#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g5c n VAL 234 N 0.00 0.63 1.22 3.53 3.14 -1.26 -4.19 118.33 121.39 3g5c n VAL 234 Ca 0.00 -0.59 0.13 0.00 -2.96 0.00 0.00 64.34 60.92 3g5c n VAL 234 Cb 0.00 -0.25 0.28 0.00 -1.06 0.00 0.00 33.84 32.81 3g5c n VAL 234 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 3g5c n GLU 235 N -2.41 1.49 0.01 1.45 0.28 -1.26 -3.87 120.64 116.34 3g5c n GLU 235 Ca -0.16 -1.06 0.06 0.00 -0.16 0.00 0.00 57.16 55.84 3g5c n GLU 235 Cb 0.79 -1.48 -0.11 0.00 1.43 0.00 0.00 31.44 32.07 3g5c n GLU 235 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3g5c n GLU 236 N 0.17 0.64 -1.80 3.44 1.02 -1.26 -4.96 120.64 117.89 3g5c n GLU 236 Ca 0.14 -0.03 -0.33 0.00 -0.02 0.00 0.00 57.16 56.92 3g5c n GLU 236 Cb 0.43 -1.64 0.04 0.00 -0.02 0.00 0.00 31.44 30.25 3g5c n GLU 236 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3g5c s GLU 237 N -3.25 2.87 -0.02 3.49 2.02 -1.25 -4.94 118.70 117.62 3g5c s GLU 237 Ca -0.06 1.37 -0.27 0.00 0.02 0.00 0.00 54.97 56.03 3g5c s GLU 237 Cb 0.11 -1.96 -0.03 0.00 0.10 0.00 0.00 34.13 32.34 3g5c s GLU 237 CO 0.85 -1.19 0.86 0.99 0.02 0.00 0.00 175.26 176.80 3g5c s THR 238 N -2.35 4.92 0.10 3.63 2.01 -1.26 -4.90 115.64 117.78 3g5c s THR 238 Ca 0.67 1.81 0.01 0.00 0.31 0.00 0.00 61.69 64.48 3g5c s THR 238 Cb -0.20 -4.21 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 3g5c s THR 238 CO 0.41 0.21 0.25 -0.54 -0.69 0.00 0.00 174.62 174.25 3g5c s LYS 239 N 0.85 3.45 -0.16 4.92 3.01 -0.69 -4.88 119.74 126.24 3g5c s LYS 239 Ca 0.46 -0.47 -0.02 0.00 -1.01 0.00 0.00 55.97 54.92 3g5c s LYS 239 Cb -0.20 -3.00 0.05 0.00 -1.01 0.00 0.00 37.83 33.67 3g5c s LYS 239 CO 0.24 0.57 0.03 0.71 0.51 0.00 0.00 175.35 177.40 3g5c s TYR 240 N -1.61 0.91 -0.58 3.18 1.51 0.05 0.15 117.35 120.98 3g5c s TYR 240 Ca 0.35 -0.65 -0.20 0.00 -1.01 0.00 0.00 57.07 55.56 3g5c s TYR 240 Cb -0.12 -0.96 0.08 0.00 -0.11 0.00 0.00 41.96 40.85 3g5c s TYR 240 CO 0.28 -0.53 0.73 0.42 -1.11 0.00 0.00 175.55 175.34 3g5c s ILE 241 N 1.89 4.75 -0.37 2.71 1.01 0.34 -4.46 121.20 127.07 3g5c s ILE 241 Ca 0.01 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.64 3g5c s ILE 241 Cb -0.16 -4.47 -0.00 0.00 0.01 0.00 0.00 42.46 37.85 3g5c s ILE 241 CO -0.07 -1.08 1.55 -1.61 0.00 0.00 0.00 174.94 173.73 3g5c s GLU 242 N 2.90 3.51 -0.08 2.79 2.02 -1.26 -1.19 118.70 127.38 3g5c s GLU 242 Ca 0.14 1.14 0.02 0.00 0.02 0.00 0.00 54.97 56.30 3g5c s GLU 242 Cb -0.21 -4.08 -0.02 0.00 0.10 0.00 0.00 34.13 29.91 3g5c s GLU 242 CO 0.09 -1.65 -0.13 -1.17 0.02 0.00 0.00 175.26 172.42 3g5c s LEU 243 N 5.91 2.78 -0.08 1.80 2.96 0.17 -0.00 118.68 132.22 3g5c s LEU 243 Ca 0.68 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 3g5c s LEU 243 Cb -0.17 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 3g5c s LEU 243 CO 0.33 0.28 -0.09 -0.32 -1.32 0.00 0.00 176.35 175.22 3g5c s MET 244 N -0.34 2.82 -0.09 1.98 -2.45 -0.38 -0.83 119.30 120.01 3g5c s MET 244 Ca 0.03 -0.60 0.04 0.00 -1.25 0.00 0.00 55.69 53.91 3g5c s MET 244 Cb -0.13 -2.56 -0.01 0.00 1.25 0.00 0.00 34.83 33.39 3g5c s MET 244 CO 0.02 0.57 -0.21 0.42 1.05 0.00 0.00 175.02 176.88 3g5c s ILE 245 N -0.57 2.38 -0.20 10.11 -1.09 -1.00 -0.92 121.20 129.91 3g5c s ILE 245 Ca 0.08 -0.93 -0.02 0.00 -2.23 0.00 0.00 60.65 57.56 3g5c s ILE 245 Cb -0.12 -1.92 -0.00 0.00 -1.58 0.00 0.00 42.46 38.84 3g5c s ILE 245 CO 0.02 0.56 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.49 3g5c s VAL 246 N 0.06 2.92 -0.23 2.92 1.01 -0.00 -1.95 120.40 125.14 3g5c s VAL 246 Ca -0.09 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 3g5c s VAL 246 Cb -0.15 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 3g5c s VAL 246 CO 0.06 0.47 0.22 0.20 0.00 0.00 0.00 175.10 176.05 3g5c s ASN 247 N 1.26 6.21 0.93 3.32 -0.87 -0.26 0.24 114.94 125.77 3g5c s ASN 247 Ca 0.03 0.23 -0.14 0.00 -1.57 0.00 0.00 52.86 51.41 3g5c s ASN 247 Cb -0.14 -2.14 0.18 0.00 -0.02 0.00 0.00 41.25 39.13 3g5c s ASN 247 CO -0.05 0.04 1.28 1.51 -2.57 0.00 0.00 177.10 177.31 3g5c s ASP 248 N 0.99 3.34 0.31 -1.22 -4.77 -1.08 -0.33 116.67 113.91 3g5c s ASP 248 Ca 0.11 0.25 0.02 0.00 -3.30 0.00 0.00 52.55 49.63 3g5c s ASP 248 Cb -0.14 -0.36 0.53 0.00 -1.09 0.00 0.00 42.92 41.86 3g5c s ASP 248 CO 0.05 -2.59 1.85 -0.74 0.70 0.00 0.00 175.17 174.44 3g5c h HIS 249 N -1.49 0.64 0.00 2.11 -0.00 -1.83 -1.92 115.15 112.65 3g5c h HIS 249 Ca -0.44 -0.07 -0.11 0.00 -0.00 0.00 0.00 60.37 59.76 3g5c h HIS 249 Cb 1.24 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 28.46 3g5c h HIS 249 CO -0.95 0.60 -0.51 -0.07 -0.00 0.00 0.00 177.93 177.00 3g5c h LEU 250 N 0.59 0.00 -0.66 0.26 4.07 -1.94 -1.09 115.31 116.54 3g5c h LEU 250 Ca 0.13 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.94 3g5c h LEU 250 Cb 0.34 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 3g5c h LEU 250 CO 0.01 0.51 -0.51 -0.03 -1.08 0.00 0.00 178.44 177.33 3g5c h MET 251 N 0.00 0.40 -0.18 1.13 1.85 -1.71 -2.53 114.93 113.89 3g5c h MET 251 Ca -0.01 -0.24 -0.15 0.00 -0.61 0.00 0.00 59.70 58.70 3g5c h MET 251 Cb 0.92 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.97 3g5c h MET 251 CO 0.07 0.82 -0.51 0.35 -0.40 0.00 0.00 176.91 177.24 3g5c h PHE 252 N 0.32 0.62 0.00 1.39 3.57 -0.94 -3.01 116.94 118.89 3g5c h PHE 252 Ca 0.01 -0.21 -0.07 0.00 3.53 0.00 0.00 57.97 61.23 3g5c h PHE 252 Cb 1.01 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 3g5c h PHE 252 CO 0.03 0.91 -0.32 0.87 -2.23 0.00 0.00 178.31 177.57 3g5c h LYS 253 N 0.40 0.00 0.00 1.11 1.57 -1.17 -2.87 116.57 115.61 3g5c h LYS 253 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3g5c h LYS 253 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.34 3g5c h LYS 253 CO 0.09 0.32 0.00 1.63 -0.57 0.00 0.00 179.45 180.93 3g5c n LYS 254 N -3.38 0.00 -2.44 3.15 4.76 -0.96 -3.25 118.16 116.05 3g5c n LYS 254 Ca 0.01 0.24 -0.16 0.00 -2.87 0.00 0.00 58.31 55.53 3g5c n LYS 254 Cb 0.53 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 32.24 3g5c n LYS 254 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 3g5c n HIS 255 N -1.50 2.27 -3.90 2.13 8.25 -1.14 -4.99 115.22 116.34 3g5c n HIS 255 Ca 0.04 -2.49 -0.29 0.00 -0.26 0.00 0.00 57.72 54.72 3g5c n HIS 255 Cb 0.17 -0.26 0.02 0.00 1.12 0.00 0.00 29.99 31.04 3g5c n HIS 255 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3g5c n ARG 256 N -0.53 -5.14 -3.71 -0.41 5.12 -1.20 -1.90 116.66 108.89 3g5c n ARG 256 Ca 0.28 0.58 -0.28 0.00 -1.93 0.00 0.00 57.85 56.49 3g5c n ARG 256 Cb 0.83 -5.35 0.01 0.00 -1.16 0.00 0.00 32.46 26.79 3g5c n ARG 256 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3g5c n LEU 257 N -4.57 -2.03 -4.28 0.55 7.99 -1.10 -4.96 117.00 108.60 3g5c n LEU 257 Ca -0.04 -0.65 -0.34 0.00 -0.01 0.00 0.00 56.01 54.97 3g5c n LEU 257 Cb 0.56 -2.33 -0.14 0.00 -0.11 0.00 0.00 43.42 41.39 3g5c n LEU 257 CO 0.75 0.31 -0.43 -0.55 -1.51 0.00 0.00 177.39 175.96 3g5c s SER 258 N -3.04 4.00 0.11 -1.43 0.15 -0.80 -5.01 113.70 107.67 3g5c s SER 258 Ca 0.56 -0.43 -0.13 0.00 0.70 0.00 0.00 55.95 56.65 3g5c s SER 258 Cb -0.29 -1.66 -0.10 0.00 -1.71 0.00 0.00 66.02 62.26 3g5c s SER 258 CO 0.69 0.02 1.38 0.58 1.20 0.00 0.00 173.24 177.12 3g5c h VAL 259 N 5.69 1.29 -0.58 4.45 2.07 -1.93 -2.84 116.25 124.40 3g5c h VAL 259 Ca -0.39 -1.68 -0.07 0.00 0.82 0.00 0.00 66.70 65.38 3g5c h VAL 259 Cb 1.17 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.62 3g5c h VAL 259 CO 0.60 0.54 0.09 1.62 0.02 0.00 0.00 177.57 180.43 3g5c h VAL 260 N 0.53 1.25 0.09 2.57 3.04 -1.96 -2.34 116.25 119.43 3g5c h VAL 260 Ca 0.01 -0.97 -0.00 0.00 -1.01 0.00 0.00 66.70 64.73 3g5c h VAL 260 Cb 1.09 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 3g5c h VAL 260 CO 0.11 0.36 -0.04 0.45 -1.01 0.00 0.00 177.57 177.43 3g5c h HIS 261 N 0.89 -0.12 -0.52 3.17 -0.00 -1.89 -2.43 115.15 114.26 3g5c h HIS 261 Ca 0.18 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.58 3g5c h HIS 261 Cb 0.40 0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.82 3g5c h HIS 261 CO 0.03 0.16 0.30 1.79 -0.00 0.00 0.00 177.93 180.21 3g5c h THR 262 N -0.39 1.04 -0.37 2.45 1.35 -1.46 0.77 112.91 116.29 3g5c h THR 262 Ca -0.01 -0.21 -0.08 0.00 -0.55 0.00 0.00 66.41 65.56 3g5c h THR 262 Cb 0.33 0.39 -0.01 0.00 -1.73 0.00 0.00 68.15 67.13 3g5c h THR 262 CO 0.02 0.11 -0.09 0.78 -0.25 0.00 0.00 175.52 176.10 3g5c h ASN 263 N 0.60 0.71 0.58 5.36 2.35 -1.47 -0.70 115.58 123.01 3g5c h ASN 263 Ca 0.21 -0.36 -0.11 0.00 -0.55 0.00 0.00 56.30 55.49 3g5c h ASN 263 Cb 0.04 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3g5c h ASN 263 CO -0.10 0.91 -0.54 0.71 -1.65 0.00 0.00 177.43 176.76 3g5c h THR 264 N 0.51 1.34 -0.37 2.81 1.35 -1.33 -1.78 112.91 115.44 3g5c h THR 264 Ca 0.09 -1.86 -0.15 0.00 -0.55 0.00 0.00 66.41 63.94 3g5c h THR 264 Cb 0.59 2.01 -0.01 0.00 -1.73 0.00 0.00 68.15 69.02 3g5c h THR 264 CO 0.04 0.52 -0.36 0.22 -0.25 0.00 0.00 175.52 175.69 3g5c h TYR 265 N 0.00 1.04 -0.00 4.73 3.20 -0.67 -2.81 116.97 122.46 3g5c h TYR 265 Ca -0.01 -0.30 -0.14 0.00 3.14 0.00 0.00 58.73 61.43 3g5c h TYR 265 Cb 0.97 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 3g5c h TYR 265 CO 0.00 1.10 -0.68 0.00 -1.64 0.00 0.00 178.16 176.94 3g5c h ALA 266 N 0.87 0.88 -0.36 1.82 0.00 -0.98 -2.91 119.26 118.58 3g5c h ALA 266 Ca 0.07 -0.61 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 3g5c h ALA 266 Cb 0.93 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3g5c h ALA 266 CO 0.09 0.84 -0.06 0.87 0.00 0.00 0.00 179.25 180.99 3g5c h LYS 267 N 0.01 0.59 -0.49 0.00 1.57 -1.27 -2.12 116.57 114.85 3g5c h LYS 267 Ca -0.01 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 3g5c h LYS 267 Cb 1.20 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 3g5c h LYS 267 CO 0.09 0.65 0.06 0.77 -0.57 0.00 0.00 179.45 180.45 3g5c h SER 268 N 0.55 0.80 -0.44 0.86 0.02 -1.31 0.17 113.55 114.20 3g5c h SER 268 Ca 0.11 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 60.76 3g5c h SER 268 Cb 0.44 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 3g5c h SER 268 CO 0.02 0.87 0.19 0.58 -1.14 0.00 0.00 176.83 177.35 3g5c h VAL 269 N 0.70 1.20 -0.53 2.27 2.07 -1.35 -1.52 116.25 119.08 3g5c h VAL 269 Ca 0.15 -0.59 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 3g5c h VAL 269 Cb 0.43 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3g5c h VAL 269 CO 0.01 0.22 0.06 0.58 0.02 0.00 0.00 177.57 178.46 3g5c h VAL 270 N 0.57 1.26 -0.78 2.57 2.07 -1.27 -2.03 116.25 118.64 3g5c h VAL 270 Ca 0.15 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.66 3g5c h VAL 270 Cb 0.17 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 3g5c h VAL 270 CO -0.01 0.36 0.50 -1.13 0.02 0.00 0.00 177.57 177.31 3g5c h ASN 271 N 0.78 0.92 -0.06 0.57 -0.73 -0.43 0.13 115.58 116.76 3g5c h ASN 271 Ca 0.16 -0.04 -0.18 0.00 1.87 0.00 0.00 56.30 58.11 3g5c h ASN 271 Cb 0.45 -0.23 -0.00 0.00 0.27 0.00 0.00 38.32 38.81 3g5c h ASN 271 CO 0.02 0.68 -0.61 0.24 -0.37 0.00 0.00 177.43 177.39 3g5c h MET 272 N 1.07 0.66 -0.05 6.67 2.86 -1.24 -2.34 114.93 122.57 3g5c h MET 272 Ca 0.28 -0.45 -0.08 0.00 -2.06 0.00 0.00 59.70 57.40 3g5c h MET 272 Cb -0.09 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 3g5c h MET 272 CO -0.06 1.07 -0.34 0.00 1.06 0.00 0.00 176.91 178.64 3g5c h ALA 273 N 0.83 1.35 -0.09 6.32 0.00 -1.06 -2.82 119.26 123.79 3g5c h ALA 273 Ca -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3g5c h ALA 273 Cb 1.18 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3g5c h ALA 273 CO 0.12 0.47 0.01 0.22 0.00 0.00 0.00 179.25 180.07 3g5c h ASP 274 N 0.08 0.15 -0.72 0.00 1.82 -0.56 -2.56 116.42 114.63 3g5c h ASP 274 Ca 0.01 -0.28 0.12 0.00 -0.39 0.00 0.00 57.03 56.48 3g5c h ASP 274 Cb 0.64 -0.04 -0.05 0.00 0.68 0.00 0.00 39.33 40.56 3g5c h ASP 274 CO 0.05 0.40 0.48 -0.07 -1.61 0.00 0.00 179.24 178.48 3g5c h LEU 275 N -0.10 0.47 -0.22 2.28 3.38 -1.21 1.02 115.31 120.93 3g5c h LEU 275 Ca 0.03 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 3g5c h LEU 275 Cb 0.32 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3g5c h LEU 275 CO 0.00 0.27 -0.21 0.40 0.09 0.00 0.00 178.44 178.99 3g5c h ILE 276 N 0.51 1.32 -0.06 1.22 2.04 -1.46 -3.29 117.51 117.79 3g5c h ILE 276 Ca 0.34 -1.37 -0.20 0.00 1.00 0.00 0.00 64.86 64.63 3g5c h ILE 276 Cb 0.63 1.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.43 3g5c h ILE 276 CO -0.11 0.42 -0.80 1.88 0.00 0.00 0.00 178.15 179.54 3g5c h TYR 277 N 0.21 0.59 -0.69 1.37 -1.99 -0.77 -3.27 116.97 112.42 3g5c h TYR 277 Ca 0.04 -0.28 0.15 0.00 2.00 0.00 0.00 58.73 60.63 3g5c h TYR 277 Cb 0.76 -0.08 -0.11 0.00 2.00 0.00 0.00 36.73 39.30 3g5c h TYR 277 CO 0.08 1.06 0.11 -0.22 -0.00 0.00 0.00 178.16 179.19 3g5c h LYS 278 N 0.28 0.21 0.00 4.88 3.64 0.16 -2.65 116.57 123.09 3g5c h LYS 278 Ca -0.05 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 3g5c h LYS 278 Cb 1.39 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.16 3g5c h LYS 278 CO 0.14 0.14 -0.65 0.22 -2.27 0.00 0.00 179.45 177.03 3g5c h ASP 279 N 0.21 0.00 -0.12 4.20 3.58 -1.70 -3.34 116.42 119.25 3g5c h ASP 279 Ca 0.38 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.70 3g5c h ASP 279 Cb 0.64 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 3g5c h ASP 279 CO -0.52 0.90 0.01 1.56 -2.88 0.00 0.00 179.24 178.32 3g5c h GLN 280 N -1.00 0.20 -0.02 0.28 4.20 -1.63 -3.24 115.11 113.90 3g5c h GLN 280 Ca -0.07 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3g5c h GLN 280 Cb 0.66 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3g5c h GLN 280 CO -0.04 0.42 -0.15 1.28 -0.67 0.00 0.00 178.83 179.66 3g5c n LEU 281 N -4.82 2.25 -3.82 1.46 4.77 -1.02 -4.95 117.00 110.87 3g5c n LEU 281 Ca -0.06 -0.76 -0.29 0.00 -0.03 0.00 0.00 56.01 54.88 3g5c n LEU 281 Cb 0.18 -0.01 0.04 0.00 -2.33 0.00 0.00 43.42 41.30 3g5c n LEU 281 CO 0.35 0.39 0.14 1.17 -1.33 0.00 0.00 177.39 178.11 3g5c n LYS 282 N 0.55 -6.15 -4.19 3.23 4.81 -1.13 -4.87 118.16 110.42 3g5c n LYS 282 Ca 0.14 0.66 -0.16 0.00 -0.87 0.00 0.00 58.31 58.08 3g5c n LYS 282 Cb 0.49 -5.60 -0.13 0.00 0.02 0.00 0.00 35.03 29.81 3g5c n LYS 282 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3g5c s THR 283 N -3.30 0.58 -0.06 3.15 2.01 -1.07 -1.71 115.64 115.24 3g5c s THR 283 Ca 0.64 -0.58 0.03 0.00 0.31 0.00 0.00 61.69 62.10 3g5c s THR 283 Cb -0.31 -0.54 -0.02 0.00 0.01 0.00 0.00 72.50 71.64 3g5c s THR 283 CO 0.79 -0.02 -0.15 -0.13 -0.69 0.00 0.00 174.62 174.42 3g5c s ARG 284 N -0.66 2.65 -0.50 4.92 1.81 0.12 -2.09 118.95 125.20 3g5c s ARG 284 Ca -0.01 -0.72 -0.17 0.00 -1.72 0.00 0.00 55.73 53.11 3g5c s ARG 284 Cb -0.05 -2.40 0.08 0.00 -0.45 0.00 0.00 34.95 32.13 3g5c s ARG 284 CO 0.00 0.53 0.50 0.42 -0.68 0.00 0.00 175.30 176.07 3g5c s ILE 285 N -0.48 5.10 -0.27 1.52 -1.09 -1.26 -0.51 121.20 124.22 3g5c s ILE 285 Ca 0.06 -0.99 -0.08 0.00 -2.23 0.00 0.00 60.65 57.41 3g5c s ILE 285 Cb -0.12 -4.24 -0.02 0.00 -1.58 0.00 0.00 42.46 36.50 3g5c s ILE 285 CO 0.02 -0.73 0.09 -0.69 -1.23 0.00 0.00 174.94 172.39 3g5c s VAL 286 N 1.97 4.37 -0.32 2.92 1.01 -0.33 -4.78 120.40 125.23 3g5c s VAL 286 Ca 0.07 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 3g5c s VAL 286 Cb -0.24 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.06 3g5c s VAL 286 CO 0.07 0.27 1.17 -0.22 0.00 0.00 0.00 175.10 176.39 3g5c s LEU 287 N 1.61 3.89 -0.12 3.92 2.96 -1.26 0.41 118.68 130.09 3g5c s LEU 287 Ca 0.06 1.06 0.14 0.00 -0.22 0.00 0.00 54.13 55.17 3g5c s LEU 287 Cb -0.16 -3.54 -0.20 0.00 0.50 0.00 0.00 46.19 42.79 3g5c s LEU 287 CO 0.04 -0.99 0.12 1.33 -1.32 0.00 0.00 176.35 175.53 3g5c n VAL 288 N 6.08 0.79 -3.74 1.68 0.24 -0.01 -3.88 118.33 119.50 3g5c n VAL 288 Ca 0.13 -0.57 -0.10 0.00 -2.04 0.00 0.00 64.34 61.76 3g5c n VAL 288 Cb 0.47 -0.44 -0.06 0.00 -1.47 0.00 0.00 33.84 32.35 3g5c n VAL 288 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3g5c s ALA 289 N -2.53 -0.62 -0.26 2.33 0.00 -1.20 -4.75 121.76 114.73 3g5c s ALA 289 Ca -0.07 -0.31 -0.25 0.00 0.00 0.00 0.00 51.96 51.32 3g5c s ALA 289 Cb 0.06 0.64 0.09 0.00 0.00 0.00 0.00 23.12 23.90 3g5c s ALA 289 CO 0.62 -0.60 0.83 1.41 0.00 0.00 0.00 175.76 178.02 3g5c s MET 290 N -3.84 0.73 0.04 0.00 1.75 -1.26 -2.39 119.30 114.33 3g5c s MET 290 Ca 0.05 0.82 0.02 0.00 -1.25 0.00 0.00 55.69 55.33 3g5c s MET 290 Cb 0.03 0.36 -0.02 0.00 2.84 0.00 0.00 34.83 38.03 3g5c s MET 290 CO -0.10 -0.10 -0.08 -1.83 -0.65 0.00 0.00 175.02 172.26 3g5c s GLU 291 N 0.25 0.52 -0.08 4.11 -1.05 -0.82 -4.99 118.70 116.63 3g5c s GLU 291 Ca 0.01 -0.70 0.02 0.00 -0.15 0.00 0.00 54.97 54.14 3g5c s GLU 291 Cb -0.05 -0.31 0.02 0.00 -0.44 0.00 0.00 34.13 33.35 3g5c s GLU 291 CO -0.01 0.06 -0.12 0.99 0.95 0.00 0.00 175.26 177.12 3g5c s THR 292 N -1.26 1.19 -1.10 1.83 2.01 -1.26 -1.11 115.64 115.94 3g5c s THR 292 Ca -0.09 -0.48 -0.21 0.00 0.31 0.00 0.00 61.69 61.22 3g5c s THR 292 Cb -0.09 -1.10 0.07 0.00 0.01 0.00 0.00 72.50 71.38 3g5c s THR 292 CO 0.00 0.37 1.51 0.26 -0.69 0.00 0.00 174.62 176.08 3g5c s TRP 293 N 0.88 2.68 0.19 4.92 0.51 0.55 -4.81 118.94 123.86 3g5c s TRP 293 Ca -0.10 -1.16 0.15 0.00 -2.12 0.00 0.00 56.10 52.87 3g5c s TRP 293 Cb -0.15 -4.68 0.50 0.00 -0.81 0.00 0.00 33.47 28.33 3g5c s TRP 293 CO 0.01 -1.85 1.66 0.00 -0.51 0.00 0.00 176.95 176.26 3g5c h ALA 294 N 8.98 0.95 0.00 0.98 0.00 -1.90 -3.26 119.26 125.02 3g5c h ALA 294 Ca 0.27 -0.45 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 3g5c h ALA 294 Cb 0.96 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3g5c h ALA 294 CO 1.41 0.62 -1.32 2.41 0.00 0.00 0.00 179.25 182.36 3g5c n THR 295 N -3.62 1.50 -3.81 0.00 -1.04 -1.26 -5.03 114.28 101.01 3g5c n THR 295 Ca -0.00 -0.02 -0.04 0.00 -2.04 0.00 0.00 64.05 61.95 3g5c n THR 295 Cb 0.57 -2.16 0.00 0.00 -1.82 0.00 0.00 70.33 66.93 3g5c n THR 295 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 3g5c s ASP 296 N -6.53 -0.09 0.20 8.00 3.84 -1.26 -5.03 116.67 115.81 3g5c s ASP 296 Ca -0.28 -0.59 -0.29 0.00 -0.00 0.00 0.00 52.55 51.39 3g5c s ASP 296 Cb 0.07 0.53 -0.08 0.00 -1.38 0.00 0.00 42.92 42.06 3g5c s ASP 296 CO 0.44 -1.02 0.92 0.20 -0.00 0.00 0.00 175.17 175.70 3g5c s ASN 297 N -3.14 7.58 0.24 2.11 0.02 -1.26 -4.67 114.94 115.82 3g5c s ASN 297 Ca 0.16 1.87 0.12 0.00 -1.02 0.00 0.00 52.86 53.99 3g5c s ASN 297 Cb -0.02 -2.59 0.16 0.00 0.02 0.00 0.00 41.25 38.82 3g5c s ASN 297 CO 0.04 0.12 1.48 0.11 0.02 0.00 0.00 177.10 178.88 3g5c h LYS 298 N 4.47 0.00 -4.31 -0.60 1.79 -2.00 -3.46 116.57 112.46 3g5c h LYS 298 Ca -0.45 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 57.86 3g5c h LYS 298 Cb 1.20 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.71 3g5c h LYS 298 CO 0.68 0.68 -0.59 -0.59 -1.08 0.00 0.00 179.45 178.56 3g5c s PHE 299 N -3.16 0.74 -0.33 -1.35 -0.12 -1.26 -5.12 117.98 107.39 3g5c s PHE 299 Ca 0.01 -1.13 -0.29 0.00 -0.05 0.00 0.00 56.93 55.47 3g5c s PHE 299 Cb 0.10 -0.39 -0.01 0.00 -0.63 0.00 0.00 43.02 42.09 3g5c s PHE 299 CO 0.76 -0.54 1.58 0.00 -0.05 0.00 0.00 175.22 176.97 3g5c s ALA 300 N -4.02 3.08 0.01 1.99 0.00 -1.26 -4.98 121.76 116.58 3g5c s ALA 300 Ca 0.21 0.16 -0.30 0.00 0.00 0.00 0.00 51.96 52.03 3g5c s ALA 300 Cb 0.07 -3.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.22 3g5c s ALA 300 CO 0.00 -2.29 1.16 -1.50 0.00 0.00 0.00 175.76 173.13 3g5c s ILE 301 N 5.73 4.24 0.10 0.00 -1.16 -1.26 -4.92 121.20 123.93 3g5c s ILE 301 Ca 0.69 1.60 0.02 0.00 -0.51 0.00 0.00 60.65 62.45 3g5c s ILE 301 Cb -0.20 -4.02 -0.04 0.00 0.61 0.00 0.00 42.46 38.81 3g5c s ILE 301 CO 0.31 0.08 0.16 -0.55 -2.81 0.00 0.00 174.94 172.14 3g5c s SER 302 N 1.19 5.92 0.44 4.50 0.15 -1.26 -5.00 113.70 119.64 3g5c s SER 302 Ca 0.57 0.09 0.21 0.00 0.70 0.00 0.00 55.95 57.51 3g5c s SER 302 Cb -0.26 -1.70 1.02 0.00 -1.71 0.00 0.00 66.02 63.37 3g5c s SER 302 CO 0.27 0.14 1.91 1.05 1.20 0.00 0.00 173.24 177.80 3g5c h GLU 303 N 2.91 0.00 -6.03 5.44 9.09 -1.96 -3.41 114.58 120.63 3g5c h GLU 303 Ca -0.47 0.00 -0.58 0.00 0.05 0.00 0.00 59.36 58.36 3g5c h GLU 303 Cb 1.17 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.21 3g5c h GLU 303 CO 0.69 0.25 0.64 1.21 0.05 0.00 0.00 179.01 181.86 3g5c s ASN 304 N -6.48 7.05 0.37 3.06 3.84 -1.26 -2.06 114.94 119.46 3g5c s ASN 304 Ca -0.02 1.30 0.05 0.00 0.21 0.00 0.00 52.86 54.41 3g5c s ASN 304 Cb 0.13 -2.51 0.72 0.00 -0.55 0.00 0.00 41.25 39.04 3g5c s ASN 304 CO 0.65 -0.57 1.97 1.55 -2.79 0.00 0.00 177.10 177.92 3g5c h PRO 305 N 7.43 0.57 -0.22 0.43 0.13 -1.93 -2.49 132.00 135.92 3g5c h PRO 305 Ca -0.23 -0.07 -0.20 0.00 -0.87 0.00 0.00 66.00 64.63 3g5c h PRO 305 Cb 1.09 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.11 3g5c h PRO 305 CO 0.92 0.47 -0.65 -0.07 -0.23 0.00 0.00 178.00 178.44 3g5c h LEU 306 N 0.58 0.94 -0.51 1.56 3.38 -1.93 -0.70 115.31 118.62 3g5c h LEU 306 Ca 0.14 -0.55 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 3g5c h LEU 306 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3g5c h LEU 306 CO -0.02 1.35 0.16 0.40 0.09 0.00 0.00 178.44 180.43 3g5c h ILE 307 N 0.60 1.23 -0.46 1.22 1.08 -1.92 -1.52 117.51 117.75 3g5c h ILE 307 Ca -0.02 -0.77 -0.03 0.00 -0.39 0.00 0.00 64.86 63.66 3g5c h ILE 307 Cb 1.27 0.76 -0.02 0.00 -3.07 0.00 0.00 36.82 35.76 3g5c h ILE 307 CO 0.14 0.29 0.19 0.74 -0.69 0.00 0.00 178.15 178.81 3g5c h THR 308 N 0.70 1.21 -0.54 -0.27 2.02 -1.42 -2.15 112.91 112.46 3g5c h THR 308 Ca 0.17 -0.63 0.04 0.00 0.77 0.00 0.00 66.41 66.75 3g5c h THR 308 Cb 0.27 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 3g5c h THR 308 CO -0.01 0.24 0.30 0.25 0.37 0.00 0.00 175.52 176.67 3g5c h LEU 309 N 0.60 0.46 -0.47 2.58 5.85 -0.93 0.69 115.31 124.10 3g5c h LEU 309 Ca 0.15 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 3g5c h LEU 309 Cb 0.19 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 3g5c h LEU 309 CO -0.01 0.32 0.02 -0.09 -0.34 0.00 0.00 178.44 178.34 3g5c h ARG 310 N 0.59 0.81 0.00 1.25 2.43 -1.16 -2.23 114.38 116.07 3g5c h ARG 310 Ca 0.23 -0.25 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 3g5c h ARG 310 Cb 0.09 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3g5c h ARG 310 CO -0.13 0.85 -0.49 0.93 -1.51 0.00 0.00 179.97 179.62 3g5c h GLU 311 N 0.67 0.00 -0.22 0.20 4.39 -1.18 -2.86 114.58 115.58 3g5c h GLU 311 Ca 0.14 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.65 3g5c h GLU 311 Cb 0.47 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 3g5c h GLU 311 CO 0.02 0.49 -0.60 0.35 -1.16 0.00 0.00 179.01 178.10 3g5c h PHE 312 N 0.00 0.95 0.00 4.33 3.57 -0.68 -2.43 116.94 122.68 3g5c h PHE 312 Ca -0.00 -0.36 -0.07 0.00 3.53 0.00 0.00 57.97 61.07 3g5c h PHE 312 Cb 0.99 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 3g5c h PHE 312 CO 0.00 1.16 -0.32 0.52 -2.23 0.00 0.00 178.31 177.43 3g5c h MET 313 N 0.55 0.00 -0.39 1.11 2.86 -1.38 -1.30 114.93 116.39 3g5c h MET 313 Ca -0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 3g5c h MET 313 Cb 1.19 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 3g5c h MET 313 CO 0.12 0.32 -0.10 0.87 1.06 0.00 0.00 176.91 179.19 3g5c h LYS 314 N 0.00 0.75 -0.39 1.72 1.57 -1.41 -2.13 116.57 116.68 3g5c h LYS 314 Ca -0.00 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 3g5c h LYS 314 Cb 0.84 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 3g5c h LYS 314 CO 0.04 0.89 0.16 -0.92 -0.57 0.00 0.00 179.45 179.06 3g5c h TYR 315 N 0.56 0.59 0.00 -1.35 3.20 -1.01 -2.72 116.97 116.25 3g5c h TYR 315 Ca 0.10 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.84 3g5c h TYR 315 Cb 0.62 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 3g5c h TYR 315 CO 0.05 0.52 -0.41 0.07 -1.64 0.00 0.00 178.16 176.75 3g5c h ARG 316 N 0.49 0.00 -0.19 1.82 0.11 -1.25 0.62 114.38 115.98 3g5c h ARG 316 Ca 0.13 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.04 3g5c h ARG 316 Cb 0.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.26 3g5c h ARG 316 CO -0.01 0.41 -0.59 -0.09 0.10 0.00 0.00 179.97 179.79 3g5c h ARG 317 N 0.00 0.61 0.00 0.08 2.43 -1.30 -2.97 114.38 113.23 3g5c h ARG 317 Ca -0.00 -0.41 -0.00 0.00 -0.81 0.00 0.00 59.98 58.76 3g5c h ARG 317 Cb 0.86 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 3g5c h ARG 317 CO 0.05 1.03 -1.70 -0.25 -1.51 0.00 0.00 179.97 177.59 3g5c n ASP 318 N -3.95 0.26 0.00 -3.80 8.00 -1.03 -4.74 116.55 111.29 3g5c n ASP 318 Ca -0.04 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.56 3g5c n ASP 318 Cb 0.63 1.52 0.00 0.00 -0.02 0.00 0.00 41.12 43.26 3g5c n ASP 318 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3g5c n PHE 319 N -2.39 0.00 -2.38 1.24 3.01 0.19 -5.01 117.46 112.12 3g5c n PHE 319 Ca -0.03 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.00 3g5c n PHE 319 Cb 0.57 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.01 3g5c n PHE 319 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3g5c s ILE 320 N -1.74 4.13 -0.16 4.37 -1.09 -1.12 -4.89 121.20 120.70 3g5c s ILE 320 Ca 0.00 1.31 0.15 0.00 -2.23 0.00 0.00 60.65 59.88 3g5c s ILE 320 Cb 0.00 -4.04 0.30 0.00 -1.58 0.00 0.00 42.46 37.15 3g5c s ILE 320 CO 0.00 -0.33 1.20 2.29 -1.23 0.00 0.00 174.94 176.87 3g5c n LYS 321 N 7.11 1.97 -3.68 2.79 2.85 -1.26 -4.76 118.16 123.18 3g5c n LYS 321 Ca 0.15 -2.46 -0.32 0.00 -1.05 0.00 0.00 58.31 54.62 3g5c n LYS 321 Cb 0.46 -1.50 -0.05 0.00 -0.65 0.00 0.00 35.03 33.29 3g5c n LYS 321 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 3g5c s GLU 322 N -2.51 3.63 -0.11 -1.58 1.03 -1.26 -5.08 118.70 112.81 3g5c s GLU 322 Ca 0.29 -0.06 -0.25 0.00 0.03 0.00 0.00 54.97 54.98 3g5c s GLU 322 Cb 0.25 -2.91 -0.02 0.00 -0.80 0.00 0.00 34.13 30.64 3g5c s GLU 322 CO 0.05 0.51 0.80 0.15 -1.33 0.00 0.00 175.26 175.43 3g5c s LYS 323 N -2.42 4.38 0.02 -4.83 -0.14 -1.26 -5.04 119.74 110.45 3g5c s LYS 323 Ca 0.38 1.01 -0.25 0.00 -1.36 0.00 0.00 55.97 55.75 3g5c s LYS 323 Cb -0.13 -3.52 0.06 0.00 -1.68 0.00 0.00 37.83 32.57 3g5c s LYS 323 CO 0.23 -0.15 0.56 -1.54 -0.76 0.00 0.00 175.35 173.69 3g5c s SER 324 N 1.01 -0.51 0.17 2.83 1.04 -1.26 -4.89 113.70 112.09 3g5c s SER 324 Ca 0.39 0.33 0.00 0.00 0.48 0.00 0.00 55.95 57.16 3g5c s SER 324 Cb -0.17 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.46 3g5c s SER 324 CO 0.16 -0.68 1.39 0.44 0.98 0.00 0.00 173.24 175.53 3g5c h ASP 325 N 2.87 0.38 -4.24 7.02 3.45 -0.79 -3.46 116.42 121.64 3g5c h ASP 325 Ca -0.30 -0.28 -0.14 0.00 0.43 0.00 0.00 57.03 56.75 3g5c h ASP 325 Cb 1.19 -0.11 -0.23 0.00 -0.56 0.00 0.00 39.33 39.62 3g5c h ASP 325 CO 0.40 1.05 -0.32 0.00 -1.57 0.00 0.00 179.24 178.80 3g5c s ALA 326 N -3.37 -0.78 -0.20 3.45 0.00 -1.04 -2.60 121.76 117.21 3g5c s ALA 326 Ca -0.04 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.63 3g5c s ALA 326 Cb 0.10 -0.33 0.03 0.00 0.00 0.00 0.00 23.12 22.92 3g5c s ALA 326 CO 0.84 -0.19 -0.18 0.08 0.00 0.00 0.00 175.76 176.31 3g5c s VAL 327 N -0.34 2.09 0.01 0.00 1.01 -0.87 -1.25 120.40 121.05 3g5c s VAL 327 Ca -0.05 -1.10 0.07 0.00 0.00 0.00 0.00 61.98 60.90 3g5c s VAL 327 Cb -0.03 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 3g5c s VAL 327 CO 0.02 0.41 -0.20 -1.00 0.00 0.00 0.00 175.10 174.33 3g5c s HIS 328 N 1.25 2.52 -0.14 5.22 3.76 -0.10 -2.69 115.29 125.10 3g5c s HIS 328 Ca 0.02 -0.29 -0.14 0.00 -0.15 0.00 0.00 55.06 54.50 3g5c s HIS 328 Cb -0.15 -1.49 -0.05 0.00 1.11 0.00 0.00 32.58 32.00 3g5c s HIS 328 CO -0.11 0.17 0.30 -1.17 -0.85 0.00 0.00 174.74 173.08 3g5c s LEU 329 N -1.12 4.27 -0.58 0.89 2.96 -0.37 -0.82 118.68 123.92 3g5c s LEU 329 Ca 0.13 0.56 -0.10 0.00 -0.22 0.00 0.00 54.13 54.50 3g5c s LEU 329 Cb -0.10 -2.39 0.15 0.00 0.50 0.00 0.00 46.19 44.34 3g5c s LEU 329 CO 0.03 0.13 0.47 -0.36 -1.32 0.00 0.00 176.35 175.30 3g5c s PHE 330 N 0.25 3.47 -0.08 5.38 2.99 0.14 -0.48 117.98 129.64 3g5c s PHE 330 Ca 0.18 -1.95 -0.17 0.00 0.00 0.00 0.00 56.93 54.98 3g5c s PHE 330 Cb -0.13 -3.56 -0.05 0.00 0.00 0.00 0.00 43.02 39.28 3g5c s PHE 330 CO 0.05 -0.97 0.46 0.45 -0.00 0.00 0.00 175.22 175.21 3g5c s SER 331 N 2.39 6.72 0.45 1.36 0.15 0.23 -2.63 113.70 122.37 3g5c s SER 331 Ca 0.10 0.86 0.25 0.00 0.70 0.00 0.00 55.95 57.85 3g5c s SER 331 Cb -0.23 -2.28 0.78 0.00 -1.71 0.00 0.00 66.02 62.59 3g5c s SER 331 CO -0.02 0.09 1.76 1.23 1.20 0.00 0.00 173.24 177.50 3g5c h GLY 332 N 6.17 0.00 -0.84 9.45 0.00 -1.86 0.71 103.07 116.70 3g5c h GLY 332 Ca -0.44 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 46.48 3g5c h GLY 332 CO 0.72 0.00 0.39 -1.14 0.00 0.00 0.00 176.54 176.51 3g5c n SER 333 N -3.21 -0.06 -4.18 0.19 3.41 -1.26 -4.52 113.62 103.99 3g5c n SER 333 Ca 0.02 -1.44 -0.26 0.00 -0.26 0.00 0.00 58.87 56.92 3g5c n SER 333 Cb 0.46 -0.99 -0.16 0.00 -0.26 0.00 0.00 64.21 63.27 3g5c n SER 333 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3g5c s GLN 334 N -5.80 1.61 0.68 4.33 2.00 -1.26 -3.14 119.66 118.08 3g5c s GLN 334 Ca 0.73 -0.67 -0.10 0.00 -2.00 0.00 0.00 55.36 53.32 3g5c s GLN 334 Cb -0.02 -1.52 0.01 0.00 0.80 0.00 0.00 33.01 32.28 3g5c s GLN 334 CO 0.52 0.38 1.04 -0.06 -0.50 0.00 0.00 175.29 176.67 3g5c s PHE 335 N -0.35 3.29 -0.02 1.67 0.08 -1.26 -4.85 117.98 116.54 3g5c s PHE 335 Ca 0.05 0.92 -0.17 0.00 0.12 0.00 0.00 56.93 57.85 3g5c s PHE 335 Cb -0.08 -2.99 -0.09 0.00 -0.57 0.00 0.00 43.02 39.28 3g5c s PHE 335 CO -0.00 -1.10 0.75 0.93 -0.10 0.00 0.00 175.22 175.69 3g5c h GLU 336 N -0.53 -0.59 -7.34 0.44 5.08 -1.74 -3.46 114.58 106.43 3g5c h GLU 336 Ca -0.45 0.04 -0.51 0.00 -1.00 0.00 0.00 59.36 57.44 3g5c h GLU 336 Cb 1.26 0.13 0.11 0.00 0.50 0.00 0.00 28.75 30.75 3g5c h GLU 336 CO 0.63 -0.39 0.34 -1.54 -1.00 0.00 0.00 179.01 177.04 3g5c s SER 337 N -4.60 4.80 0.40 1.42 1.04 -1.26 -4.91 113.70 110.58 3g5c s SER 337 Ca -0.09 1.62 0.25 0.00 0.48 0.00 0.00 55.95 58.22 3g5c s SER 337 Cb 0.01 -2.41 1.37 0.00 0.10 0.00 0.00 66.02 65.09 3g5c s SER 337 CO 0.27 -1.82 1.76 0.28 0.98 0.00 0.00 173.24 174.71 3g5c h SER 338 N -0.98 0.00 -2.23 7.02 0.02 -2.01 -3.40 113.55 111.97 3g5c h SER 338 Ca -0.45 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 59.94 3g5c h SER 338 Cb 1.23 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 3g5c h SER 338 CO 0.55 0.00 1.41 -0.13 -1.14 0.00 0.00 176.83 177.52 3g5c s ARG 339 N -3.65 3.09 0.00 3.45 3.00 -1.26 -4.85 118.95 118.73 3g5c s ARG 339 Ca -0.03 1.65 0.31 0.00 0.00 0.00 0.00 55.73 57.66 3g5c s ARG 339 Cb 0.07 -4.32 1.79 0.00 0.00 0.00 0.00 34.95 32.49 3g5c s ARG 339 CO 0.23 -2.15 2.14 -1.13 0.00 0.00 0.00 175.30 174.39 3g5c n SER 340 N 11.58 0.00 -3.66 0.23 3.41 -1.26 -4.84 113.62 119.08 3g5c n SER 340 Ca 0.27 -0.86 -0.02 0.00 -0.26 0.00 0.00 58.87 58.00 3g5c n SER 340 Cb 0.47 -0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.37 3g5c n SER 340 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3g5c s GLY 341 N -2.07 -0.34 -0.06 5.00 0.00 -1.26 -1.56 107.32 107.04 3g5c s GLY 341 Ca 0.44 0.62 -0.03 0.00 0.00 0.00 0.00 44.72 45.75 3g5c s GLY 341 CO 0.37 0.14 0.13 0.00 0.00 0.00 0.00 173.10 173.74 3g5c s ALA 342 N -2.81 -0.23 -0.02 3.20 0.00 -0.97 -4.99 121.76 115.95 3g5c s ALA 342 Ca 0.12 0.56 -0.10 0.00 0.00 0.00 0.00 51.96 52.54 3g5c s ALA 342 Cb 0.01 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.77 3g5c s ALA 342 CO -0.02 -0.13 0.21 0.00 0.00 0.00 0.00 175.76 175.82 3g5c s ALA 343 N 0.94 -0.52 0.13 0.00 0.00 -1.26 -1.04 121.76 120.00 3g5c s ALA 343 Ca -0.07 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 3g5c s ALA 343 Cb -0.10 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 22.98 3g5c s ALA 343 CO -0.04 -0.21 1.27 0.71 0.00 0.00 0.00 175.76 177.48 3g5c s TYR 344 N -1.16 3.35 -0.08 0.00 1.51 -1.22 -4.74 117.35 115.01 3g5c s TYR 344 Ca -0.12 1.23 -0.30 0.00 -1.01 0.00 0.00 57.07 56.87 3g5c s TYR 344 Cb -0.06 -3.52 -0.04 0.00 -0.11 0.00 0.00 41.96 38.22 3g5c s TYR 344 CO 0.02 -1.66 1.52 0.42 -1.11 0.00 0.00 175.55 174.74 3g5c s ILE 345 N 0.60 3.78 -0.93 2.71 1.09 -1.25 -2.63 121.20 124.57 3g5c s ILE 345 Ca 0.58 0.98 -0.03 0.00 -1.10 0.00 0.00 60.65 61.08 3g5c s ILE 345 Cb -0.33 -3.63 0.00 0.00 -1.06 0.00 0.00 42.46 37.44 3g5c s ILE 345 CO 0.33 -0.08 0.79 0.61 -0.10 0.00 0.00 174.94 176.50 3g5c n GLY 346 N 3.93 -0.15 0.08 6.18 0.00 0.12 -4.92 105.19 110.44 3g5c n GLY 346 Ca 0.16 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.20 3g5c n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g5c n GLY 347 N -1.31 -1.20 3.47 -0.02 0.00 -0.59 -4.97 105.19 100.57 3g5c n GLY 347 Ca -0.12 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 3g5c n GLY 347 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3g5c n ILE 348 N -2.68 1.82 0.00 -0.61 -6.64 -1.14 -1.92 119.36 108.19 3g5c n ILE 348 Ca -0.08 -0.40 0.00 0.00 -1.77 0.00 0.00 62.75 60.50 3g5c n ILE 348 Cb 0.74 -0.75 0.00 0.00 -1.44 0.00 0.00 39.64 38.19 3g5c n ILE 348 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3g5c s SER 350 N -2.22 6.98 0.07 0.00 0.15 -0.99 -4.98 113.70 112.71 3g5c s SER 350 Ca 0.00 1.35 -0.10 0.00 0.70 0.00 0.00 55.95 57.91 3g5c s SER 350 Cb 0.00 -2.40 -0.28 0.00 -1.71 0.00 0.00 66.02 61.64 3g5c s SER 350 CO 0.00 -0.00 1.12 0.25 1.20 0.00 0.00 173.24 175.81 3g5c h LEU 351 N 3.22 0.66 0.00 3.45 6.46 -1.93 -2.20 115.31 124.98 3g5c h LEU 351 Ca -0.48 -0.66 -0.01 0.00 -0.12 0.00 0.00 57.88 56.62 3g5c h LEU 351 Cb 1.19 -0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.91 3g5c h LEU 351 CO 0.65 1.49 -1.60 0.18 -0.62 0.00 0.00 178.44 178.55 3g5c n LEU 352 N -3.67 0.36 -0.00 2.25 4.77 -1.26 -4.51 117.00 114.93 3g5c n LEU 352 Ca -0.12 0.14 0.04 0.00 -0.03 0.00 0.00 56.01 56.04 3g5c n LEU 352 Cb 1.01 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 42.04 3g5c n LEU 352 CO 0.56 -0.07 -0.24 0.29 -1.33 0.00 0.00 177.39 176.61 3g5c n LYS 353 N -2.45 2.91 -2.26 3.23 4.76 -1.26 -4.87 118.16 118.23 3g5c n LYS 353 Ca -0.03 -0.03 -0.41 0.00 -2.87 0.00 0.00 58.31 54.97 3g5c n LYS 353 Cb 0.58 -0.97 -0.01 0.00 -1.84 0.00 0.00 35.03 32.79 3g5c n LYS 353 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3g5c n GLY 354 N 1.53 2.83 0.00 0.72 0.00 -0.81 -4.40 105.19 105.05 3g5c n GLY 354 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.63 3g5c n GLY 354 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g5c n GLY 355 N 5.11 -0.58 3.73 -0.02 0.00 -1.26 -2.04 105.19 110.12 3g5c n GLY 355 Ca 0.49 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 3g5c n GLY 355 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g5c s GLY 356 N 0.00 0.47 -0.03 -0.02 0.00 -1.09 -3.42 107.32 103.22 3g5c s GLY 356 Ca 0.00 -0.79 0.05 0.00 0.00 0.00 0.00 44.72 43.98 3g5c s GLY 356 CO 0.00 -0.43 -0.19 0.54 0.00 0.00 0.00 173.10 173.03 3g5c s VAL 357 N -3.15 1.52 -0.06 1.40 0.11 -0.21 -1.23 120.40 118.78 3g5c s VAL 357 Ca 0.18 -0.78 0.01 0.00 -2.93 0.00 0.00 61.98 58.46 3g5c s VAL 357 Cb -0.04 -1.29 0.02 0.00 -1.53 0.00 0.00 36.38 33.55 3g5c s VAL 357 CO 0.11 0.43 -0.07 0.20 -3.33 0.00 0.00 175.10 172.45 3g5c s ASN 358 N -0.15 1.38 0.65 3.54 0.01 0.37 -2.28 114.94 118.46 3g5c s ASN 358 Ca 0.00 -0.20 -0.11 0.00 -0.71 0.00 0.00 52.86 51.84 3g5c s ASN 358 Cb -0.10 -0.61 -0.02 0.00 0.41 0.00 0.00 41.25 40.93 3g5c s ASN 358 CO 0.01 -0.04 1.05 -1.83 -1.51 0.00 0.00 177.10 174.78 3g5c s GLU 359 N 0.99 3.34 0.47 -0.60 -1.05 -0.60 -0.60 118.70 120.65 3g5c s GLU 359 Ca -0.09 0.75 -0.22 0.00 -0.15 0.00 0.00 54.97 55.25 3g5c s GLU 359 Cb -0.14 -2.05 -0.07 0.00 -0.44 0.00 0.00 34.13 31.42 3g5c s GLU 359 CO 0.00 -0.75 1.16 0.12 0.95 0.00 0.00 175.26 176.74 3g5c s PHE 360 N -3.18 2.85 0.00 4.83 5.36 0.24 -4.79 117.98 123.30 3g5c s PHE 360 Ca 0.56 1.54 0.00 0.00 -0.96 0.00 0.00 56.93 58.07 3g5c s PHE 360 Cb -0.12 -3.37 0.00 0.00 -0.34 0.00 0.00 43.02 39.20 3g5c s PHE 360 CO 0.54 -1.51 0.00 0.41 -1.46 0.00 0.00 175.22 173.20 3g5c n GLY 361 N 0.41 1.98 3.86 13.12 0.00 -1.26 -4.98 105.19 118.33 3g5c n GLY 361 Ca 0.08 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 3g5c n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g5c s LYS 362 N 0.12 3.70 0.22 1.61 -0.14 -1.26 -4.77 119.74 119.22 3g5c s LYS 362 Ca 0.00 0.80 -0.08 0.00 -1.36 0.00 0.00 55.97 55.33 3g5c s LYS 362 Cb 0.00 -2.10 0.36 0.00 -1.68 0.00 0.00 37.83 34.41 3g5c s LYS 362 CO 0.00 -0.48 1.70 1.15 -0.76 0.00 0.00 175.35 176.96 3g5c h THR 363 N 0.03 0.61 -0.29 2.17 2.02 -1.99 0.41 112.91 115.88 3g5c h THR 363 Ca -0.45 -0.10 -0.16 0.00 0.77 0.00 0.00 66.41 66.47 3g5c h THR 363 Cb 1.19 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3g5c h THR 363 CO 0.62 0.05 -0.47 0.44 0.37 0.00 0.00 175.52 176.53 3g5c h ASP 364 N 0.29 0.85 -0.19 4.18 3.32 -1.95 -3.00 116.42 119.91 3g5c h ASP 364 Ca 0.35 -0.42 -0.21 0.00 0.02 0.00 0.00 57.03 56.78 3g5c h ASP 364 Cb 0.55 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.87 3g5c h ASP 364 CO -0.43 1.18 -0.70 0.25 -1.72 0.00 0.00 179.24 177.82 3g5c h LEU 365 N 0.62 0.94 -0.85 1.55 5.85 -1.63 -3.23 115.31 118.56 3g5c h LEU 365 Ca 0.03 -0.60 -0.11 0.00 0.84 0.00 0.00 57.88 58.04 3g5c h LEU 365 Cb 1.05 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 3g5c h LEU 365 CO 0.10 1.39 -0.53 -0.03 -0.34 0.00 0.00 178.44 179.03 3g5c h MET 366 N 0.55 0.00 -0.30 1.25 4.05 -0.31 -2.82 114.93 117.35 3g5c h MET 366 Ca -0.03 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 3g5c h MET 366 Cb 1.33 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.11 3g5c h MET 366 CO 0.15 0.53 -0.04 0.00 0.23 0.00 0.00 176.91 177.78 3g5c h ALA 367 N 1.47 1.37 -0.29 0.39 0.00 -1.55 -0.51 119.26 120.13 3g5c h ALA 367 Ca -0.01 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 3g5c h ALA 367 Cb 1.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3g5c h ALA 367 CO 0.07 0.43 -0.27 0.28 0.00 0.00 0.00 179.25 179.77 3g5c h VAL 368 N 0.46 1.30 -0.97 0.00 2.07 -1.53 -0.49 116.25 117.08 3g5c h VAL 368 Ca 0.10 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.21 3g5c h VAL 368 Cb 0.36 1.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.64 3g5c h VAL 368 CO 0.01 0.46 0.64 0.74 0.02 0.00 0.00 177.57 179.44 3g5c h THR 369 N 0.44 1.22 -0.12 2.57 2.02 -1.21 -1.14 112.91 116.69 3g5c h THR 369 Ca 0.05 -0.44 -0.17 0.00 0.77 0.00 0.00 66.41 66.62 3g5c h THR 369 Cb 0.83 -0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 3g5c h THR 369 CO 0.07 0.23 -0.65 0.25 0.37 0.00 0.00 175.52 175.79 3g5c h LEU 370 N 1.28 0.53 -1.26 2.58 5.85 -1.06 -2.04 115.31 121.20 3g5c h LEU 370 Ca 0.37 -0.32 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 3g5c h LEU 370 Cb -0.09 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 3g5c h LEU 370 CO -0.09 1.04 -0.28 0.00 -0.34 0.00 0.00 178.44 178.76 3g5c h ALA 371 N 0.96 1.38 0.00 1.25 0.00 -0.42 -0.03 119.26 122.40 3g5c h ALA 371 Ca -0.01 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 3g5c h ALA 371 Cb 1.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3g5c h ALA 371 CO 0.11 0.44 -1.07 -0.56 0.00 0.00 0.00 179.25 178.17 3g5c h GLN 372 N 0.13 0.00 -0.07 0.00 3.07 -1.24 -2.81 115.11 114.19 3g5c h GLN 372 Ca 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.65 3g5c h GLN 372 Cb 0.57 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.14 3g5c h GLN 372 CO 0.04 0.13 -0.38 0.77 0.09 0.00 0.00 178.83 179.48 3g5c h SER 373 N 0.00 0.46 0.52 0.06 0.02 -1.06 -2.94 113.55 110.59 3g5c h SER 373 Ca -0.06 -0.66 -0.09 0.00 -0.84 0.00 0.00 61.79 60.14 3g5c h SER 373 Cb 1.23 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 3g5c h SER 373 CO 0.02 1.04 -0.45 -0.07 -1.14 0.00 0.00 176.83 176.23 3g5c h LEU 374 N -0.10 0.00 -0.84 5.07 3.38 -1.14 -2.95 115.31 118.73 3g5c h LEU 374 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3g5c h LEU 374 Cb 1.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 3g5c h LEU 374 CO 0.08 0.45 0.31 0.00 0.09 0.00 0.00 178.44 179.37 3g5c h ALA 375 N 1.55 1.07 -0.21 1.53 0.00 -1.52 0.10 119.26 121.78 3g5c h ALA 375 Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3g5c h ALA 375 Cb 0.83 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3g5c h ALA 375 CO 0.06 0.66 0.07 0.45 0.00 0.00 0.00 179.25 180.48 3g5c h HIS 376 N 1.14 0.35 -0.69 0.00 3.86 -1.37 0.21 115.15 118.64 3g5c h HIS 376 Ca 0.26 -0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.50 3g5c h HIS 376 Cb 0.21 -0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.54 3g5c h HIS 376 CO 0.02 0.42 0.46 -0.91 0.86 0.00 0.00 177.93 178.77 3g5c h ASN 377 N 0.18 0.62 0.96 2.45 2.35 -1.30 0.36 115.58 121.20 3g5c h ASN 377 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3g5c h ASN 377 Cb 0.23 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3g5c h ASN 377 CO -0.00 0.40 -0.05 -0.38 -1.65 0.00 0.00 177.43 175.75 3g5c n ILE 378 N -4.48 0.01 0.00 2.81 -0.00 0.33 -1.54 119.36 116.49 3g5c n ILE 378 Ca 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 62.75 62.84 3g5c n ILE 378 Cb 0.23 -0.43 0.00 0.00 -0.00 0.00 0.00 39.64 39.44 3g5c n ILE 378 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3g5c n GLY 379 N 1.50 0.57 3.62 7.39 0.00 -0.50 -4.78 105.19 112.99 3g5c n GLY 379 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 3g5c n GLY 379 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g5c s ILE 380 N -2.00 4.14 -0.25 -0.61 1.01 0.60 -4.65 121.20 119.44 3g5c s ILE 380 Ca 0.00 1.23 0.09 0.00 0.00 0.00 0.00 60.65 61.97 3g5c s ILE 380 Cb 0.00 -4.33 -0.12 0.00 0.01 0.00 0.00 42.46 38.02 3g5c s ILE 380 CO 0.00 -0.70 0.31 2.30 0.00 0.00 0.00 174.94 176.86 3g5c n ILE 381 N 6.57 0.00 -2.53 2.92 -5.35 -1.26 -3.50 119.36 116.22 3g5c n ILE 381 Ca 0.14 -0.25 -0.02 0.00 -0.27 0.00 0.00 62.75 62.35 3g5c n ILE 381 Cb 0.48 0.68 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 3g5c n ILE 381 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3g5c n SER 382 N -1.50 -6.92 -4.61 7.28 2.88 -1.26 -4.86 113.62 104.63 3g5c n SER 382 Ca 0.00 0.93 -0.49 0.00 -1.33 0.00 0.00 58.87 57.99 3g5c n SER 382 Cb 0.19 -4.57 -0.05 0.00 -0.75 0.00 0.00 64.21 59.03 3g5c n SER 382 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3g5c n ASP 383 N 0.27 3.06 0.03 -3.46 -0.08 -1.26 -4.88 116.55 110.22 3g5c n ASP 383 Ca 0.03 0.73 -0.11 0.00 -1.51 0.00 0.00 54.79 53.93 3g5c n ASP 383 Cb 0.13 -1.36 0.02 0.00 2.34 0.00 0.00 41.12 42.24 3g5c n ASP 383 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3g5c h LYS 384 N 10.78 0.51 -0.32 -0.67 1.57 -1.26 -2.48 116.57 124.70 3g5c h LYS 384 Ca -0.42 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 57.96 3g5c h LYS 384 Cb 1.28 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 3g5c h LYS 384 CO 0.97 1.02 0.16 -0.09 -0.57 0.00 0.00 179.45 180.94 3g5c h ARG 385 N 0.36 0.46 -0.04 3.15 2.43 -1.75 -0.18 114.38 118.81 3g5c h ARG 385 Ca -0.02 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 58.95 3g5c h ARG 385 Cb 1.27 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 3g5c h ARG 385 CO 0.13 0.41 -0.60 0.87 -1.51 0.00 0.00 179.97 179.27 3g5c h LYS 386 N 0.39 0.12 -0.12 0.20 1.57 -1.92 -2.76 116.57 114.05 3g5c h LYS 386 Ca 0.11 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3g5c h LYS 386 Cb 0.09 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 3g5c h LYS 386 CO -0.02 0.68 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.43 3g5c h LEU 387 N 0.09 0.25 -1.40 2.94 3.38 -1.19 0.50 115.31 119.88 3g5c h LEU 387 Ca -0.01 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 3g5c h LEU 387 Cb 1.08 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3g5c h LEU 387 CO 0.09 0.58 -0.20 0.00 0.09 0.00 0.00 178.44 178.99 3g5c h ALA 388 N 0.67 1.50 0.00 1.53 0.00 -1.05 -2.15 119.26 119.77 3g5c h ALA 388 Ca 0.03 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 3g5c h ALA 388 Cb 0.48 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3g5c h ALA 388 CO 0.01 0.36 -0.72 1.03 0.00 0.00 0.00 179.25 179.93 3g5c h SER 389 N 0.13 0.00 0.00 0.00 0.87 -1.48 -3.48 113.55 109.59 3g5c h SER 389 Ca 0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 3g5c h SER 389 Cb 0.44 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 3g5c h SER 389 CO 0.03 0.72 0.00 0.61 -0.53 0.00 0.00 176.83 177.66 3g5c n GLY 390 N 1.07 0.88 0.18 5.77 0.00 -0.58 -5.00 105.19 107.52 3g5c n GLY 390 Ca 0.01 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 3g5c n GLY 390 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3g5c h GLU 391 N 2.54 -0.36 -4.87 1.61 4.81 -0.29 -3.41 114.58 114.61 3g5c h GLU 391 Ca 0.00 0.02 -0.67 0.00 -0.13 0.00 0.00 59.36 58.59 3g5c h GLU 391 Cb 0.00 0.08 -0.18 0.00 0.63 0.00 0.00 28.75 29.28 3g5c h GLU 391 CO 0.00 -0.03 -0.34 0.00 -0.73 0.00 0.00 179.01 177.91 3g5c s LYS 393 N 1.93 0.97 -0.51 0.00 -0.14 -1.26 -4.51 119.74 116.22 3g5c s LYS 393 Ca 0.10 -0.82 -0.27 0.00 -1.36 0.00 0.00 55.97 53.62 3g5c s LYS 393 Cb -0.17 -1.00 -0.02 0.00 -1.68 0.00 0.00 37.83 34.96 3g5c s LYS 393 CO 0.11 0.25 1.83 0.00 -0.76 0.00 0.00 175.35 176.78 3g5c h GLU 395 N 14.20 -0.02 -4.35 0.00 5.08 -1.98 -3.38 114.58 124.13 3g5c h GLU 395 Ca -0.28 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 57.34 3g5c h GLU 395 Cb 1.16 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.20 3g5c h GLU 395 CO 1.15 0.37 0.08 -0.51 -1.00 0.00 0.00 179.01 179.10 3g5c s ASP 396 N -5.57 6.36 0.00 1.42 -0.00 -1.26 -4.92 116.67 112.70 3g5c s ASP 396 Ca -0.15 -1.89 -0.05 0.00 -0.00 0.00 0.00 52.55 50.46 3g5c s ASP 396 Cb 0.02 -2.26 -0.21 0.00 -0.00 0.00 0.00 42.92 40.47 3g5c s ASP 396 CO 0.66 -0.91 3.14 0.41 -0.00 0.00 0.00 175.17 178.47 3g5c n THR 397 N 5.09 2.61 -2.01 -1.27 -1.04 -1.26 -4.49 114.28 111.91 3g5c n THR 397 Ca -0.02 -1.24 -0.41 0.00 -2.04 0.00 0.00 64.05 60.34 3g5c n THR 397 Cb 0.43 -1.89 -0.02 0.00 -1.82 0.00 0.00 70.33 67.04 3g5c n THR 397 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 3g5c n TRP 398 N 2.40 3.60 -3.68 -1.42 -0.00 -1.26 -3.59 117.44 113.48 3g5c n TRP 398 Ca 0.34 -2.53 -0.25 0.00 -0.00 0.00 0.00 57.50 55.05 3g5c n TRP 398 Cb 0.79 -2.48 0.06 0.00 -0.00 0.00 0.00 31.31 29.69 3g5c n TRP 398 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 3g5c n SER 399 N 8.41 -5.77 -0.53 5.87 2.88 -1.26 -4.22 113.62 118.99 3g5c n SER 399 Ca 0.49 -0.61 0.07 0.00 -1.33 0.00 0.00 58.87 57.49 3g5c n SER 399 Cb 0.43 -4.71 -0.02 0.00 -0.75 0.00 0.00 64.21 59.16 3g5c n SER 399 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3g5c n GLY 400 N -1.90 -1.68 3.81 0.46 0.00 -1.24 -1.98 105.19 102.67 3g5c n GLY 400 Ca 0.01 -1.39 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 3g5c n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g5c h ILE 402 N 2.79 1.03 0.00 0.00 2.04 -0.95 -1.35 117.51 121.07 3g5c h ILE 402 Ca -0.48 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.29 3g5c h ILE 402 Cb 1.17 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 3g5c h ILE 402 CO 0.66 0.03 0.00 0.23 0.00 0.00 0.00 178.15 179.07 3g5c n MET 403 N -5.05 0.93 -3.15 2.37 2.81 -1.26 -3.85 117.12 109.91 3g5c n MET 403 Ca -0.06 0.00 -0.32 0.00 -1.81 0.00 0.00 57.70 55.50 3g5c n MET 403 Cb 0.04 -1.21 -0.04 0.00 -0.71 0.00 0.00 33.22 31.30 3g5c n MET 403 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g5c n GLY 404 N 0.25 5.19 0.00 3.03 0.00 -0.51 -4.84 105.19 108.32 3g5c n GLY 404 Ca 0.00 -2.74 0.06 0.00 0.00 0.00 0.00 46.02 43.35 3g5c n GLY 404 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3g5c n ASP 405 N 0.66 0.00 -0.15 1.61 5.68 -1.25 -3.05 116.55 120.04 3g5c n ASP 405 Ca 0.31 -0.45 0.15 0.00 -0.50 0.00 0.00 54.79 54.30 3g5c n ASP 405 Cb 0.37 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 40.85 3g5c n ASP 405 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3g5c h THR 406 N 0.00 0.81 -4.26 2.12 1.03 -1.92 -3.39 112.91 107.30 3g5c h THR 406 Ca 0.00 -0.14 -0.58 0.00 -0.01 0.00 0.00 66.41 65.67 3g5c h THR 406 Cb 0.00 0.36 -0.30 0.00 -1.07 0.00 0.00 68.15 67.14 3g5c h THR 406 CO 0.00 0.08 -0.85 -0.83 -0.01 0.00 0.00 175.52 173.91 3g5c s GLY 407 N -3.80 0.96 -0.21 2.99 0.00 -1.17 -5.13 107.32 100.96 3g5c s GLY 407 Ca -0.08 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.84 3g5c s GLY 407 CO 0.76 -0.62 -0.16 -0.47 0.00 0.00 0.00 173.10 172.62 3g5c s TYR 408 N -0.33 2.96 0.00 1.90 6.04 -1.26 -4.93 117.35 121.73 3g5c s TYR 408 Ca 0.04 -1.93 0.00 0.00 0.04 0.00 0.00 57.07 55.22 3g5c s TYR 408 Cb -0.09 -1.91 0.00 0.00 -1.04 0.00 0.00 41.96 38.92 3g5c s TYR 408 CO 0.00 -0.84 0.00 2.48 -1.54 0.00 0.00 175.55 175.66 3g5c n TYR 409 N 4.54 0.00 -2.77 4.97 4.11 -1.26 -5.08 117.16 121.67 3g5c n TYR 409 Ca -0.18 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 57.64 3g5c n TYR 409 Cb 0.46 0.00 0.04 0.00 -0.00 0.00 0.00 39.34 39.84 3g5c n TYR 409 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.86 176.75 3g5c n LEU 410 N -0.19 -2.90 -4.73 -3.48 7.94 -1.25 -5.00 117.00 107.39 3g5c n LEU 410 Ca 0.00 -3.28 -0.42 0.00 -1.11 0.00 0.00 56.01 51.20 3g5c n LEU 410 Cb 0.00 0.81 -0.03 0.00 0.53 0.00 0.00 43.42 44.74 3g5c n LEU 410 CO 0.00 1.99 1.27 -2.84 -1.11 0.00 0.00 177.39 176.69 3g5c s PRO 411 N 0.67 4.17 0.00 1.96 0.02 -0.84 -4.66 135.00 136.32 3g5c s PRO 411 Ca 0.32 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.82 3g5c s PRO 411 Cb 0.17 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.60 3g5c s PRO 411 CO -0.20 -0.64 0.17 1.17 -0.33 0.00 0.00 177.00 177.17 3g5c n LYS 412 N 3.41 4.05 -4.14 5.54 3.00 -1.23 -4.67 118.16 124.12 3g5c n LYS 412 Ca 0.13 -0.17 -0.15 0.00 -0.00 0.00 0.00 58.31 58.11 3g5c n LYS 412 Cb 0.37 -0.65 -0.11 0.00 0.00 0.00 0.00 35.03 34.63 3g5c n LYS 412 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3g5c s LYS 413 N -0.63 0.75 0.05 1.64 1.02 -1.26 -4.96 119.74 116.36 3g5c s LYS 413 Ca 0.00 -0.97 -0.04 0.00 0.02 0.00 0.00 55.97 54.98 3g5c s LYS 413 Cb 0.00 -0.58 -0.05 0.00 -0.52 0.00 0.00 37.83 36.69 3g5c s LYS 413 CO 0.00 0.11 0.27 -0.06 -0.92 0.00 0.00 175.35 174.75 3g5c s PHE 414 N -1.72 3.54 0.74 3.18 0.08 -1.26 -0.33 117.98 122.21 3g5c s PHE 414 Ca -0.02 0.46 -0.11 0.00 0.12 0.00 0.00 56.93 57.38 3g5c s PHE 414 Cb -0.07 -1.91 0.04 0.00 -0.57 0.00 0.00 43.02 40.50 3g5c s PHE 414 CO 0.01 0.57 1.08 0.95 -0.10 0.00 0.00 175.22 177.73 3g5c s THR 415 N -1.44 3.64 0.51 0.64 -4.23 -1.26 -4.92 115.64 108.58 3g5c s THR 415 Ca 0.32 0.53 0.21 0.00 -1.18 0.00 0.00 61.69 61.57 3g5c s THR 415 Cb -0.13 -3.15 0.27 0.00 1.34 0.00 0.00 72.50 70.83 3g5c s THR 415 CO 0.21 -0.69 2.13 1.56 -0.54 0.00 0.00 174.62 177.29 3g5c h GLN 416 N -0.94 0.00 -0.44 3.99 1.08 -1.99 -1.19 115.11 115.62 3g5c h GLN 416 Ca -0.44 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 56.66 3g5c h GLN 416 Cb 1.22 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.64 3g5c h GLN 416 CO 0.54 0.06 -0.12 0.00 -0.95 0.00 0.00 178.83 178.37 3g5c h ASN 418 N 0.72 0.83 -0.61 0.00 2.35 -1.58 -1.71 115.58 115.57 3g5c h ASN 418 Ca 0.12 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.70 3g5c h ASN 418 Cb 0.61 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.74 3g5c h ASN 418 CO 0.04 0.68 0.09 0.40 -1.65 0.00 0.00 177.43 176.99 3g5c h ILE 419 N 0.91 1.26 -0.40 2.81 1.08 -1.35 -2.41 117.51 119.41 3g5c h ILE 419 Ca 0.23 -1.03 -0.07 0.00 -0.39 0.00 0.00 64.86 63.61 3g5c h ILE 419 Cb 0.03 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.45 3g5c h ILE 419 CO -0.04 0.38 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.46 3g5c h GLU 420 N 0.98 0.72 -0.44 2.37 4.39 -1.24 -1.04 114.58 120.32 3g5c h GLU 420 Ca 0.19 -0.24 0.01 0.00 0.34 0.00 0.00 59.36 59.66 3g5c h GLU 420 Cb 0.44 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 3g5c h GLU 420 CO 0.01 0.81 0.29 0.93 -1.16 0.00 0.00 179.01 179.90 3g5c h GLU 421 N 0.54 0.57 -0.09 2.33 5.08 -1.19 0.84 114.58 122.66 3g5c h GLU 421 Ca 0.11 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.24 3g5c h GLU 421 Cb 0.50 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.63 3g5c h GLU 421 CO 0.02 0.38 -0.71 -0.92 -1.00 0.00 0.00 179.01 176.78 3g5c h TYR 422 N 0.58 0.90 -0.43 4.33 3.20 -1.20 -2.59 116.97 121.76 3g5c h TYR 422 Ca 0.16 -0.42 -0.01 0.00 3.14 0.00 0.00 58.73 61.60 3g5c h TYR 422 Cb -0.06 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 3g5c h TYR 422 CO -0.00 1.24 0.21 0.45 -1.64 0.00 0.00 178.16 178.42 3g5c h HIS 423 N 0.30 0.61 -0.20 -3.82 3.86 -0.68 -2.30 115.15 112.93 3g5c h HIS 423 Ca -0.06 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.10 3g5c h HIS 423 Cb 1.36 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.63 3g5c h HIS 423 CO 0.11 0.50 0.05 -0.44 0.86 0.00 0.00 177.93 179.00 3g5c h ASP 424 N 0.55 0.25 -0.26 2.45 3.45 -0.90 0.49 116.42 122.46 3g5c h ASP 424 Ca 0.15 -0.02 -0.13 0.00 0.43 0.00 0.00 57.03 57.46 3g5c h ASP 424 Cb 0.11 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 38.81 3g5c h ASP 424 CO -0.02 0.27 -0.34 0.15 -1.57 0.00 0.00 179.24 177.73 3g5c h PHE 425 N 0.28 0.84 -0.33 4.55 3.57 -1.18 -0.80 116.94 123.87 3g5c h PHE 425 Ca 0.07 -0.27 -0.17 0.00 3.53 0.00 0.00 57.97 61.13 3g5c h PHE 425 Cb 0.12 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.69 3g5c h PHE 425 CO 0.00 1.03 -0.46 -0.07 -2.23 0.00 0.00 178.31 176.58 3g5c h LEU 426 N 0.41 0.96 -1.29 0.59 3.38 -1.00 -0.65 115.31 117.71 3g5c h LEU 426 Ca 0.03 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3g5c h LEU 426 Cb 0.92 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3g5c h LEU 426 CO 0.08 1.27 -0.07 0.78 0.09 0.00 0.00 178.44 180.59 3g5c h ASN 427 N 0.70 0.00 1.46 -0.43 2.35 -0.94 -2.54 115.58 116.18 3g5c h ASN 427 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3g5c h ASN 427 Cb 1.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.43 3g5c h ASN 427 CO 0.11 0.07 0.00 -1.28 -1.65 0.00 0.00 177.43 174.68 3g5c h SER 428 N 0.00 0.00 0.00 5.81 0.87 -0.92 -3.41 113.55 115.90 3g5c h SER 428 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3g5c h SER 428 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 3g5c h SER 428 CO 0.01 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.92 3g5c n GLY 429 N 1.13 1.00 3.86 5.77 0.00 -0.96 -4.34 105.19 111.64 3g5c n GLY 429 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3g5c n GLY 429 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g5c s GLY 430 N -1.28 2.33 -0.05 -0.02 0.00 -0.27 -4.42 107.32 103.61 3g5c s GLY 430 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 44.72 44.63 3g5c s GLY 430 CO 0.00 0.10 0.04 0.61 0.00 0.00 0.00 173.10 173.85 3g5c n GLY 431 N -0.17 0.72 0.15 0.20 0.00 -1.26 -4.06 105.19 100.76 3g5c n GLY 431 Ca 0.02 -0.57 -0.00 0.00 0.00 0.00 0.00 46.02 45.46 3g5c n GLY 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g5c h ALA 432 N 0.04 1.07 0.00 4.61 0.00 -1.88 -2.99 119.26 120.11 3g5c h ALA 432 Ca -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3g5c h ALA 432 Cb 1.01 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.71 3g5c h ALA 432 CO 0.02 0.71 0.00 0.00 0.00 0.00 0.00 179.25 179.98 3g5c n LEU 434 N -1.08 3.64 -0.25 0.00 4.32 -1.13 -4.29 117.00 118.21 3g5c n LEU 434 Ca 0.20 -1.84 0.03 0.00 -0.02 0.00 0.00 56.01 54.38 3g5c n LEU 434 Cb 0.14 -0.54 0.04 0.00 -1.62 0.00 0.00 43.42 41.44 3g5c n LEU 434 CO 0.18 0.54 0.40 0.49 -1.22 0.00 0.00 177.39 177.78 3g5c n PHE 435 N 0.55 0.07 -4.10 -1.77 3.72 -1.24 -0.77 117.46 113.92 3g5c n PHE 435 Ca 0.17 -0.14 -0.36 0.00 -0.05 0.00 0.00 57.45 57.07 3g5c n PHE 435 Cb 0.73 -0.01 -0.07 0.00 -0.94 0.00 0.00 39.48 39.19 3g5c n PHE 435 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3g5c s ASN 436 N -0.62 5.88 -0.18 4.37 4.22 -1.26 -4.74 114.94 122.60 3g5c s ASN 436 Ca 0.08 0.32 -0.18 0.00 -2.14 0.00 0.00 52.86 50.93 3g5c s ASN 436 Cb 0.05 -1.80 -0.03 0.00 1.28 0.00 0.00 41.25 40.75 3g5c s ASN 436 CO 0.07 0.39 0.51 -0.54 -2.04 0.00 0.00 177.10 175.49 3g5c s LYS 437 N -1.02 4.23 0.83 3.55 1.02 -1.26 -4.70 119.74 122.39 3g5c s LYS 437 Ca 0.15 0.43 -0.11 0.00 0.02 0.00 0.00 55.97 56.46 3g5c s LYS 437 Cb -0.12 -3.53 0.09 0.00 -0.52 0.00 0.00 37.83 33.76 3g5c s LYS 437 CO 0.04 -0.07 1.09 -2.14 -0.92 0.00 0.00 175.35 173.35 3g5c s PRO 438 N 1.39 1.75 0.00 -1.68 0.02 -1.26 -5.04 135.00 130.18 3g5c s PRO 438 Ca 0.25 1.07 -0.00 0.00 0.02 0.00 0.00 61.00 62.33 3g5c s PRO 438 Cb -0.15 -1.85 -0.00 0.00 0.02 0.00 0.00 34.50 32.52 3g5c s PRO 438 CO 0.10 -1.97 -0.00 -1.13 -0.33 0.00 0.00 177.00 173.67 3g5c n SER 439 N -3.73 0.03 -4.50 2.53 3.41 -1.26 -4.63 113.62 105.47 3g5c n SER 439 Ca 0.08 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.27 3g5c n SER 439 Cb 0.54 -0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 3g5c n SER 439 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3g5c s LYS 440 N -1.03 3.73 0.38 4.33 1.02 -1.26 -4.18 119.74 122.73 3g5c s LYS 440 Ca -0.00 -1.74 -0.27 0.00 0.02 0.00 0.00 55.97 53.98 3g5c s LYS 440 Cb 0.00 -5.15 -0.09 0.00 -0.52 0.00 0.00 37.83 32.07 3g5c s LYS 440 CO 0.00 -1.96 1.26 -0.51 -0.92 0.00 0.00 175.35 173.22 3g5c s LEU 441 N 3.37 4.27 0.00 3.17 1.43 -1.26 -4.83 118.68 124.83 3g5c s LEU 441 Ca 0.41 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 56.08 3g5c s LEU 441 Cb -0.02 -3.86 0.00 0.00 0.03 0.00 0.00 46.19 42.34 3g5c s LEU 441 CO -0.06 -0.71 0.00 0.18 0.23 0.00 0.00 176.35 175.99 3g5c n LEU 442 N 0.31 0.00 -4.23 1.79 4.77 -1.25 -4.50 117.00 113.89 3g5c n LEU 442 Ca 0.03 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.74 3g5c n LEU 442 Cb 0.44 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.37 3g5c n LEU 442 CO 0.55 0.00 -0.53 -1.81 -1.33 0.00 0.00 177.39 174.27 3g5c s ASP 443 N -1.26 2.48 0.22 -1.43 1.01 -1.26 -5.12 116.67 111.31 3g5c s ASP 443 Ca 0.00 -0.40 -0.30 0.00 0.71 0.00 0.00 52.55 52.57 3g5c s ASP 443 Cb 0.00 -0.27 -0.15 0.00 1.01 0.00 0.00 42.92 43.51 3g5c s ASP 443 CO 0.00 0.25 0.92 -2.65 0.21 0.00 0.00 175.17 173.90 3g5c n PRO 444 N 2.49 0.88 -1.56 8.23 -0.02 -1.26 -4.87 135.00 138.89 3g5c n PRO 444 Ca -0.15 0.31 -0.44 0.00 -2.02 0.00 0.00 63.50 61.20 3g5c n PRO 444 Cb 0.53 -1.62 -0.01 0.00 -0.02 0.00 0.00 33.50 32.38 3g5c n PRO 444 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3g5c n PRO 445 N 1.09 1.11 -3.59 0.52 -0.02 -1.26 -5.03 135.00 127.83 3g5c n PRO 445 Ca 0.14 0.39 -0.18 0.00 -2.02 0.00 0.00 63.50 61.83 3g5c n PRO 445 Cb 0.27 -1.76 -0.14 0.00 -0.02 0.00 0.00 33.50 31.85 3g5c n PRO 445 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3g5c s GLU 446 N -1.62 0.11 -0.23 -0.52 -6.30 -1.26 -5.12 118.70 103.77 3g5c s GLU 446 Ca 0.61 0.37 -0.29 0.00 -2.50 0.00 0.00 54.97 53.15 3g5c s GLU 446 Cb -0.67 -0.80 -0.02 0.00 0.00 0.00 0.00 34.13 32.64 3g5c s GLU 446 CO 0.59 -0.49 1.53 0.00 0.02 0.00 0.00 175.26 176.91 3g5c n GLY 448 N 4.50 1.83 0.00 0.00 0.00 -1.26 -5.02 105.19 105.25 3g5c n GLY 448 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3g5c n GLY 448 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g5c n ASN 449 N 0.00 0.96 0.00 1.61 0.23 -1.23 -4.47 115.26 112.36 3g5c n ASN 449 Ca 0.00 -0.95 0.00 0.00 -0.53 0.00 0.00 54.58 53.10 3g5c n ASN 449 Cb 0.00 0.99 0.00 0.00 -2.08 0.00 0.00 39.78 38.69 3g5c n ASN 449 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3g5c n GLY 450 N 1.49 0.82 3.11 4.83 0.00 -1.20 -4.93 105.19 109.30 3g5c n GLY 450 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 3g5c n GLY 450 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g5c s PHE 451 N -2.11 2.32 -0.67 1.61 0.40 -1.26 -4.89 117.98 113.38 3g5c s PHE 451 Ca 0.00 -1.15 -0.27 0.00 -0.60 0.00 0.00 56.93 54.90 3g5c s PHE 451 Cb 0.00 -1.63 0.02 0.00 0.51 0.00 0.00 43.02 41.93 3g5c s PHE 451 CO 0.00 -0.56 1.35 0.42 0.70 0.00 0.00 175.22 177.13 3g5c s ILE 452 N 0.94 3.73 0.00 0.64 1.01 -1.26 -4.90 121.20 121.36 3g5c s ILE 452 Ca -0.06 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.09 3g5c s ILE 452 Cb -0.15 -4.71 0.00 0.00 0.01 0.00 0.00 42.46 37.61 3g5c s ILE 452 CO -0.03 -1.57 0.00 -0.62 0.00 0.00 0.00 174.94 172.72 3g5c n GLU 453 N 9.11 0.99 -2.44 2.79 1.02 -1.26 -4.54 120.64 126.30 3g5c n GLU 453 Ca 0.07 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.79 3g5c n GLU 453 Cb 0.49 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.89 3g5c n GLU 453 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3g5c s THR 454 N 0.73 4.16 0.00 2.62 -4.23 -1.26 -3.42 115.64 114.23 3g5c s THR 454 Ca 0.00 1.53 0.00 0.00 -1.18 0.00 0.00 61.69 62.04 3g5c s THR 454 Cb 0.00 -3.98 0.00 0.00 1.34 0.00 0.00 72.50 69.86 3g5c s THR 454 CO 0.00 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 3g5c n GLY 455 N 3.28 3.03 3.81 3.99 0.00 -1.26 -4.86 105.19 113.19 3g5c n GLY 455 Ca 0.10 -0.92 -0.38 0.00 0.00 0.00 0.00 46.02 44.82 3g5c n GLY 455 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3g5c s GLU 456 N 0.00 3.97 -0.14 1.61 -1.05 -1.22 -5.01 118.70 116.85 3g5c s GLU 456 Ca 0.00 0.35 -0.17 0.00 -0.15 0.00 0.00 54.97 55.00 3g5c s GLU 456 Cb 0.00 -3.26 -0.15 0.00 -0.44 0.00 0.00 34.13 30.28 3g5c s GLU 456 CO 0.00 0.59 0.35 0.93 0.95 0.00 0.00 175.26 178.08 3g5c h GLU 457 N 5.15 0.00 -5.23 -4.83 5.08 -1.54 -3.40 114.58 109.81 3g5c h GLU 457 Ca -0.50 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.19 3g5c h GLU 457 Cb 1.21 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.33 3g5c h GLU 457 CO 0.64 0.61 -0.51 0.00 -1.00 0.00 0.00 179.01 178.76 3g5c s ASP 459 N -3.89 -0.35 0.90 0.00 -1.08 -1.26 -4.49 116.67 106.50 3g5c s ASP 459 Ca 0.07 0.23 -0.10 0.00 -0.52 0.00 0.00 52.55 52.22 3g5c s ASP 459 Cb 0.01 1.30 0.20 0.00 -1.46 0.00 0.00 42.92 42.97 3g5c s ASP 459 CO 0.04 -0.07 1.22 0.00 0.52 0.00 0.00 175.17 176.88 3g5c n GLY 461 N -3.44 -1.99 3.09 0.00 0.00 -1.26 -3.27 105.19 98.32 3g5c n GLY 461 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 3g5c n GLY 461 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g5c s THR 462 N 0.00 0.12 0.35 2.61 -4.23 -1.26 -3.54 115.64 109.69 3g5c s THR 462 Ca 0.00 -0.95 0.30 0.00 -1.18 0.00 0.00 61.69 59.86 3g5c s THR 462 Cb 0.00 -0.67 0.45 0.00 1.34 0.00 0.00 72.50 73.62 3g5c s THR 462 CO 0.00 -0.53 1.07 -0.81 -0.54 0.00 0.00 174.62 173.81 3g5c n PRO 463 N 1.09 -0.01 0.11 3.99 -0.04 -1.26 0.13 135.00 139.01 3g5c n PRO 463 Ca -0.21 0.79 -0.05 0.00 -0.04 0.00 0.00 63.50 63.98 3g5c n PRO 463 Cb 0.57 -1.71 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 3g5c n PRO 463 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3g5c h ALA 464 N 0.83 -0.40 0.00 0.55 0.00 -2.02 -3.27 119.26 114.95 3g5c h ALA 464 Ca 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.47 3g5c h ALA 464 Cb 2.36 0.14 0.00 0.00 0.00 0.00 0.00 17.79 20.29 3g5c h ALA 464 CO -0.12 -0.38 0.00 -0.85 0.00 0.00 0.00 179.25 177.90 3g5c n GLU 465 N -4.52 0.24 0.05 0.00 0.28 0.92 -2.99 120.64 114.62 3g5c n GLU 465 Ca -0.04 0.07 -0.11 0.00 -0.16 0.00 0.00 57.16 56.92 3g5c n GLU 465 Cb 0.14 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.51 3g5c n GLU 465 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3g5c h VAL 467 N 0.28 1.06 -0.65 0.00 2.07 -1.58 -1.48 116.25 115.95 3g5c h VAL 467 Ca -0.04 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 3g5c h VAL 467 Cb 1.37 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 3g5c h VAL 467 CO 0.14 0.16 0.32 -0.07 0.02 0.00 0.00 177.57 178.13 3g5c h LEU 468 N 0.86 0.85 -7.06 2.57 3.38 -1.73 -3.44 115.31 110.74 3g5c h LEU 468 Ca 0.32 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 3g5c h LEU 468 Cb 0.18 -0.22 -0.23 0.00 0.09 0.00 0.00 40.66 40.48 3g5c h LEU 468 CO -0.11 0.74 -0.17 -0.70 0.09 0.00 0.00 178.44 178.29 3g5c s GLU 469 N -5.73 0.53 0.00 1.13 2.12 -0.91 -4.98 118.70 110.86 3g5c s GLU 469 Ca -0.13 1.20 0.00 0.00 0.36 0.00 0.00 54.97 56.40 3g5c s GLU 469 Cb 0.14 0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.95 3g5c s GLU 469 CO 0.79 -0.19 0.00 0.41 -0.54 0.00 0.00 175.26 175.73 3g5c n GLY 470 N 4.97 2.22 0.31 -1.50 0.00 -1.21 -4.60 105.19 105.38 3g5c n GLY 470 Ca -0.15 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.05 3g5c n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g5c h ALA 471 N 0.00 1.36 -0.01 4.61 0.00 -1.55 0.79 119.26 124.46 3g5c h ALA 471 Ca 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 3g5c h ALA 471 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3g5c h ALA 471 CO 0.00 -0.01 -0.77 1.49 0.00 0.00 0.00 179.25 179.96 3g5c h GLU 472 N 0.00 0.12 0.00 0.00 4.57 -1.92 -3.37 114.58 113.98 3g5c h GLU 472 Ca 0.00 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 3g5c h GLU 472 Cb 0.01 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.63 3g5c h GLU 472 CO -0.00 0.84 -1.24 0.00 -1.18 0.00 0.00 179.01 177.42 3g5c s LYS 475 N 0.08 0.20 -1.49 0.00 2.20 0.04 -4.65 119.74 116.12 3g5c s LYS 475 Ca 0.09 0.54 -0.13 0.00 -0.36 0.00 0.00 55.97 56.11 3g5c s LYS 475 Cb -0.11 -0.49 0.07 0.00 -1.51 0.00 0.00 37.83 35.78 3g5c s LYS 475 CO -0.00 -0.47 1.04 1.17 -0.36 0.00 0.00 175.35 176.72 3g5c n LYS 476 N 5.34 -6.14 -2.37 4.03 4.81 -1.26 -0.98 118.16 121.59 3g5c n LYS 476 Ca -0.06 0.65 -0.19 0.00 -0.87 0.00 0.00 58.31 57.85 3g5c n LYS 476 Cb 0.50 -5.59 -0.01 0.00 0.02 0.00 0.00 35.03 29.95 3g5c n LYS 476 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3g5c s THR 478 N -2.96 0.41 0.47 0.00 2.01 -0.15 -1.39 115.64 114.03 3g5c s THR 478 Ca 0.00 -0.19 -0.23 0.00 0.31 0.00 0.00 61.69 61.58 3g5c s THR 478 Cb -0.00 -0.37 -0.07 0.00 0.01 0.00 0.00 72.50 72.07 3g5c s THR 478 CO 0.00 0.13 1.19 -0.76 -0.69 0.00 0.00 174.62 174.49 3g5c s LEU 479 N 0.07 3.99 0.00 4.42 1.02 -1.26 -0.78 118.68 126.14 3g5c s LEU 479 Ca -0.00 2.35 0.00 0.00 0.02 0.00 0.00 54.13 56.50 3g5c s LEU 479 Cb -0.04 -4.25 0.00 0.00 0.02 0.00 0.00 46.19 41.92 3g5c s LEU 479 CO -0.00 -0.99 0.00 0.35 0.02 0.00 0.00 176.35 175.73 3g5c n THR 480 N -0.55 0.00 0.13 5.49 -2.24 0.33 -4.89 114.28 112.56 3g5c n THR 480 Ca 0.08 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.80 3g5c n THR 480 Cb 0.48 -1.61 -0.03 0.00 -2.10 0.00 0.00 70.33 67.07 3g5c n THR 480 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3g5c h GLN 481 N 0.00 -0.35 -4.32 -0.78 -0.00 -1.95 -3.38 115.11 104.34 3g5c h GLN 481 Ca 0.00 0.02 -0.76 0.00 -0.00 0.00 0.00 58.65 57.92 3g5c h GLN 481 Cb 0.00 0.08 -0.22 0.00 0.00 0.00 0.00 27.48 27.34 3g5c h GLN 481 CO 0.00 -0.23 0.90 -0.51 0.00 0.00 0.00 178.83 178.98 3g5c s ASP 482 N -3.26 7.08 -0.23 -0.69 1.01 -1.26 -4.95 116.67 114.37 3g5c s ASP 482 Ca -0.05 -3.06 -0.25 0.00 0.71 0.00 0.00 52.55 49.90 3g5c s ASP 482 Cb 0.01 -2.32 0.07 0.00 1.01 0.00 0.00 42.92 41.68 3g5c s ASP 482 CO 0.16 -0.62 0.70 -0.94 0.21 0.00 0.00 175.17 174.68 3g5c s SER 483 N 2.37 -0.72 -0.01 0.27 1.04 -1.26 -4.76 113.70 110.64 3g5c s SER 483 Ca 0.36 1.31 0.01 0.00 0.48 0.00 0.00 55.95 58.11 3g5c s SER 483 Cb -0.06 1.31 -0.02 0.00 0.10 0.00 0.00 66.02 67.35 3g5c s SER 483 CO -0.04 -0.29 0.02 0.00 0.98 0.00 0.00 173.24 173.90 3g5c n GLN 484 N 2.45 1.71 -4.07 4.02 6.02 -0.99 -4.87 117.38 121.64 3g5c n GLN 484 Ca -0.15 -0.01 -0.10 0.00 -0.01 0.00 0.00 57.00 56.73 3g5c n GLN 484 Cb 0.55 -1.03 -0.07 0.00 1.02 0.00 0.00 30.24 30.71 3g5c n GLN 484 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3g5c n SER 486 N -0.32 1.13 -4.19 0.00 2.88 -1.26 -4.62 113.62 107.23 3g5c n SER 486 Ca -0.01 0.16 -0.13 0.00 -1.33 0.00 0.00 58.87 57.56 3g5c n SER 486 Cb 0.64 -0.38 -0.10 0.00 -0.75 0.00 0.00 64.21 63.61 3g5c n SER 486 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 3g5c s ASP 487 N -5.89 1.41 0.00 -3.46 3.84 -1.26 -3.53 116.67 107.77 3g5c s ASP 487 Ca -0.07 -0.92 0.00 0.00 -0.00 0.00 0.00 52.55 51.56 3g5c s ASP 487 Cb 0.01 0.03 0.00 0.00 -1.38 0.00 0.00 42.92 41.59 3g5c s ASP 487 CO 0.10 -0.35 0.00 0.61 -0.00 0.00 0.00 175.17 175.53 3g5c n GLY 488 N 0.19 3.60 0.22 2.12 0.00 -1.26 -4.76 105.19 105.30 3g5c n GLY 488 Ca -0.13 -1.73 0.08 0.00 0.00 0.00 0.00 46.02 44.23 3g5c n GLY 488 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3g5c h LEU 489 N 0.00 0.00 -5.04 0.99 3.38 -1.91 -3.10 115.31 109.63 3g5c h LEU 489 Ca 0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 3g5c h LEU 489 Cb 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 40.44 3g5c h LEU 489 CO 0.00 0.25 0.61 0.00 0.09 0.00 0.00 178.44 179.39 3g5c n LYS 492 N 5.37 0.00 -0.02 0.00 4.81 -0.93 -4.74 118.16 122.66 3g5c n LYS 492 Ca -0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.43 3g5c n LYS 492 Cb 0.50 -0.10 -0.00 0.00 0.02 0.00 0.00 35.03 35.45 3g5c n LYS 492 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 3g5c h LYS 493 N 0.00 0.00 0.00 1.64 1.57 -1.98 -3.46 116.57 114.34 3g5c h LYS 493 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g5c h LYS 493 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3g5c h LYS 493 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 3g5c s LYS 495 N 0.00 2.47 0.79 0.00 3.01 -1.26 -2.36 119.74 122.39 3g5c s LYS 495 Ca 0.00 -1.52 -0.11 0.00 -1.01 0.00 0.00 55.97 53.32 3g5c s LYS 495 Cb 0.00 -2.26 0.07 0.00 -1.01 0.00 0.00 37.83 34.63 3g5c s LYS 495 CO 0.00 0.02 1.12 -0.06 0.51 0.00 0.00 175.35 176.94 3g5c s PHE 496 N -2.43 2.23 -0.08 3.18 2.99 -1.26 -2.19 117.98 120.42 3g5c s PHE 496 Ca 0.41 1.63 -0.16 0.00 0.00 0.00 0.00 56.93 58.81 3g5c s PHE 496 Cb -0.03 -3.20 -0.05 0.00 0.00 0.00 0.00 43.02 39.74 3g5c s PHE 496 CO 0.25 -2.18 0.41 -1.14 -0.00 0.00 0.00 175.22 172.56 3g5c s GLN 497 N -4.60 4.17 0.33 0.44 2.00 -1.20 -4.67 119.66 116.14 3g5c s GLN 497 Ca 0.65 0.36 -0.27 0.00 -2.00 0.00 0.00 55.36 54.11 3g5c s GLN 497 Cb -0.21 -3.36 -0.13 0.00 0.80 0.00 0.00 33.01 30.11 3g5c s GLN 497 CO 0.53 0.36 0.97 -0.35 -0.50 0.00 0.00 175.29 176.31 3g5c n PRO 498 N 3.00 1.29 -1.68 1.67 -0.04 -1.26 -3.39 135.00 134.59 3g5c n PRO 498 Ca -0.10 0.45 -0.45 0.00 -0.04 0.00 0.00 63.50 63.36 3g5c n PRO 498 Cb 0.52 -1.86 -0.04 0.00 -0.04 0.00 0.00 33.50 32.09 3g5c n PRO 498 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 3g5c n MET 499 N 0.59 2.55 0.00 0.54 1.56 -1.26 -2.45 117.12 118.65 3g5c n MET 499 Ca 0.10 0.93 0.00 0.00 -0.27 0.00 0.00 57.70 58.46 3g5c n MET 499 Cb 0.34 -2.81 0.00 0.00 2.15 0.00 0.00 33.22 32.90 3g5c n MET 499 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3g5c n GLY 500 N 4.28 1.09 3.68 -5.12 0.00 0.07 -4.94 105.19 104.25 3g5c n GLY 500 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3g5c n GLY 500 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g5c s THR 501 N -2.00 4.86 -0.26 2.61 2.01 -1.03 -4.75 115.64 117.09 3g5c s THR 501 Ca 0.00 1.74 -0.28 0.00 0.31 0.00 0.00 61.69 63.46 3g5c s THR 501 Cb 0.00 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 3g5c s THR 501 CO 0.00 0.03 2.08 -0.69 -0.69 0.00 0.00 174.62 175.35 3g5c s VAL 502 N 2.07 3.16 -0.15 3.82 1.01 -1.26 0.36 120.40 129.41 3g5c s VAL 502 Ca 0.41 0.16 0.18 0.00 0.00 0.00 0.00 61.98 62.73 3g5c s VAL 502 Cb -0.17 -3.22 -0.26 0.00 0.00 0.00 0.00 36.38 32.73 3g5c s VAL 502 CO 0.14 -0.14 0.16 0.00 0.00 0.00 0.00 175.10 175.26 3g5c s ARG 504 N -2.71 0.03 0.47 0.00 3.52 -1.09 -5.02 118.95 114.14 3g5c s ARG 504 Ca -0.09 0.55 -0.10 0.00 -0.13 0.00 0.00 55.73 55.96 3g5c s ARG 504 Cb 0.08 -0.29 -0.05 0.00 -1.56 0.00 0.00 34.95 33.12 3g5c s ARG 504 CO 0.81 -0.31 0.83 -2.00 -0.81 0.00 0.00 175.30 173.82 3g5c s GLU 505 N 2.29 3.71 0.15 5.12 2.56 -1.26 -0.26 118.70 131.00 3g5c s GLU 505 Ca 0.03 0.48 -0.31 0.00 0.00 0.00 0.00 54.97 55.17 3g5c s GLU 505 Cb -0.12 -2.32 -0.09 0.00 2.00 0.00 0.00 34.13 33.60 3g5c s GLU 505 CO -0.06 -0.18 1.47 0.00 -0.56 0.00 0.00 175.26 175.93 3g5c s ALA 506 N -2.61 3.67 0.14 6.30 0.00 -1.26 -4.84 121.76 123.17 3g5c s ALA 506 Ca 0.51 1.25 0.05 0.00 0.00 0.00 0.00 51.96 53.77 3g5c s ALA 506 Cb -0.10 -3.57 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 3g5c s ALA 506 CO 0.38 -0.69 1.33 -0.39 0.00 0.00 0.00 175.76 176.38 3g5c h VAL 507 N 4.05 1.61 -2.73 0.00 -1.51 -1.89 -3.48 116.25 112.30 3g5c h VAL 507 Ca -0.43 -3.05 -0.10 0.00 -1.23 0.00 0.00 66.70 61.89 3g5c h VAL 507 Cb 1.21 2.69 -0.02 0.00 -2.13 0.00 0.00 31.29 33.04 3g5c h VAL 507 CO 0.87 0.88 -0.05 -0.46 -1.23 0.00 0.00 177.57 177.58 3g5c n ASN 508 N -3.50 -0.51 -0.05 4.19 0.23 -1.26 -4.90 115.26 109.47 3g5c n ASN 508 Ca -0.02 -1.69 0.10 0.00 -0.53 0.00 0.00 54.58 52.44 3g5c n ASN 508 Cb 0.88 0.94 0.59 0.00 -2.08 0.00 0.00 39.78 40.11 3g5c n ASN 508 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 3g5c n ASP 509 N -1.93 0.14 0.01 0.53 5.75 -1.26 -2.24 116.55 117.55 3g5c n ASP 509 Ca 0.00 -1.39 0.11 0.00 -0.01 0.00 0.00 54.79 53.50 3g5c n ASP 509 Cb 0.21 -0.01 0.02 0.00 -1.03 0.00 0.00 41.12 40.32 3g5c n ASP 509 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3g5c s ASP 511 N -3.41 6.39 -0.11 0.00 3.68 -0.95 -0.95 116.67 121.32 3g5c s ASP 511 Ca 0.06 0.39 0.01 0.00 2.13 0.00 0.00 52.55 55.15 3g5c s ASP 511 Cb 0.16 -2.01 -0.01 0.00 -1.45 0.00 0.00 42.92 39.61 3g5c s ASP 511 CO 0.81 -0.01 -0.17 -0.63 0.13 0.00 0.00 175.17 175.30 3g5c s ILE 512 N -1.81 2.75 0.59 4.11 -1.09 -1.23 -4.74 121.20 119.78 3g5c s ILE 512 Ca 0.38 -0.78 -0.19 0.00 -2.23 0.00 0.00 60.65 57.83 3g5c s ILE 512 Cb -0.11 -2.12 -0.03 0.00 -1.58 0.00 0.00 42.46 38.61 3g5c s ILE 512 CO 0.28 0.54 1.23 0.00 -1.23 0.00 0.00 174.94 175.76 3g5c s ARG 513 N 0.26 2.95 -0.09 2.79 1.70 -1.26 -4.66 118.95 120.64 3g5c s ARG 513 Ca -0.12 1.89 0.01 0.00 -0.47 0.00 0.00 55.73 57.04 3g5c s ARG 513 Cb -0.16 -1.96 -0.03 0.00 -0.57 0.00 0.00 34.95 32.24 3g5c s ARG 513 CO 0.06 -1.24 -0.09 -1.21 -1.08 0.00 0.00 175.30 171.74 3g5c s GLU 514 N -3.28 2.94 0.06 3.89 0.41 0.64 -4.98 118.70 118.37 3g5c s GLU 514 Ca 0.77 -0.61 0.07 0.00 -0.41 0.00 0.00 54.97 54.80 3g5c s GLU 514 Cb -0.32 -2.59 -0.04 0.00 -1.78 0.00 0.00 34.13 29.40 3g5c s GLU 514 CO 0.35 0.51 -0.14 0.95 -0.49 0.00 0.00 175.26 176.44 3g5c s THR 515 N -0.41 3.10 0.27 3.63 -4.23 -1.26 -1.79 115.64 114.94 3g5c s THR 515 Ca 0.06 -1.18 -0.30 0.00 -1.18 0.00 0.00 61.69 59.09 3g5c s THR 515 Cb -0.12 -2.37 -0.11 0.00 1.34 0.00 0.00 72.50 71.24 3g5c s THR 515 CO 0.02 0.26 1.52 0.00 -0.54 0.00 0.00 174.62 175.88 3g5c h SER 517 N 5.06 0.00 0.00 0.00 0.87 -1.84 0.24 113.55 117.88 3g5c h SER 517 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 3g5c h SER 517 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 3g5c h SER 517 CO 0.79 0.02 0.00 0.61 -0.53 0.00 0.00 176.83 177.72 3g5c n GLY 518 N 0.29 1.39 0.03 5.77 0.00 -1.22 -4.48 105.19 106.98 3g5c n GLY 518 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 3g5c n GLY 518 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3g5c n ASN 519 N 0.00 3.59 -4.45 1.61 2.85 -1.26 -4.80 115.26 112.79 3g5c n ASN 519 Ca 0.00 0.00 -0.28 0.00 -0.11 0.00 0.00 54.58 54.19 3g5c n ASN 519 Cb 0.00 0.69 -0.11 0.00 1.24 0.00 0.00 39.78 41.59 3g5c n ASN 519 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 3g5c s SER 520 N -3.63 3.61 0.25 1.20 0.15 -1.26 -5.03 113.70 108.99 3g5c s SER 520 Ca -0.03 -0.76 0.13 0.00 0.70 0.00 0.00 55.95 56.00 3g5c s SER 520 Cb 0.02 -0.36 0.05 0.00 -1.71 0.00 0.00 66.02 64.02 3g5c s SER 520 CO 0.24 0.14 1.43 0.77 1.20 0.00 0.00 173.24 177.01 3g5c h SER 521 N 3.33 0.00 -3.89 5.45 4.64 -1.90 -3.43 113.55 117.76 3g5c h SER 521 Ca -0.48 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.38 3g5c h SER 521 Cb 1.20 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 3g5c h SER 521 CO 0.47 0.61 0.28 -1.10 -0.87 0.00 0.00 176.83 176.22 3g5c s GLN 522 N -2.96 4.34 -0.07 4.77 -0.21 -1.26 -1.16 119.66 123.10 3g5c s GLN 522 Ca 0.03 1.11 -0.30 0.00 0.02 0.00 0.00 55.36 56.22 3g5c s GLN 522 Cb 0.08 -2.53 -0.02 0.00 1.00 0.00 0.00 33.01 31.54 3g5c s GLN 522 CO 0.76 0.16 1.12 0.00 -2.12 0.00 0.00 175.29 175.21 3g5c n ALA 524 N 5.08 -2.64 -1.54 0.00 0.00 -1.26 -4.74 120.51 115.42 3g5c n ALA 524 Ca 0.10 0.44 -0.60 0.00 0.00 0.00 0.00 53.44 53.38 3g5c n ALA 524 Cb 0.47 -1.66 -0.08 0.00 0.00 0.00 0.00 19.45 18.18 3g5c n ALA 524 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3g5c n PRO 525 N 1.00 0.00 -1.81 0.00 -0.02 -1.26 -4.78 135.00 128.13 3g5c n PRO 525 Ca 0.17 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.23 3g5c n PRO 525 Cb 0.25 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.20 3g5c n PRO 525 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3g5c s ASN 526 N 0.48 6.29 0.18 2.55 3.84 -1.26 -4.99 114.94 122.02 3g5c s ASN 526 Ca 0.93 2.24 0.08 0.00 0.21 0.00 0.00 52.86 56.32 3g5c s ASN 526 Cb -1.31 -2.53 -0.04 0.00 -0.55 0.00 0.00 41.25 36.82 3g5c s ASN 526 CO 0.61 -1.24 -0.16 0.27 -2.79 0.00 0.00 177.10 173.79 3g5c s ILE 527 N 5.25 1.72 0.33 -5.21 -5.25 -1.26 -4.52 121.20 112.26 3g5c s ILE 527 Ca 0.85 -2.02 0.06 0.00 -0.99 0.00 0.00 60.65 58.54 3g5c s ILE 527 Cb -0.36 -1.89 -0.03 0.00 2.95 0.00 0.00 42.46 43.13 3g5c s ILE 527 CO 0.36 -0.46 0.23 -1.38 -1.79 0.00 0.00 174.94 171.90 3g5c s HIS 528 N -2.48 1.71 0.48 1.37 -3.43 -1.26 -3.51 115.29 108.17 3g5c s HIS 528 Ca 0.18 -1.55 -0.24 0.00 -0.80 0.00 0.00 55.06 52.65 3g5c s HIS 528 Cb -0.03 -0.80 -0.07 0.00 -1.43 0.00 0.00 32.58 30.25 3g5c s HIS 528 CO 0.06 -0.72 1.37 0.15 -2.00 0.00 0.00 174.74 173.60 3g5c s LYS 529 N -3.58 3.54 0.92 -0.38 1.02 -0.13 -1.10 119.74 120.03 3g5c s LYS 529 Ca 0.37 2.28 -0.11 0.00 0.02 0.00 0.00 55.97 58.52 3g5c s LYS 529 Cb 0.03 -2.51 0.14 0.00 -0.52 0.00 0.00 37.83 34.97 3g5c s LYS 529 CO 0.23 -0.89 1.09 0.00 -0.92 0.00 0.00 175.35 174.86 3g5c s MET 530 N -2.60 1.07 -0.12 1.68 0.23 -0.05 -4.41 119.30 115.09 3g5c s MET 530 Ca 0.64 0.96 -0.29 0.00 -1.03 0.00 0.00 55.69 55.97 3g5c s MET 530 Cb -0.41 -1.78 -0.04 0.00 -1.53 0.00 0.00 34.83 31.07 3g5c s MET 530 CO 0.51 -2.41 1.67 -0.51 -2.03 0.00 0.00 175.02 172.25 3g5c s ASP 531 N -3.21 6.49 0.00 -1.18 1.01 -1.26 -3.37 116.67 115.15 3g5c s ASP 531 Ca 0.64 1.99 0.00 0.00 0.71 0.00 0.00 52.55 55.89 3g5c s ASP 531 Cb -0.19 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.21 3g5c s ASP 531 CO 0.58 -1.11 0.00 0.61 0.21 0.00 0.00 175.17 175.46 3g5c n GLY 532 N 4.42 1.37 3.75 0.21 0.00 -1.05 -4.94 105.19 108.95 3g5c n GLY 532 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3g5c n GLY 532 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g5c s TYR 533 N 0.00 2.90 0.33 1.61 1.51 -1.22 -4.73 117.35 117.75 3g5c s TYR 533 Ca 0.00 0.88 -0.27 0.00 -1.01 0.00 0.00 57.07 56.68 3g5c s TYR 533 Cb 0.00 -3.94 -0.09 0.00 -0.11 0.00 0.00 41.96 37.82 3g5c s TYR 533 CO 0.00 -3.14 1.01 -1.54 -1.11 0.00 0.00 175.55 170.77 3g5c s SER 534 N 0.48 7.17 0.25 2.29 1.04 -1.26 -0.17 113.70 123.49 3g5c s SER 534 Ca 0.62 2.02 0.02 0.00 0.48 0.00 0.00 55.95 59.09 3g5c s SER 534 Cb -0.45 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.02 3g5c s SER 534 CO 0.44 -0.20 0.06 0.00 0.98 0.00 0.00 173.24 174.52 3g5c n ASP 536 N -0.44 -4.53 -2.21 0.00 8.00 -1.26 -0.23 116.55 115.87 3g5c n ASP 536 Ca -0.02 0.32 -0.04 0.00 0.71 0.00 0.00 54.79 55.76 3g5c n ASP 536 Cb 0.65 -4.02 0.01 0.00 -0.02 0.00 0.00 41.12 37.74 3g5c n ASP 536 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3g5c n GLY 537 N -0.47 -1.05 4.27 0.44 0.00 -1.26 -3.91 105.19 103.21 3g5c n GLY 537 Ca -0.18 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.46 3g5c n GLY 537 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3g5c n VAL 538 N -0.39 0.00 0.12 1.61 3.14 -1.23 -4.69 118.33 116.90 3g5c n VAL 538 Ca 0.06 0.00 0.04 0.00 -2.96 0.00 0.00 64.34 61.49 3g5c n VAL 538 Cb 0.24 -0.17 0.02 0.00 -1.06 0.00 0.00 33.84 32.86 3g5c n VAL 538 CO 0.00 0.00 0.00 -0.61 -6.46 0.00 0.00 176.83 169.76 3g5c h GLN 539 N 0.00 0.00 -4.85 1.45 5.75 -1.66 -3.48 115.11 112.32 3g5c h GLN 539 Ca 0.00 0.00 -0.33 0.00 -0.15 0.00 0.00 58.65 58.17 3g5c h GLN 539 Cb 0.00 0.00 -0.15 0.00 1.07 0.00 0.00 27.48 28.40 3g5c h GLN 539 CO 0.00 0.31 -0.62 0.20 -2.65 0.00 0.00 178.83 176.07 3g5c s GLY 540 N -4.49 1.70 -0.03 2.39 0.00 0.67 -4.57 107.32 102.99 3g5c s GLY 540 Ca 0.02 -1.85 0.01 0.00 0.00 0.00 0.00 44.72 42.91 3g5c s GLY 540 CO 0.76 -1.57 -0.03 -0.42 0.00 0.00 0.00 173.10 171.83 3g5c s ILE 541 N -3.81 0.38 0.16 0.90 1.01 -1.21 -0.11 121.20 118.53 3g5c s ILE 541 Ca 0.38 -0.09 -0.31 0.00 0.00 0.00 0.00 60.65 60.64 3g5c s ILE 541 Cb 0.08 -0.40 -0.08 0.00 0.01 0.00 0.00 42.46 42.06 3g5c s ILE 541 CO 0.13 0.17 1.32 0.00 0.00 0.00 0.00 174.94 176.56 3g5c s PHE 543 N 0.54 0.04 -1.79 0.00 0.40 0.67 -2.52 117.98 115.33 3g5c s PHE 543 Ca 0.60 0.14 0.00 0.00 -0.60 0.00 0.00 56.93 57.06 3g5c s PHE 543 Cb -0.36 -0.50 0.00 0.00 0.51 0.00 0.00 43.02 42.67 3g5c s PHE 543 CO 0.35 -0.33 0.00 0.41 0.70 0.00 0.00 175.22 176.35 3g5c n GLY 544 N 5.30 0.71 1.39 4.36 0.00 -1.26 -1.65 105.19 114.03 3g5c n GLY 544 Ca -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3g5c n GLY 544 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g5c n GLY 545 N -0.85 0.80 3.54 -0.02 0.00 -1.26 -4.63 105.19 102.77 3g5c n GLY 545 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 3g5c n GLY 545 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g5c s ARG 546 N -0.54 2.36 -0.07 1.61 0.52 -0.66 -4.23 118.95 117.94 3g5c s ARG 546 Ca 0.00 -0.83 -0.22 0.00 -0.52 0.00 0.00 55.73 54.16 3g5c s ARG 546 Cb 0.00 -2.37 -0.04 0.00 0.52 0.00 0.00 34.95 33.06 3g5c s ARG 546 CO 0.00 0.58 0.66 0.00 0.02 0.00 0.00 175.30 176.55 3g5c s LYS 548 N 0.66 2.50 0.34 0.00 1.02 -0.97 -4.92 119.74 118.37 3g5c s LYS 548 Ca 0.35 -1.93 0.09 0.00 0.02 0.00 0.00 55.97 54.50 3g5c s LYS 548 Cb -0.17 -3.89 -0.07 0.00 -0.52 0.00 0.00 37.83 33.18 3g5c s LYS 548 CO 0.17 -1.18 -0.07 0.95 -0.92 0.00 0.00 175.35 174.29 3g5c s THR 549 N 1.05 2.09 0.26 2.17 -4.23 -1.26 -3.29 115.64 112.43 3g5c s THR 549 Ca 0.08 -2.16 0.09 0.00 -1.18 0.00 0.00 61.69 58.52 3g5c s THR 549 Cb -0.24 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 3g5c s THR 549 CO -0.02 -0.19 1.59 0.03 -0.54 0.00 0.00 174.62 175.49 3g5c h ARG 550 N 2.03 0.06 -0.33 3.99 3.08 -1.95 -2.54 114.38 118.73 3g5c h ARG 550 Ca -0.42 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.43 3g5c h ARG 550 Cb 1.25 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.30 3g5c h ARG 550 CO 0.71 0.67 -0.40 0.22 -1.07 0.00 0.00 179.97 180.09 3g5c h ASP 551 N 0.04 0.86 0.58 7.04 1.82 -1.96 -1.70 116.42 123.11 3g5c h ASP 551 Ca -0.01 -0.39 -0.14 0.00 -0.39 0.00 0.00 57.03 56.10 3g5c h ASP 551 Cb 1.11 -0.24 -0.02 0.00 0.68 0.00 0.00 39.33 40.87 3g5c h ASP 551 CO 0.09 1.15 -0.65 0.03 -1.61 0.00 0.00 179.24 178.25 3g5c h ARG 552 N 0.65 0.06 -0.24 0.28 3.08 -1.94 -2.43 114.38 113.84 3g5c h ARG 552 Ca 0.05 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 3g5c h ARG 552 Cb 0.97 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.02 3g5c h ARG 552 CO 0.09 0.69 -0.54 0.37 -1.07 0.00 0.00 179.97 179.51 3g5c h GLN 553 N 0.04 0.72 -0.49 0.04 4.15 -1.36 -1.22 115.11 116.99 3g5c h GLN 553 Ca -0.01 -0.45 -0.07 0.00 0.77 0.00 0.00 58.65 58.89 3g5c h GLN 553 Cb 1.15 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.87 3g5c h GLN 553 CO 0.09 1.07 0.02 0.00 -1.93 0.00 0.00 178.83 178.07 3g5c h LYS 555 N 0.76 0.40 -0.38 0.00 1.57 -1.36 -1.67 116.57 115.88 3g5c h LYS 555 Ca 0.15 -0.35 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 3g5c h LYS 555 Cb 0.44 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 3g5c h LYS 555 CO 0.02 1.00 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.94 3g5c h TYR 556 N 0.26 0.66 0.09 -1.35 3.20 -1.09 -0.98 116.97 117.76 3g5c h TYR 556 Ca -0.04 -0.09 -0.31 0.00 3.14 0.00 0.00 58.73 61.43 3g5c h TYR 556 Cb 1.38 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 3g5c h TYR 556 CO 0.05 0.66 -1.67 0.82 -1.64 0.00 0.00 178.16 176.37 3g5c h ILE 557 N 0.59 0.80 0.00 1.81 2.04 -1.51 -3.43 117.51 117.80 3g5c h ILE 557 Ca 0.12 -2.31 0.00 0.00 1.00 0.00 0.00 64.86 63.66 3g5c h ILE 557 Cb 0.43 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 3g5c h ILE 557 CO 0.02 0.70 -0.72 0.79 0.00 0.00 0.00 178.15 178.94 3g5c n TRP 558 N -3.84 0.00 0.00 1.37 7.02 -0.63 -0.19 117.44 121.17 3g5c n TRP 558 Ca -0.30 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.18 3g5c n TRP 558 Cb 0.92 -0.06 0.00 0.00 -2.42 0.00 0.00 31.31 29.75 3g5c n TRP 558 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3g5c n GLY 559 N 1.42 3.34 0.23 6.99 0.00 -0.37 -4.75 105.19 112.05 3g5c n GLY 559 Ca 0.01 -1.92 0.08 0.00 0.00 0.00 0.00 46.02 44.19 3g5c n GLY 559 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3g5c h GLN 560 N 0.00 0.00 0.00 1.61 5.75 -1.92 -2.49 115.11 118.06 3g5c h GLN 560 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3g5c h GLN 560 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 3g5c h GLN 560 CO 0.00 0.21 0.00 1.17 -2.65 0.00 0.00 178.83 177.56 3g5c n LYS 561 N -3.89 0.22 -3.09 1.69 4.81 -1.26 -4.80 118.16 111.84 3g5c n LYS 561 Ca -0.02 0.29 -0.38 0.00 -0.87 0.00 0.00 58.31 57.33 3g5c n LYS 561 Cb 0.30 -1.82 -0.06 0.00 0.02 0.00 0.00 35.03 33.47 3g5c n LYS 561 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3g5c s VAL 562 N -3.18 4.53 0.20 3.15 1.01 -0.94 -4.98 120.40 120.19 3g5c s VAL 562 Ca 0.08 1.42 0.10 0.00 0.00 0.00 0.00 61.98 63.57 3g5c s VAL 562 Cb 0.11 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3g5c s VAL 562 CO 0.51 0.39 -0.19 0.42 0.00 0.00 0.00 175.10 176.23 3g5c s THR 563 N -1.31 2.02 0.39 3.92 -4.23 -1.26 -4.46 115.64 110.72 3g5c s THR 563 Ca 0.38 -2.08 -0.25 0.00 -1.18 0.00 0.00 61.69 58.55 3g5c s THR 563 Cb -0.20 -2.01 -0.09 0.00 1.34 0.00 0.00 72.50 71.55 3g5c s THR 563 CO 0.22 -0.35 1.15 0.00 -0.54 0.00 0.00 174.62 175.10 3g5c s ALA 564 N -2.24 3.15 0.93 3.99 0.00 -1.26 -0.44 121.76 125.88 3g5c s ALA 564 Ca 0.20 0.92 -0.11 0.00 0.00 0.00 0.00 51.96 52.97 3g5c s ALA 564 Cb -0.05 -3.36 0.15 0.00 0.00 0.00 0.00 23.12 19.86 3g5c s ALA 564 CO 0.09 -0.46 1.09 -1.12 0.00 0.00 0.00 175.76 175.36 3g5c s SER 565 N -1.20 3.07 0.64 0.00 0.01 -0.18 -4.58 113.70 111.46 3g5c s SER 565 Ca 0.57 1.70 -0.18 0.00 1.31 0.00 0.00 55.95 59.34 3g5c s SER 565 Cb -0.29 -2.33 -0.01 0.00 0.21 0.00 0.00 66.02 63.59 3g5c s SER 565 CO 0.37 -2.92 1.26 -0.62 0.41 0.00 0.00 173.24 171.73 3g5c s ASP 566 N -3.10 4.77 0.59 2.44 -1.08 -1.26 -4.89 116.67 114.13 3g5c s ASP 566 Ca 0.65 2.52 0.28 0.00 -0.52 0.00 0.00 52.55 55.48 3g5c s ASP 566 Cb -0.20 -2.61 1.60 0.00 -1.46 0.00 0.00 42.92 40.25 3g5c s ASP 566 CO 0.58 -1.89 2.05 0.07 0.52 0.00 0.00 175.17 176.51 3g5c h LYS 567 N 0.58 0.00 -0.10 4.34 2.10 -1.99 -0.68 116.57 120.83 3g5c h LYS 567 Ca -0.50 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.02 3g5c h LYS 567 Cb 1.32 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.64 3g5c h LYS 567 CO 0.53 0.00 -0.52 -0.92 -2.00 0.00 0.00 179.45 176.55 3g5c h TYR 568 N 0.00 0.32 -0.99 0.07 5.03 -1.98 -1.52 116.97 117.90 3g5c h TYR 568 Ca 0.12 -0.11 0.05 0.00 2.58 0.00 0.00 58.73 61.37 3g5c h TYR 568 Cb 0.65 -0.06 -0.06 0.00 1.55 0.00 0.00 36.73 38.80 3g5c h TYR 568 CO 0.00 0.72 0.65 0.00 -1.32 0.00 0.00 178.16 178.21 3g5c h TYR 570 N 1.23 -0.11 0.00 0.00 0.05 -1.55 -2.69 116.97 113.90 3g5c h TYR 570 Ca 0.41 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.18 3g5c h TYR 570 Cb 0.05 0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.83 3g5c h TYR 570 CO -0.00 0.35 0.12 0.93 -1.05 0.00 0.00 178.16 178.51 3g5c h GLU 571 N -0.65 0.00 0.00 4.88 5.08 -0.98 -2.54 114.58 120.37 3g5c h GLU 571 Ca -0.01 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 3g5c h GLU 571 Cb 0.52 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 3g5c h GLU 571 CO 0.02 0.00 -1.58 1.63 -1.00 0.00 0.00 179.01 178.08 3g5c n LYS 572 N -2.82 0.44 0.07 2.33 4.76 -0.84 -4.70 118.16 117.41 3g5c n LYS 572 Ca -0.02 0.05 -0.13 0.00 -2.87 0.00 0.00 58.31 55.34 3g5c n LYS 572 Cb 0.17 -1.21 -0.14 0.00 -1.84 0.00 0.00 35.03 32.02 3g5c n LYS 572 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3g5c h LEU 573 N 0.00 0.26 -0.84 -0.35 3.38 -1.44 -3.36 115.31 112.96 3g5c h LEU 573 Ca -0.23 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.38 3g5c h LEU 573 Cb 1.37 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 3g5c h LEU 573 CO -0.03 1.26 -0.21 0.78 0.09 0.00 0.00 178.44 180.33 3g5c h ASN 574 N 0.05 0.00 1.17 -0.43 2.35 -1.64 -2.89 115.58 114.18 3g5c h ASN 574 Ca -0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 3g5c h ASN 574 Cb 1.94 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.31 3g5c h ASN 574 CO 0.16 0.21 -0.18 -0.38 -1.65 0.00 0.00 177.43 175.59 3g5c n ILE 575 N -3.28 0.38 0.02 2.81 -0.00 -1.26 -0.72 119.36 117.31 3g5c n ILE 575 Ca 0.01 -0.20 -0.13 0.00 -0.00 0.00 0.00 62.75 62.43 3g5c n ILE 575 Cb 0.47 -0.40 -0.09 0.00 -0.00 0.00 0.00 39.64 39.62 3g5c n ILE 575 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 3g5c h GLU 576 N 0.00 -0.06 -0.46 0.38 5.08 -1.66 -3.41 114.58 114.46 3g5c h GLU 576 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g5c h GLU 576 Cb 0.67 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3g5c h GLU 576 CO 0.00 0.29 0.00 0.41 -1.00 0.00 0.00 179.01 178.71 3g5c n GLY 577 N -0.15 1.00 1.65 -3.84 0.00 -1.01 -4.80 105.19 98.03 3g5c n GLY 577 Ca -0.08 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 3g5c n GLY 577 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g5c n THR 578 N -1.38 0.00 0.55 2.61 -2.24 -0.84 -4.50 114.28 108.47 3g5c n THR 578 Ca 0.00 -0.96 0.11 0.00 -2.27 0.00 0.00 64.05 60.92 3g5c n THR 578 Cb 0.25 -0.24 0.43 0.00 -2.10 0.00 0.00 70.33 68.68 3g5c n THR 578 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3g5c n GLU 579 N -1.00 0.11 0.00 -0.78 4.71 -1.26 -2.98 120.64 119.43 3g5c n GLU 579 Ca -0.02 0.27 0.12 0.00 -0.01 0.00 0.00 57.16 57.52 3g5c n GLU 579 Cb 0.27 -1.68 0.10 0.00 -1.01 0.00 0.00 31.44 29.12 3g5c n GLU 579 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3g5c n LYS 580 N -1.88 1.23 0.00 3.49 5.02 -1.26 -4.90 118.16 119.87 3g5c n LYS 580 Ca 0.04 -0.97 0.00 0.00 -2.02 0.00 0.00 58.31 55.36 3g5c n LYS 580 Cb 0.25 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 3g5c n LYS 580 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g5c n GLY 581 N 1.39 0.78 3.83 0.72 0.00 -1.16 -4.81 105.19 105.94 3g5c n GLY 581 Ca 0.10 0.60 -0.06 0.00 0.00 0.00 0.00 46.02 46.66 3g5c n GLY 581 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g5c s ASN 582 N 0.00 -0.15 -0.27 1.61 2.20 -1.26 -1.99 114.94 115.08 3g5c s ASN 582 Ca 0.00 -0.71 0.12 0.00 -0.94 0.00 0.00 52.86 51.33 3g5c s ASN 582 Cb 0.00 0.69 0.65 0.00 -2.00 0.00 0.00 41.25 40.59 3g5c s ASN 582 CO 0.00 -1.31 1.63 0.00 -2.94 0.00 0.00 177.10 174.48 3g5c n GLY 584 N -0.38 0.45 3.01 0.00 0.00 -1.25 -4.84 105.19 102.17 3g5c n GLY 584 Ca 0.33 -2.21 -0.20 0.00 0.00 0.00 0.00 46.02 43.94 3g5c n GLY 584 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3g5c s LYS 585 N -0.55 0.94 0.00 1.61 2.20 -1.26 -0.47 119.74 122.21 3g5c s LYS 585 Ca 0.00 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.29 3g5c s LYS 585 Cb 0.00 -0.88 0.00 0.00 -1.51 0.00 0.00 37.83 35.44 3g5c s LYS 585 CO 0.00 0.14 0.00 -3.47 -0.36 0.00 0.00 175.35 171.66 3g5c n ASP 586 N 3.18 0.00 -3.94 1.43 2.03 -0.37 -4.92 116.55 113.97 3g5c n ASP 586 Ca -0.17 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.74 3g5c n ASP 586 Cb 0.55 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.93 3g5c n ASP 586 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3g5c n LYS 587 N 0.00 3.91 -1.49 -0.67 5.02 -1.26 -4.66 118.16 119.01 3g5c n LYS 587 Ca 0.00 -4.57 -0.17 0.00 -2.02 0.00 0.00 58.31 51.55 3g5c n LYS 587 Cb 0.00 -2.46 -0.07 0.00 -0.02 0.00 0.00 35.03 32.48 3g5c n LYS 587 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3g5c n ASP 588 N 1.43 -5.47 -3.97 4.39 8.00 -1.26 -4.96 116.55 114.70 3g5c n ASP 588 Ca 0.26 0.42 -0.25 0.00 0.71 0.00 0.00 54.79 55.93 3g5c n ASP 588 Cb 0.35 -4.55 -0.17 0.00 -0.02 0.00 0.00 41.12 36.74 3g5c n ASP 588 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3g5c s THR 589 N -2.44 1.06 0.46 -3.53 -4.23 -1.26 -5.13 115.64 100.56 3g5c s THR 589 Ca 0.00 -0.39 -0.23 0.00 -1.18 0.00 0.00 61.69 59.89 3g5c s THR 589 Cb 0.00 -1.01 -0.07 0.00 1.34 0.00 0.00 72.50 72.76 3g5c s THR 589 CO 0.00 0.35 1.24 0.26 -0.54 0.00 0.00 174.62 175.93 3g5c s TRP 590 N 1.05 2.75 -0.18 3.99 0.52 -1.26 -1.23 118.94 124.58 3g5c s TRP 590 Ca -0.07 1.48 -0.17 0.00 0.02 0.00 0.00 56.10 57.36 3g5c s TRP 590 Cb -0.15 -3.53 -0.04 0.00 -1.15 0.00 0.00 33.47 28.60 3g5c s TRP 590 CO -0.01 -1.92 0.43 0.42 0.02 0.00 0.00 176.95 175.89 3g5c s ILE 591 N -1.42 5.19 -0.06 2.03 1.09 0.38 -4.86 121.20 123.55 3g5c s ILE 591 Ca 0.63 0.79 -0.25 0.00 -1.10 0.00 0.00 60.65 60.72 3g5c s ILE 591 Cb -0.33 -3.76 -0.03 0.00 -1.06 0.00 0.00 42.46 37.28 3g5c s ILE 591 CO 0.41 0.27 0.77 0.00 -0.10 0.00 0.00 174.94 176.28 3g5c s GLN 592 N 1.12 4.45 0.49 2.79 -2.07 -1.26 1.00 119.66 126.17 3g5c s GLN 592 Ca 0.21 0.99 -0.22 0.00 -1.82 0.00 0.00 55.36 54.52 3g5c s GLN 592 Cb -0.15 -3.46 -0.06 0.00 -1.09 0.00 0.00 33.01 28.25 3g5c s GLN 592 CO 0.08 0.00 1.24 0.00 -1.32 0.00 0.00 175.29 175.29 3g5c s ASN 594 N -1.21 5.97 0.62 0.00 2.47 -1.26 -4.37 114.94 117.16 3g5c s ASN 594 Ca 0.66 1.83 0.36 0.00 0.42 0.00 0.00 52.86 56.13 3g5c s ASN 594 Cb -0.33 -2.54 2.06 0.00 -1.45 0.00 0.00 41.25 38.99 3g5c s ASN 594 CO 0.39 -1.04 2.30 0.07 -3.72 0.00 0.00 177.10 175.11 3g5c h LYS 595 N 0.74 0.00 -0.08 0.43 2.10 -1.98 -1.65 116.57 116.13 3g5c h LYS 595 Ca -0.48 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 57.94 3g5c h LYS 595 Cb 1.22 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.56 3g5c h LYS 595 CO 0.58 0.00 -0.88 0.00 -2.00 0.00 0.00 179.45 177.15 3g5c h ARG 596 N 0.00 0.68 -0.94 0.07 -0.00 -1.99 -3.34 114.38 108.85 3g5c h ARG 596 Ca 0.00 -0.62 -0.63 0.00 -0.50 0.00 0.00 59.98 58.23 3g5c h ARG 596 Cb 0.01 0.15 -0.31 0.00 0.00 0.00 0.00 29.97 29.82 3g5c h ARG 596 CO -0.00 1.23 0.55 -0.25 0.00 0.00 0.00 179.97 181.50 3g5c n ASP 597 N -3.87 6.81 0.20 7.04 8.00 -0.63 -4.62 116.55 129.48 3g5c n ASP 597 Ca -0.08 -3.77 0.12 0.00 0.71 0.00 0.00 54.79 51.77 3g5c n ASP 597 Cb 0.80 -0.85 0.16 0.00 -0.02 0.00 0.00 41.12 41.21 3g5c n ASP 597 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 3g5c h VAL 598 N 1.20 0.00 -0.44 2.53 3.04 -1.67 -3.14 116.25 117.77 3g5c h VAL 598 Ca 0.56 -0.98 0.00 0.00 -1.01 0.00 0.00 66.70 65.27 3g5c h VAL 598 Cb 1.11 1.93 0.00 0.00 -2.01 0.00 0.00 31.29 32.32 3g5c h VAL 598 CO 1.39 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 178.13 3g5c n LEU 599 N -3.03 3.31 -0.32 3.16 7.99 -1.26 -4.25 117.00 122.61 3g5c n LEU 599 Ca 0.04 -1.48 0.03 0.00 -0.01 0.00 0.00 56.01 54.59 3g5c n LEU 599 Cb 0.53 -0.28 0.06 0.00 -0.11 0.00 0.00 43.42 43.61 3g5c n LEU 599 CO 0.34 0.74 0.46 0.00 -1.51 0.00 0.00 177.39 177.43 3g5c n GLY 601 N 0.23 0.67 3.69 0.00 0.00 -1.25 -4.15 105.19 104.39 3g5c n GLY 601 Ca 0.05 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3g5c n GLY 601 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3g5c s TYR 602 N 2.93 2.32 0.01 1.61 5.04 -0.14 -0.65 117.35 128.48 3g5c s TYR 602 Ca 0.00 0.21 -0.30 0.00 -2.44 0.00 0.00 57.07 54.54 3g5c s TYR 602 Cb 0.00 -4.02 -0.06 0.00 0.35 0.00 0.00 41.96 38.23 3g5c s TYR 602 CO 0.00 -4.16 1.42 -1.17 -1.34 0.00 0.00 175.55 170.30 3g5c s LEU 603 N 2.72 4.32 -0.19 6.97 2.96 0.16 -4.79 118.68 130.83 3g5c s LEU 603 Ca 0.76 2.15 0.00 0.00 -0.22 0.00 0.00 54.13 56.82 3g5c s LEU 603 Cb -0.41 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 42.73 3g5c s LEU 603 CO 0.33 -0.73 -0.16 -0.76 -1.32 0.00 0.00 176.35 173.72 3g5c s LEU 604 N 2.34 2.39 0.40 -0.68 1.43 -1.26 -4.46 118.68 118.83 3g5c s LEU 604 Ca 0.65 -0.67 0.08 0.00 -1.03 0.00 0.00 54.13 53.15 3g5c s LEU 604 Cb -0.32 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 3g5c s LEU 604 CO 0.27 -0.02 0.16 0.00 0.23 0.00 0.00 176.35 176.99 3g5c n THR 606 N -1.20 0.00 -3.05 0.00 -2.24 0.41 0.37 114.28 108.57 3g5c n THR 606 Ca -0.02 0.01 -0.45 0.00 -2.27 0.00 0.00 64.05 61.32 3g5c n THR 606 Cb 0.64 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 3g5c n THR 606 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3g5c s ASN 607 N -1.04 6.59 0.32 3.42 2.47 -1.26 -4.06 114.94 121.37 3g5c s ASN 607 Ca 0.00 -2.10 -0.07 0.00 0.42 0.00 0.00 52.86 51.12 3g5c s ASN 607 Cb 0.00 -2.34 -0.06 0.00 -1.45 0.00 0.00 41.25 37.41 3g5c s ASN 607 CO 0.00 -0.96 0.61 -0.51 -3.72 0.00 0.00 177.10 172.53 3g5c s ILE 608 N 2.07 4.96 0.00 -5.21 2.07 -1.26 -4.76 121.20 119.07 3g5c s ILE 608 Ca 0.26 0.23 0.00 0.00 -1.41 0.00 0.00 60.65 59.72 3g5c s ILE 608 Cb -0.09 -3.73 0.00 0.00 0.13 0.00 0.00 42.46 38.77 3g5c s ILE 608 CO -0.07 -0.36 0.00 0.61 -1.91 0.00 0.00 174.94 173.21 3g5c n GLY 609 N -0.99 0.24 0.13 1.50 0.00 -1.26 -5.05 105.19 99.75 3g5c n GLY 609 Ca -0.01 -1.75 0.01 0.00 0.00 0.00 0.00 46.02 44.28 3g5c n GLY 609 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3g5c n ASN 610 N 0.00 0.66 -3.60 1.61 6.94 -1.26 -4.96 115.26 114.65 3g5c n ASN 610 Ca 0.00 -1.67 -0.27 0.00 -0.02 0.00 0.00 54.58 52.62 3g5c n ASN 610 Cb 0.00 -0.09 -0.16 0.00 -2.36 0.00 0.00 39.78 37.16 3g5c n ASN 610 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 3g5c s ILE 611 N -0.51 0.00 0.59 1.53 1.10 -1.26 -5.01 121.20 117.64 3g5c s ILE 611 Ca 0.03 -0.47 -0.17 0.00 -0.51 0.00 0.00 60.65 59.53 3g5c s ILE 611 Cb 0.03 -0.81 -0.03 0.00 0.15 0.00 0.00 42.46 41.80 3g5c s ILE 611 CO 0.00 -0.46 1.11 -2.16 -2.11 0.00 0.00 174.94 171.32 3g5c s PRO 612 N 2.08 3.16 0.41 3.50 0.04 -1.26 -4.35 135.00 138.59 3g5c s PRO 612 Ca 0.05 1.46 0.13 0.00 0.04 0.00 0.00 61.00 62.67 3g5c s PRO 612 Cb -0.16 -1.99 0.87 0.00 0.04 0.00 0.00 34.50 33.25 3g5c s PRO 612 CO -0.20 -0.97 1.92 0.00 0.04 0.00 0.00 177.00 177.79 3g5c h ARG 613 N 0.67 0.04 -4.59 4.56 3.08 -0.85 -3.27 114.38 114.02 3g5c h ARG 613 Ca -0.48 -0.01 -0.23 0.00 0.07 0.00 0.00 59.98 59.32 3g5c h ARG 613 Cb 1.25 -0.01 -0.15 0.00 0.08 0.00 0.00 29.97 31.14 3g5c h ARG 613 CO 0.56 0.28 -0.65 -0.48 -1.07 0.00 0.00 179.97 178.61 3g5c s LEU 614 N -8.52 1.85 0.00 3.04 2.34 -1.26 -1.02 118.68 115.11 3g5c s LEU 614 Ca -0.04 -1.22 0.00 0.00 0.06 0.00 0.00 54.13 52.93 3g5c s LEU 614 Cb 0.15 0.16 0.00 0.00 -0.56 0.00 0.00 46.19 45.94 3g5c s LEU 614 CO 0.71 -0.68 0.00 0.61 -1.06 0.00 0.00 176.35 175.93 3g5c n GLY 615 N -0.18 -0.86 3.09 -3.48 0.00 -1.26 -4.84 105.19 97.65 3g5c n GLY 615 Ca -0.05 -1.14 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 3g5c n GLY 615 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3g5c s GLU 616 N 0.00 2.60 -0.18 1.61 2.12 0.68 -4.88 118.70 120.66 3g5c s GLU 616 Ca 0.00 -0.69 -0.29 0.00 0.36 0.00 0.00 54.97 54.35 3g5c s GLU 616 Cb 0.00 -2.23 -0.03 0.00 0.26 0.00 0.00 34.13 32.14 3g5c s GLU 616 CO 0.00 -0.12 1.54 -1.17 -0.54 0.00 0.00 175.26 174.97 3g5c s LEU 617 N 1.13 4.04 -1.11 2.70 2.96 -1.26 -0.05 118.68 127.10 3g5c s LEU 617 Ca -0.01 1.74 -0.09 0.00 -0.22 0.00 0.00 54.13 55.55 3g5c s LEU 617 Cb -0.14 -3.53 0.28 0.00 0.50 0.00 0.00 46.19 43.29 3g5c s LEU 617 CO -0.06 -1.09 1.11 -0.67 -1.32 0.00 0.00 176.35 174.32 3g5c n ASP 618 N 7.78 5.49 0.00 3.68 2.03 0.21 -4.95 116.55 130.79 3g5c n ASP 618 Ca 0.17 -3.05 0.00 0.00 0.52 0.00 0.00 54.79 52.43 3g5c n ASP 618 Cb 0.45 -1.36 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 3g5c n ASP 618 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3g5c n GLY 619 N 2.63 0.17 3.78 0.27 0.00 -1.26 -4.63 105.19 106.15 3g5c n GLY 619 Ca 0.24 -1.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.18 3g5c n GLY 619 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g5c s GLU 620 N 0.00 2.36 0.01 1.61 8.01 -1.26 -5.02 118.70 124.41 3g5c s GLU 620 Ca 0.00 -1.66 -0.25 0.00 0.01 0.00 0.00 54.97 53.07 3g5c s GLU 620 Cb 0.00 -2.16 -0.05 0.00 -4.31 0.00 0.00 34.13 27.62 3g5c s GLU 620 CO 0.00 -0.06 0.77 0.42 0.01 0.00 0.00 175.26 176.40 3g5c s ILE 621 N -2.50 4.84 0.19 -1.63 1.09 -1.26 -4.69 121.20 117.23 3g5c s ILE 621 Ca 0.42 1.62 -0.28 0.00 -1.10 0.00 0.00 60.65 61.31 3g5c s ILE 621 Cb -0.00 -4.12 -0.08 0.00 -1.06 0.00 0.00 42.46 37.20 3g5c s ILE 621 CO 0.24 0.31 0.88 -0.89 -0.10 0.00 0.00 174.94 175.38 3g5c s THR 622 N 0.31 4.26 -0.35 2.92 2.01 -1.04 -4.92 115.64 118.83 3g5c s THR 622 Ca 0.40 1.93 0.06 0.00 0.31 0.00 0.00 61.69 64.40 3g5c s THR 622 Cb -0.20 -4.25 0.18 0.00 0.01 0.00 0.00 72.50 68.24 3g5c s THR 622 CO 0.22 0.48 0.58 -0.94 -0.69 0.00 0.00 174.62 174.27 3g5c s SER 623 N -0.96 -1.23 0.38 3.53 1.04 -1.26 -1.55 113.70 113.65 3g5c s SER 623 Ca 0.40 -0.42 0.07 0.00 0.48 0.00 0.00 55.95 56.48 3g5c s SER 623 Cb -0.24 1.83 -0.00 0.00 0.10 0.00 0.00 66.02 67.70 3g5c s SER 623 CO 0.29 -0.24 0.50 -0.89 0.98 0.00 0.00 173.24 173.88 3g5c s THR 624 N 2.26 3.50 -0.12 2.02 2.01 -0.69 -4.98 115.64 119.64 3g5c s THR 624 Ca 0.13 -1.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 3g5c s THR 624 Cb -0.08 -3.19 0.04 0.00 0.01 0.00 0.00 72.50 69.28 3g5c s THR 624 CO -0.16 -0.08 0.01 -0.22 -0.69 0.00 0.00 174.62 173.48 3g5c s LEU 625 N -4.24 0.82 -0.06 4.42 2.96 -1.26 -2.51 118.68 118.81 3g5c s LEU 625 Ca 0.50 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 54.05 3g5c s LEU 625 Cb -0.09 -0.51 -0.03 0.00 0.50 0.00 0.00 46.19 46.06 3g5c s LEU 625 CO 0.32 -0.24 -0.13 0.68 -1.32 0.00 0.00 176.35 175.66 3g5c s VAL 626 N 1.92 3.20 0.05 1.68 -7.23 -0.95 -4.95 120.40 114.12 3g5c s VAL 626 Ca 0.03 -0.66 -0.13 0.00 -1.81 0.00 0.00 61.98 59.41 3g5c s VAL 626 Cb -0.14 -2.27 -0.06 0.00 0.56 0.00 0.00 36.38 34.47 3g5c s VAL 626 CO -0.06 0.59 0.42 0.68 -0.31 0.00 0.00 175.10 176.41 3g5c s VAL 627 N -0.63 5.04 -0.52 1.32 -7.23 -1.26 -0.20 120.40 116.92 3g5c s VAL 627 Ca 0.09 0.67 0.04 0.00 -1.81 0.00 0.00 61.98 60.98 3g5c s VAL 627 Cb -0.11 -3.68 0.17 0.00 0.56 0.00 0.00 36.38 33.31 3g5c s VAL 627 CO 0.01 0.43 0.39 -1.58 -0.31 0.00 0.00 175.10 174.04 3g5c s GLN 628 N -1.51 1.46 -0.31 4.82 0.74 0.65 -4.94 119.66 120.57 3g5c s GLN 628 Ca 0.29 -2.55 0.00 0.00 0.05 0.00 0.00 55.36 53.15 3g5c s GLN 628 Cb -0.15 -2.14 0.00 0.00 1.10 0.00 0.00 33.01 31.81 3g5c s GLN 628 CO 0.16 -1.35 0.00 0.00 -0.55 0.00 0.00 175.29 173.55 3g5c n GLN 629 N 2.55 -1.79 0.00 1.67 10.64 -1.26 -1.58 117.38 127.60 3g5c n GLN 629 Ca 0.26 0.18 0.00 0.00 -1.83 0.00 0.00 57.00 55.60 3g5c n GLN 629 Cb 0.43 -4.43 0.00 0.00 -0.86 0.00 0.00 30.24 25.38 3g5c n GLN 629 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3g5c n GLY 630 N -0.28 0.56 3.11 2.61 0.00 -1.26 -5.12 105.19 104.82 3g5c n GLY 630 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 3g5c n GLY 630 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3g5c s ARG 631 N 0.00 2.38 -0.31 1.61 0.52 -0.61 -5.09 118.95 117.45 3g5c s ARG 631 Ca 0.00 -1.27 -0.23 0.00 -0.52 0.00 0.00 55.73 53.71 3g5c s ARG 631 Cb 0.00 -2.97 0.00 0.00 0.52 0.00 0.00 34.95 32.50 3g5c s ARG 631 CO 0.00 -0.55 0.79 0.95 0.02 0.00 0.00 175.30 176.50 3g5c s THR 632 N 1.18 4.79 -0.11 0.02 -4.23 -1.26 -0.25 115.64 115.76 3g5c s THR 632 Ca -0.06 1.14 -0.05 0.00 -1.18 0.00 0.00 61.69 61.54 3g5c s THR 632 Cb -0.19 -4.15 -0.04 0.00 1.34 0.00 0.00 72.50 69.46 3g5c s THR 632 CO -0.04 -0.27 0.08 -0.76 -0.54 0.00 0.00 174.62 173.08 3g5c s LEU 633 N 2.97 4.02 -0.39 4.79 1.43 0.71 -4.96 118.68 127.25 3g5c s LEU 633 Ca 0.32 0.31 -0.13 0.00 -1.03 0.00 0.00 54.13 53.60 3g5c s LEU 633 Cb -0.14 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.14 3g5c s LEU 633 CO 0.13 0.38 0.24 0.21 0.23 0.00 0.00 176.35 177.54 3g5c s ASN 634 N -0.85 5.89 -0.24 2.29 2.47 -1.26 -2.23 114.94 121.01 3g5c s ASN 634 Ca 0.13 -0.95 -0.06 0.00 0.42 0.00 0.00 52.86 52.41 3g5c s ASN 634 Cb -0.12 -2.08 -0.02 0.00 -1.45 0.00 0.00 41.25 37.58 3g5c s ASN 634 CO 0.03 -0.41 0.02 0.00 -3.72 0.00 0.00 177.10 173.02 3g5c s SER 636 N 1.56 1.99 0.07 0.00 0.01 0.16 -1.71 113.70 115.77 3g5c s SER 636 Ca 0.06 -0.79 -0.00 0.00 1.31 0.00 0.00 55.95 56.53 3g5c s SER 636 Cb -0.15 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.01 3g5c s SER 636 CO 0.01 -0.13 0.09 0.61 0.41 0.00 0.00 173.24 174.23 3g5c n GLY 637 N 0.62 2.97 0.00 3.44 0.00 -0.59 0.12 105.19 111.74 3g5c n GLY 637 Ca -0.16 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.43 3g5c n GLY 637 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g5c n GLY 638 N -0.11 1.29 3.30 -0.02 0.00 -1.26 -2.48 105.19 105.91 3g5c n GLY 638 Ca 0.00 -0.27 -0.45 0.00 0.00 0.00 0.00 46.02 45.30 3g5c n GLY 638 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3g5c s HIS 639 N -1.89 3.28 -0.30 1.61 3.76 -1.26 -4.28 115.29 116.21 3g5c s HIS 639 Ca 0.00 -1.35 -0.10 0.00 -0.15 0.00 0.00 55.06 53.46 3g5c s HIS 639 Cb 0.00 -3.68 -0.02 0.00 1.11 0.00 0.00 32.58 29.99 3g5c s HIS 639 CO 0.00 -0.99 0.16 0.08 -0.85 0.00 0.00 174.74 173.13 3g5c s VAL 640 N 1.56 4.75 -0.14 -0.90 1.01 0.34 0.63 120.40 127.66 3g5c s VAL 640 Ca 0.04 -0.28 -0.07 0.00 0.00 0.00 0.00 61.98 61.67 3g5c s VAL 640 Cb -0.29 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 3g5c s VAL 640 CO 0.03 0.12 0.10 -0.54 0.00 0.00 0.00 175.10 174.81 3g5c s LYS 641 N 1.65 3.60 -0.00 2.72 -0.14 0.93 -0.05 119.74 128.45 3g5c s LYS 641 Ca 0.05 -0.23 -0.01 0.00 -1.36 0.00 0.00 55.97 54.43 3g5c s LYS 641 Cb -0.17 -3.18 -0.00 0.00 -1.68 0.00 0.00 37.83 32.81 3g5c s LYS 641 CO 0.07 0.59 -0.01 1.28 -0.76 0.00 0.00 175.35 176.52 3g5c n LEU 642 N 2.56 0.13 -4.93 3.17 4.77 -1.17 -0.23 117.00 121.29 3g5c n LEU 642 Ca -0.18 0.02 -0.25 0.00 -0.03 0.00 0.00 56.01 55.56 3g5c n LEU 642 Cb 0.54 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 3g5c n LEU 642 CO 0.32 -0.51 0.30 -0.70 -1.33 0.00 0.00 177.39 175.48 3g5c s GLU 643 N -1.12 3.50 0.30 3.23 2.56 -1.22 -4.97 118.70 120.98 3g5c s GLU 643 Ca -0.01 -0.09 0.24 0.00 0.00 0.00 0.00 54.97 55.10 3g5c s GLU 643 Cb 0.00 -2.53 1.10 0.00 2.00 0.00 0.00 34.13 34.71 3g5c s GLU 643 CO 0.01 -0.03 1.72 0.93 -0.56 0.00 0.00 175.26 177.33 3g5c h GLU 644 N 0.50 0.00 0.00 4.30 3.07 -2.02 -3.10 114.58 117.32 3g5c h GLU 644 Ca -0.48 0.00 -0.43 0.00 -0.50 0.00 0.00 59.36 57.95 3g5c h GLU 644 Cb 1.21 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.06 3g5c h GLU 644 CO 0.61 0.00 -2.48 -0.25 -1.40 0.00 0.00 179.01 175.49 3g5c n ASP 645 N -2.30 1.94 -4.69 1.42 10.43 -1.26 -4.97 116.55 117.13 3g5c n ASP 645 Ca 0.01 0.18 -0.42 0.00 2.57 0.00 0.00 54.79 57.12 3g5c n ASP 645 Cb 0.15 -0.66 -0.03 0.00 1.84 0.00 0.00 41.12 42.43 3g5c n ASP 645 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3g5c s VAL 646 N -2.49 4.81 -0.16 2.53 1.01 -1.17 -5.04 120.40 119.88 3g5c s VAL 646 Ca -0.36 1.95 -0.00 0.00 0.00 0.00 0.00 61.98 63.57 3g5c s VAL 646 Cb 0.13 -4.27 0.04 0.00 0.00 0.00 0.00 36.38 32.27 3g5c s VAL 646 CO 0.51 0.02 -0.06 -0.62 0.00 0.00 0.00 175.10 174.94 3g5c s ASP 647 N 1.10 2.82 0.21 3.32 2.15 -1.26 -3.07 116.67 121.93 3g5c s ASP 647 Ca 0.46 -0.65 -0.29 0.00 0.43 0.00 0.00 52.55 52.51 3g5c s ASP 647 Cb -0.18 -0.95 -0.08 0.00 -0.30 0.00 0.00 42.92 41.41 3g5c s ASP 647 CO 0.17 -0.17 0.90 -0.76 -0.17 0.00 0.00 175.17 175.14 3g5c s LEU 648 N 1.61 4.62 0.00 -1.34 1.43 0.93 -3.94 118.68 121.99 3g5c s LEU 648 Ca 0.01 1.85 0.00 0.00 -1.03 0.00 0.00 54.13 54.96 3g5c s LEU 648 Cb -0.15 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.55 3g5c s LEU 648 CO -0.08 0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.26 3g5c n GLY 649 N 1.61 1.08 3.39 -3.19 0.00 -1.26 -0.50 105.19 106.32 3g5c n GLY 649 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 3g5c n GLY 649 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g5c s TYR 650 N -1.30 2.40 -0.08 1.61 1.51 -1.25 0.39 117.35 120.63 3g5c s TYR 650 Ca 0.00 -0.35 -0.33 0.00 -1.01 0.00 0.00 57.07 55.38 3g5c s TYR 650 Cb 0.00 -1.39 -0.11 0.00 -0.11 0.00 0.00 41.96 40.35 3g5c s TYR 650 CO 0.00 0.21 1.93 0.28 -1.11 0.00 0.00 175.55 176.86 3g5c n VAL 651 N 1.52 0.60 -1.75 0.71 0.31 0.18 -4.75 118.33 115.15 3g5c n VAL 651 Ca -0.17 -0.13 -0.42 0.00 -0.01 0.00 0.00 64.34 63.61 3g5c n VAL 651 Cb 0.52 -1.99 -0.01 0.00 -0.91 0.00 0.00 33.84 31.45 3g5c n VAL 651 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3g5c n GLU 652 N 7.01 2.54 -1.75 5.55 2.13 -1.26 -4.80 120.64 130.06 3g5c n GLU 652 Ca 0.23 0.89 -0.42 0.00 0.66 0.00 0.00 57.16 58.53 3g5c n GLU 652 Cb 0.32 -2.60 -0.02 0.00 0.27 0.00 0.00 31.44 29.41 3g5c n GLU 652 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3g5c s ASP 653 N -0.02 6.37 0.00 4.31 -0.00 -1.26 -2.85 116.67 123.22 3g5c s ASP 653 Ca 0.56 2.91 0.00 0.00 -0.00 0.00 0.00 52.55 56.02 3g5c s ASP 653 Cb -0.51 -2.62 0.00 0.00 -0.00 0.00 0.00 42.92 39.80 3g5c s ASP 653 CO 0.60 -0.95 0.00 0.61 -0.00 0.00 0.00 175.17 175.43 3g5c n GLY 654 N 3.14 0.78 3.74 0.21 0.00 0.13 -4.97 105.19 108.22 3g5c n GLY 654 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3g5c n GLY 654 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g5c s THR 655 N -2.09 3.52 0.28 2.61 2.01 -1.13 -4.63 115.64 116.21 3g5c s THR 655 Ca 0.00 1.29 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 3g5c s THR 655 Cb 0.00 -3.82 -0.11 0.00 0.01 0.00 0.00 72.50 68.57 3g5c s THR 655 CO 0.00 0.21 1.62 -2.84 -0.69 0.00 0.00 174.62 172.92 3g5c s PRO 656 N -0.29 4.12 -0.02 4.92 0.02 -1.26 -1.08 135.00 141.40 3g5c s PRO 656 Ca 0.53 2.59 0.03 0.00 0.02 0.00 0.00 61.00 64.17 3g5c s PRO 656 Cb -0.33 -3.03 0.05 0.00 0.02 0.00 0.00 34.50 31.21 3g5c s PRO 656 CO 0.37 -0.66 0.98 0.00 -0.33 0.00 0.00 177.00 177.36 3g5c n GLY 658 N -0.60 -1.77 3.66 0.00 0.00 -1.22 -4.95 105.19 100.30 3g5c n GLY 658 Ca 0.03 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 3g5c n GLY 658 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3g5c s PRO 659 N -1.92 4.16 -1.82 1.61 0.02 -1.26 -2.69 135.00 133.10 3g5c s PRO 659 Ca 0.00 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.18 3g5c s PRO 659 Cb 0.00 -3.99 0.00 0.00 0.02 0.00 0.00 34.50 30.53 3g5c s PRO 659 CO 0.00 -0.87 0.00 1.04 -0.33 0.00 0.00 177.00 176.84 3g5c n GLN 660 N 7.15 -1.67 -4.19 5.54 3.00 -1.26 -4.99 117.38 120.97 3g5c n GLN 660 Ca 0.17 1.03 -0.17 0.00 -0.01 0.00 0.00 57.00 58.02 3g5c n GLN 660 Cb 0.43 -5.65 -0.15 0.00 0.00 0.00 0.00 30.24 24.87 3g5c n GLN 660 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 3g5c s MET 661 N -4.84 0.58 0.25 -1.09 -1.94 -1.09 -1.10 119.30 110.07 3g5c s MET 661 Ca 0.00 -0.18 0.05 0.00 -1.71 0.00 0.00 55.69 53.85 3g5c s MET 661 Cb 0.00 -0.58 -0.05 0.00 2.01 0.00 0.00 34.83 36.20 3g5c s MET 661 CO 0.00 0.06 -0.03 -1.64 -0.01 0.00 0.00 175.02 173.40 3g5c s MET 662 N 0.20 1.41 0.02 2.03 -1.94 0.10 -1.44 119.30 119.68 3g5c s MET 662 Ca -0.02 -1.71 -0.22 0.00 -1.71 0.00 0.00 55.69 52.03 3g5c s MET 662 Cb -0.06 -0.83 -0.05 0.00 2.01 0.00 0.00 34.83 35.89 3g5c s MET 662 CO -0.00 -0.04 0.66 0.00 -0.01 0.00 0.00 175.02 175.63 3g5c s LEU 664 N -0.20 -0.53 -1.28 0.00 0.20 0.31 0.20 118.68 117.38 3g5c s LEU 664 Ca 0.34 0.52 -0.01 0.00 0.69 0.00 0.00 54.13 55.67 3g5c s LEU 664 Cb -0.19 1.05 -0.00 0.00 -0.43 0.00 0.00 46.19 46.62 3g5c s LEU 664 CO 0.19 -0.27 0.73 1.21 -0.29 0.00 0.00 176.35 177.93 3g5c n GLU 665 N 5.37 -4.82 -2.08 1.98 2.13 -1.26 -2.03 120.64 119.92 3g5c n GLU 665 Ca -0.06 0.64 -0.19 0.00 0.66 0.00 0.00 57.16 58.21 3g5c n GLU 665 Cb 0.50 -5.21 -0.03 0.00 0.27 0.00 0.00 31.44 26.96 3g5c n GLU 665 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3g5c n HIS 666 N -4.22 -0.59 -4.42 4.31 8.25 -1.26 -5.00 115.22 112.29 3g5c n HIS 666 Ca -0.29 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 56.97 3g5c n HIS 666 Cb 0.67 -3.55 -0.15 0.00 1.12 0.00 0.00 29.99 28.07 3g5c n HIS 666 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3g5c s ARG 667 N -4.49 0.98 -0.61 -0.41 0.52 -0.86 -4.68 118.95 109.40 3g5c s ARG 667 Ca 0.00 -0.33 -0.25 0.00 -0.52 0.00 0.00 55.73 54.63 3g5c s ARG 667 Cb 0.00 -0.91 0.04 0.00 0.52 0.00 0.00 34.95 34.60 3g5c s ARG 667 CO 0.00 0.14 1.04 0.00 0.02 0.00 0.00 175.30 176.49 3g5c s LEU 669 N 4.40 2.80 0.80 0.00 1.43 0.68 -4.90 118.68 123.88 3g5c s LEU 669 Ca 0.31 -0.73 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 3g5c s LEU 669 Cb -0.12 -1.45 0.07 0.00 0.03 0.00 0.00 46.19 44.73 3g5c s LEU 669 CO 0.18 0.08 1.12 -2.84 0.23 0.00 0.00 176.35 175.13 3g5c s PRO 670 N -3.01 1.93 0.59 1.29 0.02 -1.26 0.02 135.00 134.59 3g5c s PRO 670 Ca 0.25 1.38 0.29 0.00 0.02 0.00 0.00 61.00 62.95 3g5c s PRO 670 Cb -0.08 -1.84 1.69 0.00 0.02 0.00 0.00 34.50 34.29 3g5c s PRO 670 CO 0.14 -1.92 2.11 -0.39 -0.33 0.00 0.00 177.00 176.61 3g5c h VAL 671 N -1.12 0.44 0.00 3.83 -1.51 -1.48 -1.90 116.25 114.51 3g5c h VAL 671 Ca -0.44 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.96 3g5c h VAL 671 Cb 1.25 0.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.24 3g5c h VAL 671 CO 0.48 0.00 -0.32 0.00 -1.23 0.00 0.00 177.57 176.51 3g5c h ALA 672 N 1.76 1.42 0.00 5.19 0.00 -1.91 -2.82 119.26 122.91 3g5c h ALA 672 Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3g5c h ALA 672 Cb 0.47 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3g5c h ALA 672 CO -0.00 0.40 0.00 0.43 0.00 0.00 0.00 179.25 180.08 3g5c n SER 673 N -4.09 0.00 -0.00 0.00 7.64 -0.71 -1.58 113.62 114.88 3g5c n SER 673 Ca -0.02 -0.47 0.06 0.00 1.01 0.00 0.00 58.87 59.46 3g5c n SER 673 Cb 0.37 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.48 3g5c n SER 673 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3g5c n PHE 674 N -0.95 0.00 -3.92 1.43 3.01 -1.06 -5.04 117.46 110.92 3g5c n PHE 674 Ca 0.09 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.16 3g5c n PHE 674 Cb 0.04 -0.16 0.02 0.00 -0.01 0.00 0.00 39.48 39.37 3g5c n PHE 674 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3g5c n ASN 675 N -1.66 -4.63 -4.77 4.37 3.02 -0.61 -4.91 115.26 106.07 3g5c n ASN 675 Ca -0.00 -1.16 -0.40 0.00 -0.03 0.00 0.00 54.58 52.98 3g5c n ASN 675 Cb 0.27 -2.19 -0.02 0.00 -0.61 0.00 0.00 39.78 37.23 3g5c n ASN 675 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3g5c s PHE 676 N -3.43 3.12 0.73 3.10 2.99 -1.26 -5.03 117.98 118.20 3g5c s PHE 676 Ca 0.42 1.47 -0.11 0.00 0.00 0.00 0.00 56.93 58.71 3g5c s PHE 676 Cb -0.21 -3.59 0.03 0.00 0.00 0.00 0.00 43.02 39.25 3g5c s PHE 676 CO 0.93 -1.62 1.07 -1.12 -0.00 0.00 0.00 175.22 174.48 3g5c s SER 677 N -0.63 5.02 0.08 1.36 0.01 -1.26 -5.08 113.70 113.21 3g5c s SER 677 Ca 0.50 1.57 0.01 0.00 1.31 0.00 0.00 55.95 59.33 3g5c s SER 677 Cb -0.38 -2.39 -0.04 0.00 0.21 0.00 0.00 66.02 63.43 3g5c s SER 677 CO 0.49 -1.67 -0.05 -0.89 0.41 0.00 0.00 173.24 171.54 3g5c s THR 678 N -3.05 0.54 0.88 1.44 2.01 -1.26 -5.01 115.64 111.19 3g5c s THR 678 Ca 0.59 -1.90 -0.14 0.00 0.31 0.00 0.00 61.69 60.56 3g5c s THR 678 Cb -0.15 -1.64 0.13 0.00 0.01 0.00 0.00 72.50 70.86 3g5c s THR 678 CO 0.55 -0.90 1.23 0.00 -0.69 0.00 0.00 174.62 174.81 3g5c s LEU 680 N -5.75 4.56 -0.09 0.00 1.43 -1.26 -4.80 118.68 112.77 3g5c s LEU 680 Ca 0.67 2.19 -0.05 0.00 -1.03 0.00 0.00 54.13 55.91 3g5c s LEU 680 Cb -0.08 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.55 3g5c s LEU 680 CO 0.51 -0.10 0.21 -0.55 0.23 0.00 0.00 176.35 176.65 3g5c s SER 681 N -0.81 -0.22 -0.13 2.29 0.15 -1.26 -3.80 113.70 109.92 3g5c s SER 681 Ca 0.45 0.44 0.15 0.00 0.70 0.00 0.00 55.95 57.69 3g5c s SER 681 Cb -0.31 0.37 0.52 0.00 -1.71 0.00 0.00 66.02 64.89 3g5c s SER 681 CO 0.39 -0.13 1.43 -1.20 1.20 0.00 0.00 173.24 174.92 3g5c n SER 682 N 3.81 3.88 -4.02 5.45 7.64 -1.26 -4.85 113.62 124.27 3g5c n SER 682 Ca -0.21 -2.67 -0.22 0.00 1.01 0.00 0.00 58.87 56.78 3g5c n SER 682 Cb 0.55 -0.47 -0.16 0.00 -1.01 0.00 0.00 64.21 63.11 3g5c n SER 682 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3g5c s LYS 683 N -2.21 1.15 -0.00 1.43 -0.14 -1.26 -5.00 119.74 113.71 3g5c s LYS 683 Ca 0.39 -0.35 -0.30 0.00 -1.36 0.00 0.00 55.97 54.35 3g5c s LYS 683 Cb 0.29 -1.05 -0.08 0.00 -1.68 0.00 0.00 37.83 35.31 3g5c s LYS 683 CO 0.13 0.11 1.89 -2.00 -0.76 0.00 0.00 175.35 174.72 3g5c s GLU 684 N 0.26 4.10 -0.54 1.68 2.12 -1.26 -2.81 118.70 122.24 3g5c s GLU 684 Ca -0.05 2.45 -0.01 0.00 0.36 0.00 0.00 54.97 57.72 3g5c s GLU 684 Cb -0.10 -4.12 0.00 0.00 0.26 0.00 0.00 34.13 30.17 3g5c s GLU 684 CO 0.01 -0.98 0.19 0.41 -0.54 0.00 0.00 175.26 174.35 3g5c n GLY 685 N 4.49 0.25 3.17 -1.50 0.00 -1.26 -5.05 105.19 105.28 3g5c n GLY 685 Ca 0.20 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 3g5c n GLY 685 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3g5c s THR 686 N -2.71 0.90 -0.25 2.61 -4.23 -1.12 -5.05 115.64 105.78 3g5c s THR 686 Ca 0.09 -1.60 -0.12 0.00 -1.18 0.00 0.00 61.69 58.89 3g5c s THR 686 Cb -0.04 -1.31 -0.05 0.00 1.34 0.00 0.00 72.50 72.44 3g5c s THR 686 CO 0.12 -0.55 0.21 -0.63 -0.54 0.00 0.00 174.62 173.23 3g5c s ILE 687 N -2.38 5.31 -1.24 2.99 -1.09 -1.26 -4.42 121.20 119.10 3g5c s ILE 687 Ca 0.04 0.27 -0.01 0.00 -2.23 0.00 0.00 60.65 58.72 3g5c s ILE 687 Cb -0.03 -3.55 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 3g5c s ILE 687 CO -0.00 0.28 0.82 0.00 -1.23 0.00 0.00 174.94 174.82 3g5c n SER 689 N -3.08 -4.39 0.00 0.00 7.64 -1.16 -1.11 113.62 111.53 3g5c n SER 689 Ca -0.27 0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.74 3g5c n SER 689 Cb 0.67 -3.13 0.00 0.00 -1.01 0.00 0.00 64.21 60.74 3g5c n SER 689 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g5c n GLY 690 N 0.38 0.50 1.00 0.23 0.00 -0.77 -4.77 105.19 101.76 3g5c n GLY 690 Ca -0.06 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.60 3g5c n GLY 690 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3g5c n ASN 691 N 0.74 1.23 -3.64 1.61 3.02 -0.26 -5.02 115.26 112.95 3g5c n ASN 691 Ca 0.00 -2.72 -0.00 0.00 -0.03 0.00 0.00 54.58 51.82 3g5c n ASN 691 Cb 0.00 -0.38 -0.00 0.00 -0.61 0.00 0.00 39.78 38.79 3g5c n ASN 691 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3g5c s GLY 692 N -2.38 -0.24 -0.08 7.41 0.00 -1.22 -1.23 107.32 109.57 3g5c s GLY 692 Ca 0.32 0.29 0.01 0.00 0.00 0.00 0.00 44.72 45.34 3g5c s GLY 692 CO -0.11 1.11 -0.12 0.14 0.00 0.00 0.00 173.10 174.12 3g5c s VAL 693 N -2.59 3.25 -0.36 1.40 1.01 -0.58 -4.52 120.40 118.01 3g5c s VAL 693 Ca 0.17 -0.63 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 3g5c s VAL 693 Cb 0.01 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 34.09 3g5c s VAL 693 CO -0.00 0.57 1.02 0.00 0.00 0.00 0.00 175.10 176.68 3g5c s SER 695 N 1.87 3.91 0.45 0.00 1.04 -0.40 -0.87 113.70 119.70 3g5c s SER 695 Ca 0.43 0.93 0.31 0.00 0.48 0.00 0.00 55.95 58.09 3g5c s SER 695 Cb -0.11 -1.49 1.33 0.00 0.10 0.00 0.00 66.02 65.85 3g5c s SER 695 CO 0.19 -2.29 1.91 -0.55 0.98 0.00 0.00 173.24 173.48 3g5c h ASN 696 N -1.32 0.00 -0.02 7.02 -1.07 -1.32 -0.73 115.58 118.14 3g5c h ASN 696 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 3g5c h ASN 696 Cb 1.33 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.58 3g5c h ASN 696 CO 0.63 0.00 0.00 -0.62 0.07 0.00 0.00 177.43 177.51 3g5c n GLU 697 N -2.75 1.19 -3.51 4.14 1.02 -1.26 -4.92 120.64 114.55 3g5c n GLU 697 Ca 0.01 -0.27 -0.21 0.00 -0.02 0.00 0.00 57.16 56.67 3g5c n GLU 697 Cb 0.24 -1.44 0.08 0.00 -0.02 0.00 0.00 31.44 30.30 3g5c n GLU 697 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3g5c n LEU 698 N -0.62 -3.65 -4.26 -4.62 4.77 -0.28 -5.04 117.00 103.30 3g5c n LEU 698 Ca 0.20 -0.56 -0.25 0.00 -0.03 0.00 0.00 56.01 55.37 3g5c n LEU 698 Cb 0.16 -3.04 -0.13 0.00 -2.33 0.00 0.00 43.42 38.08 3g5c n LEU 698 CO 0.16 0.53 -0.52 -0.54 -1.33 0.00 0.00 177.39 175.69 3g5c s LYS 699 N -5.89 1.26 -0.30 3.23 1.02 -1.26 -4.69 119.74 113.11 3g5c s LYS 699 Ca 0.33 -1.02 -0.27 0.00 0.02 0.00 0.00 55.97 55.03 3g5c s LYS 699 Cb -0.15 -1.43 0.01 0.00 -0.52 0.00 0.00 37.83 35.75 3g5c s LYS 699 CO 0.72 0.35 0.97 0.00 -0.92 0.00 0.00 175.35 176.47 3g5c s VAL 701 N 3.31 4.88 0.60 0.00 1.01 -0.13 -4.92 120.40 125.15 3g5c s VAL 701 Ca 0.41 -1.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.14 3g5c s VAL 701 Cb -0.13 -4.47 -0.03 0.00 0.00 0.00 0.00 36.38 31.74 3g5c s VAL 701 CO 0.12 -1.10 1.07 0.00 0.00 0.00 0.00 175.10 175.20 3g5c s ASN 703 N -2.62 1.70 0.47 0.00 0.01 -0.36 -4.93 114.94 109.21 3g5c s ASN 703 Ca 0.65 0.54 -0.24 0.00 -0.71 0.00 0.00 52.86 53.09 3g5c s ASN 703 Cb -0.17 -0.74 -0.08 0.00 0.41 0.00 0.00 41.25 40.67 3g5c s ASN 703 CO 0.36 -3.63 1.41 -2.11 -1.51 0.00 0.00 177.10 171.62 3g5c n ARG 704 N -4.42 2.11 -0.74 -0.60 1.85 -1.26 -2.82 116.66 110.78 3g5c n ARG 704 Ca 0.13 0.75 0.00 0.00 -1.00 0.00 0.00 57.85 57.74 3g5c n ARG 704 Cb 0.59 -2.61 0.00 0.00 -1.05 0.00 0.00 32.46 29.40 3g5c n ARG 704 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3g5c n HIS 705 N -0.41 0.00 -4.52 2.89 8.25 -1.26 -4.99 115.22 115.19 3g5c n HIS 705 Ca 0.06 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.19 3g5c n HIS 705 Cb 0.42 -0.66 -0.12 0.00 1.12 0.00 0.00 29.99 30.75 3g5c n HIS 705 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3g5c s TRP 706 N -2.63 2.98 0.33 4.41 0.52 -1.13 0.72 118.94 124.15 3g5c s TRP 706 Ca 0.00 -0.22 0.04 0.00 0.02 0.00 0.00 56.10 55.94 3g5c s TRP 706 Cb 0.00 -1.86 -0.06 0.00 -1.15 0.00 0.00 33.47 30.40 3g5c s TRP 706 CO 0.00 0.08 0.06 0.96 0.02 0.00 0.00 176.95 178.07 3g5c s ILE 707 N -0.06 1.17 0.00 2.03 -4.36 0.16 -4.64 121.20 115.51 3g5c s ILE 707 Ca 0.01 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3g5c s ILE 707 Cb -0.13 -2.77 0.00 0.00 1.25 0.00 0.00 42.46 40.81 3g5c s ILE 707 CO 0.03 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.82 3g5c n GLY 708 N -0.71 2.55 0.02 6.27 0.00 -1.26 -2.61 105.19 109.45 3g5c n GLY 708 Ca -0.03 -1.90 0.07 0.00 0.00 0.00 0.00 46.02 44.17 3g5c n GLY 708 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3g5c n SER 709 N 0.00 0.12 -0.06 1.61 3.41 -1.26 -2.33 113.62 115.11 3g5c n SER 709 Ca 0.00 0.53 0.01 0.00 -0.26 0.00 0.00 58.87 59.15 3g5c n SER 709 Cb 0.00 -0.56 0.01 0.00 -0.26 0.00 0.00 64.21 63.40 3g5c n SER 709 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3g5c n ASP 710 N -1.64 1.03 -3.44 4.04 3.85 -1.26 -4.24 116.55 114.88 3g5c n ASP 710 Ca 0.03 -1.01 -0.25 0.00 -0.71 0.00 0.00 54.79 52.85 3g5c n ASP 710 Cb 0.17 0.10 0.05 0.00 -1.35 0.00 0.00 41.12 40.08 3g5c n ASP 710 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3g5c n ASN 712 N -2.74 0.30 -4.68 0.00 4.05 -1.18 -4.49 115.26 106.52 3g5c n ASN 712 Ca -0.03 -0.12 -0.36 0.00 0.45 0.00 0.00 54.58 54.52 3g5c n ASN 712 Cb 0.57 1.56 -0.09 0.00 1.23 0.00 0.00 39.78 43.05 3g5c n ASN 712 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 3g5c s THR 713 N -3.40 5.36 -0.25 -0.44 2.01 -1.07 -4.99 115.64 112.85 3g5c s THR 713 Ca -0.04 0.24 -0.23 0.00 0.31 0.00 0.00 61.69 61.98 3g5c s THR 713 Cb 0.14 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.12 3g5c s THR 713 CO 0.88 0.36 0.75 -0.47 -0.69 0.00 0.00 174.62 175.45 3g5c s TYR 714 N 0.88 3.29 -0.39 4.92 5.04 -1.26 -0.66 117.35 129.17 3g5c s TYR 714 Ca 0.09 0.99 0.03 0.00 -2.44 0.00 0.00 57.07 55.74 3g5c s TYR 714 Cb -0.13 -2.98 0.16 0.00 0.35 0.00 0.00 41.96 39.36 3g5c s TYR 714 CO 0.03 -0.39 0.35 0.12 -1.34 0.00 0.00 175.55 174.33 3g5c s PHE 715 N 2.72 0.28 0.54 4.97 5.36 0.22 -4.96 117.98 127.12 3g5c s PHE 715 Ca 0.31 -1.49 -0.17 0.00 -0.96 0.00 0.00 56.93 54.63 3g5c s PHE 715 Cb -0.15 -0.63 -0.06 0.00 -0.34 0.00 0.00 43.02 41.83 3g5c s PHE 715 CO 0.08 -0.92 1.03 -1.25 -1.46 0.00 0.00 175.22 172.70 3g5c s PRO 716 N 0.85 3.64 0.00 10.12 0.04 -1.25 -4.45 135.00 143.96 3g5c s PRO 716 Ca 0.23 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.43 3g5c s PRO 716 Cb -0.10 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3g5c s PRO 716 CO -0.07 -0.54 0.03 -2.39 0.04 0.00 0.00 177.00 174.07 3g5c n HIS 717 N -1.63 0.00 -0.89 0.56 1.44 -1.26 -5.07 115.22 108.37 3g5c n HIS 717 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 3g5c n HIS 717 Cb 0.53 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.64 3g5c n HIS 717 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62