0.48 0.00 0.00 55.95 58.97 2qtz s SER 365 Cb -0.12 -2.56 0.30 0.00 0.10 0.00 0.00 66.02 63.74 2qtz s SER 365 CO 0.52 -1.57 1.79 0.25 0.98 0.00 0.00 173.24 175.22 2qtz h LEU 366 N 0.26 0.51 -0.39 2.42 5.85 -1.04 -1.30 115.31 121.62 2qtz h LEU 366 Ca -0.47 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.36 2qtz h LEU 366 Cb 1.25 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 2qtz h LEU 366 CO 0.54 0.31 0.00 -0.61 -0.34 0.00 0.00 178.44 178.35 2qtz h GLN 367 N 0.65 0.11 -0.39 1.25 5.75 -1.32 -1.44 115.11 119.71 2qtz h GLN 367 Ca 0.33 -0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.78 2qtz h GLN 367 Cb 0.30 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 2qtz h GLN 367 CO -0.23 0.07 0.04 0.35 -2.65 0.00 0.00 178.83 176.41 2qtz h PHE 368 N 0.11 0.71 -0.41 3.99 3.57 -1.64 -0.45 116.94 122.81 2qtz h PHE 368 Ca 0.19 -0.11 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 2qtz h PHE 368 Cb 0.26 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2qtz h PHE 368 CO -0.26 0.72 -0.02 0.82 -2.23 0.00 0.00 178.31 177.34 2qtz h ILE 369 N 0.50 1.26 0.00 1.41 2.04 -1.03 0.44 117.51 122.13 2qtz h ILE 369 Ca 0.12 -1.05 -0.09 0.00 1.00 0.00 0.00 64.86 64.83 2qtz h ILE 369 Cb 0.41 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2qtz h ILE 369 CO 0.01 0.36 -0.44 -0.26 0.00 0.00 0.00 178.15 177.82 2qtz h PHE 370 N 0.57 0.00 0.09 1.37 -1.00 -1.17 -1.13 116.94 115.68 2qtz h PHE 370 Ca 0.11 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.70 2qtz h PHE 370 Cb 0.51 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.09 2qtz h PHE 370 CO 0.04 0.44 -0.80 1.15 -1.61 0.00 0.00 178.31 177.53 2qtz h THR 371 N 0.00 1.45 0.00 -1.55 2.02 -0.73 -3.41 112.91 110.69 2qtz h THR 371 Ca -0.00 -2.37 0.00 0.00 0.77 0.00 0.00 66.41 64.81 2qtz h THR 371 Cb 0.83 2.93 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2qtz h THR 371 CO 0.06 0.68 -0.63 0.79 0.37 0.00 0.00 175.52 176.79 2qtz n TRP 372 N -4.11 0.00 -0.00 3.16 7.02 0.11 -0.26 117.44 123.35 2qtz n TRP 372 Ca -0.13 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.37 2qtz n TRP 372 Cb 0.79 -0.05 -0.03 0.00 -2.42 0.00 0.00 31.31 29.61 2qtz n TRP 372 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2qtz s LEU 374 N -3.39 2.55 -1.28 0.00 1.43 -0.92 -1.41 118.68 115.66 2qtz s LEU 374 Ca -0.01 -0.33 -0.17 0.00 -1.03 0.00 0.00 54.13 52.59 2qtz s LEU 374 Cb 0.02 -1.53 0.10 0.00 0.03 0.00 0.00 46.19 44.81 2qtz s LEU 374 CO 0.14 0.25 1.66 1.21 0.23 0.00 0.00 176.35 179.85 2qtz n GLU 375 N 2.91 3.24 0.22 1.70 4.07 0.26 -4.48 120.64 128.56 2qtz n GLU 375 Ca -0.18 -3.43 0.16 0.00 -0.06 0.00 0.00 57.16 53.65 2qtz n GLU 375 Cb 0.52 -3.37 0.71 0.00 -0.06 0.00 0.00 31.44 29.25 2qtz n GLU 375 CO 0.00 0.00 0.00 -0.84 -0.06 0.00 0.00 177.13 176.23 2qtz h ILE 376 N 5.28 0.00 0.00 6.31 3.07 -1.88 -1.73 117.51 128.56 2qtz h ILE 376 Ca 0.42 -0.23 0.00 0.00 1.55 0.00 0.00 64.86 66.60 2qtz h ILE 376 Cb 0.87 1.05 0.00 0.00 -0.27 0.00 0.00 36.82 38.46 2qtz h ILE 376 CO 1.41 0.00 0.00 0.54 -1.05 0.00 0.00 178.15 179.05 2qtz n ARG 377 N -2.67 0.12 -1.70 0.16 5.12 -1.26 -3.99 116.66 112.44 2qtz n ARG 377 Ca -0.00 0.19 -0.41 0.00 -1.93 0.00 0.00 57.85 55.71 2qtz n ARG 377 Cb 0.18 -1.66 0.01 0.00 -1.16 0.00 0.00 32.46 29.83 2qtz n ARG 377 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2qtz n ALA 378 N -1.64 1.25 -2.40 7.54 0.00 -0.65 -4.57 120.51 120.04 2qtz n ALA 378 Ca 0.05 0.26 -0.43 0.00 0.00 0.00 0.00 53.44 53.32 2qtz n ALA 378 Cb 0.31 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.48 2qtz n ALA 378 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2qtz s ILE 379 N -1.20 4.18 0.15 0.00 1.01 -1.26 -4.08 121.20 119.99 2qtz s ILE 379 Ca 0.61 1.48 -0.31 0.00 0.00 0.00 0.00 60.65 62.43 2qtz s ILE 379 Cb -0.51 -3.95 -0.11 0.00 0.01 0.00 0.00 42.46 37.90 2qtz s ILE 379 CO 0.58 -0.06 1.76 -2.84 0.00 0.00 0.00 174.94 174.38 2qtz s PRO 380 N 2.84 4.15 0.85 2.79 0.02 -1.26 -4.98 135.00 139.40 2qtz s PRO 380 Ca 0.57 2.56 -0.11 0.00 0.02 0.00 0.00 61.00 64.03 2qtz s PRO 380 Cb -0.24 -3.41 0.10 0.00 0.02 0.00 0.00 34.50 30.96 2qtz s PRO 380 CO 0.20 -0.79 1.09 0.15 -0.33 0.00 0.00 177.00 177.32 2qtz s LYS 381 N 2.15 1.67 0.40 5.54 -0.14 -1.26 -4.83 119.74 123.28 2qtz s LYS 381 Ca 0.78 0.84 0.07 0.00 -1.36 0.00 0.00 55.97 56.30 2qtz s LYS 381 Cb -0.46 -1.85 0.84 0.00 -1.68 0.00 0.00 37.83 34.67 2qtz s LYS 381 CO 0.34 -1.96 2.05 0.87 -0.76 0.00 0.00 175.35 175.90 2qtz h LYS 382 N -1.34 0.57 -0.09 1.68 1.57 -1.93 -1.45 116.57 115.56 2qtz h LYS 382 Ca -0.48 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.18 2qtz h LYS 382 Cb 1.27 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2qtz h LYS 382 CO 0.55 0.37 -0.34 0.00 -0.57 0.00 0.00 179.45 179.47 2qtz h ALA 383 N 1.73 1.26 -0.11 3.86 0.00 -1.92 0.18 119.26 124.26 2qtz h ALA 383 Ca 0.16 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2qtz h ALA 383 Cb -0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2qtz h ALA 383 CO -0.04 0.51 -0.12 0.35 0.00 0.00 0.00 179.25 179.95 2qtz h PHE 384 N 0.16 0.33 -0.81 0.00 3.57 -1.65 -2.44 116.94 116.10 2qtz h PHE 384 Ca 0.02 -0.10 0.08 0.00 3.53 0.00 0.00 57.97 61.50 2qtz h PHE 384 Cb 0.68 -0.07 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 2qtz h PHE 384 CO 0.01 0.70 0.47 -0.07 -2.23 0.00 0.00 178.31 177.19 2qtz h LEU 385 N -0.13 0.71 -0.41 0.59 3.38 -1.17 -1.46 115.31 116.81 2qtz h LEU 385 Ca 0.02 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.09 2qtz h LEU 385 Cb 0.65 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.23 2qtz h LEU 385 CO 0.03 0.43 0.05 -0.09 0.09 0.00 0.00 178.44 178.95 2qtz h ARG 386 N 0.83 0.16 -0.15 1.13 9.65 -0.89 -1.91 114.38 123.20 2qtz h ARG 386 Ca 0.37 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 59.18 2qtz h ARG 386 Cb 0.27 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.80 2qtz h ARG 386 CO -0.21 0.11 -0.20 0.00 2.80 0.00 0.00 179.97 182.47 2qtz h ALA 387 N 1.33 1.39 0.00 2.80 0.00 -0.90 -2.81 119.26 121.08 2qtz h ALA 387 Ca 0.20 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2qtz h ALA 387 Cb 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2qtz h ALA 387 CO -0.29 0.42 -0.42 -0.07 0.00 0.00 0.00 179.25 178.89 2qtz h LEU 388 N 0.24 0.00 -0.71 0.00 3.38 -0.55 -3.07 115.31 114.59 2qtz h LEU 388 Ca 0.04 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.16 2qtz h LEU 388 Cb 0.49 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.10 2qtz h LEU 388 CO 0.03 0.42 -0.17 0.58 0.09 0.00 0.00 178.44 179.39 2qtz h VAL 389 N 0.00 0.29 0.00 1.22 2.07 -1.11 -1.74 116.25 116.99 2qtz h VAL 389 Ca -0.00 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2qtz h VAL 389 Cb 0.87 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2qtz h VAL 389 CO 0.05 0.00 -0.02 0.44 0.02 0.00 0.00 177.57 178.07 2qtz h ASP 390 N 0.00 0.00 -0.43 0.57 5.19 -1.66 -2.36 116.42 117.74 2qtz h ASP 390 Ca 0.35 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.76 2qtz h ASP 390 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 2qtz h ASP 390 CO -0.73 0.02 0.00 -1.22 -3.12 0.00 0.00 179.24 174.19 2qtz n TYR 391 N -3.19 1.36 -4.09 4.55 4.01 -0.66 -4.93 117.16 114.20 2qtz n TYR 391 Ca -0.02 -0.76 -0.34 0.00 -0.16 0.00 0.00 57.90 56.62 2qtz n TYR 391 Cb 0.17 -0.35 -0.15 0.00 -0.31 0.00 0.00 39.34 38.71 2qtz n TYR 391 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2qtz s THR 392 N -2.52 2.91 -0.11 -0.72 2.01 -0.89 -0.59 115.64 115.73 2qtz s THR 392 Ca 0.46 -0.66 0.16 0.00 0.31 0.00 0.00 61.69 61.96 2qtz s THR 392 Cb 0.35 -2.28 -0.21 0.00 0.01 0.00 0.00 72.50 70.37 2qtz s THR 392 CO 0.14 0.47 0.57 -1.54 -0.69 0.00 0.00 174.62 173.58 2qtz n SER 393 N 4.58 0.59 -4.72 3.53 3.41 -1.19 -4.72 113.62 115.09 2qtz n SER 393 Ca -0.19 0.27 -0.42 0.00 -0.26 0.00 0.00 58.87 58.27 2qtz n SER 393 Cb 0.51 0.44 -0.03 0.00 -0.26 0.00 0.00 64.21 64.86 2qtz n SER 393 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2qtz s ASP 394 N -5.70 7.31 0.13 4.04 2.15 -1.26 -4.95 116.67 118.38 2qtz s ASP 394 Ca -0.05 1.85 -0.19 0.00 0.43 0.00 0.00 52.55 54.58 2qtz s ASP 394 Cb 0.08 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.08 2qtz s ASP 394 CO 0.83 -0.26 1.75 0.28 -0.17 0.00 0.00 175.17 177.60 2qtz h SER 395 N 6.22 0.11 -0.41 -0.34 0.02 -1.99 0.42 113.55 117.59 2qtz h SER 395 Ca -0.42 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.48 2qtz h SER 395 Cb 1.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 2qtz h SER 395 CO 0.75 0.09 0.01 0.00 -1.14 0.00 0.00 176.83 176.54 2qtz h ALA 396 N 1.12 0.55 -0.20 3.77 0.00 -1.99 -1.69 119.26 120.82 2qtz h ALA 396 Ca 0.09 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2qtz h ALA 396 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2qtz h ALA 396 CO -0.08 0.32 0.11 0.93 0.00 0.00 0.00 179.25 180.53 2qtz h GLU 397 N 0.55 0.28 -0.32 0.00 5.08 -1.88 -0.09 114.58 118.19 2qtz h GLU 397 Ca 0.12 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2qtz h GLU 397 Cb 0.47 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2qtz h GLU 397 CO 0.02 0.26 -0.07 -0.22 -1.00 0.00 0.00 179.01 178.00 2qtz h LYS 398 N 0.22 0.01 -0.93 2.33 3.64 -0.90 -1.69 116.57 119.24 2qtz h LYS 398 Ca 0.07 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.52 2qtz h LYS 398 Cb 0.07 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 2qtz h LYS 398 CO -0.01 0.01 0.59 -0.09 -2.27 0.00 0.00 179.45 177.67 2qtz h ARG 399 N 0.01 1.03 -0.45 1.90 9.65 -0.98 -1.44 114.38 124.09 2qtz h ARG 399 Ca 0.15 -0.06 -0.08 0.00 -1.10 0.00 0.00 59.98 58.89 2qtz h ARG 399 Cb 0.23 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 2qtz h ARG 399 CO -0.32 0.68 -0.05 -0.09 2.80 0.00 0.00 179.97 182.99 2qtz h ARG 400 N 1.06 0.83 -0.54 0.20 9.65 -0.16 -1.49 114.38 123.93 2qtz h ARG 400 Ca 0.41 -0.29 -0.07 0.00 -1.10 0.00 0.00 59.98 58.93 2qtz h ARG 400 Cb 0.20 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 2qtz h ARG 400 CO -0.18 0.91 0.05 -0.07 2.80 0.00 0.00 179.97 183.48 2qtz h LEU 401 N 0.67 0.85 -0.49 3.80 3.38 -1.05 -1.03 115.31 121.43 2qtz h LEU 401 Ca 0.12 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 57.95 2qtz h LEU 401 Cb 0.56 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2qtz h LEU 401 CO 0.03 0.88 0.23 1.56 0.09 0.00 0.00 178.44 181.23 2qtz h GLN 402 N 0.83 0.44 -0.10 1.13 4.20 -1.07 -2.23 115.11 118.31 2qtz h GLN 402 Ca 0.17 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.87 2qtz h GLN 402 Cb 0.42 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2qtz h GLN 402 CO 0.01 0.29 -0.01 0.93 -0.67 0.00 0.00 178.83 179.39 2qtz h GLU 403 N 0.45 0.02 0.00 1.46 5.08 -0.73 -2.33 114.58 118.53 2qtz h GLU 403 Ca 0.22 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2qtz h GLU 403 Cb 0.16 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2qtz h GLU 403 CO -0.18 0.02 -0.09 -0.07 -1.00 0.00 0.00 179.01 177.69 2qtz h LEU 404 N 0.02 0.00 -1.98 1.33 3.38 -0.95 -1.84 115.31 115.28 2qtz h LEU 404 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qtz h LEU 404 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2qtz h LEU 404 CO -0.09 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2qtz s SER 406 N -1.77 6.31 0.20 0.00 1.04 -0.69 -4.37 113.70 114.42 2qtz s SER 406 Ca 0.29 1.06 -0.17 0.00 0.48 0.00 0.00 55.95 57.61 2qtz s SER 406 Cb 0.19 -2.30 0.19 0.00 0.10 0.00 0.00 66.02 64.20 2qtz s SER 406 CO 0.29 -0.59 1.60 0.11 0.98 0.00 0.00 173.24 175.62 2qtz h LYS 407 N 0.34 -0.09 0.00 4.02 6.56 -1.64 -2.43 116.57 123.32 2qtz h LYS 407 Ca -0.46 0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.11 2qtz h LYS 407 Cb 1.20 0.02 -0.00 0.00 -0.57 0.00 0.00 32.23 32.88 2qtz h LYS 407 CO 0.62 -0.06 -0.11 1.96 -2.06 0.00 0.00 179.45 179.80 2qtz h GLN 408 N -0.09 0.00 -0.51 3.15 7.50 -1.86 -2.80 115.11 120.49 2qtz h GLN 408 Ca 0.28 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.43 2qtz h GLN 408 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.06 2qtz h GLN 408 CO -0.69 0.11 0.00 0.41 -1.50 0.00 0.00 178.83 177.16 2qtz n GLY 409 N -0.94 1.41 0.37 3.46 0.00 -0.92 -4.56 105.19 104.01 2qtz n GLY 409 Ca -0.02 -0.55 0.03 0.00 0.00 0.00 0.00 46.02 45.48 2qtz n GLY 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtz h ALA 410 N 3.89 1.43 -0.43 4.61 0.00 -1.49 0.80 119.26 128.07 2qtz h ALA 410 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2qtz h ALA 410 Cb 0.71 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qtz h ALA 410 CO 0.02 0.42 -0.24 0.00 0.00 0.00 0.00 179.25 179.44 2qtz h ALA 411 N 1.47 0.61 -0.57 0.00 0.00 -1.86 -0.76 119.26 118.14 2qtz h ALA 411 Ca 0.43 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2qtz h ALA 411 Cb 0.19 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2qtz h ALA 411 CO -0.17 0.61 -0.06 -0.44 0.00 0.00 0.00 179.25 179.19 2qtz h ASP 412 N 0.76 1.04 -0.16 0.00 5.19 -1.67 -0.56 116.42 121.02 2qtz h ASP 412 Ca 0.09 -0.33 0.03 0.00 -0.62 0.00 0.00 57.03 56.20 2qtz h ASP 412 Cb 0.82 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 40.02 2qtz h ASP 412 CO 0.07 1.12 -0.00 0.22 -3.12 0.00 0.00 179.24 177.53 2qtz h TYR 413 N 0.94 -0.01 -0.64 4.55 3.20 -0.76 0.27 116.97 124.51 2qtz h TYR 413 Ca 0.16 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.95 2qtz h TYR 413 Cb 0.62 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 2qtz h TYR 413 CO 0.04 -0.02 0.07 0.77 -1.64 0.00 0.00 178.16 177.38 2qtz h SER 414 N 0.05 1.05 0.25 -2.11 0.02 -0.92 -0.01 113.55 111.88 2qtz h SER 414 Ca 0.07 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 2qtz h SER 414 Cb 0.09 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.35 2qtz h SER 414 CO -0.13 1.06 -0.12 -0.09 -1.14 0.00 0.00 176.83 176.42 2qtz h ARG 415 N 1.00 -0.32 0.00 3.45 2.43 -0.91 0.14 114.38 120.16 2qtz h ARG 415 Ca 0.19 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2qtz h ARG 415 Cb 0.48 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2qtz h ARG 415 CO 0.02 0.04 -1.24 1.19 -1.51 0.00 0.00 179.97 178.47 2qtz n PHE 416 N -5.04 0.25 0.00 2.20 3.72 0.92 -3.28 117.46 116.22 2qtz n PHE 416 Ca -0.09 0.07 -0.03 0.00 -0.05 0.00 0.00 57.45 57.36 2qtz n PHE 416 Cb 0.26 -0.46 -0.01 0.00 -0.94 0.00 0.00 39.48 38.34 2qtz n PHE 416 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2qtz n VAL 417 N -2.05 1.29 0.32 -4.37 0.31 -0.12 -4.58 118.33 109.12 2qtz n VAL 417 Ca 0.01 0.31 -0.13 0.00 -0.01 0.00 0.00 64.34 64.52 2qtz n VAL 417 Cb 0.47 -1.82 -0.06 0.00 -0.91 0.00 0.00 33.84 31.52 2qtz n VAL 417 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2qtz h ARG 418 N -0.31 -0.81 0.00 5.55 2.43 -1.32 -1.43 114.38 118.49 2qtz h ARG 418 Ca -0.01 0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2qtz h ARG 418 Cb 0.34 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2qtz h ARG 418 CO -0.01 -0.54 -0.26 -0.44 -1.51 0.00 0.00 179.97 177.21 2qtz h ASP 419 N -1.18 0.00 0.00 -3.80 3.32 -0.85 -3.42 116.42 110.49 2qtz h ASP 419 Ca -0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2qtz h ASP 419 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2qtz h ASP 419 CO 0.14 0.26 0.00 0.00 -1.72 0.00 0.00 179.24 177.92 2qtz n ALA 420 N -2.45 0.00 -3.58 3.45 0.00 -1.21 -5.04 120.51 111.69 2qtz n ALA 420 Ca -0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.27 2qtz n ALA 420 Cb 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.70 2qtz n ALA 420 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qtz s ALA 422 N -3.83 -1.67 0.42 0.00 0.00 -0.54 -3.10 121.76 113.04 2qtz s ALA 422 Ca 0.00 1.86 0.07 0.00 0.00 0.00 0.00 51.96 53.89 2qtz s ALA 422 Cb 0.00 -1.03 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 2qtz s ALA 422 CO 0.00 -0.32 0.15 0.00 0.00 0.00 0.00 175.76 175.59 2qtz h LEU 424 N 1.47 -0.37 -0.47 0.00 5.85 -1.71 -1.49 115.31 118.60 2qtz h LEU 424 Ca -0.43 0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.53 2qtz h LEU 424 Cb 1.25 0.33 -0.05 0.00 0.37 0.00 0.00 40.66 42.56 2qtz h LEU 424 CO 0.72 -0.16 0.17 0.25 -0.34 0.00 0.00 178.44 179.08 2qtz h LEU 425 N 0.09 0.17 -0.67 2.25 5.85 -1.96 0.64 115.31 121.68 2qtz h LEU 425 Ca 0.36 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.13 2qtz h LEU 425 Cb 0.60 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2qtz h LEU 425 CO -0.61 0.13 0.42 0.44 -0.34 0.00 0.00 178.44 178.48 2qtz h ASP 426 N 0.34 0.80 -0.38 1.25 3.32 -1.70 -0.12 116.42 119.92 2qtz h ASP 426 Ca 0.22 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 2qtz h ASP 426 Cb 0.22 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2qtz h ASP 426 CO -0.23 0.60 0.13 0.25 -1.72 0.00 0.00 179.24 178.28 2qtz h LEU 427 N 0.92 0.55 -0.69 1.55 5.85 -0.75 -1.17 115.31 121.57 2qtz h LEU 427 Ca 0.24 -0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 2qtz h LEU 427 Cb -0.06 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2qtz h LEU 427 CO -0.05 0.60 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.55 2qtz h LEU 428 N 0.47 0.97 -0.95 2.25 3.38 -0.34 -0.35 115.31 120.74 2qtz h LEU 428 Ca 0.12 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 2qtz h LEU 428 Cb 0.24 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2qtz h LEU 428 CO -0.01 1.04 -0.09 -0.07 0.09 0.00 0.00 178.44 179.40 2qtz h LEU 429 N 0.90 0.64 -0.33 1.67 3.38 -0.87 -2.92 115.31 117.78 2qtz h LEU 429 Ca 0.16 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2qtz h LEU 429 Cb 0.56 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2qtz h LEU 429 CO 0.03 0.77 -0.38 0.00 0.09 0.00 0.00 178.44 178.95 2qtz h ALA 430 N 1.29 0.81 -2.62 1.53 0.00 -0.95 -3.35 119.26 115.96 2qtz h ALA 430 Ca 0.11 -0.35 -0.64 0.00 0.00 0.00 0.00 54.91 54.03 2qtz h ALA 430 Cb 0.52 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 17.85 2qtz h ALA 430 CO 0.03 0.48 -0.43 1.19 0.00 0.00 0.00 179.25 180.53 2qtz n PHE 431 N -3.28 3.51 0.31 0.00 3.72 -0.16 -4.93 117.46 116.63 2qtz n PHE 431 Ca 0.02 -4.12 0.21 0.00 -0.05 0.00 0.00 57.45 53.50 2qtz n PHE 431 Cb 0.63 -0.71 1.12 0.00 -0.94 0.00 0.00 39.48 39.57 2qtz n PHE 431 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2qtz h PRO 432 N 4.98 0.00 -0.01 -1.08 0.13 -1.70 -1.04 132.00 133.28 2qtz h PRO 432 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2qtz h PRO 432 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2qtz h PRO 432 CO 0.83 0.00 -0.03 -1.13 -0.23 0.00 0.00 178.00 177.44 2qtz n SER 433 N -2.94 0.57 -4.62 1.44 3.41 -1.26 -4.79 113.62 105.43 2qtz n SER 433 Ca -0.03 -1.01 -0.42 0.00 -0.26 0.00 0.00 58.87 57.15 2qtz n SER 433 Cb 0.06 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 63.95 2qtz n SER 433 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qtz s GLN 435 N 3.29 1.85 0.42 0.00 -1.52 0.24 -4.98 119.66 118.96 2qtz s GLN 435 Ca 0.38 -2.82 -0.12 0.00 -1.95 0.00 0.00 55.36 50.85 2qtz s GLN 435 Cb -0.13 -2.67 -0.07 0.00 -0.22 0.00 0.00 33.01 29.92 2qtz s GLN 435 CO 0.14 -1.31 0.82 -1.25 -0.25 0.00 0.00 175.29 173.44 2qtz s PRO 436 N -0.79 3.83 0.50 2.91 0.04 -1.26 -4.86 135.00 135.37 2qtz s PRO 436 Ca 0.27 0.59 -0.19 0.00 0.04 0.00 0.00 61.00 61.70 2qtz s PRO 436 Cb -0.04 -2.34 -0.08 0.00 0.04 0.00 0.00 34.50 32.08 2qtz s PRO 436 CO -0.16 -0.08 1.01 -1.25 0.04 0.00 0.00 177.00 176.56 2qtz s PRO 437 N -3.85 3.84 0.37 0.56 0.04 -1.26 -4.95 135.00 129.75 2qtz s PRO 437 Ca 0.53 1.21 0.10 0.00 0.04 0.00 0.00 61.00 62.87 2qtz s PRO 437 Cb -0.10 -2.11 0.85 0.00 0.04 0.00 0.00 34.50 33.17 2qtz s PRO 437 CO 0.31 -0.37 1.89 1.25 0.04 0.00 0.00 177.00 180.11 2qtz h LEU 438 N 1.34 0.61 -0.77 -3.56 5.85 -1.97 -1.79 115.31 115.03 2qtz h LEU 438 Ca -0.48 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.33 2qtz h LEU 438 Cb 1.20 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.09 2qtz h LEU 438 CO 0.60 0.32 0.46 0.77 -0.34 0.00 0.00 178.44 180.25 2qtz h SER 439 N 0.65 0.72 -0.53 1.25 4.64 -1.92 -1.79 113.55 116.56 2qtz h SER 439 Ca 0.42 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2qtz h SER 439 Cb 0.70 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 2qtz h SER 439 CO -0.18 0.46 0.35 0.25 -0.87 0.00 0.00 176.83 176.84 2qtz h LEU 440 N 0.85 0.62 -0.64 5.97 5.85 -1.67 -2.16 115.31 124.14 2qtz h LEU 440 Ca 0.34 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.06 2qtz h LEU 440 Cb 0.16 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2qtz h LEU 440 CO -0.17 0.46 0.39 -0.07 -0.34 0.00 0.00 178.44 178.71 2qtz h LEU 441 N 0.72 0.62 -0.52 2.25 4.07 -1.36 -2.44 115.31 118.66 2qtz h LEU 441 Ca 0.19 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.16 2qtz h LEU 441 Cb -0.07 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 41.55 2qtz h LEU 441 CO -0.04 0.43 0.00 0.18 -1.08 0.00 0.00 178.44 177.93 2qtz n LEU 442 N -4.73 0.75 0.18 1.67 4.77 -0.72 -0.83 117.00 118.09 2qtz n LEU 442 Ca 0.07 0.65 0.07 0.00 -0.03 0.00 0.00 56.01 56.76 2qtz n LEU 442 Cb 0.10 -0.50 0.13 0.00 -2.33 0.00 0.00 43.42 40.82 2qtz n LEU 442 CO 0.32 -0.46 0.64 -0.33 -1.33 0.00 0.00 177.39 176.22 2qtz h GLU 443 N 0.00 0.00 0.00 3.23 5.08 -0.91 -3.40 114.58 118.58 2qtz h GLU 443 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qtz h GLU 443 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2qtz h GLU 443 CO 0.00 0.28 -0.98 0.72 -1.00 0.00 0.00 179.01 178.03 2qtz n HIS 444 N -3.19 0.00 -2.44 4.33 8.25 -0.61 -5.00 115.22 116.56 2qtz n HIS 444 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.07 2qtz n HIS 444 Cb 0.62 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.70 2qtz n HIS 444 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2qtz s LEU 445 N -3.36 4.39 0.87 2.41 1.43 -0.01 -5.00 118.68 119.40 2qtz s LEU 445 Ca 0.00 2.02 -0.12 0.00 -1.03 0.00 0.00 54.13 55.00 2qtz s LEU 445 Cb 0.00 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.78 2qtz s LEU 445 CO 0.00 -0.43 1.21 -2.16 0.23 0.00 0.00 176.35 175.21 2qtz s PRO 446 N 0.84 1.25 0.34 1.29 0.04 -1.26 -4.83 135.00 132.66 2qtz s PRO 446 Ca 0.57 -0.36 -0.29 0.00 0.04 0.00 0.00 61.00 60.97 2qtz s PRO 446 Cb -0.29 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.17 2qtz s PRO 446 CO 0.30 -1.97 1.51 0.21 0.04 0.00 0.00 177.00 177.09 2qtz s LYS 447 N -5.65 4.14 -0.51 4.56 2.20 -1.26 -0.58 119.74 122.64 2qtz s LYS 447 Ca 0.69 2.54 -0.28 0.00 -0.36 0.00 0.00 55.97 58.56 2qtz s LYS 447 Cb -0.06 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 2qtz s LYS 447 CO 0.50 -0.54 1.56 -1.17 -0.36 0.00 0.00 175.35 175.34 2qtz s LEU 448 N -1.46 3.42 0.32 5.43 2.96 -0.50 -4.18 118.68 124.68 2qtz s LEU 448 Ca 0.56 0.54 -0.26 0.00 -0.22 0.00 0.00 54.13 54.75 2qtz s LEU 448 Cb -0.46 -3.10 -0.10 0.00 0.50 0.00 0.00 46.19 43.02 2qtz s LEU 448 CO 0.56 -1.79 0.94 -1.10 -1.32 0.00 0.00 176.35 173.65 2qtz s GLN 449 N 5.73 4.58 0.60 1.98 -1.52 -1.26 -4.88 119.66 124.89 2qtz s GLN 449 Ca 0.61 1.33 -0.19 0.00 -1.95 0.00 0.00 55.36 55.16 2qtz s GLN 449 Cb -0.13 -2.80 -0.03 0.00 -0.22 0.00 0.00 33.01 29.82 2qtz s GLN 449 CO 0.27 0.28 1.21 -1.25 -0.25 0.00 0.00 175.29 175.55 2qtz s PRO 450 N -2.05 2.93 -0.21 2.91 0.04 -1.26 -4.80 135.00 132.56 2qtz s PRO 450 Ca 0.50 1.83 -0.09 0.00 0.04 0.00 0.00 61.00 63.28 2qtz s PRO 450 Cb -0.19 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 2qtz s PRO 450 CO 0.24 -1.24 0.11 1.03 0.04 0.00 0.00 177.00 177.18 2qtz s ARG 451 N -3.36 4.05 0.35 4.56 3.00 -0.59 -4.85 118.95 122.12 2qtz s ARG 451 Ca 0.77 -0.29 -0.25 0.00 0.00 0.00 0.00 55.73 55.96 2qtz s ARG 451 Cb -0.30 -3.37 -0.10 0.00 0.00 0.00 0.00 34.95 31.17 2qtz s ARG 451 CO 0.34 0.20 0.95 -1.25 0.00 0.00 0.00 175.30 175.54 2qtz s PRO 452 N 0.62 4.47 0.11 3.54 0.04 -1.26 -0.68 135.00 141.84 2qtz s PRO 452 Ca 0.06 1.29 0.04 0.00 0.04 0.00 0.00 61.00 62.43 2qtz s PRO 452 Cb -0.12 -2.63 -0.04 0.00 0.04 0.00 0.00 34.50 31.75 2qtz s PRO 452 CO 0.01 0.18 -0.11 0.71 0.04 0.00 0.00 177.00 177.82 2qtz s TYR 453 N -1.76 1.18 0.07 0.56 2.02 0.55 -4.95 117.35 115.02 2qtz s TYR 453 Ca 0.54 -0.63 -0.14 0.00 -0.37 0.00 0.00 57.07 56.47 2qtz s TYR 453 Cb -0.16 -0.63 -0.06 0.00 -0.40 0.00 0.00 41.96 40.70 2qtz s TYR 453 CO 0.21 0.05 0.47 -1.12 -1.57 0.00 0.00 175.55 173.59 2qtz s SER 454 N -2.48 6.82 0.08 2.29 0.01 -1.26 -1.02 113.70 118.13 2qtz s SER 454 Ca 0.07 1.00 -0.31 0.00 1.31 0.00 0.00 55.95 58.03 2qtz s SER 454 Cb -0.03 -2.26 -0.08 0.00 0.21 0.00 0.00 66.02 63.86 2qtz s SER 454 CO 0.01 0.22 1.47 0.00 0.41 0.00 0.00 173.24 175.35 2qtz n ALA 456 N 4.68 4.07 -3.30 0.00 0.00 0.41 -3.77 120.51 122.60 2qtz n ALA 456 Ca 0.13 -3.23 -0.09 0.00 0.00 0.00 0.00 53.44 50.26 2qtz n ALA 456 Cb 0.42 -0.58 -0.04 0.00 0.00 0.00 0.00 19.45 19.25 2qtz n ALA 456 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qtz s SER 457 N -2.84 -0.16 -0.08 0.00 1.04 -1.26 -3.56 113.70 106.85 2qtz s SER 457 Ca 0.42 -0.74 0.02 0.00 0.48 0.00 0.00 55.95 56.13 2qtz s SER 457 Cb 0.39 0.60 -0.02 0.00 0.10 0.00 0.00 66.02 67.09 2qtz s SER 457 CO -0.03 -1.13 -0.12 -0.55 0.98 0.00 0.00 173.24 172.38 2qtz s SER 458 N -2.96 4.15 0.62 7.02 0.15 -1.26 -4.32 113.70 117.10 2qtz s SER 458 Ca 0.16 -0.20 0.34 0.00 0.70 0.00 0.00 55.95 56.95 2qtz s SER 458 Cb -0.01 -1.12 1.93 0.00 -1.71 0.00 0.00 66.02 65.11 2qtz s SER 458 CO 0.05 0.30 2.20 0.28 1.20 0.00 0.00 173.24 177.26 2qtz h SER 459 N 5.71 0.00 0.36 5.45 0.02 -1.84 -0.98 113.55 122.27 2qtz h SER 459 Ca -0.41 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.43 2qtz h SER 459 Cb 1.17 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 2qtz h SER 459 CO 0.52 0.00 -0.46 -0.07 -1.14 0.00 0.00 176.83 175.69 2qtz h LEU 460 N 0.00 0.13 0.11 5.07 3.38 -1.95 -2.96 115.31 119.09 2qtz h LEU 460 Ca 0.03 -0.06 -0.36 0.00 0.09 0.00 0.00 57.88 57.58 2qtz h LEU 460 Cb 0.25 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2qtz h LEU 460 CO -0.00 0.57 -2.03 0.33 0.09 0.00 0.00 178.44 177.40 2qtz n PHE 461 N -3.99 1.13 -3.52 1.13 7.35 -0.45 -4.57 117.46 114.54 2qtz n PHE 461 Ca -0.02 0.24 -0.27 0.00 -0.76 0.00 0.00 57.45 56.65 2qtz n PHE 461 Cb 0.50 -1.15 -0.09 0.00 0.35 0.00 0.00 39.48 39.08 2qtz n PHE 461 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 2qtz n HIS 462 N -3.44 2.07 -1.72 -5.13 8.25 -0.76 -5.06 115.22 109.43 2qtz n HIS 462 Ca -0.33 -3.96 -0.43 0.00 -0.26 0.00 0.00 57.72 52.75 2qtz n HIS 462 Cb 1.04 -0.41 -0.03 0.00 1.12 0.00 0.00 29.99 31.72 2qtz n HIS 462 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2qtz n PRO 463 N 1.60 2.64 -0.66 -0.41 -0.04 -1.12 -1.75 135.00 135.27 2qtz n PRO 463 Ca 0.25 0.95 0.00 0.00 -0.04 0.00 0.00 63.50 64.66 2qtz n PRO 463 Cb 0.42 -2.75 0.00 0.00 -0.04 0.00 0.00 33.50 31.13 2qtz n PRO 463 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qtz n GLY 464 N 3.14 0.85 3.40 0.55 0.00 -1.26 -5.03 105.19 106.83 2qtz n GLY 464 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 2qtz n GLY 464 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qtz s LYS 465 N -0.33 1.47 -0.05 1.61 -0.14 -0.71 -0.96 119.74 120.63 2qtz s LYS 465 Ca 0.00 -1.64 -0.00 0.00 -1.36 0.00 0.00 55.97 52.97 2qtz s LYS 465 Cb 0.00 -1.44 0.03 0.00 -1.68 0.00 0.00 37.83 34.74 2qtz s LYS 465 CO 0.00 0.26 -0.00 -1.17 -0.76 0.00 0.00 175.35 173.68 2qtz s LEU 466 N -3.28 0.95 0.07 3.17 2.96 -0.25 -4.71 118.68 117.59 2qtz s LEU 466 Ca 0.25 -0.06 0.03 0.00 -0.22 0.00 0.00 54.13 54.13 2qtz s LEU 466 Cb -0.03 -0.33 -0.04 0.00 0.50 0.00 0.00 46.19 46.28 2qtz s LEU 466 CO 0.10 -0.13 0.05 -1.00 -1.32 0.00 0.00 176.35 174.05 2qtz s HIS 467 N 1.37 3.14 0.11 5.38 3.76 -1.26 -0.75 115.29 127.04 2qtz s HIS 467 Ca -0.05 0.06 -0.03 0.00 -0.15 0.00 0.00 55.06 54.90 2qtz s HIS 467 Cb -0.13 -1.61 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 2qtz s HIS 467 CO -0.02 0.51 0.09 -0.59 -0.85 0.00 0.00 174.74 173.87 2qtz s PHE 468 N -1.32 0.65 -0.04 1.40 -0.12 -0.50 -0.44 117.98 117.60 2qtz s PHE 468 Ca 0.27 -1.06 0.02 0.00 -0.05 0.00 0.00 56.93 56.10 2qtz s PHE 468 Cb -0.12 -0.35 0.01 0.00 -0.63 0.00 0.00 43.02 41.93 2qtz s PHE 468 CO 0.19 -0.53 -0.07 0.08 -0.05 0.00 0.00 175.22 174.85 2qtz s VAL 469 N -3.99 0.65 -0.02 -2.49 1.01 -1.26 -0.66 120.40 113.65 2qtz s VAL 469 Ca 0.17 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 2qtz s VAL 469 Cb 0.07 -0.62 0.03 0.00 0.00 0.00 0.00 36.38 35.85 2qtz s VAL 469 CO -0.02 0.23 0.33 0.72 0.00 0.00 0.00 175.10 176.35 2qtz s PHE 470 N 0.54 -0.20 0.15 5.22 -0.12 -0.28 -4.87 117.98 118.41 2qtz s PHE 470 Ca -0.08 0.31 -0.26 0.00 -0.05 0.00 0.00 56.93 56.86 2qtz s PHE 470 Cb -0.11 0.11 -0.08 0.00 -0.63 0.00 0.00 43.02 42.31 2qtz s PHE 470 CO 0.01 -0.39 0.79 -0.80 -0.05 0.00 0.00 175.22 174.77 2qtz s ASN 471 N -1.29 7.38 -0.16 1.98 0.01 -1.26 -0.79 114.94 120.81 2qtz s ASN 471 Ca -0.13 1.64 -0.29 0.00 -0.71 0.00 0.00 52.86 53.36 2qtz s ASN 471 Cb -0.05 -2.50 -0.01 0.00 0.41 0.00 0.00 41.25 39.09 2qtz s ASN 471 CO 0.04 0.18 1.26 -0.63 -1.51 0.00 0.00 177.10 176.44 2qtz s ILE 472 N -0.97 4.28 0.01 0.60 1.01 0.46 -4.92 121.20 121.66 2qtz s ILE 472 Ca 0.37 1.55 -0.30 0.00 0.00 0.00 0.00 60.65 62.26 2qtz s ILE 472 Cb -0.23 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2qtz s ILE 472 CO 0.26 -0.13 1.05 -0.69 0.00 0.00 0.00 174.94 175.42 2qtz s VAL 473 N 3.47 4.62 -0.02 2.92 1.01 -1.26 -4.58 120.40 126.57 2qtz s VAL 473 Ca 0.55 1.89 0.03 0.00 0.00 0.00 0.00 61.98 64.45 2qtz s VAL 473 Cb -0.22 -4.21 -0.00 0.00 0.00 0.00 0.00 36.38 31.95 2qtz s VAL 473 CO 0.15 0.13 -0.12 -1.61 0.00 0.00 0.00 175.10 173.65 2qtz s GLU 474 N 1.11 1.13 0.05 2.72 2.02 -1.26 -0.98 118.70 123.49 2qtz s GLU 474 Ca 0.54 -0.42 -0.13 0.00 0.02 0.00 0.00 54.97 54.97 2qtz s GLU 474 Cb -0.23 -1.05 0.02 0.00 0.10 0.00 0.00 34.13 32.96 2qtz s GLU 474 CO 0.28 0.20 0.30 -0.59 0.02 0.00 0.00 175.26 175.47 2qtz s PHE 475 N -0.04 -0.09 0.09 1.61 -0.12 -0.60 -4.97 117.98 113.86 2qtz s PHE 475 Ca 0.00 -0.08 -0.28 0.00 -0.05 0.00 0.00 56.93 56.53 2qtz s PHE 475 Cb -0.08 0.09 -0.06 0.00 -0.63 0.00 0.00 43.02 42.35 2qtz s PHE 475 CO 0.00 -0.51 0.86 -0.51 -0.05 0.00 0.00 175.22 175.01 2qtz s LEU 476 N -2.15 4.49 0.27 -1.99 1.43 -1.26 -1.09 118.68 118.37 2qtz s LEU 476 Ca -0.04 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 54.72 2qtz s LEU 476 Cb -0.00 -3.42 -0.05 0.00 0.03 0.00 0.00 46.19 42.75 2qtz s LEU 476 CO -0.04 -0.01 0.09 -0.94 0.23 0.00 0.00 176.35 175.68 2qtz s SER 477 N -0.14 1.35 0.51 2.29 1.04 -1.25 -4.91 113.70 112.60 2qtz s SER 477 Ca 0.42 -1.39 0.33 0.00 0.48 0.00 0.00 55.95 55.80 2qtz s SER 477 Cb -0.22 0.14 1.51 0.00 0.10 0.00 0.00 66.02 67.55 2qtz s SER 477 CO 0.27 -0.72 2.00 0.74 0.98 0.00 0.00 173.24 176.50 2qtz h THR 478 N 2.34 0.00 -1.39 2.02 2.02 -1.91 -3.46 112.91 112.53 2qtz h THR 478 Ca -0.38 -0.32 -0.74 0.00 0.77 0.00 0.00 66.41 65.74 2qtz h THR 478 Cb 1.25 1.23 0.04 0.00 -1.74 0.00 0.00 68.15 68.93 2qtz h THR 478 CO 0.62 0.00 0.42 0.00 0.37 0.00 0.00 175.52 176.93 2qtz n ALA 479 N -2.01 -1.71 0.09 6.16 0.00 -1.26 -4.87 120.51 116.90 2qtz n ALA 479 Ca -0.00 0.52 -0.04 0.00 0.00 0.00 0.00 53.44 53.92 2qtz n ALA 479 Cb 0.22 -1.99 -0.06 0.00 0.00 0.00 0.00 19.45 17.63 2qtz n ALA 479 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2qtz h THR 480 N 3.65 1.49 -0.28 0.00 2.02 -1.98 -3.31 112.91 114.49 2qtz h THR 480 Ca -0.48 -3.04 0.00 0.00 0.77 0.00 0.00 66.41 63.66 2qtz h THR 480 Cb 1.36 2.69 0.00 0.00 -1.74 0.00 0.00 68.15 70.47 2qtz h THR 480 CO 0.78 0.83 0.00 0.35 0.37 0.00 0.00 175.52 177.86 2qtz n THR 481 N -3.35 1.76 -3.73 3.16 -2.24 -1.26 -4.94 114.28 103.69 2qtz n THR 481 Ca 0.00 -1.53 -0.12 0.00 -2.27 0.00 0.00 64.05 60.13 2qtz n THR 481 Cb 0.87 0.05 -0.13 0.00 -2.10 0.00 0.00 70.33 69.02 2qtz n THR 481 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2qtz s GLU 482 N -2.09 0.21 -0.19 -0.78 2.12 -1.25 -5.08 118.70 111.65 2qtz s GLU 482 Ca 0.34 0.54 -0.17 0.00 0.36 0.00 0.00 54.97 56.04 2qtz s GLU 482 Cb 0.25 -0.12 -0.13 0.00 0.26 0.00 0.00 34.13 34.39 2qtz s GLU 482 CO 0.11 -0.16 0.05 0.28 -0.54 0.00 0.00 175.26 175.00 2qtz n VAL 483 N 4.24 1.49 -4.37 3.70 0.31 -1.26 -4.58 118.33 117.85 2qtz n VAL 483 Ca -0.25 0.05 -0.33 0.00 -0.01 0.00 0.00 64.34 63.80 2qtz n VAL 483 Cb 0.53 -2.16 -0.10 0.00 -0.91 0.00 0.00 33.84 31.20 2qtz n VAL 483 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2qtz s LEU 484 N -7.98 3.40 0.05 7.52 1.43 -1.26 -3.76 118.68 118.08 2qtz s LEU 484 Ca -0.24 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2qtz s LEU 484 Cb 0.05 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2qtz s LEU 484 CO 0.46 0.30 -0.04 -0.13 0.23 0.00 0.00 176.35 177.17 2qtz s ARG 485 N -1.35 2.51 0.34 1.70 0.52 -0.25 -4.95 118.95 117.47 2qtz s ARG 485 Ca 0.17 -0.80 0.00 0.00 -0.52 0.00 0.00 55.73 54.59 2qtz s ARG 485 Cb -0.11 -2.50 -0.03 0.00 0.52 0.00 0.00 34.95 32.82 2qtz s ARG 485 CO 0.07 0.57 0.54 0.15 0.02 0.00 0.00 175.30 176.66 2qtz s LYS 486 N -1.88 3.49 0.80 3.54 1.02 -1.26 -1.56 119.74 123.88 2qtz s LYS 486 Ca 0.21 -0.32 -0.13 0.00 0.02 0.00 0.00 55.97 55.74 2qtz s LYS 486 Cb -0.11 -2.67 0.08 0.00 -0.52 0.00 0.00 37.83 34.61 2qtz s LYS 486 CO 0.13 0.16 1.20 0.20 -0.92 0.00 0.00 175.35 176.11 2qtz s GLY 487 N -3.98 2.14 0.04 -3.33 0.00 -0.15 -4.82 107.32 97.22 2qtz s GLY 487 Ca 0.40 0.81 -0.26 0.00 0.00 0.00 0.00 44.72 45.67 2qtz s GLY 487 CO 0.36 1.22 1.49 -2.08 0.00 0.00 0.00 173.10 174.09 2qtz h VAL 488 N -0.86 0.80 0.00 1.40 2.07 -1.94 -0.59 116.25 117.14 2qtz h VAL 488 Ca -0.46 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 2qtz h VAL 488 Cb 1.29 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2qtz h VAL 488 CO 0.47 0.07 -0.05 0.00 0.02 0.00 0.00 177.57 178.08 2qtz h THR 490 N -0.76 1.30 -0.52 0.00 1.35 -1.92 -0.35 112.91 112.01 2qtz h THR 490 Ca -0.01 -1.46 -0.06 0.00 -0.55 0.00 0.00 66.41 64.34 2qtz h THR 490 Cb 0.86 1.72 -0.02 0.00 -1.73 0.00 0.00 68.15 68.98 2qtz h THR 490 CO 0.01 0.43 0.10 1.23 -0.25 0.00 0.00 175.52 177.03 2qtz h GLY 491 N 1.23 0.93 0.84 5.82 0.00 -1.17 -0.88 103.07 109.84 2qtz h GLY 491 Ca 0.01 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2qtz h GLY 491 CO 0.06 0.56 0.03 -0.25 0.00 0.00 0.00 176.54 176.94 2qtz h TRP 492 N 0.75 0.14 -0.86 5.60 7.01 -1.12 -2.45 115.95 125.01 2qtz h TRP 492 Ca 0.16 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.17 2qtz h TRP 492 Cb 0.38 -0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.35 2qtz h TRP 492 CO 0.03 0.27 0.56 -0.07 -2.79 0.00 0.00 178.44 176.44 2qtz h LEU 493 N -0.03 0.95 -1.00 0.65 3.38 -0.99 -0.63 115.31 117.64 2qtz h LEU 493 Ca 0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2qtz h LEU 493 Cb 0.19 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2qtz h LEU 493 CO -0.00 0.67 0.43 0.00 0.09 0.00 0.00 178.44 179.63 2qtz h ALA 494 N 1.34 1.23 -0.30 1.53 0.00 -1.09 -2.11 119.26 119.86 2qtz h ALA 494 Ca 0.33 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2qtz h ALA 494 Cb -0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 2qtz h ALA 494 CO -0.10 0.61 -0.07 -0.07 0.00 0.00 0.00 179.25 179.63 2qtz h LEU 495 N 1.14 0.58 -0.99 0.00 3.38 -0.88 -3.08 115.31 115.46 2qtz h LEU 495 Ca 0.28 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.95 2qtz h LEU 495 Cb 0.05 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 2qtz h LEU 495 CO -0.04 0.81 0.64 -0.07 0.09 0.00 0.00 178.44 179.87 2qtz h LEU 496 N 0.35 1.04 -0.79 1.67 3.38 -0.79 -2.84 115.31 117.34 2qtz h LEU 496 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qtz h LEU 496 Cb 0.55 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2qtz h LEU 496 CO 0.03 0.68 -0.14 1.33 0.09 0.00 0.00 178.44 180.44 2qtz n VAL 497 N -4.49 0.00 -0.18 1.22 0.24 -0.82 -4.31 118.33 109.99 2qtz n VAL 497 Ca 0.15 -0.20 0.21 0.00 -2.04 0.00 0.00 64.34 62.46 2qtz n VAL 497 Cb 0.15 0.52 0.60 0.00 -1.47 0.00 0.00 33.84 33.64 2qtz n VAL 497 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qtz h ALA 498 N 4.04 2.42 -0.00 2.33 0.00 -1.41 0.23 119.26 126.87 2qtz h ALA 498 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qtz h ALA 498 Cb 0.53 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2qtz h ALA 498 CO 0.00 -0.67 -0.68 -1.13 0.00 0.00 0.00 179.25 176.77 2qtz n SER 499 N -4.42 0.78 0.00 0.00 3.41 -1.26 -3.77 113.62 108.36 2qtz n SER 499 Ca 0.17 -0.62 -0.01 0.00 -0.26 0.00 0.00 58.87 58.15 2qtz n SER 499 Cb 0.74 0.55 -0.11 0.00 -0.26 0.00 0.00 64.21 65.12 2qtz n SER 499 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2qtz n VAL 500 N -1.40 1.14 1.16 -3.33 0.31 -0.04 -5.14 118.33 111.02 2qtz n VAL 500 Ca 0.05 -0.71 0.00 0.00 -0.01 0.00 0.00 64.34 63.67 2qtz n VAL 500 Cb 0.34 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 32.62 2qtz n VAL 500 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2qtz n LEU 501 N -2.82 0.35 -4.04 7.52 7.94 0.60 -4.33 117.00 122.23 2qtz n LEU 501 Ca -0.14 -0.18 -0.16 0.00 -1.11 0.00 0.00 56.01 54.43 2qtz n LEU 501 Cb 0.88 -0.18 -0.13 0.00 0.53 0.00 0.00 43.42 44.53 2qtz n LEU 501 CO 0.43 0.09 -0.42 0.00 -1.11 0.00 0.00 177.39 176.38 2qtz s ALA 517 N -1.54 0.67 0.62 1.96 0.00 -1.26 -4.95 121.76 117.26 2qtz s ALA 517 Ca 0.00 -0.53 -0.16 0.00 0.00 0.00 0.00 51.96 51.26 2qtz s ALA 517 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 2qtz s ALA 517 CO 0.00 0.10 1.12 -1.25 0.00 0.00 0.00 175.76 175.73 2qtz s PRO 518 N -0.78 2.96 0.08 0.00 0.04 -1.26 -4.82 135.00 131.22 2qtz s PRO 518 Ca -0.02 1.48 0.09 0.00 0.04 0.00 0.00 61.00 62.60 2qtz s PRO 518 Cb -0.06 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2qtz s PRO 518 CO 0.00 -1.14 -0.25 0.15 0.04 0.00 0.00 177.00 175.81 2qtz s LYS 519 N -3.81 1.48 0.08 4.56 1.02 -1.26 -0.71 119.74 121.10 2qtz s LYS 519 Ca 0.69 -1.16 0.04 0.00 0.02 0.00 0.00 55.97 55.56 2qtz s LYS 519 Cb -0.22 -1.76 -0.03 0.00 -0.52 0.00 0.00 37.83 35.30 2qtz s LYS 519 CO 0.37 0.44 -0.10 0.96 -0.92 0.00 0.00 175.35 176.09 2qtz s ILE 520 N -0.94 0.89 -0.18 2.17 -4.36 -0.37 -4.93 121.20 113.48 2qtz s ILE 520 Ca 0.11 -1.50 -0.09 0.00 -0.26 0.00 0.00 60.65 58.91 2qtz s ILE 520 Cb -0.10 -1.19 -0.05 0.00 1.25 0.00 0.00 42.46 42.37 2qtz s ILE 520 CO 0.04 -0.49 0.12 -0.44 0.24 0.00 0.00 174.94 174.41 2qtz s SER 521 N -2.20 6.17 0.14 4.36 0.01 -1.26 -0.67 113.70 120.25 2qtz s SER 521 Ca 0.02 0.27 0.03 0.00 1.31 0.00 0.00 55.95 57.58 2qtz s SER 521 Cb -0.05 -2.06 -0.04 0.00 0.21 0.00 0.00 66.02 64.08 2qtz s SER 521 CO 0.00 0.24 -0.07 0.27 0.41 0.00 0.00 173.24 174.09 2qtz s ILE 522 N -0.02 0.97 0.02 1.44 -4.36 0.23 -1.68 121.20 117.80 2qtz s ILE 522 Ca 0.09 -2.01 -0.07 0.00 -0.26 0.00 0.00 60.65 58.40 2qtz s ILE 522 Cb -0.11 -1.87 -0.00 0.00 1.25 0.00 0.00 42.46 41.72 2qtz s ILE 522 CO -0.00 -0.72 0.13 0.72 0.24 0.00 0.00 174.94 175.31 2qtz s PHE 523 N -3.46 0.09 0.66 1.37 -0.12 -0.77 -0.24 117.98 115.50 2qtz s PHE 523 Ca 0.17 -0.25 -0.12 0.00 -0.05 0.00 0.00 56.93 56.68 2qtz s PHE 523 Cb 0.04 -0.07 -0.01 0.00 -0.63 0.00 0.00 43.02 42.35 2qtz s PHE 523 CO 0.00 -0.32 1.05 -1.25 -0.05 0.00 0.00 175.22 174.65 2qtz s PRO 524 N -1.81 3.13 -0.26 1.99 0.04 -1.26 -0.67 135.00 136.16 2qtz s PRO 524 Ca -0.11 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 61.77 2qtz s PRO 524 Cb -0.05 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2qtz s PRO 524 CO -0.01 -0.95 0.29 1.03 0.04 0.00 0.00 177.00 177.41 2qtz s ARG 525 N -4.84 4.02 0.21 4.56 0.52 -1.20 -4.78 118.95 117.45 2qtz s ARG 525 Ca 0.59 -0.09 -0.17 0.00 -0.52 0.00 0.00 55.73 55.54 2qtz s ARG 525 Cb -0.14 -3.63 0.22 0.00 0.52 0.00 0.00 34.95 31.92 2qtz s ARG 525 CO 0.50 -0.19 1.58 1.79 0.02 0.00 0.00 175.30 179.01 2qtz h THR 526 N 5.31 0.14 -3.43 0.02 1.35 -1.95 -3.38 112.91 110.97 2qtz h THR 526 Ca -0.34 0.00 -0.63 0.00 -0.55 0.00 0.00 66.41 64.89 2qtz h THR 526 Cb 1.17 0.14 -0.19 0.00 -1.73 0.00 0.00 68.15 67.54 2qtz h THR 526 CO 0.62 0.00 -0.60 -0.89 -0.25 0.00 0.00 175.52 174.40 2qtz s THR 527 N -6.07 4.51 -0.02 6.82 2.01 -1.26 -5.09 115.64 116.54 2qtz s THR 527 Ca -0.14 -0.12 0.04 0.00 0.31 0.00 0.00 61.69 61.77 2qtz s THR 527 Cb 0.19 -3.05 -0.00 0.00 0.01 0.00 0.00 72.50 69.64 2qtz s THR 527 CO 0.72 0.42 -0.13 0.20 -0.69 0.00 0.00 174.62 175.13 2qtz s ASN 528 N 0.82 1.64 0.00 3.53 0.01 -1.26 -4.92 114.94 114.75 2qtz s ASN 528 Ca 0.03 -0.26 0.00 0.00 -0.71 0.00 0.00 52.86 51.92 2qtz s ASN 528 Cb -0.14 -0.32 0.00 0.00 0.41 0.00 0.00 41.25 41.20 2qtz s ASN 528 CO 0.02 0.14 0.13 -1.54 -1.51 0.00 0.00 177.10 174.34 2qtz n SER 529 N 3.00 0.26 -3.72 -1.22 3.41 -1.26 -4.90 113.62 109.19 2qtz n SER 529 Ca -0.16 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.38 2qtz n SER 529 Cb 0.54 0.22 -0.00 0.00 -0.26 0.00 0.00 64.21 64.72 2qtz n SER 529 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2qtz n PHE 530 N -0.22 2.99 -4.39 7.33 7.35 -1.26 -4.93 117.46 124.32 2qtz n PHE 530 Ca 0.00 -2.87 -0.26 0.00 -0.76 0.00 0.00 57.45 53.56 2qtz n PHE 530 Cb 0.07 -2.14 -0.11 0.00 0.35 0.00 0.00 39.48 37.65 2qtz n PHE 530 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 2qtz s HIS 531 N 1.07 2.41 0.55 -5.13 3.76 -1.26 -4.23 115.29 112.46 2qtz s HIS 531 Ca 0.46 -0.31 -0.19 0.00 -0.15 0.00 0.00 55.06 54.87 2qtz s HIS 531 Cb 0.13 -1.16 -0.08 0.00 1.11 0.00 0.00 32.58 32.59 2qtz s HIS 531 CO -0.04 0.55 0.74 1.28 -0.85 0.00 0.00 174.74 176.42 2qtz n LEU 532 N -0.01 1.98 -4.77 0.89 4.77 -1.26 -4.93 117.00 113.68 2qtz n LEU 532 Ca -0.10 0.81 -0.40 0.00 -0.03 0.00 0.00 56.01 56.29 2qtz n LEU 532 Cb 0.57 -1.27 0.01 0.00 -2.33 0.00 0.00 43.42 40.40 2qtz n LEU 532 CO 0.33 -2.42 1.04 -2.84 -1.33 0.00 0.00 177.39 172.16 2qtz s PRO 533 N -2.28 3.70 0.30 3.23 0.02 -1.26 -4.89 135.00 133.83 2qtz s PRO 533 Ca 0.70 2.35 0.04 0.00 0.02 0.00 0.00 61.00 64.11 2qtz s PRO 533 Cb -0.46 -2.64 0.65 0.00 0.02 0.00 0.00 34.50 32.07 2qtz s PRO 533 CO 0.52 -0.78 1.83 -0.44 -0.33 0.00 0.00 177.00 177.80 2qtz h ASP 534 N 2.32 0.84 -3.39 2.53 3.32 -2.01 -3.37 116.42 116.66 2qtz h ASP 534 Ca -0.51 0.05 -0.62 0.00 0.02 0.00 0.00 57.03 55.98 2qtz h ASP 534 Cb 1.26 -0.11 -0.13 0.00 0.22 0.00 0.00 39.33 40.57 2qtz h ASP 534 CO 0.61 0.42 0.45 -0.62 -1.72 0.00 0.00 179.24 178.38 2qtz s ASP 535 N -5.67 6.37 0.02 6.45 2.15 -1.26 -4.93 116.67 119.80 2qtz s ASP 535 Ca -0.11 -0.28 0.13 0.00 0.43 0.00 0.00 52.55 52.71 2qtz s ASP 535 Cb 0.23 -2.41 0.54 0.00 -0.30 0.00 0.00 42.92 40.98 2qtz s ASP 535 CO 0.80 -1.08 1.40 -0.81 -0.17 0.00 0.00 175.17 175.32 2qtz n PRO 536 N 7.07 0.02 0.12 4.34 -0.04 -1.26 -2.16 135.00 143.09 2qtz n PRO 536 Ca 0.02 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 63.92 2qtz n PRO 536 Cb 0.48 -1.53 0.41 0.00 -0.04 0.00 0.00 33.50 32.81 2qtz n PRO 536 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qtz h SER 537 N 0.00 0.00 -3.13 3.54 4.64 -1.90 0.12 113.55 116.82 2qtz h SER 537 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 2qtz h SER 537 Cb 0.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 2qtz h SER 537 CO 0.00 0.00 0.65 -0.63 -0.87 0.00 0.00 176.83 175.98 2qtz s ILE 538 N -3.16 4.25 0.56 0.95 -1.09 -0.92 -3.01 121.20 118.79 2qtz s ILE 538 Ca 0.09 1.59 -0.17 0.00 -2.23 0.00 0.00 60.65 59.93 2qtz s ILE 538 Cb 0.11 -4.02 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 2qtz s ILE 538 CO 0.56 0.03 1.06 -2.16 -1.23 0.00 0.00 174.94 173.21 2qtz s PRO 539 N 1.87 3.41 0.04 2.79 0.04 -1.26 -4.30 135.00 137.59 2qtz s PRO 539 Ca 0.56 1.30 -0.00 0.00 0.04 0.00 0.00 61.00 62.90 2qtz s PRO 539 Cb -0.25 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 2qtz s PRO 539 CO 0.24 -0.75 -0.04 0.96 0.04 0.00 0.00 177.00 177.45 2qtz s ILE 540 N -2.25 0.25 -0.08 0.56 -4.36 0.02 -2.51 121.20 112.84 2qtz s ILE 540 Ca 0.66 -1.37 0.03 0.00 -0.26 0.00 0.00 60.65 59.70 2qtz s ILE 540 Cb -0.17 -0.92 0.01 0.00 1.25 0.00 0.00 42.46 42.63 2qtz s ILE 540 CO 0.32 -0.72 -0.15 -0.63 0.24 0.00 0.00 174.94 174.00 2qtz s ILE 541 N -2.61 1.34 -0.11 8.37 1.01 -0.31 -1.53 121.20 127.36 2qtz s ILE 541 Ca -0.04 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 60.05 2qtz s ILE 541 Cb -0.02 -1.21 0.00 0.00 0.01 0.00 0.00 42.46 41.25 2qtz s ILE 541 CO -0.05 0.40 -0.23 -0.04 0.00 0.00 0.00 174.94 175.02 2qtz s MET 542 N 0.63 3.05 -0.20 2.79 -1.94 0.40 -0.91 119.30 123.13 2qtz s MET 542 Ca -0.15 -0.87 0.01 0.00 -1.71 0.00 0.00 55.69 52.98 2qtz s MET 542 Cb -0.16 -2.35 0.04 0.00 2.01 0.00 0.00 34.83 34.36 2qtz s MET 542 CO 0.04 0.12 -0.12 0.08 -0.01 0.00 0.00 175.02 175.13 2qtz s VAL 543 N 0.49 1.73 -0.44 -6.03 1.01 0.44 -0.87 120.40 116.74 2qtz s VAL 543 Ca -0.15 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 60.87 2qtz s VAL 543 Cb -0.17 -1.76 0.17 0.00 0.00 0.00 0.00 36.38 34.62 2qtz s VAL 543 CO 0.06 0.23 0.53 -0.83 0.00 0.00 0.00 175.10 175.08 2qtz s GLY 544 N 1.37 -0.41 0.43 4.51 0.00 -0.63 -1.13 107.32 111.45 2qtz s GLY 544 Ca -0.01 -0.88 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 2qtz s GLY 544 CO -0.09 3.09 1.11 2.56 0.00 0.00 0.00 173.10 179.77 2qtz s PRO 545 N 1.05 3.96 3.98 2.90 0.04 -1.26 -2.91 135.00 142.76 2qtz s PRO 545 Ca 0.24 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2qtz s PRO 545 Cb -0.05 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 32.01 2qtz s PRO 545 CO -0.07 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.02 2qtz n GLY 546 N 0.40 2.69 0.04 0.56 0.00 0.32 -1.67 105.19 107.53 2qtz n GLY 546 Ca 0.06 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.97 2qtz n GLY 546 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qtz n THR 547 N 0.00 1.00 0.22 2.61 -2.24 -1.26 -1.76 114.28 112.85 2qtz n THR 547 Ca 0.00 0.26 0.11 0.00 -2.27 0.00 0.00 64.05 62.15 2qtz n THR 547 Cb 0.00 -1.08 0.58 0.00 -2.10 0.00 0.00 70.33 67.73 2qtz n THR 547 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2qtz h GLY 548 N 2.27 0.00 2.00 3.38 0.00 -1.53 -1.15 103.07 108.04 2qtz h GLY 548 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2qtz h GLY 548 CO 0.00 0.00 -0.06 1.19 0.00 0.00 0.00 176.54 177.67 2qtz h ILE 549 N 0.00 0.23 -0.41 2.60 2.10 -1.21 -3.38 117.51 117.44 2qtz h ILE 549 Ca 0.00 -0.42 0.08 0.00 1.08 0.00 0.00 64.86 65.60 2qtz h ILE 549 Cb 0.47 1.33 -0.09 0.00 -1.09 0.00 0.00 36.82 37.44 2qtz h ILE 549 CO 0.00 0.05 -0.37 0.00 -1.08 0.00 0.00 178.15 176.76 2qtz h ALA 550 N 1.94 -0.27 0.00 0.18 0.00 -1.46 0.08 119.26 119.73 2qtz h ALA 550 Ca -0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2qtz h ALA 550 Cb 0.33 0.78 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2qtz h ALA 550 CO 0.01 -0.78 -0.08 -1.00 0.00 0.00 0.00 179.25 177.40 2qtz h PRO 551 N -0.28 0.00 0.00 0.00 0.13 -1.75 -2.55 132.00 127.56 2qtz h PRO 551 Ca 0.16 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.15 2qtz h PRO 551 Cb 0.56 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 2qtz h PRO 551 CO -0.56 0.08 -0.68 0.74 -0.23 0.00 0.00 178.00 177.35 2qtz h PHE 552 N 0.00 0.00 -0.51 1.56 0.04 -1.25 -0.15 116.94 116.62 2qtz h PHE 552 Ca -0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.78 2qtz h PHE 552 Cb 0.16 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.28 2qtz h PHE 552 CO 0.00 0.68 0.32 0.82 -0.60 0.00 0.00 178.31 179.53 2qtz h ILE 553 N 0.00 1.09 -0.33 -0.55 1.08 -1.05 -0.89 117.51 116.86 2qtz h ILE 553 Ca -0.01 -0.22 0.04 0.00 -0.39 0.00 0.00 64.86 64.28 2qtz h ILE 553 Cb 1.33 0.38 -0.04 0.00 -3.07 0.00 0.00 36.82 35.43 2qtz h ILE 553 CO 0.09 0.12 0.11 1.23 -0.69 0.00 0.00 178.15 179.00 2qtz h GLY 554 N 0.65 0.41 0.62 5.37 0.00 -1.33 -0.92 103.07 107.86 2qtz h GLY 554 Ca 0.20 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.52 2qtz h GLY 554 CO -0.07 0.02 0.11 0.74 0.00 0.00 0.00 176.54 177.35 2qtz h PHE 555 N 0.24 0.20 -0.39 5.60 -1.00 -0.80 -1.09 116.94 119.71 2qtz h PHE 555 Ca 0.15 0.02 -0.16 0.00 2.81 0.00 0.00 57.97 60.79 2qtz h PHE 555 Cb 0.13 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.65 2qtz h PHE 555 CO -0.15 0.07 -0.37 -0.07 -1.61 0.00 0.00 178.31 176.18 2qtz h LEU 556 N 0.26 0.98 -0.80 1.54 3.38 -0.97 -0.92 115.31 118.77 2qtz h LEU 556 Ca 0.18 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 2qtz h LEU 556 Cb 0.18 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 2qtz h LEU 556 CO -0.20 1.24 0.37 1.56 0.09 0.00 0.00 178.44 181.50 2qtz h GLN 557 N 0.76 1.16 -0.25 1.13 4.20 -0.99 0.30 115.11 121.41 2qtz h GLN 557 Ca 0.07 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 2qtz h GLN 557 Cb 0.96 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 2qtz h GLN 557 CO 0.09 0.90 0.07 1.25 -0.67 0.00 0.00 178.83 180.47 2qtz h HIS 558 N 1.13 0.42 -0.31 2.96 2.76 -0.87 -2.53 115.15 118.72 2qtz h HIS 558 Ca 0.27 -0.05 -0.09 0.00 -2.20 0.00 0.00 60.37 58.31 2qtz h HIS 558 Cb 0.13 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 28.96 2qtz h HIS 558 CO 0.01 0.48 -0.19 0.00 -1.30 0.00 0.00 177.93 176.94 2qtz h ARG 559 N 0.24 0.57 -0.50 5.26 2.47 -1.04 -1.14 114.38 120.24 2qtz h ARG 559 Ca 0.08 -0.20 0.06 0.00 -1.26 0.00 0.00 59.98 58.66 2qtz h ARG 559 Cb 0.26 -0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 28.49 2qtz h ARG 559 CO -0.00 0.73 0.22 1.49 0.56 0.00 0.00 179.97 182.96 2qtz h GLU 560 N 0.51 0.41 -0.13 0.04 4.81 -0.71 0.07 114.58 119.59 2qtz h GLU 560 Ca 0.08 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2qtz h GLU 560 Cb 0.61 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2qtz h GLU 560 CO 0.04 0.27 0.03 0.87 -0.73 0.00 0.00 179.01 179.50 2qtz h LYS 561 N 0.42 0.20 -0.67 1.92 1.79 -1.18 -1.76 116.57 117.30 2qtz h LYS 561 Ca 0.23 -0.05 0.14 0.00 -2.18 0.00 0.00 60.65 58.79 2qtz h LYS 561 Cb 0.19 -0.03 -0.10 0.00 -1.58 0.00 0.00 32.23 30.72 2qtz h LYS 561 CO -0.20 0.36 0.14 -0.07 -1.08 0.00 0.00 179.45 178.61 2qtz h LEU 562 N 0.00 -0.02 -0.66 2.94 3.38 -1.07 -1.80 115.31 118.07 2qtz h LEU 562 Ca 0.04 0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 2qtz h LEU 562 Cb 0.25 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2qtz h LEU 562 CO 0.00 -0.03 -0.08 1.56 0.09 0.00 0.00 178.44 179.99 2qtz h GLN 563 N 0.25 0.96 -0.78 1.13 4.20 -0.85 -2.27 115.11 117.75 2qtz h GLN 563 Ca 0.37 -0.33 0.04 0.00 0.06 0.00 0.00 58.65 58.79 2qtz h GLN 563 Cb 0.59 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.25 2qtz h GLN 563 CO -0.47 0.99 0.52 0.93 -0.67 0.00 0.00 178.83 180.13 2qtz h GLU 564 N 0.86 0.91 -0.43 1.46 5.08 -0.96 -2.20 114.58 119.31 2qtz h GLU 564 Ca 0.14 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 2qtz h GLU 564 Cb 0.62 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2qtz h GLU 564 CO 0.04 0.60 0.00 1.96 -1.00 0.00 0.00 179.01 180.62 2qtz h GLN 565 N 0.94 0.76 -2.72 2.33 4.20 -0.98 -3.38 115.11 116.26 2qtz h GLN 565 Ca 0.32 -0.24 -0.60 0.00 0.06 0.00 0.00 58.65 58.18 2qtz h GLN 565 Cb 0.08 -0.07 -0.40 0.00 0.30 0.00 0.00 27.48 27.39 2qtz h GLN 565 CO -0.10 0.83 -0.79 -1.01 -0.67 0.00 0.00 178.83 177.10 2qtz s HIS 566 N -5.01 2.15 0.90 2.96 3.76 -0.88 -5.10 115.29 114.06 2qtz s HIS 566 Ca -0.13 -2.72 -0.11 0.00 -0.15 0.00 0.00 55.06 51.95 2qtz s HIS 566 Cb 0.11 -1.72 0.13 0.00 1.11 0.00 0.00 32.58 32.21 2qtz s HIS 566 CO 0.80 -0.71 1.09 -2.14 -0.85 0.00 0.00 174.74 172.93 2qtz s PRO 567 N -0.48 1.21 0.00 8.40 0.02 -0.86 -2.41 135.00 140.88 2qtz s PRO 567 Ca 0.28 0.99 0.00 0.00 0.02 0.00 0.00 61.00 62.28 2qtz s PRO 567 Cb -0.03 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.70 2qtz s PRO 567 CO -0.16 -2.32 0.00 -0.40 -0.33 0.00 0.00 177.00 173.79 2qtz n ASP 568 N -3.96 -1.52 -4.76 2.53 5.75 -1.26 -4.98 116.55 108.35 2qtz n ASP 568 Ca 0.08 0.00 -0.32 0.00 -0.01 0.00 0.00 54.79 54.54 2qtz n ASP 568 Cb 0.54 -1.97 0.09 0.00 -1.03 0.00 0.00 41.12 38.75 2qtz n ASP 568 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2qtz s GLY 569 N -2.00 1.83 -0.67 6.12 0.00 -1.01 -4.97 107.32 106.62 2qtz s GLY 569 Ca 0.00 0.41 -0.22 0.00 0.00 0.00 0.00 44.72 44.90 2qtz s GLY 569 CO 0.00 0.76 0.96 0.21 0.00 0.00 0.00 173.10 175.03 2qtz s ASN 570 N -3.04 6.19 -0.15 1.64 2.47 -1.26 -5.02 114.94 115.77 2qtz s ASN 570 Ca 0.64 -1.06 -0.02 0.00 0.42 0.00 0.00 52.86 52.84 2qtz s ASN 570 Cb -0.19 -2.41 -0.02 0.00 -1.45 0.00 0.00 41.25 37.18 2qtz s ASN 570 CO 0.52 -1.41 -0.09 -0.36 -3.72 0.00 0.00 177.10 172.04 2qtz s PHE 571 N 3.93 2.90 0.70 0.43 0.08 -1.26 -3.40 117.98 121.36 2qtz s PHE 571 Ca 0.22 -0.60 -0.15 0.00 0.12 0.00 0.00 56.93 56.52 2qtz s PHE 571 Cb -0.17 -1.93 0.02 0.00 -0.57 0.00 0.00 43.02 40.38 2qtz s PHE 571 CO 0.09 -0.22 1.16 0.20 -0.10 0.00 0.00 175.22 176.35 2qtz s GLY 572 N 0.57 2.27 0.74 4.36 0.00 0.42 -4.90 107.32 110.78 2qtz s GLY 572 Ca -0.06 0.74 -0.15 0.00 0.00 0.00 0.00 44.72 45.25 2qtz s GLY 572 CO 0.03 1.13 1.00 0.00 0.00 0.00 0.00 173.10 175.26 2qtz n ALA 573 N -2.56 -0.23 -3.83 3.20 0.00 -1.26 -4.79 120.51 111.03 2qtz n ALA 573 Ca 0.12 -0.22 -0.26 0.00 0.00 0.00 0.00 53.44 53.08 2qtz n ALA 573 Cb 0.51 -2.13 -0.17 0.00 0.00 0.00 0.00 19.45 17.66 2qtz n ALA 573 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2qtz s MET 574 N -3.47 1.08 -0.09 0.00 -1.94 -1.26 -0.80 119.30 112.83 2qtz s MET 574 Ca 0.73 -0.26 -0.01 0.00 -1.71 0.00 0.00 55.69 54.44 2qtz s MET 574 Cb -0.33 -1.64 -0.03 0.00 2.01 0.00 0.00 34.83 34.84 2qtz s MET 574 CO 0.51 -0.40 -0.02 -1.58 -0.01 0.00 0.00 175.02 173.52 2qtz s TRP 575 N 1.79 3.09 -0.10 -0.03 0.52 -0.58 -0.19 118.94 123.43 2qtz s TRP 575 Ca 0.03 0.12 0.01 0.00 0.02 0.00 0.00 56.10 56.28 2qtz s TRP 575 Cb -0.14 -1.78 0.02 0.00 -1.15 0.00 0.00 33.47 30.42 2qtz s TRP 575 CO -0.07 0.40 -0.14 -1.17 0.02 0.00 0.00 176.95 175.99 2qtz s LEU 576 N -0.78 1.63 -0.35 2.99 2.96 -0.42 -0.45 118.68 124.25 2qtz s LEU 576 Ca 0.12 -0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 53.53 2qtz s LEU 576 Cb -0.11 -1.01 0.01 0.00 0.50 0.00 0.00 46.19 45.58 2qtz s LEU 576 CO 0.02 -0.00 0.21 -0.36 -1.32 0.00 0.00 176.35 174.90 2qtz s PHE 577 N 1.04 3.22 0.07 5.38 0.08 -0.05 -0.92 117.98 126.80 2qtz s PHE 577 Ca -0.06 -0.65 0.07 0.00 0.12 0.00 0.00 56.93 56.41 2qtz s PHE 577 Cb -0.15 -2.44 -0.04 0.00 -0.57 0.00 0.00 43.02 39.83 2qtz s PHE 577 CO -0.02 -0.53 -0.15 0.12 -0.10 0.00 0.00 175.22 174.55 2qtz s PHE 578 N 1.62 2.63 0.01 0.36 5.36 -0.45 -1.60 117.98 125.91 2qtz s PHE 578 Ca 0.04 -0.21 0.01 0.00 -0.96 0.00 0.00 56.93 55.81 2qtz s PHE 578 Cb -0.18 -1.45 -0.01 0.00 -0.34 0.00 0.00 43.02 41.04 2qtz s PHE 578 CO 0.08 0.34 -0.04 0.20 -1.46 0.00 0.00 175.22 174.34 2qtz s GLY 579 N -1.76 0.21 0.30 13.12 0.00 -1.26 -1.15 107.32 116.77 2qtz s GLY 579 Ca 0.17 -0.29 -0.02 0.00 0.00 0.00 0.00 44.72 44.59 2qtz s GLY 579 CO 0.08 -0.29 0.41 0.00 0.00 0.00 0.00 173.10 173.31 2qtz h ARG 581 N 0.00 0.31 -3.41 0.00 3.08 -1.85 -0.12 114.38 112.40 2qtz h ARG 581 Ca -0.23 -0.53 -0.28 0.00 0.07 0.00 0.00 59.98 59.00 2qtz h ARG 581 Cb 1.00 0.20 -0.33 0.00 0.08 0.00 0.00 29.97 30.92 2qtz h ARG 581 CO 0.31 1.26 -0.68 -1.01 -1.07 0.00 0.00 179.97 178.77 2qtz s HIS 582 N -2.46 -0.04 0.40 3.04 3.76 -1.26 -0.69 115.29 118.04 2qtz s HIS 582 Ca -0.15 0.27 0.11 0.00 -0.15 0.00 0.00 55.06 55.14 2qtz s HIS 582 Cb 0.02 -0.20 0.91 0.00 1.11 0.00 0.00 32.58 34.42 2qtz s HIS 582 CO 0.83 -0.13 1.95 -0.22 -0.85 0.00 0.00 174.74 176.32 2qtz h LYS 583 N 7.36 0.55 -0.57 1.40 3.64 -1.95 -2.29 116.57 124.70 2qtz h LYS 583 Ca -0.43 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2qtz h LYS 583 Cb 1.13 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2qtz h LYS 583 CO 0.44 0.36 0.00 -0.25 -2.27 0.00 0.00 179.45 177.73 2qtz n ASP 584 N -4.49 3.07 0.00 4.20 8.00 -1.26 -4.32 116.55 121.75 2qtz n ASP 584 Ca 0.12 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.60 2qtz n ASP 584 Cb 0.35 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 2qtz n ASP 584 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2qtz n ARG 585 N 1.15 0.00 -1.50 -1.24 1.74 -0.89 -4.83 116.66 111.08 2qtz n ARG 585 Ca 0.19 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.28 2qtz n ARG 585 Cb 0.49 -0.41 0.08 0.00 -1.02 0.00 0.00 32.46 31.61 2qtz n ARG 585 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2qtz n ASP 586 N -2.61 1.73 -4.54 0.55 5.75 -1.03 -1.62 116.55 114.76 2qtz n ASP 586 Ca 0.00 -2.76 -0.43 0.00 -0.01 0.00 0.00 54.79 51.59 2qtz n ASP 586 Cb 0.28 -0.40 -0.00 0.00 -1.03 0.00 0.00 41.12 39.97 2qtz n ASP 586 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2qtz s TYR 587 N -1.95 2.94 0.37 2.11 6.04 -1.25 -4.75 117.35 120.85 2qtz s TYR 587 Ca 0.36 -1.66 -0.28 0.00 0.04 0.00 0.00 57.07 55.53 2qtz s TYR 587 Cb 0.38 -4.63 -0.11 0.00 -1.04 0.00 0.00 41.96 36.55 2qtz s TYR 587 CO -0.10 -1.71 1.48 1.28 -1.54 0.00 0.00 175.55 174.96 2qtz n LEU 588 N 7.72 4.65 -2.07 6.97 4.77 -1.26 -3.05 117.00 134.73 2qtz n LEU 588 Ca 0.43 1.22 -0.21 0.00 -0.03 0.00 0.00 56.01 57.43 2qtz n LEU 588 Cb 0.46 -1.61 -0.04 0.00 -2.33 0.00 0.00 43.42 39.90 2qtz n LEU 588 CO 0.71 0.10 -0.24 0.49 -1.33 0.00 0.00 177.39 177.13 2qtz n PHE 589 N 0.52 -0.60 -0.15 -1.77 3.72 -1.26 -4.89 117.46 113.03 2qtz n PHE 589 Ca 0.02 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.38 2qtz n PHE 589 Cb 0.38 -3.74 0.03 0.00 -0.94 0.00 0.00 39.48 35.22 2qtz n PHE 589 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 2qtz h ARG 590 N 0.00 -0.01 -0.63 -1.08 2.43 -1.96 0.69 114.38 113.83 2qtz h ARG 590 Ca -0.46 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 58.62 2qtz h ARG 590 Cb 1.36 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 2qtz h ARG 590 CO 0.60 -0.01 0.06 0.87 -1.51 0.00 0.00 179.97 179.97 2qtz h LYS 591 N -0.01 1.07 -0.55 0.20 6.56 -1.90 -2.14 116.57 119.79 2qtz h LYS 591 Ca 0.23 -0.31 -0.11 0.00 -1.06 0.00 0.00 60.65 59.40 2qtz h LYS 591 Cb 0.36 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 31.89 2qtz h LYS 591 CO -0.50 1.01 -0.09 1.49 -2.06 0.00 0.00 179.45 179.30 2qtz h GLU 592 N 0.97 1.03 -0.86 3.15 4.81 -1.74 -1.93 114.58 120.01 2qtz h GLU 592 Ca 0.18 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2qtz h GLU 592 Cb 0.49 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.76 2qtz h GLU 592 CO 0.02 1.06 0.53 -0.07 -0.73 0.00 0.00 179.01 179.83 2qtz h LEU 593 N 0.91 1.02 -0.76 1.64 3.38 -0.73 -0.43 115.31 120.34 2qtz h LEU 593 Ca 0.14 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2qtz h LEU 593 Cb 0.66 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 2qtz h LEU 593 CO 0.05 0.78 0.49 -0.09 0.09 0.00 0.00 178.44 179.76 2qtz h ARG 594 N 1.18 1.00 -0.13 1.13 2.43 -1.14 -0.68 114.38 118.17 2qtz h ARG 594 Ca 0.31 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.43 2qtz h ARG 594 Cb -0.07 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.24 2qtz h ARG 594 CO -0.06 0.67 0.05 1.25 -1.51 0.00 0.00 179.97 180.37 2qtz h HIS 595 N 1.03 0.09 -0.84 2.20 2.76 -0.70 0.77 115.15 120.46 2qtz h HIS 595 Ca 0.28 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.52 2qtz h HIS 595 Cb -0.11 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 28.77 2qtz h HIS 595 CO -0.02 0.05 0.52 0.74 -1.30 0.00 0.00 177.93 177.92 2qtz h PHE 596 N 0.12 0.96 -0.32 5.26 0.04 -0.57 -1.49 116.94 120.93 2qtz h PHE 596 Ca 0.05 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.76 2qtz h PHE 596 Cb 0.02 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.86 2qtz h PHE 596 CO -0.10 0.48 -0.14 -0.07 -0.60 0.00 0.00 178.31 177.88 2qtz h LEU 597 N 0.94 0.68 -0.92 1.54 3.38 -0.84 -0.14 115.31 119.95 2qtz h LEU 597 Ca 0.37 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2qtz h LEU 597 Cb 0.18 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 2qtz h LEU 597 CO -0.18 0.93 0.61 0.50 0.09 0.00 0.00 178.44 180.39 2qtz h LYS 598 N 0.43 1.20 -0.16 1.13 3.64 -0.46 -1.92 116.57 120.43 2qtz h LYS 598 Ca 0.07 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2qtz h LYS 598 Cb 0.67 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2qtz h LYS 598 CO 0.04 0.79 0.00 0.72 -2.27 0.00 0.00 179.45 178.74 2qtz n HIS 599 N -4.45 0.20 -1.34 1.91 8.25 -0.60 -4.92 115.22 114.27 2qtz n HIS 599 Ca 0.11 -0.10 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 2qtz n HIS 599 Cb 0.03 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 2qtz n HIS 599 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qtz n GLY 600 N 0.98 0.88 0.10 -1.41 0.00 -0.72 -4.91 105.19 100.11 2qtz n GLY 600 Ca 0.13 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.28 2qtz n GLY 600 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qtz h ILE 601 N 0.00 1.04 -3.28 -0.61 2.04 -1.28 -3.43 117.51 112.00 2qtz h ILE 601 Ca -0.17 -2.18 -0.58 0.00 1.00 0.00 0.00 64.86 62.93 2qtz h ILE 601 Cb 0.59 2.37 -0.07 0.00 -0.74 0.00 0.00 36.82 38.97 2qtz h ILE 601 CO 0.24 0.35 0.45 -0.22 0.00 0.00 0.00 178.15 178.97 2qtz s LEU 602 N -7.94 4.15 -0.10 1.44 2.96 -0.88 -4.50 118.68 113.81 2qtz s LEU 602 Ca -0.27 1.17 -0.26 0.00 -0.22 0.00 0.00 54.13 54.55 2qtz s LEU 602 Cb 0.04 -3.26 -0.28 0.00 0.50 0.00 0.00 46.19 43.19 2qtz s LEU 602 CO 0.60 -0.45 0.82 0.74 -1.32 0.00 0.00 176.35 176.74 2qtz h THR 603 N 5.27 1.67 -3.80 3.68 2.02 -0.85 -3.38 112.91 117.52 2qtz h THR 603 Ca -0.27 -2.43 -0.24 0.00 0.77 0.00 0.00 66.41 64.24 2qtz h THR 603 Cb 1.12 3.31 -0.27 0.00 -1.74 0.00 0.00 68.15 70.56 2qtz h THR 603 CO 0.86 0.66 -0.72 -1.00 0.37 0.00 0.00 175.52 175.68 2qtz s HIS 604 N -2.31 0.13 -0.09 3.16 3.76 -1.01 -5.01 115.29 113.92 2qtz s HIS 604 Ca -0.17 -0.09 0.01 0.00 -0.15 0.00 0.00 55.06 54.66 2qtz s HIS 604 Cb -0.01 -0.08 0.02 0.00 1.11 0.00 0.00 32.58 33.61 2qtz s HIS 604 CO 0.75 -0.03 -0.12 -1.17 -0.85 0.00 0.00 174.74 173.33 2qtz s LEU 605 N -0.24 1.55 -0.18 0.89 2.96 -1.26 -1.31 118.68 121.09 2qtz s LEU 605 Ca -0.02 -0.34 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 2qtz s LEU 605 Cb -0.02 -0.91 0.04 0.00 0.50 0.00 0.00 46.19 45.80 2qtz s LEU 605 CO -0.00 -0.01 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.38 2qtz s LYS 606 N 1.03 1.94 -0.10 1.98 -0.14 -0.09 -5.00 119.74 119.36 2qtz s LYS 606 Ca -0.07 -0.73 0.02 0.00 -1.36 0.00 0.00 55.97 53.82 2qtz s LYS 606 Cb -0.15 -2.28 -0.02 0.00 -1.68 0.00 0.00 37.83 33.70 2qtz s LYS 606 CO -0.01 -0.40 -0.14 0.08 -0.76 0.00 0.00 175.35 174.11 2qtz s VAL 607 N 1.46 2.97 0.01 3.17 1.01 -1.26 -1.34 120.40 126.42 2qtz s VAL 607 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.30 2qtz s VAL 607 Cb -0.16 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 2qtz s VAL 607 CO -0.08 0.55 -0.07 -0.94 0.00 0.00 0.00 175.10 174.56 2qtz s SER 608 N -0.03 4.62 -0.25 3.32 1.04 -0.30 -4.96 113.70 117.14 2qtz s SER 608 Ca -0.04 -0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.26 2qtz s SER 608 Cb -0.14 -1.07 0.06 0.00 0.10 0.00 0.00 66.02 64.97 2qtz s SER 608 CO 0.04 0.27 -0.09 -0.36 0.98 0.00 0.00 173.24 174.08 2qtz s PHE 609 N -1.02 2.96 -0.41 5.02 0.08 -1.22 -1.46 117.98 121.93 2qtz s PHE 609 Ca 0.17 -2.11 0.24 0.00 0.12 0.00 0.00 56.93 55.35 2qtz s PHE 609 Cb -0.11 -1.81 0.44 0.00 -0.57 0.00 0.00 43.02 40.97 2qtz s PHE 609 CO 0.08 -0.84 1.65 0.66 -0.10 0.00 0.00 175.22 176.67 2qtz h SER 610 N 7.84 0.00 0.00 1.36 4.64 -0.92 -3.32 113.55 123.15 2qtz h SER 610 Ca -0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2qtz h SER 610 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2qtz h SER 610 CO 0.45 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.95 2qtz n ARG 611 N -3.05 2.09 -3.14 4.77 1.74 0.14 -4.98 116.66 114.22 2qtz n ARG 611 Ca 0.04 -1.21 -0.35 0.00 -0.77 0.00 0.00 57.85 55.56 2qtz n ARG 611 Cb 0.51 -0.90 -0.06 0.00 -1.02 0.00 0.00 32.46 30.99 2qtz n ARG 611 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qtz s ASP 612 N -0.72 6.92 0.57 0.55 1.01 -1.18 -4.95 116.67 118.87 2qtz s ASP 612 Ca 0.00 1.33 -0.15 0.00 0.71 0.00 0.00 52.55 54.44 2qtz s ASP 612 Cb 0.00 -2.39 -0.05 0.00 1.01 0.00 0.00 42.92 41.49 2qtz s ASP 612 CO 0.00 -0.06 1.02 0.00 0.21 0.00 0.00 175.17 176.34 2qtz s ALA 613 N -1.70 2.93 1.08 5.23 0.00 -1.26 -5.03 121.76 123.01 2qtz s ALA 613 Ca 0.47 0.20 -0.16 0.00 0.00 0.00 0.00 51.96 52.47 2qtz s ALA 613 Cb -0.14 -3.15 0.23 0.00 0.00 0.00 0.00 23.12 20.06 2qtz s ALA 613 CO 0.19 -0.58 1.13 -1.25 0.00 0.00 0.00 175.76 175.26 2qtz s PRO 614 N -4.32 -0.27 0.00 0.00 0.04 -1.26 -5.19 135.00 123.99 2qtz s PRO 614 Ca 0.60 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.73 2qtz s PRO 614 Cb -0.12 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.72 2qtz s PRO 614 CO 0.39 -3.11 0.00 -2.30 0.04 0.00 0.00 177.00 172.02 2qtz n PRO 621 N -4.36 0.00 -1.68 0.56 -0.02 -1.26 -5.32 135.00 122.92 2qtz n PRO 621 Ca 0.10 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 61.14 2qtz n PRO 621 Cb 0.59 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 34.03 2qtz n PRO 621 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qtz n ALA 622 N -1.42 1.65 -0.01 3.55 0.00 -1.26 -4.92 120.51 118.10 2qtz n ALA 622 Ca 0.00 0.32 -0.20 0.00 0.00 0.00 0.00 53.44 53.56 2qtz n ALA 622 Cb 0.00 -2.53 -0.14 0.00 0.00 0.00 0.00 19.45 16.78 2qtz n ALA 622 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2qtz h LYS 623 N 8.40 0.20 -5.51 0.00 3.64 -1.94 -3.22 116.57 118.14 2qtz h LYS 623 Ca -0.47 -0.34 -0.51 0.00 -1.27 0.00 0.00 60.65 58.06 2qtz h LYS 623 Cb 1.24 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 33.05 2qtz h LYS 623 CO 0.94 1.16 -0.66 0.71 -2.27 0.00 0.00 179.45 179.33 2qtz s TYR 624 N -2.42 2.03 0.35 1.91 2.02 -1.26 -3.18 117.35 116.80 2qtz s TYR 624 Ca -0.20 -0.72 0.05 0.00 -0.37 0.00 0.00 57.07 55.83 2qtz s TYR 624 Cb 0.03 -1.21 0.70 0.00 -0.40 0.00 0.00 41.96 41.09 2qtz s TYR 624 CO 0.75 0.28 1.96 -0.39 -1.57 0.00 0.00 175.55 176.58 2qtz h VAL 625 N 2.20 1.05 0.00 0.71 -1.51 -1.93 -1.78 116.25 114.99 2qtz h VAL 625 Ca -0.40 -0.27 -0.05 0.00 -1.23 0.00 0.00 66.70 64.74 2qtz h VAL 625 Cb 1.24 0.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.57 2qtz h VAL 625 CO 0.69 0.15 -0.26 0.06 -1.23 0.00 0.00 177.57 176.98 2qtz h GLN 626 N 0.80 0.00 -0.18 5.19 -0.00 -1.96 -0.40 115.11 118.56 2qtz h GLN 626 Ca 0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.95 2qtz h GLN 626 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.66 2qtz h GLN 626 CO -0.10 0.26 0.11 -0.44 -0.00 0.00 0.00 178.83 178.66 2qtz h ASP 627 N 0.00 0.21 -0.21 0.06 3.32 -1.73 -1.37 116.42 116.69 2qtz h ASP 627 Ca -0.00 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 2qtz h ASP 627 Cb 0.48 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 2qtz h ASP 627 CO 0.03 0.18 -0.19 0.78 -1.72 0.00 0.00 179.24 178.32 2qtz h ASN 628 N 0.22 0.66 -0.59 6.45 -0.26 -1.40 -2.51 115.58 118.13 2qtz h ASN 628 Ca 0.06 -0.22 0.01 0.00 -0.56 0.00 0.00 56.30 55.60 2qtz h ASN 628 Cb 0.01 -0.18 -0.03 0.00 -1.06 0.00 0.00 38.32 37.06 2qtz h ASN 628 CO -0.01 0.85 0.38 0.40 -1.06 0.00 0.00 177.43 177.99 2qtz h ILE 629 N 0.58 1.12 -0.62 2.81 2.04 -0.91 -2.60 117.51 119.93 2qtz h ILE 629 Ca 0.09 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2qtz h ILE 629 Cb 0.65 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 2qtz h ILE 629 CO 0.05 0.14 0.27 1.56 0.00 0.00 0.00 178.15 180.17 2qtz h GLN 630 N 0.78 0.90 0.00 2.37 4.20 -1.12 -1.98 115.11 120.26 2qtz h GLN 630 Ca 0.23 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2qtz h GLN 630 Cb -0.05 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.56 2qtz h GLN 630 CO -0.07 0.72 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.69 2qtz h LEU 631 N 0.89 0.00 -3.25 1.46 3.38 -1.10 -2.45 115.31 114.25 2qtz h LEU 631 Ca 0.21 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.02 2qtz h LEU 631 Cb 0.14 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 2qtz h LEU 631 CO -0.02 0.06 -0.39 1.41 0.09 0.00 0.00 178.44 179.58 2qtz n HIS 632 N -3.41 0.85 -0.22 1.13 8.25 -0.80 -4.80 115.22 116.22 2qtz n HIS 632 Ca -0.02 -1.69 0.06 0.00 -0.26 0.00 0.00 57.72 55.82 2qtz n HIS 632 Cb 0.19 -0.37 0.33 0.00 1.12 0.00 0.00 29.99 31.27 2qtz n HIS 632 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2qtz h GLY 633 N 1.21 1.05 0.92 -1.41 0.00 -0.89 -1.68 103.07 102.28 2qtz h GLY 633 Ca 0.14 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2qtz h GLY 633 CO 0.28 0.23 0.02 -1.61 0.00 0.00 0.00 176.54 175.45 2qtz h GLN 634 N 0.80 0.04 -0.60 4.80 4.15 -1.87 -0.55 115.11 121.89 2qtz h GLN 634 Ca 0.34 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.68 2qtz h GLN 634 Cb 0.29 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 2qtz h GLN 634 CO -0.12 0.11 0.08 1.96 -1.93 0.00 0.00 178.83 178.93 2qtz h GLN 635 N -0.04 1.00 0.01 1.69 4.20 -1.89 -2.30 115.11 117.79 2qtz h GLN 635 Ca 0.01 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 2qtz h GLN 635 Cb 0.08 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2qtz h GLN 635 CO -0.00 0.95 -0.01 0.28 -0.67 0.00 0.00 178.83 179.38 2qtz h VAL 636 N 0.90 1.01 -0.52 -0.54 2.07 -1.17 -1.20 116.25 116.80 2qtz h VAL 636 Ca 0.18 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.64 2qtz h VAL 636 Cb 0.45 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2qtz h VAL 636 CO 0.01 0.02 0.34 0.00 0.02 0.00 0.00 177.57 177.96 2qtz h ALA 637 N 0.94 0.66 -0.23 1.67 0.00 -1.06 -2.12 119.26 119.13 2qtz h ALA 637 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qtz h ALA 637 Cb 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qtz h ALA 637 CO 0.00 0.09 0.14 -0.09 0.00 0.00 0.00 179.25 179.40 2qtz h ARG 638 N 0.69 0.29 -0.30 0.00 2.43 -1.25 0.20 114.38 116.44 2qtz h ARG 638 Ca 0.19 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 2qtz h ARG 638 Cb -0.06 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.37 2qtz h ARG 638 CO -0.05 0.19 -0.05 0.82 -1.51 0.00 0.00 179.97 179.37 2qtz h ILE 639 N 0.30 0.73 -0.09 1.20 2.04 -1.11 0.16 117.51 120.74 2qtz h ILE 639 Ca 0.09 -0.01 -0.19 0.00 1.00 0.00 0.00 64.86 65.74 2qtz h ILE 639 Cb -0.02 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2qtz h ILE 639 CO -0.03 0.01 -0.74 -0.07 0.00 0.00 0.00 178.15 177.31 2qtz h LEU 640 N 0.03 0.59 0.00 1.44 3.38 -1.13 0.01 115.31 119.63 2qtz h LEU 640 Ca 0.14 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2qtz h LEU 640 Cb 0.21 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2qtz h LEU 640 CO -0.28 1.14 -1.72 0.18 0.09 0.00 0.00 178.44 177.86 2qtz n LEU 641 N -3.86 0.06 -0.00 1.67 4.77 0.68 -4.15 117.00 116.16 2qtz n LEU 641 Ca -0.05 -0.04 0.02 0.00 -0.03 0.00 0.00 56.01 55.91 2qtz n LEU 641 Cb 0.72 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.79 2qtz n LEU 641 CO 0.49 0.01 -0.47 0.00 -1.33 0.00 0.00 177.39 176.10 2qtz n GLN 642 N -2.05 0.86 -0.11 3.23 6.02 0.51 -4.79 117.38 121.06 2qtz n GLN 642 Ca -0.03 -0.02 0.04 0.00 -0.01 0.00 0.00 57.00 56.98 2qtz n GLN 642 Cb 0.44 -1.02 0.09 0.00 1.02 0.00 0.00 30.24 30.77 2qtz n GLN 642 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2qtz n GLU 643 N -1.54 2.79 -2.14 -1.09 1.02 -0.83 -4.98 120.64 113.87 2qtz n GLU 643 Ca -0.00 -1.91 -0.17 0.00 -0.02 0.00 0.00 57.16 55.05 2qtz n GLU 643 Cb 0.07 -1.21 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 2qtz n GLU 643 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2qtz n ASN 644 N -0.21 -5.12 -4.74 1.62 3.02 -1.16 -4.55 115.26 104.11 2qtz n ASN 644 Ca 0.07 0.09 -0.30 0.00 -0.03 0.00 0.00 54.58 54.41 2qtz n ASN 644 Cb 0.40 -4.20 0.12 0.00 -0.61 0.00 0.00 39.78 35.50 2qtz n ASN 644 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2qtz s GLY 645 N -2.35 1.62 0.05 7.41 0.00 -0.03 -4.80 107.32 109.23 2qtz s GLY 645 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 44.72 44.73 2qtz s GLY 645 CO 0.00 0.40 -0.15 0.30 0.00 0.00 0.00 173.10 173.65 2qtz s HIS 646 N -2.98 2.63 -0.02 1.90 3.76 -1.05 -4.72 115.29 114.81 2qtz s HIS 646 Ca 0.63 -0.21 0.06 0.00 -0.15 0.00 0.00 55.06 55.38 2qtz s HIS 646 Cb -0.17 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.04 2qtz s HIS 646 CO 0.56 0.31 -0.21 -1.50 -0.85 0.00 0.00 174.74 173.06 2qtz s ILE 647 N -1.00 1.64 -0.07 0.60 2.07 0.46 -1.17 121.20 123.74 2qtz s ILE 647 Ca 0.16 -0.87 0.03 0.00 -1.41 0.00 0.00 60.65 58.56 2qtz s ILE 647 Cb -0.11 -1.37 0.00 0.00 0.13 0.00 0.00 42.46 41.12 2qtz s ILE 647 CO 0.07 0.46 -0.17 -0.31 -1.91 0.00 0.00 174.94 173.09 2qtz s TYR 648 N -0.38 1.79 -0.11 3.50 2.02 -0.09 -1.05 117.35 123.03 2qtz s TYR 648 Ca 0.05 -0.63 0.01 0.00 -0.37 0.00 0.00 57.07 56.13 2qtz s TYR 648 Cb -0.09 -1.24 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 2qtz s TYR 648 CO 0.00 -0.27 -0.15 0.08 -1.57 0.00 0.00 175.55 173.64 2qtz s VAL 649 N 0.37 1.49 -0.02 0.71 1.01 -0.33 -0.42 120.40 123.21 2qtz s VAL 649 Ca -0.12 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.26 2qtz s VAL 649 Cb -0.15 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.86 2qtz s VAL 649 CO 0.04 0.44 -0.08 0.00 0.00 0.00 0.00 175.10 175.50 2qtz n GLY 651 N 3.24 -2.37 0.10 0.00 0.00 -0.81 -4.09 105.19 101.26 2qtz n GLY 651 Ca -0.18 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.48 2qtz n GLY 651 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2qtz h ASP 652 N 0.00 0.27 -3.36 1.61 3.58 -1.88 -1.33 116.42 115.31 2qtz h ASP 652 Ca 0.00 -0.27 -0.57 0.00 0.42 0.00 0.00 57.03 56.61 2qtz h ASP 652 Cb 0.00 -0.09 -0.07 0.00 1.72 0.00 0.00 39.33 40.90 2qtz h ASP 652 CO 0.00 1.15 0.02 0.00 -2.88 0.00 0.00 179.24 177.54 2qtz s ALA 653 N -2.88 3.41 0.35 -0.78 0.00 -1.26 -2.39 121.76 118.21 2qtz s ALA 653 Ca -0.03 -0.02 0.13 0.00 0.00 0.00 0.00 51.96 52.04 2qtz s ALA 653 Cb 0.09 -2.86 0.68 0.00 0.00 0.00 0.00 23.12 21.02 2qtz s ALA 653 CO 0.85 -0.14 1.79 0.87 0.00 0.00 0.00 175.76 179.14 2qtz h LYS 654 N 6.85 0.00 -0.29 0.00 6.56 -1.88 -2.89 116.57 124.92 2qtz h LYS 654 Ca -0.40 0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.23 2qtz h LYS 654 Cb 1.18 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.81 2qtz h LYS 654 CO 0.76 0.41 0.06 -0.91 -2.06 0.00 0.00 179.45 177.71 2qtz h ASN 655 N 0.00 0.03 -0.48 0.86 -0.26 -1.99 -1.10 115.58 112.64 2qtz h ASN 655 Ca -0.00 0.04 0.02 0.00 -0.56 0.00 0.00 56.30 55.80 2qtz h ASN 655 Cb 0.73 0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 38.02 2qtz h ASN 655 CO 0.05 0.05 0.30 -0.03 -1.06 0.00 0.00 177.43 176.74 2qtz h MET 656 N 0.18 0.58 -0.39 0.81 4.05 -1.93 -1.03 114.93 117.19 2qtz h MET 656 Ca 0.13 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.53 2qtz h MET 656 Cb 0.14 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 2qtz h MET 656 CO -0.17 0.38 0.25 0.00 0.23 0.00 0.00 176.91 177.60 2qtz h ALA 657 N 1.20 0.50 -0.56 0.39 0.00 -1.30 -0.49 119.26 118.99 2qtz h ALA 657 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2qtz h ALA 657 Cb -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2qtz h ALA 657 CO -0.07 -0.07 0.32 -0.22 0.00 0.00 0.00 179.25 179.21 2qtz h LYS 658 N 0.51 0.78 -0.51 0.00 3.64 -1.03 -0.94 116.57 119.01 2qtz h LYS 658 Ca 0.15 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 2qtz h LYS 658 Cb -0.04 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2qtz h LYS 658 CO -0.04 0.58 0.11 -0.44 -2.27 0.00 0.00 179.45 177.39 2qtz h ASP 659 N 0.76 0.73 -0.21 4.20 3.32 -0.80 0.64 116.42 125.06 2qtz h ASP 659 Ca 0.20 -0.13 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 2qtz h ASP 659 Cb 0.02 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2qtz h ASP 659 CO -0.03 0.72 -0.42 0.58 -1.72 0.00 0.00 179.24 178.36 2qtz h VAL 660 N 0.75 1.32 -0.36 -1.35 2.07 -0.91 -1.95 116.25 115.82 2qtz h VAL 660 Ca 0.17 -1.64 0.06 0.00 0.82 0.00 0.00 66.70 66.10 2qtz h VAL 660 Cb 0.29 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 2qtz h VAL 660 CO -0.00 0.52 0.07 -0.74 0.02 0.00 0.00 177.57 177.43 2qtz h HIS 661 N 0.36 0.11 -0.21 1.57 -0.00 -0.79 -1.24 115.15 114.96 2qtz h HIS 661 Ca 0.01 0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.32 2qtz h HIS 661 Cb 1.03 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.43 2qtz h HIS 661 CO 0.09 0.01 -0.21 -0.44 -0.00 0.00 0.00 177.93 177.38 2qtz h ASP 662 N 0.19 0.36 -0.52 3.26 3.32 -0.80 -1.23 116.42 121.00 2qtz h ASP 662 Ca 0.17 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2qtz h ASP 662 Cb 0.20 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2qtz h ASP 662 CO -0.23 0.58 0.20 0.00 -1.72 0.00 0.00 179.24 178.07 2qtz h ALA 663 N 1.46 0.68 -0.71 3.45 0.00 -1.06 -2.44 119.26 120.64 2qtz h ALA 663 Ca 0.06 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2qtz h ALA 663 Cb 0.56 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2qtz h ALA 663 CO 0.04 0.29 0.28 -0.07 0.00 0.00 0.00 179.25 179.79 2qtz h LEU 664 N 0.70 0.96 -0.54 0.00 3.38 -0.68 -0.96 115.31 118.18 2qtz h LEU 664 Ca 0.17 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2qtz h LEU 664 Cb 0.21 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 2qtz h LEU 664 CO -0.01 0.86 0.35 0.58 0.09 0.00 0.00 178.44 180.31 2qtz h VAL 665 N 1.03 1.13 -0.50 1.22 2.07 -0.99 -1.22 116.25 118.99 2qtz h VAL 665 Ca 0.24 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2qtz h VAL 665 Cb 0.20 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 2qtz h VAL 665 CO -0.02 0.13 0.21 1.56 0.02 0.00 0.00 177.57 179.47 2qtz h GLN 666 N 0.72 0.75 -0.29 1.57 4.20 -0.96 -1.73 115.11 119.36 2qtz h GLN 666 Ca 0.20 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2qtz h GLN 666 Cb -0.07 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 2qtz h GLN 666 CO -0.05 0.66 0.14 0.82 -0.67 0.00 0.00 178.83 179.73 2qtz h ILE 667 N 0.67 1.15 -0.29 2.54 2.04 -0.94 -0.35 117.51 122.33 2qtz h ILE 667 Ca 0.17 -0.44 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2qtz h ILE 667 Cb 0.18 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2qtz h ILE 667 CO -0.01 0.16 0.04 0.40 0.00 0.00 0.00 178.15 178.74 2qtz h ILE 668 N 0.34 1.23 -0.19 -0.67 2.04 -1.16 0.21 117.51 119.31 2qtz h ILE 668 Ca 0.10 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.20 2qtz h ILE 668 Cb 0.12 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 2qtz h ILE 668 CO -0.01 0.26 -0.07 -1.28 0.00 0.00 0.00 178.15 177.05 2qtz h SER 669 N 0.31 -0.26 -0.12 1.72 0.87 -1.20 -1.40 113.55 113.47 2qtz h SER 669 Ca 0.09 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2qtz h SER 669 Cb 0.35 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2qtz h SER 669 CO 0.01 -0.10 0.04 0.50 -0.53 0.00 0.00 176.83 176.75 2qtz h LYS 670 N -0.04 0.19 0.04 2.24 3.64 -0.91 -0.45 116.57 121.28 2qtz h LYS 670 Ca 0.10 -0.04 -0.23 0.00 -1.27 0.00 0.00 60.65 59.21 2qtz h LYS 670 Cb 0.19 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2qtz h LYS 670 CO -0.22 0.30 -1.02 0.93 -2.27 0.00 0.00 179.45 177.17 2qtz h GLU 671 N 0.03 0.29 0.00 1.90 4.39 -0.51 -3.23 114.58 117.46 2qtz h GLU 671 Ca 0.04 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.37 2qtz h GLU 671 Cb 0.19 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2qtz h GLU 671 CO -0.00 1.10 -1.33 0.28 -1.16 0.00 0.00 179.01 177.90 2qtz n VAL 672 N -3.64 0.23 -2.55 3.13 0.31 -0.53 -5.00 118.33 110.28 2qtz n VAL 672 Ca -0.06 -0.39 -0.06 0.00 -0.01 0.00 0.00 64.34 63.82 2qtz n VAL 672 Cb 0.89 0.04 0.02 0.00 -0.91 0.00 0.00 33.84 33.88 2qtz n VAL 672 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qtz n GLY 673 N 1.29 0.32 3.57 2.92 0.00 -0.22 -5.06 105.19 108.00 2qtz n GLY 673 Ca -0.00 -0.35 -0.26 0.00 0.00 0.00 0.00 46.02 45.42 2qtz n GLY 673 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qtz s VAL 674 N -3.10 2.36 0.63 1.61 -7.23 -0.92 -5.05 120.40 108.70 2qtz s VAL 674 Ca 0.06 -2.14 -0.17 0.00 -1.81 0.00 0.00 61.98 57.91 2qtz s VAL 674 Cb -0.02 -2.69 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 2qtz s VAL 674 CO 0.21 -0.20 1.19 -1.61 -0.31 0.00 0.00 175.10 174.38 2qtz s GLU 675 N -3.64 2.76 0.20 4.82 0.41 -1.26 -4.56 118.70 117.43 2qtz s GLU 675 Ca 0.33 1.74 -0.11 0.00 -0.41 0.00 0.00 54.97 56.52 2qtz s GLU 675 Cb 0.02 -1.91 0.26 0.00 -1.78 0.00 0.00 34.13 30.72 2qtz s GLU 675 CO 0.17 -1.35 1.69 -0.22 -0.49 0.00 0.00 175.26 175.06 2qtz h LYS 676 N 0.49 0.18 -0.54 1.61 3.64 -1.95 -1.12 116.57 118.87 2qtz h LYS 676 Ca -0.49 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 58.92 2qtz h LYS 676 Cb 1.29 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.02 2qtz h LYS 676 CO 0.54 0.12 0.28 1.25 -2.27 0.00 0.00 179.45 179.37 2qtz h LEU 677 N 0.18 0.41 -1.18 5.20 5.85 -1.99 -0.86 115.31 122.93 2qtz h LEU 677 Ca 0.30 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2qtz h LEU 677 Cb 0.45 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 2qtz h LEU 677 CO -0.43 0.28 0.21 -0.08 -0.34 0.00 0.00 178.44 178.07 2qtz h GLU 678 N 0.55 0.78 -0.62 1.25 4.81 -1.70 -1.83 114.58 117.81 2qtz h GLU 678 Ca 0.24 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 2qtz h GLU 678 Cb 0.14 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2qtz h GLU 678 CO -0.16 0.65 0.21 0.00 -0.73 0.00 0.00 179.01 178.98 2qtz h ALA 679 N 1.46 0.82 -0.38 2.92 0.00 -0.63 0.34 119.26 123.79 2qtz h ALA 679 Ca 0.18 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2qtz h ALA 679 Cb 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2qtz h ALA 679 CO -0.02 0.48 0.21 0.52 0.00 0.00 0.00 179.25 180.44 2qtz h MET 680 N 0.89 0.42 -0.34 0.00 2.86 -0.91 -2.12 114.93 115.74 2qtz h MET 680 Ca 0.20 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.74 2qtz h MET 680 Cb 0.27 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 2qtz h MET 680 CO -0.01 0.28 -0.12 0.87 1.06 0.00 0.00 176.91 178.99 2qtz h LYS 681 N 0.43 0.59 -0.24 1.72 1.57 -1.21 -1.75 116.57 117.70 2qtz h LYS 681 Ca 0.16 -0.18 0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2qtz h LYS 681 Cb 0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 2qtz h LYS 681 CO -0.09 0.70 0.05 1.15 -0.57 0.00 0.00 179.45 180.70 2qtz h THR 682 N 0.54 0.89 -0.41 -0.16 2.02 -0.44 -1.08 112.91 114.28 2qtz h THR 682 Ca 0.10 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 67.15 2qtz h THR 682 Cb 0.53 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 2qtz h THR 682 CO 0.03 0.03 -0.09 -0.07 0.37 0.00 0.00 175.52 175.79 2qtz h LEU 683 N 0.14 0.69 -0.75 2.58 3.38 -1.20 0.03 115.31 120.18 2qtz h LEU 683 Ca 0.11 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 2qtz h LEU 683 Cb 0.10 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 2qtz h LEU 683 CO -0.14 0.81 0.46 0.00 0.09 0.00 0.00 178.44 179.66 2qtz h ALA 684 N 1.26 0.96 -0.35 1.53 0.00 -0.97 -1.29 119.26 120.39 2qtz h ALA 684 Ca 0.12 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2qtz h ALA 684 Cb 0.53 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2qtz h ALA 684 CO 0.03 0.42 -0.36 1.15 0.00 0.00 0.00 179.25 180.49 2qtz h THR 685 N 1.02 1.28 -0.98 0.00 2.02 -0.64 -1.02 112.91 114.59 2qtz h THR 685 Ca 0.27 -1.52 0.05 0.00 0.77 0.00 0.00 66.41 65.98 2qtz h THR 685 Cb -0.05 1.39 -0.06 0.00 -1.74 0.00 0.00 68.15 67.70 2qtz h THR 685 CO -0.05 0.50 0.64 -0.07 0.37 0.00 0.00 175.52 176.91 2qtz h LEU 686 N 0.66 1.05 -0.28 2.58 3.38 -0.67 0.81 115.31 122.85 2qtz h LEU 686 Ca 0.06 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 2qtz h LEU 686 Cb 0.91 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2qtz h LEU 686 CO 0.08 0.70 0.02 0.11 0.09 0.00 0.00 178.44 179.44 2qtz h LYS 687 N 1.21 0.48 -0.33 1.13 1.57 -0.97 0.04 116.57 119.69 2qtz h LYS 687 Ca 0.41 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2qtz h LYS 687 Cb 0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2qtz h LYS 687 CO -0.14 0.61 0.19 0.93 -0.57 0.00 0.00 179.45 180.47 2qtz h GLU 688 N 0.28 0.45 -0.02 3.15 4.39 -0.71 -0.99 114.58 121.13 2qtz h GLU 688 Ca 0.08 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2qtz h GLU 688 Cb 0.38 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2qtz h GLU 688 CO 0.01 0.32 0.00 0.39 -1.16 0.00 0.00 179.01 178.57 2qtz n GLU 689 N -4.46 1.16 -2.41 2.33 1.02 0.24 -4.91 120.64 113.61 2qtz n GLU 689 Ca 0.02 -0.24 -0.17 0.00 -0.02 0.00 0.00 57.16 56.75 2qtz n GLU 689 Cb 0.09 -1.43 -0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2qtz n GLU 689 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qtz n LYS 690 N -0.66 -1.75 0.00 3.49 4.76 -0.38 -4.90 118.16 118.73 2qtz n LYS 690 Ca 0.20 0.82 0.07 0.00 -2.87 0.00 0.00 58.31 56.53 2qtz n LYS 690 Cb 0.15 -5.29 0.04 0.00 -1.84 0.00 0.00 35.03 28.10 2qtz n LYS 690 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qtz n ARG 691 N -2.76 1.26 -3.76 1.97 1.74 -0.06 -4.79 116.66 110.26 2qtz n ARG 691 Ca -0.19 -1.20 -0.29 0.00 -0.77 0.00 0.00 57.85 55.40 2qtz n ARG 691 Cb 0.65 -1.26 -0.15 0.00 -1.02 0.00 0.00 32.46 30.67 2qtz n ARG 691 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2qtz s TYR 692 N -1.36 1.65 0.05 -1.55 6.04 -1.11 -0.40 117.35 120.67 2qtz s TYR 692 Ca 0.16 -1.54 0.06 0.00 0.04 0.00 0.00 57.07 55.78 2qtz s TYR 692 Cb 0.12 -1.55 -0.04 0.00 -1.04 0.00 0.00 41.96 39.45 2qtz s TYR 692 CO 0.23 -0.80 -0.11 -0.51 -1.54 0.00 0.00 175.55 172.81 2qtz s LEU 693 N 1.64 2.94 -0.01 6.97 1.43 -0.22 -4.29 118.68 127.15 2qtz s LEU 693 Ca 0.05 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2qtz s LEU 693 Cb -0.17 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.31 2qtz s LEU 693 CO -0.19 0.24 -0.13 -1.10 0.23 0.00 0.00 176.35 175.40 2qtz s GLN 694 N -1.70 1.06 -0.44 1.70 -0.21 -1.26 -1.19 119.66 117.62 2qtz s GLN 694 Ca 0.18 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 55.11 2qtz s GLN 694 Cb -0.11 -1.02 0.14 0.00 1.00 0.00 0.00 33.01 33.02 2qtz s GLN 694 CO 0.09 0.28 0.25 0.34 -2.12 0.00 0.00 175.29 174.13 2qtz s ASP 695 N -0.32 3.56 -0.13 5.90 2.15 0.42 -4.96 116.67 123.28 2qtz s ASP 695 Ca 0.05 -2.64 -0.04 0.00 0.43 0.00 0.00 52.55 50.35 2qtz s ASP 695 Cb -0.05 -0.98 -0.03 0.00 -0.30 0.00 0.00 42.92 41.55 2qtz s ASP 695 CO -0.00 -0.26 0.00 -0.63 -0.17 0.00 0.00 175.17 174.11 2qtz s ILE 696 N 0.34 4.28 -1.29 4.11 -1.09 -1.26 -1.93 121.20 124.37 2qtz s ILE 696 Ca 0.18 -0.24 0.21 0.00 -2.23 0.00 0.00 60.65 58.57 2qtz s ILE 696 Cb -0.23 -2.85 -0.15 0.00 -1.58 0.00 0.00 42.46 37.65 2qtz s ILE 696 CO -0.01 0.54 0.92 0.79 -1.23 0.00 0.00 174.94 175.95 2qtz n TRP 697 N 2.89 0.00 -1.12 3.97 8.01 -0.50 -4.97 117.44 125.71 2qtz n TRP 697 Ca -0.18 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.01 2qtz n TRP 697 Cb 0.53 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.83 2qtz n TRP 697 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13