#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3r s SER 264 N 0.00 3.48 0.24 1.96 1.04 -1.26 -4.74 113.70 114.42 1u3r s SER 264 Ca 0.00 2.15 -0.05 0.00 0.48 0.00 0.00 55.95 58.53 1u3r s SER 264 Cb 0.00 -2.56 0.36 0.00 0.10 0.00 0.00 66.02 63.92 1u3r s SER 264 CO 0.00 -2.73 1.82 -0.65 0.98 0.00 0.00 173.24 172.66 1u3r h PRO 265 N -1.42 0.79 -0.76 4.02 0.11 -1.93 -0.09 132.00 132.73 1u3r h PRO 265 Ca -0.44 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1u3r h PRO 265 Cb 1.27 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 1u3r h PRO 265 CO 0.45 0.53 0.30 1.49 -0.21 0.00 0.00 178.00 180.56 1u3r h GLU 266 N 0.82 1.13 0.00 1.05 4.81 -1.92 -0.64 114.58 119.82 1u3r h GLU 266 Ca 0.38 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1u3r h GLU 266 Cb 0.30 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1u3r h GLU 266 CO -0.22 0.91 -0.35 1.96 -0.73 0.00 0.00 179.01 180.59 1u3r h GLN 267 N 1.10 0.00 -0.23 1.92 4.20 -1.68 -1.82 115.11 118.59 1u3r h GLN 267 Ca 0.25 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.77 1u3r h GLN 267 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1u3r h GLN 267 CO -0.02 0.35 -0.61 1.25 -0.67 0.00 0.00 178.83 179.12 1u3r h LEU 268 N 0.00 0.94 -1.25 1.46 5.85 -0.45 -2.50 115.31 119.35 1u3r h LEU 268 Ca -0.00 -0.57 -0.07 0.00 0.84 0.00 0.00 57.88 58.08 1u3r h LEU 268 Cb 1.07 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1u3r h LEU 268 CO 0.04 1.34 -0.28 0.58 -0.34 0.00 0.00 178.44 179.78 1u3r h VAL 269 N 0.59 1.24 -0.55 1.05 2.07 -0.96 -1.89 116.25 117.80 1u3r h VAL 269 Ca -0.01 -1.12 -0.10 0.00 0.82 0.00 0.00 66.70 66.30 1u3r h VAL 269 Cb 1.23 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1u3r h VAL 269 CO 0.13 0.33 -0.04 -0.07 0.02 0.00 0.00 177.57 177.95 1u3r h LEU 270 N 0.13 0.96 -1.50 2.57 3.38 -1.18 -1.50 115.31 118.17 1u3r h LEU 270 Ca 0.02 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 1u3r h LEU 270 Cb 0.58 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1u3r h LEU 270 CO 0.04 1.03 -0.26 0.71 0.09 0.00 0.00 178.44 180.06 1u3r h THR 271 N 0.89 1.08 -0.13 0.22 1.35 -0.91 -1.20 112.91 114.20 1u3r h THR 271 Ca 0.15 -0.91 -0.19 0.00 -0.55 0.00 0.00 66.41 64.91 1u3r h THR 271 Cb 0.57 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 1u3r h THR 271 CO 0.03 0.25 -0.70 -0.07 -0.25 0.00 0.00 175.52 174.78 1u3r h LEU 272 N 0.00 0.68 -0.78 3.87 3.38 -0.87 -1.51 115.31 120.08 1u3r h LEU 272 Ca -0.00 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.50 1u3r h LEU 272 Cb 0.49 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1u3r h LEU 272 CO 0.03 1.19 0.33 0.25 0.09 0.00 0.00 178.44 180.33 1u3r h LEU 273 N 0.41 1.05 -0.47 1.67 5.85 -0.55 -2.26 115.31 121.01 1u3r h LEU 273 Ca -0.03 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1u3r h LEU 273 Cb 1.29 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1u3r h LEU 273 CO 0.13 0.92 0.00 -0.33 -0.34 0.00 0.00 178.44 178.83 1u3r h GLU 274 N 1.12 0.00 0.00 1.25 4.39 -1.12 -2.90 114.58 117.32 1u3r h GLU 274 Ca 0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1u3r h GLU 274 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1u3r h GLU 274 CO -0.03 0.00 -0.43 0.00 -1.16 0.00 0.00 179.01 177.39 1u3r n ALA 275 N -2.03 3.22 -1.62 3.43 0.00 -0.58 -4.92 120.51 118.01 1u3r n ALA 275 Ca 0.03 -0.29 -0.52 0.00 0.00 0.00 0.00 53.44 52.67 1u3r n ALA 275 Cb 0.43 -1.19 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 1u3r n ALA 275 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u3r n GLU 276 N -1.62 1.31 -1.29 0.00 -0.58 -0.90 -4.51 120.64 113.05 1u3r n GLU 276 Ca 0.05 0.47 -0.31 0.00 -0.42 0.00 0.00 57.16 56.95 1u3r n GLU 276 Cb 0.36 -2.15 0.09 0.00 -0.57 0.00 0.00 31.44 29.17 1u3r n GLU 276 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1u3r s PRO 277 N 1.07 2.25 0.76 3.49 0.04 -1.26 -5.00 135.00 136.34 1u3r s PRO 277 Ca 0.86 1.23 -0.11 0.00 0.04 0.00 0.00 61.00 63.02 1u3r s PRO 277 Cb -0.93 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 31.77 1u3r s PRO 277 CO 0.48 -1.66 1.08 -1.25 0.04 0.00 0.00 177.00 175.70 1u3r s PRO 278 N -4.76 2.39 0.13 0.56 0.04 -1.26 -4.97 135.00 127.13 1u3r s PRO 278 Ca 0.62 1.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.38 1u3r s PRO 278 Cb -0.18 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 1u3r s PRO 278 CO 0.54 -1.51 1.30 -1.01 0.04 0.00 0.00 177.00 176.37 1u3r s HIS 279 N -2.98 3.31 -0.08 0.56 3.76 -1.26 -5.01 115.29 113.60 1u3r s HIS 279 Ca 0.60 1.16 -0.01 0.00 -0.15 0.00 0.00 55.06 56.66 1u3r s HIS 279 Cb -0.16 -3.57 -0.03 0.00 1.11 0.00 0.00 32.58 29.93 1u3r s HIS 279 CO 0.56 -1.86 -0.02 0.08 -0.85 0.00 0.00 174.74 172.64 1u3r s VAL 280 N 0.68 4.13 0.05 -0.90 1.01 -1.26 -5.12 120.40 119.00 1u3r s VAL 280 Ca 0.60 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.32 1u3r s VAL 280 Cb -0.35 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1u3r s VAL 280 CO 0.33 0.60 -0.15 -0.76 0.00 0.00 0.00 175.10 175.12 1u3r s LEU 281 N -0.85 2.20 0.00 3.92 1.02 -1.26 -4.38 118.68 119.32 1u3r s LEU 281 Ca 0.13 -0.51 0.27 0.00 0.02 0.00 0.00 54.13 54.04 1u3r s LEU 281 Cb -0.11 -0.64 0.74 0.00 0.02 0.00 0.00 46.19 46.20 1u3r s LEU 281 CO 0.02 0.03 1.57 2.30 0.02 0.00 0.00 176.35 180.29 1u3r n ILE 282 N 1.72 0.00 -3.43 -0.59 -5.35 -1.26 -4.97 119.36 105.48 1u3r n ILE 282 Ca -0.19 -0.34 -0.18 0.00 -0.27 0.00 0.00 62.75 61.78 1u3r n ILE 282 Cb 0.54 0.85 0.09 0.00 -1.74 0.00 0.00 39.64 39.38 1u3r n ILE 282 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1u3r n SER 283 N 0.59 -2.63 -4.30 7.28 7.64 -1.26 -5.00 113.62 115.95 1u3r n SER 283 Ca 0.17 -0.60 -0.35 0.00 1.01 0.00 0.00 58.87 59.10 1u3r n SER 283 Cb 0.44 -5.03 -0.14 0.00 -1.01 0.00 0.00 64.21 58.47 1u3r n SER 283 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1u3r s ARG 284 N -5.47 3.30 0.29 1.43 3.52 -1.26 -5.08 118.95 115.69 1u3r s ARG 284 Ca 0.08 -0.67 -0.30 0.00 -0.13 0.00 0.00 55.73 54.70 1u3r s ARG 284 Cb -0.03 -3.01 -0.12 0.00 -1.56 0.00 0.00 34.95 30.22 1u3r s ARG 284 CO 0.72 -0.23 1.54 -2.30 -0.81 0.00 0.00 175.30 174.22 1u3r n PRO 285 N 4.78 2.56 -1.60 5.12 -0.02 -1.26 -4.84 135.00 139.74 1u3r n PRO 285 Ca -0.18 0.91 -0.47 0.00 -2.02 0.00 0.00 63.50 61.74 1u3r n PRO 285 Cb 0.50 -2.66 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 1u3r n PRO 285 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1u3r n SER 286 N 1.99 1.60 0.00 2.55 2.88 -1.26 -4.95 113.62 116.43 1u3r n SER 286 Ca 0.08 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.77 1u3r n SER 286 Cb 0.36 -1.27 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 1u3r n SER 286 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1u3r n ALA 287 N 1.35 0.00 -1.62 -1.46 0.00 -1.26 -5.16 120.51 112.36 1u3r n ALA 287 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.20 1u3r n ALA 287 Cb 0.27 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.78 1u3r n ALA 287 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1u3r n PRO 288 N -0.04 0.88 -3.75 0.00 -0.02 -1.26 -5.00 135.00 125.81 1u3r n PRO 288 Ca 0.00 0.35 -0.33 0.00 -2.02 0.00 0.00 63.50 61.50 1u3r n PRO 288 Cb 0.00 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.18 1u3r n PRO 288 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1u3r s PHE 289 N -1.52 3.52 0.30 6.00 0.08 -1.26 -5.03 117.98 120.08 1u3r s PHE 289 Ca 0.78 0.50 0.03 0.00 0.12 0.00 0.00 56.93 58.37 1u3r s PHE 289 Cb -0.40 -1.95 -0.06 0.00 -0.57 0.00 0.00 43.02 40.04 1u3r s PHE 289 CO 0.45 0.53 0.06 0.95 -0.10 0.00 0.00 175.22 177.11 1u3r s THR 290 N -1.49 1.06 0.31 0.64 -4.23 -1.26 -4.96 115.64 105.69 1u3r s THR 290 Ca 0.35 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.88 1u3r s THR 290 Cb -0.13 -2.73 0.29 0.00 1.34 0.00 0.00 72.50 71.28 1u3r s THR 290 CO 0.22 -0.03 1.87 -0.33 -0.54 0.00 0.00 174.62 175.82 1u3r h GLU 291 N 2.20 0.92 0.34 3.99 5.08 -1.96 0.82 114.58 125.97 1u3r h GLU 291 Ca -0.40 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1u3r h GLU 291 Cb 1.24 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1u3r h GLU 291 CO 0.67 0.61 -0.16 0.00 -1.00 0.00 0.00 179.01 179.13 1u3r h ALA 292 N 1.54 -0.46 -0.71 3.43 0.00 -1.96 -2.91 119.26 118.19 1u3r h ALA 292 Ca 0.44 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1u3r h ALA 292 Cb 0.41 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1u3r h ALA 292 CO -0.20 -0.49 0.47 0.66 0.00 0.00 0.00 179.25 179.69 1u3r h SER 293 N -1.00 0.82 0.77 0.00 4.64 -1.93 -1.48 113.55 115.38 1u3r h SER 293 Ca -0.05 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.21 1u3r h SER 293 Cb 0.50 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1u3r h SER 293 CO 0.08 0.60 -0.37 -0.03 -0.87 0.00 0.00 176.83 176.24 1u3r h MET 294 N 0.97 -1.00 -0.93 4.77 -1.53 -0.92 0.15 114.93 116.45 1u3r h MET 294 Ca 0.26 0.07 0.05 0.00 -3.44 0.00 0.00 59.70 56.64 1u3r h MET 294 Cb -0.10 0.23 -0.06 0.00 -0.55 0.00 0.00 31.60 31.11 1u3r h MET 294 CO -0.06 -0.67 0.59 0.52 0.14 0.00 0.00 176.91 177.44 1u3r h MET 295 N -1.17 1.08 -0.72 0.39 2.86 -1.50 -0.13 114.93 115.74 1u3r h MET 295 Ca -0.11 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 1u3r h MET 295 Cb 0.79 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1u3r h MET 295 CO 0.17 0.71 0.29 0.00 1.06 0.00 0.00 176.91 179.15 1u3r h MET 296 N 1.11 1.05 -0.25 1.72 -0.00 -1.26 -0.66 114.93 116.64 1u3r h MET 296 Ca 0.39 -0.18 -0.14 0.00 -0.00 0.00 0.00 59.70 59.77 1u3r h MET 296 Cb 0.11 -0.18 -0.01 0.00 -0.00 0.00 0.00 31.60 31.52 1u3r h MET 296 CO -0.15 0.85 -0.42 0.77 -0.00 0.00 0.00 176.91 177.96 1u3r h SER 297 N 1.03 0.64 -0.18 -0.10 0.02 0.18 -1.66 113.55 113.49 1u3r h SER 297 Ca 0.24 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1u3r h SER 297 Cb 0.19 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1u3r h SER 297 CO -0.02 0.98 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.45 1u3r h LEU 298 N 0.49 0.42 -0.56 5.07 3.38 -0.67 -1.01 115.31 122.44 1u3r h LEU 298 Ca 0.04 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.52 1u3r h LEU 298 Cb 0.93 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1u3r h LEU 298 CO 0.08 0.78 0.17 0.71 0.09 0.00 0.00 178.44 180.27 1u3r h THR 299 N 0.07 1.24 -0.57 0.22 1.35 -1.14 0.96 112.91 115.04 1u3r h THR 299 Ca 0.04 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 1u3r h THR 299 Cb 0.63 0.71 -0.03 0.00 -1.73 0.00 0.00 68.15 67.74 1u3r h THR 299 CO 0.03 0.30 0.37 0.50 -0.25 0.00 0.00 175.52 176.48 1u3r h LYS 300 N 0.78 0.76 -0.19 4.72 3.64 -1.28 -1.24 116.57 123.75 1u3r h LYS 300 Ca 0.18 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 1u3r h LYS 300 Cb 0.29 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1u3r h LYS 300 CO -0.00 0.51 0.03 1.25 -2.27 0.00 0.00 179.45 178.96 1u3r h LEU 301 N 0.77 0.31 -0.93 5.20 5.85 -0.84 -2.44 115.31 123.23 1u3r h LEU 301 Ca 0.21 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1u3r h LEU 301 Cb -0.07 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 1u3r h LEU 301 CO -0.04 0.50 0.59 0.00 -0.34 0.00 0.00 178.44 179.15 1u3r h ALA 302 N 0.82 1.27 -0.29 1.25 0.00 -0.58 -0.07 119.26 121.67 1u3r h ALA 302 Ca 0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1u3r h ALA 302 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1u3r h ALA 302 CO 0.00 0.38 0.12 0.22 0.00 0.00 0.00 179.25 179.97 1u3r h ASP 303 N 1.09 0.39 -0.49 0.00 3.58 -1.14 -0.46 116.42 119.39 1u3r h ASP 303 Ca 0.40 -0.16 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 1u3r h ASP 303 Cb 0.14 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 1u3r h ASP 303 CO -0.16 0.44 0.29 0.11 -2.88 0.00 0.00 179.24 177.04 1u3r h LYS 304 N 0.32 0.68 -0.37 0.28 1.57 -0.91 -2.96 116.57 115.18 1u3r h LYS 304 Ca 0.10 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.74 1u3r h LYS 304 Cb 0.17 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1u3r h LYS 304 CO -0.01 0.50 -0.06 0.93 -0.57 0.00 0.00 179.45 180.24 1u3r h GLU 305 N 0.66 0.61 -0.88 3.15 5.08 -0.77 -2.87 114.58 119.56 1u3r h GLU 305 Ca 0.18 -0.16 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1u3r h GLU 305 Cb 0.01 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.13 1u3r h GLU 305 CO -0.03 0.68 0.56 -0.07 -1.00 0.00 0.00 179.01 179.14 1u3r h LEU 306 N 0.57 0.89 -0.12 1.33 3.38 -0.92 0.23 115.31 120.67 1u3r h LEU 306 Ca 0.11 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1u3r h LEU 306 Cb 0.46 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1u3r h LEU 306 CO 0.02 0.58 0.05 0.58 0.09 0.00 0.00 178.44 179.76 1u3r h VAL 307 N 1.03 0.99 0.00 1.22 2.07 -1.45 -1.74 116.25 118.36 1u3r h VAL 307 Ca 0.38 -0.04 -0.07 0.00 0.82 0.00 0.00 66.70 67.79 1u3r h VAL 307 Cb 0.14 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1u3r h VAL 307 CO -0.16 0.02 -0.32 0.45 0.02 0.00 0.00 177.57 177.58 1u3r h HIS 308 N 0.12 0.00 -0.50 1.57 3.86 -1.34 -2.87 115.15 115.98 1u3r h HIS 308 Ca 0.05 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 1u3r h HIS 308 Cb 0.01 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 1u3r h HIS 308 CO -0.09 0.32 0.06 1.98 0.86 0.00 0.00 177.93 181.06 1u3r h MET 309 N 0.00 0.85 -0.64 2.45 -1.53 -0.03 -0.85 114.93 115.17 1u3r h MET 309 Ca -0.00 -0.24 0.00 0.00 -3.44 0.00 0.00 59.70 56.02 1u3r h MET 309 Cb 0.59 -0.09 -0.03 0.00 -0.55 0.00 0.00 31.60 31.52 1u3r h MET 309 CO 0.04 0.85 0.42 0.82 0.14 0.00 0.00 176.91 179.18 1u3r h ILE 310 N 0.72 1.17 0.00 1.77 2.04 -1.11 -0.43 117.51 121.67 1u3r h ILE 310 Ca 0.15 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 1u3r h ILE 310 Cb 0.43 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1u3r h ILE 310 CO 0.01 0.17 -0.48 0.77 0.00 0.00 0.00 178.15 178.62 1u3r h SER 311 N 0.87 0.00 0.09 1.72 4.64 -1.45 -2.75 113.55 116.67 1u3r h SER 311 Ca 0.23 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1u3r h SER 311 Cb -0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1u3r h SER 311 CO -0.05 0.48 -0.04 -0.25 -0.87 0.00 0.00 176.83 176.10 1u3r h TRP 312 N 0.00 -0.11 -0.95 4.77 7.01 -0.33 -2.90 115.95 123.44 1u3r h TRP 312 Ca -0.00 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.06 1u3r h TRP 312 Cb 1.01 0.04 -0.06 0.00 -2.10 0.00 0.00 29.16 28.04 1u3r h TRP 312 CO 0.00 0.09 0.62 0.00 -2.79 0.00 0.00 178.44 176.35 1u3r h ALA 313 N 0.60 1.48 0.00 2.65 0.00 -1.00 -1.02 119.26 121.97 1u3r h ALA 313 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1u3r h ALA 313 Cb 0.25 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1u3r h ALA 313 CO 0.02 0.37 0.00 0.87 0.00 0.00 0.00 179.25 180.51 1u3r h LYS 314 N 1.08 0.00 -0.01 0.00 1.57 -1.39 -2.11 116.57 115.70 1u3r h LYS 314 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1u3r h LYS 314 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 1u3r h LYS 314 CO -0.17 0.00 -0.12 1.63 -0.57 0.00 0.00 179.45 180.22 1u3r n LYS 315 N -2.75 1.27 -2.78 3.15 5.02 -0.39 -4.62 118.16 117.06 1u3r n LYS 315 Ca 0.00 -0.75 -0.42 0.00 -2.02 0.00 0.00 58.31 55.12 1u3r n LYS 315 Cb 0.23 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.72 1u3r n LYS 315 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1u3r s ILE 316 N -2.24 4.68 -0.41 -0.18 1.01 -0.80 -4.86 121.20 118.39 1u3r s ILE 316 Ca 0.31 1.58 -0.44 0.00 0.00 0.00 0.00 60.65 62.11 1u3r s ILE 316 Cb 0.20 -4.27 -0.18 0.00 0.01 0.00 0.00 42.46 38.22 1u3r s ILE 316 CO 0.42 -0.30 1.73 -2.65 0.00 0.00 0.00 174.94 174.14 1u3r n PRO 317 N 6.44 0.47 0.00 2.79 -0.02 -1.26 -0.84 135.00 142.58 1u3r n PRO 317 Ca 0.08 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1u3r n PRO 317 Cb 0.47 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1u3r n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u3r n GLY 318 N 4.49 2.87 0.22 -1.23 0.00 -1.26 -4.93 105.19 105.34 1u3r n GLY 318 Ca 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.28 1u3r n GLY 318 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u3r h PHE 319 N 0.00 0.61 0.00 1.61 3.57 -1.26 -1.47 116.94 120.00 1u3r h PHE 319 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1u3r h PHE 319 Cb 0.00 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1u3r h PHE 319 CO 0.00 0.35 0.00 1.33 -2.23 0.00 0.00 178.31 177.76 1u3r n VAL 320 N -4.78 0.88 0.85 1.41 0.24 -1.26 -1.88 118.33 113.79 1u3r n VAL 320 Ca 0.04 0.28 0.13 0.00 -2.04 0.00 0.00 64.34 62.75 1u3r n VAL 320 Cb 0.07 -1.20 0.36 0.00 -1.47 0.00 0.00 33.84 31.59 1u3r n VAL 320 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1u3r n GLU 321 N -2.17 0.11 -1.65 7.34 4.71 -0.56 -4.85 120.64 123.57 1u3r n GLU 321 Ca 0.02 0.05 -0.32 0.00 -0.01 0.00 0.00 57.16 56.90 1u3r n GLU 321 Cb 0.20 -1.59 0.05 0.00 -1.01 0.00 0.00 31.44 29.10 1u3r n GLU 321 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1u3r s LEU 322 N -3.50 3.24 0.76 -4.62 1.43 -0.79 -4.94 118.68 110.27 1u3r s LEU 322 Ca 0.11 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 54.85 1u3r s LEU 322 Cb 0.16 -4.52 0.06 0.00 0.03 0.00 0.00 46.19 41.92 1u3r s LEU 322 CO 0.64 -1.55 1.20 -0.94 0.23 0.00 0.00 176.35 175.93 1u3r s SER 323 N -3.23 3.99 0.41 2.29 1.04 -1.26 -4.77 113.70 112.16 1u3r s SER 323 Ca 0.62 2.33 0.08 0.00 0.48 0.00 0.00 55.95 59.46 1u3r s SER 323 Cb -0.16 -2.59 0.87 0.00 0.10 0.00 0.00 66.02 64.24 1u3r s SER 323 CO 0.48 -2.40 2.02 0.25 0.98 0.00 0.00 173.24 174.57 1u3r h LEU 324 N -0.56 0.36 -1.02 2.42 5.85 -1.93 -1.49 115.31 118.93 1u3r h LEU 324 Ca -0.47 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 1u3r h LEU 324 Cb 1.29 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 1u3r h LEU 324 CO 0.48 0.33 0.55 0.15 -0.34 0.00 0.00 178.44 179.62 1u3r h PHE 325 N 0.40 1.19 -0.04 1.25 3.57 -2.00 -2.48 116.94 118.84 1u3r h PHE 325 Ca 0.10 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.44 1u3r h PHE 325 Cb 0.09 -0.39 0.01 0.00 2.79 0.00 0.00 35.95 38.45 1u3r h PHE 325 CO 0.00 0.78 -0.62 -0.44 -2.23 0.00 0.00 178.31 175.81 1u3r h ASP 326 N 1.25 0.60 -0.70 0.41 3.32 -1.64 -2.30 116.42 117.36 1u3r h ASP 326 Ca 0.33 -0.72 0.08 0.00 0.02 0.00 0.00 57.03 56.73 1u3r h ASP 326 Cb -0.06 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 39.24 1u3r h ASP 326 CO -0.06 1.24 0.37 1.56 -1.72 0.00 0.00 179.24 180.63 1u3r h GLN 327 N 0.03 0.64 -0.07 3.56 4.20 -1.28 0.15 115.11 122.34 1u3r h GLN 327 Ca -0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1u3r h GLN 327 Cb 1.30 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.93 1u3r h GLN 327 CO 0.12 0.42 -0.01 0.28 -0.67 0.00 0.00 178.83 178.97 1u3r h VAL 328 N 0.66 1.28 -0.27 -0.54 2.07 -1.52 -2.50 116.25 115.44 1u3r h VAL 328 Ca 0.33 -0.89 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 1u3r h VAL 328 Cb 0.27 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1u3r h VAL 328 CO -0.22 0.25 -0.18 -0.09 0.02 0.00 0.00 177.57 177.34 1u3r h ARG 329 N -0.20 0.48 -0.17 1.57 2.43 -1.05 0.21 114.38 117.64 1u3r h ARG 329 Ca 0.02 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 58.98 1u3r h ARG 329 Cb 0.39 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1u3r h ARG 329 CO 0.01 0.65 -0.11 -0.07 -1.51 0.00 0.00 179.97 178.94 1u3r h LEU 330 N 0.43 0.38 -0.54 3.80 3.38 -0.70 -2.36 115.31 119.71 1u3r h LEU 330 Ca 0.07 -0.43 -0.12 0.00 0.09 0.00 0.00 57.88 57.49 1u3r h LEU 330 Cb 0.57 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1u3r h LEU 330 CO 0.04 0.74 -0.17 -0.07 0.09 0.00 0.00 178.44 179.07 1u3r h LEU 331 N 0.04 1.02 -1.30 1.67 3.38 -1.34 -1.76 115.31 117.01 1u3r h LEU 331 Ca 0.03 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 1u3r h LEU 331 Cb 0.60 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1u3r h LEU 331 CO 0.03 1.16 -0.30 -0.33 0.09 0.00 0.00 178.44 179.08 1u3r h GLU 332 N 0.88 0.07 0.17 1.13 5.08 -0.97 -2.04 114.58 118.89 1u3r h GLU 332 Ca 0.12 -0.02 -0.31 0.00 -1.00 0.00 0.00 59.36 58.15 1u3r h GLU 332 Cb 0.74 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 30.01 1u3r h GLU 332 CO 0.06 0.37 -1.33 1.03 -1.00 0.00 0.00 179.01 178.14 1u3r h SER 333 N 0.06 0.78 -0.00 1.42 0.87 -1.24 -3.40 113.55 112.04 1u3r h SER 333 Ca 0.01 -0.78 0.00 0.00 -1.23 0.00 0.00 61.79 59.79 1u3r h SER 333 Cb 0.57 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1u3r h SER 333 CO 0.04 1.59 -0.65 0.00 -0.53 0.00 0.00 176.83 177.29 1u3r h TRP 335 N 0.77 -0.31 -0.49 0.00 5.08 -1.58 -0.94 115.95 118.47 1u3r h TRP 335 Ca 0.00 0.06 0.00 0.00 1.08 0.00 0.00 58.89 60.04 1u3r h TRP 335 Cb 0.49 0.25 -0.02 0.00 -3.00 0.00 0.00 29.16 26.88 1u3r h TRP 335 CO 0.00 -0.30 0.31 1.98 -1.28 0.00 0.00 178.44 179.15 1u3r h MET 336 N 0.02 0.65 -0.92 0.12 4.05 -1.88 -1.00 114.93 115.97 1u3r h MET 336 Ca 0.36 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.74 1u3r h MET 336 Cb 0.58 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 31.19 1u3r h MET 336 CO -0.73 0.44 0.57 0.93 0.23 0.00 0.00 176.91 178.35 1u3r h GLU 337 N 0.66 1.24 -0.53 0.39 5.08 -1.53 -0.96 114.58 118.93 1u3r h GLU 337 Ca 0.18 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 1u3r h GLU 337 Cb -0.06 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 28.91 1u3r h GLU 337 CO -0.04 0.86 -0.13 0.28 -1.00 0.00 0.00 179.01 178.98 1u3r h VAL 338 N 1.27 1.27 -0.24 3.13 2.07 -0.86 -0.79 116.25 122.10 1u3r h VAL 338 Ca 0.33 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1u3r h VAL 338 Cb -0.07 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1u3r h VAL 338 CO -0.06 0.45 0.12 -0.07 0.02 0.00 0.00 177.57 178.03 1u3r h LEU 339 N 0.90 0.30 -1.37 2.57 3.38 -0.73 -2.39 115.31 117.97 1u3r h LEU 339 Ca 0.13 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1u3r h LEU 339 Cb 0.70 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1u3r h LEU 339 CO 0.05 0.33 -0.20 0.24 0.09 0.00 0.00 178.44 178.95 1u3r h MET 340 N 0.26 0.16 -0.06 1.13 2.86 -0.98 -1.35 114.93 116.95 1u3r h MET 340 Ca 0.08 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 1u3r h MET 340 Cb 0.10 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1u3r h MET 340 CO -0.01 0.37 -0.46 1.98 1.06 0.00 0.00 176.91 179.84 1u3r h MET 341 N 0.15 0.14 -0.31 1.72 1.85 -0.95 -1.69 114.93 115.84 1u3r h MET 341 Ca 0.03 -0.07 -0.16 0.00 -0.61 0.00 0.00 59.70 58.89 1u3r h MET 341 Cb 0.45 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.48 1u3r h MET 341 CO 0.03 0.58 -0.42 0.78 -0.40 0.00 0.00 176.91 177.48 1u3r h GLY 342 N 1.35 0.91 0.85 1.39 0.00 -0.84 -2.27 103.07 104.45 1u3r h GLY 342 Ca 0.01 -0.99 0.03 0.00 0.00 0.00 0.00 47.33 46.37 1u3r h GLY 342 CO 0.07 0.90 0.39 -2.00 0.00 0.00 0.00 176.54 175.90 1u3r h LEU 343 N 0.61 0.64 -0.34 3.11 5.85 -0.91 -1.51 115.31 122.75 1u3r h LEU 343 Ca 0.04 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1u3r h LEU 343 Cb 1.02 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1u3r h LEU 343 CO 0.10 0.44 0.05 0.24 -0.34 0.00 0.00 178.44 178.93 1u3r h MET 344 N 0.77 0.57 -0.82 1.25 2.86 -1.18 -0.04 114.93 118.34 1u3r h MET 344 Ca 0.26 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1u3r h MET 344 Cb 0.04 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1u3r h MET 344 CO -0.11 0.65 0.48 2.35 1.06 0.00 0.00 176.91 181.34 1u3r h TRP 345 N 0.40 1.09 -0.16 -0.22 2.91 -1.19 -1.26 115.95 117.52 1u3r h TRP 345 Ca 0.10 -0.01 -0.10 0.00 1.13 0.00 0.00 58.89 60.01 1u3r h TRP 345 Cb 0.36 -0.36 -0.01 0.00 -0.51 0.00 0.00 29.16 28.64 1u3r h TRP 345 CO 0.02 0.73 -0.35 0.00 -1.03 0.00 0.00 178.44 177.82 1u3r h ARG 346 N 1.13 0.32 -0.00 2.65 3.08 -1.05 -3.09 114.38 117.42 1u3r h ARG 346 Ca 0.29 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1u3r h ARG 346 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1u3r h ARG 346 CO -0.05 0.64 -0.32 0.43 -1.07 0.00 0.00 179.97 179.59 1u3r n SER 347 N -4.07 0.34 -0.24 7.04 7.64 -0.05 -4.41 113.62 119.88 1u3r n SER 347 Ca -0.01 -0.02 0.05 0.00 1.01 0.00 0.00 58.87 59.89 1u3r n SER 347 Cb 0.45 -0.01 0.17 0.00 -1.01 0.00 0.00 64.21 63.81 1u3r n SER 347 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1u3r h ILE 348 N 0.03 0.56 -0.14 0.44 2.10 -1.16 -0.72 117.51 118.62 1u3r h ILE 348 Ca 0.00 -0.10 0.00 0.00 1.08 0.00 0.00 64.86 65.84 1u3r h ILE 348 Cb 0.50 0.24 0.00 0.00 -1.09 0.00 0.00 36.82 36.47 1u3r h ILE 348 CO 0.00 0.05 0.00 0.47 -1.08 0.00 0.00 178.15 177.59 1u3r n ASP 349 N -5.12 1.76 -3.27 2.19 8.00 -1.26 -4.43 116.55 114.41 1u3r n ASP 349 Ca 0.13 -2.15 -0.25 0.00 0.71 0.00 0.00 54.79 53.23 1u3r n ASP 349 Cb 0.43 -0.42 -0.08 0.00 -0.02 0.00 0.00 41.12 41.03 1u3r n ASP 349 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1u3r n HIS 350 N 0.10 -0.89 -1.58 1.24 8.25 -0.28 -5.13 115.22 116.94 1u3r n HIS 350 Ca 0.06 -3.29 -0.44 0.00 -0.26 0.00 0.00 57.72 53.79 1u3r n HIS 350 Cb 0.38 0.11 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 1u3r n HIS 350 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1u3r n PRO 351 N 2.25 1.28 0.00 -0.41 -0.04 -1.26 -2.06 135.00 134.76 1u3r n PRO 351 Ca 0.26 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.17 1u3r n PRO 351 Cb 0.51 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1u3r n PRO 351 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u3r n GLY 352 N 1.26 2.76 3.56 0.55 0.00 -1.26 -5.01 105.19 107.04 1u3r n GLY 352 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1u3r n GLY 352 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u3r s LYS 353 N -0.14 2.03 -0.34 1.61 1.02 -0.87 -4.40 119.74 118.65 1u3r s LYS 353 Ca 0.00 -1.22 -0.03 0.00 0.02 0.00 0.00 55.97 54.74 1u3r s LYS 353 Cb 0.00 -2.17 0.06 0.00 -0.52 0.00 0.00 37.83 35.20 1u3r s LYS 353 CO 0.00 0.45 0.07 -0.51 -0.92 0.00 0.00 175.35 174.44 1u3r s LEU 354 N -2.66 4.33 -1.36 3.17 1.43 -0.70 -4.84 118.68 118.07 1u3r s LEU 354 Ca 0.24 -1.44 -0.11 0.00 -1.03 0.00 0.00 54.13 51.78 1u3r s LEU 354 Cb -0.09 -1.77 0.11 0.00 0.03 0.00 0.00 46.19 44.47 1u3r s LEU 354 CO 0.14 -0.35 2.06 -0.38 0.23 0.00 0.00 176.35 178.05 1u3r n ILE 355 N 4.65 4.05 -0.15 -0.59 2.08 -1.26 -2.32 119.36 125.82 1u3r n ILE 355 Ca -0.10 -3.84 0.07 0.00 0.56 0.00 0.00 62.75 59.44 1u3r n ILE 355 Cb 0.43 -2.45 0.38 0.00 -0.75 0.00 0.00 39.64 37.25 1u3r n ILE 355 CO 0.00 0.00 0.00 -0.26 0.56 0.00 0.00 176.55 176.85 1u3r h PHE 356 N 5.77 0.70 -1.98 1.39 -1.00 -1.79 -3.43 116.94 116.60 1u3r h PHE 356 Ca 0.48 0.02 0.14 0.00 2.81 0.00 0.00 57.97 61.42 1u3r h PHE 356 Cb 0.61 -0.23 -0.17 0.00 3.61 0.00 0.00 35.95 39.77 1u3r h PHE 356 CO 1.36 0.38 0.58 0.00 -1.61 0.00 0.00 178.31 179.01 1u3r s ALA 357 N -5.62 -1.90 0.33 2.45 0.00 -0.95 -4.96 121.76 111.11 1u3r s ALA 357 Ca -0.09 1.24 0.10 0.00 0.00 0.00 0.00 51.96 53.21 1u3r s ALA 357 Cb 0.19 0.10 0.88 0.00 0.00 0.00 0.00 23.12 24.29 1u3r s ALA 357 CO 0.76 -0.60 1.76 -1.35 0.00 0.00 0.00 175.76 176.33 1u3r h PRO 358 N 2.09 0.59 -0.51 0.00 0.11 -1.87 0.15 132.00 132.56 1u3r h PRO 358 Ca -0.18 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.85 1u3r h PRO 358 Cb 1.21 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 1u3r h PRO 358 CO 0.29 0.39 0.05 -0.40 -0.21 0.00 0.00 178.00 178.12 1u3r n ASP 359 N -4.78 5.01 -3.10 -2.05 5.75 -1.26 -4.58 116.55 111.53 1u3r n ASP 359 Ca 0.25 -3.04 -0.20 0.00 -0.01 0.00 0.00 54.79 51.80 1u3r n ASP 359 Cb 0.70 -0.66 -0.04 0.00 -1.03 0.00 0.00 41.12 40.09 1u3r n ASP 359 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1u3r n LEU 360 N 0.13 -0.90 -4.49 -2.12 7.94 0.51 -4.77 117.00 113.29 1u3r n LEU 360 Ca 0.29 -4.19 -0.35 0.00 -1.11 0.00 0.00 56.01 50.64 1u3r n LEU 360 Cb 1.15 0.67 -0.12 0.00 0.53 0.00 0.00 43.42 45.65 1u3r n LEU 360 CO 0.30 2.00 -0.31 -0.69 -1.11 0.00 0.00 177.39 177.58 1u3r s VAL 361 N -0.37 4.18 0.13 1.96 1.01 -1.23 -2.25 120.40 123.84 1u3r s VAL 361 Ca 0.34 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.16 1u3r s VAL 361 Cb 0.14 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1u3r s VAL 361 CO -0.15 0.42 -0.19 -0.76 0.00 0.00 0.00 175.10 174.42 1u3r s LEU 362 N 0.94 2.37 0.47 3.92 1.43 -0.98 -4.98 118.68 121.85 1u3r s LEU 362 Ca 0.02 -0.78 0.08 0.00 -1.03 0.00 0.00 54.13 52.42 1u3r s LEU 362 Cb -0.14 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.27 1u3r s LEU 362 CO 0.02 -0.00 0.49 -1.81 0.23 0.00 0.00 176.35 175.27 1u3r s ASP 363 N -2.30 5.05 0.19 2.29 1.11 -1.26 -1.71 116.67 120.04 1u3r s ASP 363 Ca 0.11 -0.83 -0.06 0.00 0.18 0.00 0.00 52.55 51.95 1u3r s ASP 363 Cb -0.08 -0.21 0.12 0.00 1.07 0.00 0.00 42.92 43.82 1u3r s ASP 363 CO 0.05 -0.89 1.59 -0.09 1.18 0.00 0.00 175.17 177.01 1u3r h ARG 364 N 0.76 0.84 0.00 8.23 2.43 -1.98 -2.48 114.38 122.17 1u3r h ARG 364 Ca -0.38 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 58.43 1u3r h ARG 364 Cb 1.28 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1u3r h ARG 364 CO 0.53 0.99 -0.01 -0.44 -1.51 0.00 0.00 179.97 179.53 1u3r h ASP 365 N 0.72 0.00 1.47 -3.80 3.32 -1.96 -2.19 116.42 113.98 1u3r h ASP 365 Ca 0.09 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1u3r h ASP 365 Cb 0.79 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 1u3r h ASP 365 CO 0.07 0.01 -0.42 -0.33 -1.72 0.00 0.00 179.24 176.85 1u3r h GLU 366 N 0.00 0.00 0.00 3.56 5.08 -1.84 -3.03 114.58 118.35 1u3r h GLU 366 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1u3r h GLU 366 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1u3r h GLU 366 CO 0.00 0.42 0.00 0.41 -1.00 0.00 0.00 179.01 178.84 1u3r n GLY 367 N 1.07 -1.34 0.15 -3.84 0.00 -0.83 -3.45 105.19 96.96 1u3r n GLY 367 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 1u3r n GLY 367 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u3r h LYS 368 N 0.00 0.21 -0.02 1.61 1.57 -1.53 -3.11 116.57 115.30 1u3r h LYS 368 Ca 0.00 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1u3r h LYS 368 Cb 0.35 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 1u3r h LYS 368 CO 0.00 0.81 0.02 0.00 -0.57 0.00 0.00 179.45 179.70 1u3r s VAL 370 N -4.85 4.16 0.22 0.00 1.01 -1.18 -4.76 120.40 115.00 1u3r s VAL 370 Ca -0.05 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 1u3r s VAL 370 Cb 0.16 -3.02 -0.12 0.00 0.00 0.00 0.00 36.38 33.40 1u3r s VAL 370 CO 0.61 0.23 1.67 -0.70 0.00 0.00 0.00 175.10 176.91 1u3r s GLU 371 N 1.57 4.14 0.00 2.72 2.12 -1.26 -2.53 118.70 125.46 1u3r s GLU 371 Ca 0.05 2.56 0.00 0.00 0.36 0.00 0.00 54.97 57.94 1u3r s GLU 371 Cb -0.16 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.16 1u3r s GLU 371 CO 0.03 -0.70 0.00 0.41 -0.54 0.00 0.00 175.26 174.46 1u3r n GLY 372 N 3.47 2.40 0.10 -1.50 0.00 -1.26 -4.87 105.19 103.53 1u3r n GLY 372 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 1u3r n GLY 372 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1u3r h ILE 373 N 0.00 0.76 -0.63 -0.61 2.04 -1.72 -3.31 117.51 114.03 1u3r h ILE 373 Ca 0.00 -2.30 0.03 0.00 1.00 0.00 0.00 64.86 63.58 1u3r h ILE 373 Cb 0.00 2.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 1u3r h ILE 373 CO 0.00 0.43 0.42 0.25 0.00 0.00 0.00 178.15 179.25 1u3r h LEU 374 N 0.00 0.67 0.08 1.44 5.85 -1.69 0.22 115.31 121.88 1u3r h LEU 374 Ca -0.13 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1u3r h LEU 374 Cb 1.62 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 1u3r h LEU 374 CO 0.06 0.47 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.45 1u3r h GLU 375 N 0.78 -0.20 -0.65 1.25 4.81 -1.92 -1.39 114.58 117.26 1u3r h GLU 375 Ca 0.25 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1u3r h GLU 375 Cb 0.03 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1u3r h GLU 375 CO -0.07 -0.13 0.13 0.82 -0.73 0.00 0.00 179.01 179.03 1u3r h ILE 376 N -0.21 1.26 -0.76 2.32 2.04 -1.33 -2.43 117.51 118.40 1u3r h ILE 376 Ca 0.01 -0.99 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 1u3r h ILE 376 Cb 0.21 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1u3r h ILE 376 CO -0.04 0.37 0.39 -0.26 0.00 0.00 0.00 178.15 178.61 1u3r h PHE 377 N 0.98 1.06 -0.89 1.37 -1.00 -0.45 -1.78 116.94 116.24 1u3r h PHE 377 Ca 0.20 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.92 1u3r h PHE 377 Cb 0.41 -0.33 -0.04 0.00 3.61 0.00 0.00 35.95 39.59 1u3r h PHE 377 CO 0.03 0.77 0.47 -0.44 -1.61 0.00 0.00 178.31 177.53 1u3r h ASP 378 N 1.05 1.12 -0.13 2.17 3.32 -1.02 0.18 116.42 123.11 1u3r h ASP 378 Ca 0.26 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1u3r h ASP 378 Cb 0.08 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1u3r h ASP 378 CO -0.04 0.91 0.06 0.24 -1.72 0.00 0.00 179.24 178.69 1u3r h MET 379 N 1.25 0.19 -0.51 3.56 2.86 -1.03 -0.79 114.93 120.45 1u3r h MET 379 Ca 0.31 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.91 1u3r h MET 379 Cb 0.05 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1u3r h MET 379 CO -0.05 0.27 0.30 -0.07 1.06 0.00 0.00 176.91 178.41 1u3r h LEU 380 N 0.07 0.63 -0.83 1.22 3.38 -0.95 -0.88 115.31 117.95 1u3r h LEU 380 Ca 0.04 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1u3r h LEU 380 Cb 0.14 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1u3r h LEU 380 CO -0.00 0.52 -0.05 -0.07 0.09 0.00 0.00 178.44 178.92 1u3r h LEU 381 N 0.68 0.80 -0.14 1.67 3.38 -0.57 -0.28 115.31 120.85 1u3r h LEU 381 Ca 0.18 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1u3r h LEU 381 Cb 0.02 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1u3r h LEU 381 CO -0.03 0.90 -0.05 0.00 0.09 0.00 0.00 178.44 179.35 1u3r h ALA 382 N 1.18 0.20 -0.60 1.53 0.00 -0.86 -0.54 119.26 120.17 1u3r h ALA 382 Ca 0.14 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1u3r h ALA 382 Cb 0.53 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1u3r h ALA 382 CO 0.03 -0.03 0.16 1.15 0.00 0.00 0.00 179.25 180.56 1u3r h THR 383 N -0.04 1.23 -0.62 0.00 2.02 -1.06 -1.29 112.91 113.15 1u3r h THR 383 Ca 0.03 -0.83 -0.10 0.00 0.77 0.00 0.00 66.41 66.29 1u3r h THR 383 Cb 0.50 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 1u3r h THR 383 CO 0.02 0.31 0.01 0.74 0.37 0.00 0.00 175.52 176.97 1u3r h THR 384 N 0.88 1.27 -0.44 3.16 2.02 -0.95 -1.82 112.91 117.03 1u3r h THR 384 Ca 0.19 -1.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.18 1u3r h THR 384 Cb 0.29 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1u3r h THR 384 CO -0.00 0.42 0.09 -1.28 0.37 0.00 0.00 175.52 175.12 1u3r h SER 385 N 1.00 0.61 -0.02 4.18 0.87 -0.61 -1.00 113.55 118.57 1u3r h SER 385 Ca 0.18 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1u3r h SER 385 Cb 0.56 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1u3r h SER 385 CO 0.03 0.62 -0.00 -0.09 -0.53 0.00 0.00 176.83 176.86 1u3r h ARG 386 N 0.64 0.04 -0.40 2.24 9.65 -0.72 -1.93 114.38 123.90 1u3r h ARG 386 Ca 0.14 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.01 1u3r h ARG 386 Cb 0.26 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.82 1u3r h ARG 386 CO -0.00 0.34 0.26 0.74 2.80 0.00 0.00 179.97 184.11 1u3r h PHE 387 N -0.27 0.51 -0.33 2.20 0.04 -1.14 -2.12 116.94 115.83 1u3r h PHE 387 Ca 0.01 0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 1u3r h PHE 387 Cb 0.32 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1u3r h PHE 387 CO 0.03 0.32 0.09 -0.09 -0.60 0.00 0.00 178.31 178.07 1u3r h ARG 388 N 0.55 0.51 0.00 1.51 2.43 -0.95 -1.10 114.38 117.33 1u3r h ARG 388 Ca 0.15 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 1u3r h ARG 388 Cb -0.06 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 1u3r h ARG 388 CO -0.03 0.56 -0.34 1.05 -1.51 0.00 0.00 179.97 179.70 1u3r h GLU 389 N 0.37 0.00 0.00 0.20 4.11 -0.83 -1.15 114.58 117.28 1u3r h GLU 389 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.53 1u3r h GLU 389 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1u3r h GLU 389 CO -0.00 0.34 0.00 1.28 0.07 0.00 0.00 179.01 180.70 1u3r n LEU 390 N -3.77 0.15 -3.34 3.06 4.77 -0.85 -4.93 117.00 112.09 1u3r n LEU 390 Ca -0.01 0.51 -0.16 0.00 -0.03 0.00 0.00 56.01 56.32 1u3r n LEU 390 Cb 0.42 -0.47 0.08 0.00 -2.33 0.00 0.00 43.42 41.13 1u3r n LEU 390 CO 0.36 -0.04 0.09 0.29 -1.33 0.00 0.00 177.39 176.76 1u3r n LYS 391 N -1.64 -5.52 -1.59 3.23 5.02 -0.43 -4.87 118.16 112.35 1u3r n LYS 391 Ca 0.07 0.84 -0.50 0.00 -2.02 0.00 0.00 58.31 56.69 1u3r n LYS 391 Cb 0.35 -5.79 -0.05 0.00 -0.02 0.00 0.00 35.03 29.52 1u3r n LYS 391 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1u3r n LEU 392 N -3.87 1.75 -4.93 -0.35 7.94 -0.62 -4.96 117.00 111.97 1u3r n LEU 392 Ca -0.24 1.13 -0.27 0.00 -1.11 0.00 0.00 56.01 55.52 1u3r n LEU 392 Cb 0.66 -1.22 -0.03 0.00 0.53 0.00 0.00 43.42 43.35 1u3r n LEU 392 CO 0.59 -1.07 -0.00 -1.10 -1.11 0.00 0.00 177.39 174.70 1u3r s GLN 393 N 0.15 3.51 0.20 1.96 -1.52 -1.26 -4.98 119.66 117.72 1u3r s GLN 393 Ca 0.79 -0.38 -0.10 0.00 -1.95 0.00 0.00 55.36 53.72 1u3r s GLN 393 Cb -0.89 -2.87 0.25 0.00 -0.22 0.00 0.00 33.01 29.29 1u3r s GLN 393 CO 0.48 0.43 1.74 1.25 -0.25 0.00 0.00 175.29 178.95 1u3r h HIS 394 N 2.09 0.36 0.00 0.91 2.76 -1.99 -0.97 115.15 118.31 1u3r h HIS 394 Ca -0.48 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 57.66 1u3r h HIS 394 Cb 1.19 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 30.06 1u3r h HIS 394 CO 0.55 0.10 -0.31 0.87 -1.30 0.00 0.00 177.93 177.84 1u3r h LYS 395 N 0.39 0.00 -0.23 5.26 1.57 -1.99 -1.54 116.57 120.02 1u3r h LYS 395 Ca 0.29 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.99 1u3r h LYS 395 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1u3r h LYS 395 CO -0.29 0.31 -0.18 0.93 -0.57 0.00 0.00 179.45 179.64 1u3r h GLU 396 N 0.00 0.54 -0.71 3.15 5.08 -1.72 -2.61 114.58 118.31 1u3r h GLU 396 Ca -0.00 -0.26 0.11 0.00 -1.00 0.00 0.00 59.36 58.20 1u3r h GLU 396 Cb 0.55 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.72 1u3r h GLU 396 CO 0.04 0.84 0.32 -0.92 -1.00 0.00 0.00 179.01 178.29 1u3r h TYR 397 N 0.24 0.56 -0.52 4.33 3.20 -0.65 0.14 116.97 124.28 1u3r h TYR 397 Ca 0.04 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1u3r h TYR 397 Cb 0.72 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 1u3r h TYR 397 CO 0.07 0.15 0.30 -0.07 -1.64 0.00 0.00 178.16 176.97 1u3r h LEU 398 N 0.52 0.64 -0.11 2.82 3.38 -1.15 -0.81 115.31 120.60 1u3r h LEU 398 Ca 0.37 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 1u3r h LEU 398 Cb 0.46 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1u3r h LEU 398 CO -0.32 0.53 -0.11 0.00 0.09 0.00 0.00 178.44 178.63 1u3r h VAL 400 N -0.13 0.93 -0.60 0.00 2.07 -0.90 0.21 116.25 117.83 1u3r h VAL 400 Ca 0.02 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 1u3r h VAL 400 Cb 0.64 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1u3r h VAL 400 CO 0.03 0.13 0.17 0.50 0.02 0.00 0.00 177.57 178.42 1u3r h LYS 401 N 0.69 0.95 -0.69 1.57 3.64 -1.13 -0.21 116.57 121.39 1u3r h LYS 401 Ca 0.33 -0.21 -0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1u3r h LYS 401 Cb 0.26 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1u3r h LYS 401 CO -0.22 0.85 0.21 0.00 -2.27 0.00 0.00 179.45 178.03 1u3r h ALA 402 N 1.05 0.90 -0.59 5.00 0.00 -0.80 -2.61 119.26 122.21 1u3r h ALA 402 Ca 0.19 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1u3r h ALA 402 Cb 0.31 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1u3r h ALA 402 CO -0.00 0.58 0.20 0.52 0.00 0.00 0.00 179.25 180.56 1u3r h MET 403 N 1.01 0.88 -0.86 0.00 2.86 -0.15 -1.68 114.93 117.00 1u3r h MET 403 Ca 0.22 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1u3r h MET 403 Cb 0.30 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1u3r h MET 403 CO -0.01 0.75 0.55 0.82 1.06 0.00 0.00 176.91 180.08 1u3r h ILE 404 N 0.86 1.23 -0.04 -1.22 2.04 -0.67 0.06 117.51 119.77 1u3r h ILE 404 Ca 0.20 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1u3r h ILE 404 Cb 0.22 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1u3r h ILE 404 CO -0.01 0.22 -0.00 0.25 0.00 0.00 0.00 178.15 178.61 1u3r h LEU 405 N 1.17 0.07 -0.44 1.44 5.85 -1.24 -2.61 115.31 119.55 1u3r h LEU 405 Ca 0.31 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1u3r h LEU 405 Cb -0.11 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1u3r h LEU 405 CO -0.06 0.38 0.00 0.18 -0.34 0.00 0.00 178.44 178.59 1u3r n LEU 406 N -4.88 0.72 -0.26 2.25 4.77 -0.67 -3.39 117.00 115.53 1u3r n LEU 406 Ca -0.07 0.63 0.03 0.00 -0.03 0.00 0.00 56.01 56.57 1u3r n LEU 406 Cb 0.19 -0.48 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 1u3r n LEU 406 CO 0.34 -0.42 0.56 -3.20 -1.33 0.00 0.00 177.39 173.34 1u3r n ASN 407 N -2.25 2.45 0.08 -1.43 2.85 -0.01 -4.85 115.26 112.10 1u3r n ASN 407 Ca 0.03 -2.21 -0.04 0.00 -0.11 0.00 0.00 54.58 52.26 1u3r n ASN 407 Cb 0.31 -0.16 -0.02 0.00 1.24 0.00 0.00 39.78 41.15 1u3r n ASN 407 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 1u3r h SER 408 N 0.72 -0.23 -3.79 1.20 4.64 -1.48 -3.48 113.55 111.14 1u3r h SER 408 Ca 0.00 0.01 -0.43 0.00 -0.47 0.00 0.00 61.79 60.90 1u3r h SER 408 Cb 0.70 0.06 0.18 0.00 -0.31 0.00 0.00 62.40 63.03 1u3r h SER 408 CO 0.02 0.07 0.33 -0.55 -0.87 0.00 0.00 176.83 175.83 1u3r s SER 409 N -4.31 2.22 0.87 4.97 0.15 -1.26 -4.96 113.70 111.38 1u3r s SER 409 Ca -0.04 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1u3r s SER 409 Cb 0.00 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 1u3r s SER 409 CO 0.12 -3.29 0.00 0.80 1.20 0.00 0.00 173.24 172.07 1u3r n MET 410 N -4.15 0.00 0.00 5.44 0.00 -1.26 -5.10 117.12 112.05 1u3r n MET 410 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.86 1u3r n MET 410 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.81 1u3r n MET 410 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 1u3r n GLN 418 N 13.73 0.00 -0.20 2.12 6.02 -1.26 -5.26 117.38 132.53 1u3r n GLN 418 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 1u3r n GLN 418 Cb 0.00 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.28 1u3r n GLN 418 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1u3r h ASP 419 N 0.00 0.75 0.96 1.08 1.82 -2.06 -2.65 116.42 116.33 1u3r h ASP 419 Ca 0.00 -0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 1u3r h ASP 419 Cb 0.00 -0.19 0.00 0.00 0.68 0.00 0.00 39.33 39.82 1u3r h ASP 419 CO 0.00 0.69 -1.02 0.00 -1.61 0.00 0.00 179.24 177.31 1u3r n ALA 420 N -2.34 2.56 0.04 -0.78 0.00 -1.26 -4.13 120.51 114.60 1u3r n ALA 420 Ca 0.03 -0.24 -0.13 0.00 0.00 0.00 0.00 53.44 53.10 1u3r n ALA 420 Cb 0.14 -1.10 -0.08 0.00 0.00 0.00 0.00 19.45 18.41 1u3r n ALA 420 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1u3r h ASP 421 N 0.00 -0.07 -0.86 0.00 3.58 -1.98 -2.84 116.42 114.25 1u3r h ASP 421 Ca 0.00 -0.21 0.10 0.00 0.42 0.00 0.00 57.03 57.34 1u3r h ASP 421 Cb 0.99 0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.99 1u3r h ASP 421 CO 0.00 0.17 0.56 -1.28 -2.88 0.00 0.00 179.24 175.81 1u3r h SER 422 N -0.31 0.74 0.08 2.28 0.87 -1.64 -2.40 113.55 113.17 1u3r h SER 422 Ca -0.01 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.60 1u3r h SER 422 Cb 0.27 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 62.06 1u3r h SER 422 CO 0.01 0.43 -0.27 -1.28 -0.53 0.00 0.00 176.83 175.19 1u3r h SER 423 N 0.82 -0.79 -0.66 6.23 0.87 -1.66 -1.17 113.55 117.19 1u3r h SER 423 Ca 0.40 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 61.03 1u3r h SER 423 Cb 0.45 0.31 -0.03 0.00 -0.44 0.00 0.00 62.40 62.68 1u3r h SER 423 CO -0.17 -0.36 0.33 0.03 -0.53 0.00 0.00 176.83 176.14 1u3r h ARG 424 N -0.46 0.97 -0.59 2.24 -0.00 -1.35 -1.84 114.38 113.35 1u3r h ARG 424 Ca 0.04 -0.13 0.08 0.00 -0.50 0.00 0.00 59.98 59.48 1u3r h ARG 424 Cb 0.51 -0.18 -0.07 0.00 0.00 0.00 0.00 29.97 30.23 1u3r h ARG 424 CO -0.18 0.75 0.23 0.87 0.00 0.00 0.00 179.97 181.63 1u3r h LYS 425 N 0.97 0.41 -0.13 0.04 1.79 -0.93 0.88 116.57 119.60 1u3r h LYS 425 Ca 0.24 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.67 1u3r h LYS 425 Cb 0.09 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1u3r h LYS 425 CO -0.03 0.27 0.03 1.25 -1.08 0.00 0.00 179.45 179.89 1u3r h LEU 426 N 0.42 0.19 -0.53 2.94 5.85 -0.44 -0.23 115.31 123.50 1u3r h LEU 426 Ca 0.29 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1u3r h LEU 426 Cb 0.33 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1u3r h LEU 426 CO -0.28 0.36 0.33 0.00 -0.34 0.00 0.00 178.44 178.50 1u3r h ALA 427 N 0.84 0.68 -0.54 1.25 0.00 -1.00 0.26 119.26 120.75 1u3r h ALA 427 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1u3r h ALA 427 Cb 0.24 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1u3r h ALA 427 CO -0.00 0.05 0.33 1.25 0.00 0.00 0.00 179.25 180.88 1u3r h HIS 428 N 0.66 0.61 -0.23 0.00 -0.00 -0.66 0.70 115.15 116.23 1u3r h HIS 428 Ca 0.21 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.56 1u3r h HIS 428 Cb -0.00 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.20 1u3r h HIS 428 CO -0.06 0.35 0.00 1.25 -0.00 0.00 0.00 177.93 179.48 1u3r h LEU 429 N 0.65 0.39 -0.74 0.26 6.46 -0.43 -1.59 115.31 120.31 1u3r h LEU 429 Ca 0.22 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 1u3r h LEU 429 Cb 0.02 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 39.81 1u3r h LEU 429 CO -0.09 0.60 0.46 0.25 -0.62 0.00 0.00 178.44 179.04 1u3r h LEU 430 N 0.17 0.87 -1.23 2.25 5.85 -0.22 -1.76 115.31 121.24 1u3r h LEU 430 Ca 0.06 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 1u3r h LEU 430 Cb 0.40 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1u3r h LEU 430 CO 0.01 0.66 0.09 -1.13 -0.34 0.00 0.00 178.44 177.73 1u3r h ASN 431 N 1.01 0.57 -0.52 1.25 -0.73 -0.77 -1.39 115.58 115.00 1u3r h ASN 431 Ca 0.27 -0.09 -0.10 0.00 1.87 0.00 0.00 56.30 58.25 1u3r h ASN 431 Cb -0.07 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.35 1u3r h ASN 431 CO -0.05 0.58 -0.04 0.00 -0.37 0.00 0.00 177.43 177.55 1u3r h ALA 432 N 1.50 0.89 0.00 1.57 0.00 -0.45 -0.23 119.26 122.54 1u3r h ALA 432 Ca 0.14 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1u3r h ALA 432 Cb 0.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1u3r h ALA 432 CO -0.00 0.65 -0.76 0.28 0.00 0.00 0.00 179.25 179.42 1u3r h VAL 433 N 0.89 1.53 -0.27 0.00 2.07 -1.04 -1.81 116.25 117.61 1u3r h VAL 433 Ca 0.15 -2.61 -0.05 0.00 0.82 0.00 0.00 66.70 65.01 1u3r h VAL 433 Cb 0.58 2.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 1u3r h VAL 433 CO 0.03 0.74 -0.04 0.74 0.02 0.00 0.00 177.57 179.07 1u3r h THR 434 N 0.00 1.27 -0.80 2.57 2.02 -0.98 -1.19 112.91 115.80 1u3r h THR 434 Ca -0.01 -1.03 0.05 0.00 0.77 0.00 0.00 66.41 66.20 1u3r h THR 434 Cb 1.35 1.40 -0.05 0.00 -1.74 0.00 0.00 68.15 69.12 1u3r h THR 434 CO 0.10 0.32 0.53 -0.78 0.37 0.00 0.00 175.52 176.06 1u3r h ASP 435 N 0.26 0.81 -0.40 4.18 1.82 -0.93 -1.29 116.42 120.87 1u3r h ASP 435 Ca 0.07 -0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.58 1u3r h ASP 435 Cb 0.50 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 1u3r h ASP 435 CO 0.02 0.53 -0.26 0.00 -1.61 0.00 0.00 179.24 177.93 1u3r h ALA 436 N 1.55 0.72 -0.49 -0.78 0.00 -0.89 -1.54 119.26 117.83 1u3r h ALA 436 Ca 0.34 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1u3r h ALA 436 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1u3r h ALA 436 CO -0.11 0.67 0.07 1.25 0.00 0.00 0.00 179.25 181.12 1u3r h LEU 437 N 0.78 0.79 -0.56 0.00 5.85 -0.30 -0.29 115.31 121.58 1u3r h LEU 437 Ca 0.09 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1u3r h LEU 437 Cb 0.82 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1u3r h LEU 437 CO 0.07 0.86 0.37 0.58 -0.34 0.00 0.00 178.44 179.98 1u3r h VAL 438 N 0.69 1.15 0.17 1.05 2.07 -1.17 -1.50 116.25 118.71 1u3r h VAL 438 Ca 0.15 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.41 1u3r h VAL 438 Cb 0.42 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1u3r h VAL 438 CO 0.01 0.14 -0.19 -0.25 0.02 0.00 0.00 177.57 177.30 1u3r h TRP 439 N 0.76 -0.51 -0.65 1.57 7.01 -0.99 -0.48 115.95 122.66 1u3r h TRP 439 Ca 0.20 0.00 0.13 0.00 2.11 0.00 0.00 58.89 61.34 1u3r h TRP 439 Cb -0.08 0.20 -0.09 0.00 -2.10 0.00 0.00 29.16 27.08 1u3r h TRP 439 CO -0.03 -0.29 0.14 0.28 -2.79 0.00 0.00 178.44 175.75 1u3r h VAL 440 N -0.41 0.60 -0.65 2.65 2.07 -0.66 -0.49 116.25 119.36 1u3r h VAL 440 Ca 0.01 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 1u3r h VAL 440 Cb 0.39 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1u3r h VAL 440 CO -0.06 0.05 0.20 0.40 0.02 0.00 0.00 177.57 178.17 1u3r h ILE 441 N 0.26 1.24 0.00 4.57 2.04 -0.90 -2.46 117.51 122.27 1u3r h ILE 441 Ca 0.35 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1u3r h ILE 441 Cb 0.54 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 1u3r h ILE 441 CO -0.44 0.33 -0.20 0.00 0.00 0.00 0.00 178.15 177.84 1u3r h ALA 442 N 1.25 1.50 0.00 1.87 0.00 0.49 -2.30 119.26 122.06 1u3r h ALA 442 Ca 0.21 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1u3r h ALA 442 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1u3r h ALA 442 CO -0.01 0.25 0.00 0.87 0.00 0.00 0.00 179.25 180.37 1u3r h LYS 443 N 0.00 0.00 0.00 0.00 1.79 -0.82 -2.77 116.57 114.77 1u3r h LYS 443 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1u3r h LYS 443 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1u3r h LYS 443 CO 0.03 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 177.27 1u3r n SER 444 N -2.56 0.41 -1.53 0.86 3.41 -0.86 -4.87 113.62 108.49 1u3r n SER 444 Ca 0.04 0.62 -0.15 0.00 -0.26 0.00 0.00 58.87 59.12 1u3r n SER 444 Cb 0.39 -0.70 -0.02 0.00 -0.26 0.00 0.00 64.21 63.61 1u3r n SER 444 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u3r n GLY 445 N -0.26 0.29 3.99 5.00 0.00 -1.04 -5.02 105.19 108.15 1u3r n GLY 445 Ca 0.02 -0.28 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 1u3r n GLY 445 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u3r s ILE 446 N -2.68 2.64 0.49 -0.61 -4.36 -1.26 -5.04 121.20 110.37 1u3r s ILE 446 Ca 0.00 -0.76 -0.20 0.00 -0.26 0.00 0.00 60.65 59.43 1u3r s ILE 446 Cb 0.00 -2.88 -0.11 0.00 1.25 0.00 0.00 42.46 40.72 1u3r s ILE 446 CO 0.00 0.00 0.47 -0.24 0.24 0.00 0.00 174.94 175.41 1u3r n SER 447 N -2.28 -1.22 -0.20 4.36 2.88 -1.26 -4.68 113.62 111.22 1u3r n SER 447 Ca 0.09 0.81 -0.07 0.00 -1.33 0.00 0.00 58.87 58.37 1u3r n SER 447 Cb 0.60 -1.11 0.02 0.00 -0.75 0.00 0.00 64.21 62.97 1u3r n SER 447 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1u3r h SER 448 N 0.50 0.74 -0.77 -3.46 0.87 -1.99 0.13 113.55 109.58 1u3r h SER 448 Ca -0.43 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 59.97 1u3r h SER 448 Cb 1.40 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 63.14 1u3r h SER 448 CO 0.49 0.67 0.40 -0.61 -0.53 0.00 0.00 176.83 177.25 1u3r h GLN 449 N 0.76 1.11 0.00 2.24 5.75 -2.00 -1.69 115.11 121.28 1u3r h GLN 449 Ca 0.19 -0.14 -0.09 0.00 -0.15 0.00 0.00 58.65 58.45 1u3r h GLN 449 Cb 0.13 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.46 1u3r h GLN 449 CO -0.02 0.83 -0.45 1.96 -2.65 0.00 0.00 178.83 178.50 1u3r h GLN 450 N 1.10 0.00 -0.33 1.69 4.20 -1.73 -1.55 115.11 118.49 1u3r h GLN 450 Ca 0.27 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.86 1u3r h GLN 450 Cb 0.07 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1u3r h GLN 450 CO -0.04 0.45 -0.30 1.96 -0.67 0.00 0.00 178.83 180.24 1u3r h GLN 451 N 0.00 0.71 -0.18 1.46 4.20 0.10 -0.62 115.11 120.77 1u3r h GLN 451 Ca -0.00 -0.31 -0.10 0.00 0.06 0.00 0.00 58.65 58.30 1u3r h GLN 451 Cb 0.88 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.65 1u3r h GLN 451 CO 0.06 0.91 -0.26 0.77 -0.67 0.00 0.00 178.83 179.64 1u3r h SER 452 N 0.60 0.55 -0.46 1.46 0.02 -1.01 -1.81 113.55 112.91 1u3r h SER 452 Ca 0.07 -0.51 -0.04 0.00 -0.84 0.00 0.00 61.79 60.46 1u3r h SER 452 Cb 0.80 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1u3r h SER 452 CO 0.07 0.96 0.14 -0.03 -1.14 0.00 0.00 176.83 176.82 1u3r h MET 453 N 0.16 0.78 -0.27 3.45 4.05 -1.18 -1.63 114.93 120.28 1u3r h MET 453 Ca 0.02 -0.15 -0.13 0.00 -0.28 0.00 0.00 59.70 59.17 1u3r h MET 453 Cb 0.83 -0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 31.51 1u3r h MET 453 CO 0.06 0.70 -0.33 -0.09 0.23 0.00 0.00 176.91 177.48 1u3r h ARG 454 N 0.76 0.70 -0.28 0.39 2.43 -1.05 -0.87 114.38 116.46 1u3r h ARG 454 Ca 0.17 -0.39 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 1u3r h ARG 454 Cb 0.26 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1u3r h ARG 454 CO -0.00 1.01 0.18 1.25 -1.51 0.00 0.00 179.97 180.89 1u3r h LEU 455 N 0.44 0.33 -0.76 3.80 5.85 -1.10 -1.02 115.31 122.85 1u3r h LEU 455 Ca 0.04 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1u3r h LEU 455 Cb 0.91 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1u3r h LEU 455 CO 0.08 0.27 0.23 0.00 -0.34 0.00 0.00 178.44 178.68 1u3r h ALA 456 N 1.08 0.99 -0.37 1.25 0.00 -1.28 -1.88 119.26 119.06 1u3r h ALA 456 Ca 0.10 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1u3r h ALA 456 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1u3r h ALA 456 CO -0.02 0.67 -0.15 -0.91 0.00 0.00 0.00 179.25 178.84 1u3r h ASN 457 N 1.11 0.65 -0.14 0.00 2.35 -0.81 -0.71 115.58 118.03 1u3r h ASN 457 Ca 0.24 -0.20 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 1u3r h ASN 457 Cb 0.31 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1u3r h ASN 457 CO -0.01 0.82 -0.26 -0.07 -1.65 0.00 0.00 177.43 176.27 1u3r h LEU 458 N 0.60 0.47 -0.93 1.61 3.38 -0.99 -3.19 115.31 116.26 1u3r h LEU 458 Ca 0.10 -0.54 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 1u3r h LEU 458 Cb 0.59 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1u3r h LEU 458 CO 0.04 0.93 -0.09 -0.07 0.09 0.00 0.00 178.44 179.33 1u3r h LEU 459 N 0.03 0.66 -2.18 1.67 3.38 -1.26 -2.35 115.31 115.26 1u3r h LEU 459 Ca 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1u3r h LEU 459 Cb 0.84 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1u3r h LEU 459 CO 0.06 0.79 -0.06 0.24 0.09 0.00 0.00 178.44 179.56 1u3r h MET 460 N 0.62 0.00 0.00 1.13 2.86 -1.16 -0.87 114.93 117.52 1u3r h MET 460 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1u3r h MET 460 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1u3r h MET 460 CO 0.03 0.06 0.00 -0.07 1.06 0.00 0.00 176.91 177.99 1u3r h LEU 461 N 0.00 0.00 -1.04 1.22 3.38 -1.40 -3.01 115.31 114.46 1u3r h LEU 461 Ca -0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 1u3r h LEU 461 Cb 0.23 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 1u3r h LEU 461 CO 0.01 0.00 0.64 -0.07 0.09 0.00 0.00 178.44 179.10 1u3r h LEU 462 N 0.00 1.00 -0.94 1.67 3.38 -1.22 -0.54 115.31 118.65 1u3r h LEU 462 Ca 0.00 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.09 1u3r h LEU 462 Cb 0.62 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 1u3r h LEU 462 CO 0.00 0.62 0.57 0.28 0.09 0.00 0.00 178.44 180.00 1u3r h SER 463 N 1.12 0.84 0.60 -0.43 0.02 -1.68 0.81 113.55 114.82 1u3r h SER 463 Ca 0.44 0.05 -0.12 0.00 -0.84 0.00 0.00 61.79 61.31 1u3r h SER 463 Cb 0.23 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1u3r h SER 463 CO -0.18 0.46 -0.57 0.45 -1.14 0.00 0.00 176.83 175.85 1u3r h HIS 464 N 0.93 0.00 -0.05 3.45 3.86 -1.27 -0.85 115.15 121.22 1u3r h HIS 464 Ca 0.46 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 59.42 1u3r h HIS 464 Cb 0.43 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.92 1u3r h HIS 464 CO -0.03 0.57 -0.95 0.28 0.86 0.00 0.00 177.93 178.67 1u3r h VAL 465 N 0.00 1.29 -0.50 2.45 2.07 -0.53 -1.77 116.25 119.25 1u3r h VAL 465 Ca -0.01 -2.17 -0.02 0.00 0.82 0.00 0.00 66.70 65.32 1u3r h VAL 465 Cb 1.03 2.25 -0.02 0.00 -1.52 0.00 0.00 31.29 33.02 1u3r h VAL 465 CO 0.07 0.67 0.23 -0.09 0.02 0.00 0.00 177.57 178.48 1u3r h ARG 466 N 0.43 0.74 0.10 1.57 9.65 -0.76 -0.75 114.38 125.37 1u3r h ARG 466 Ca -0.10 -0.12 -0.00 0.00 -1.10 0.00 0.00 59.98 58.66 1u3r h ARG 466 Cb 1.59 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 30.04 1u3r h ARG 466 CO 0.19 0.63 -0.05 1.25 2.80 0.00 0.00 179.97 184.78 1u3r h HIS 467 N 0.67 -0.13 -0.09 2.20 2.76 -1.11 0.02 115.15 119.47 1u3r h HIS 467 Ca 0.17 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1u3r h HIS 467 Cb 0.14 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 1u3r h HIS 467 CO -0.00 -0.01 0.01 0.00 -1.30 0.00 0.00 177.93 176.62 1u3r h ALA 468 N 0.68 1.85 -0.18 5.26 0.00 -1.22 -1.77 119.26 123.88 1u3r h ALA 468 Ca -0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1u3r h ALA 468 Cb 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1u3r h ALA 468 CO 0.02 0.12 -0.06 1.03 0.00 0.00 0.00 179.25 180.36 1u3r h SER 469 N 0.13 0.37 -0.68 0.00 0.87 -0.55 0.17 113.55 113.86 1u3r h SER 469 Ca 0.03 -0.39 -0.03 0.00 -1.23 0.00 0.00 61.79 60.18 1u3r h SER 469 Cb 0.07 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 1u3r h SER 469 CO -0.00 0.67 0.32 0.78 -0.53 0.00 0.00 176.83 178.07 1u3r h ASN 470 N 0.06 0.91 -0.20 6.23 -0.26 -0.44 -1.09 115.58 120.80 1u3r h ASN 470 Ca 0.04 -0.11 -0.19 0.00 -0.56 0.00 0.00 56.30 55.48 1u3r h ASN 470 Cb 0.52 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 37.55 1u3r h ASN 470 CO 0.02 0.79 -0.59 0.11 -1.06 0.00 0.00 177.43 176.70 1u3r h LYS 471 N 1.00 0.81 -0.69 0.81 1.79 -1.19 -2.52 116.57 116.57 1u3r h LYS 471 Ca 0.24 -0.54 -0.03 0.00 -2.18 0.00 0.00 60.65 58.14 1u3r h LYS 471 Cb 0.13 0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1u3r h LYS 471 CO -0.03 1.17 0.30 0.78 -1.08 0.00 0.00 179.45 180.59 1u3r h GLY 472 N 0.74 1.07 1.79 3.86 0.00 -0.23 -2.26 103.07 108.04 1u3r h GLY 472 Ca 0.00 -0.53 -0.20 0.00 0.00 0.00 0.00 47.33 46.60 1u3r h GLY 472 CO 0.13 0.51 -0.90 -0.33 0.00 0.00 0.00 176.54 175.94 1u3r h MET 473 N 0.98 0.18 -0.74 4.80 2.86 -1.17 -1.96 114.93 119.89 1u3r h MET 473 Ca 0.24 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1u3r h MET 473 Cb 0.14 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1u3r h MET 473 CO -0.03 0.97 0.35 1.49 1.06 0.00 0.00 176.91 180.75 1u3r h GLU 474 N 0.10 1.07 -0.40 1.72 4.57 -1.27 0.99 114.58 121.35 1u3r h GLU 474 Ca -0.05 -0.16 -0.11 0.00 -1.18 0.00 0.00 59.36 57.86 1u3r h GLU 474 Cb 1.54 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 1u3r h GLU 474 CO 0.14 0.84 -0.17 1.25 -1.18 0.00 0.00 179.01 179.89 1u3r h HIS 475 N 1.04 0.95 -0.52 0.92 2.76 -1.35 -2.26 115.15 116.69 1u3r h HIS 475 Ca 0.25 -0.23 -0.09 0.00 -2.20 0.00 0.00 60.37 58.11 1u3r h HIS 475 Cb 0.13 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 1u3r h HIS 475 CO 0.01 0.98 -0.01 1.25 -1.30 0.00 0.00 177.93 178.86 1u3r h LEU 476 N 0.64 0.91 -0.30 0.26 5.85 -1.09 -1.96 115.31 119.62 1u3r h LEU 476 Ca 0.09 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1u3r h LEU 476 Cb 0.72 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.46 1u3r h LEU 476 CO 0.05 1.00 0.02 0.25 -0.34 0.00 0.00 178.44 179.42 1u3r h LEU 477 N 0.80 -0.08 -0.95 2.25 6.46 -0.72 0.11 115.31 123.18 1u3r h LEU 477 Ca 0.15 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 1u3r h LEU 477 Cb 0.54 0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.54 1u3r h LEU 477 CO 0.03 -0.01 0.51 -1.13 -0.62 0.00 0.00 178.44 177.22 1u3r h ASN 478 N 0.11 1.11 -0.56 1.25 -1.24 -1.26 -0.91 115.58 114.07 1u3r h ASN 478 Ca 0.14 -0.09 -0.00 0.00 0.71 0.00 0.00 56.30 57.07 1u3r h ASN 478 Cb 0.18 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 38.93 1u3r h ASN 478 CO -0.23 0.87 0.35 0.24 -1.29 0.00 0.00 177.43 177.37 1u3r h MET 479 N 1.25 0.76 0.62 6.67 2.86 -0.48 -2.33 114.93 124.28 1u3r h MET 479 Ca 0.32 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.86 1u3r h MET 479 Cb -0.00 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 31.50 1u3r h MET 479 CO -0.05 0.54 -0.30 -0.22 1.06 0.00 0.00 176.91 177.94 1u3r h LYS 480 N 0.76 -0.80 -0.62 1.72 3.64 -0.20 -2.18 116.57 118.88 1u3r h LYS 480 Ca 0.20 0.05 0.18 0.00 -1.27 0.00 0.00 60.65 59.82 1u3r h LYS 480 Cb -0.03 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1u3r h LYS 480 CO -0.04 -0.52 0.63 0.00 -2.27 0.00 0.00 179.45 177.25 1u3r n LYS 482 N -3.70 1.40 -2.73 0.00 5.02 -0.87 -4.94 118.16 112.33 1u3r n LYS 482 Ca 0.12 -0.93 -0.16 0.00 -2.02 0.00 0.00 58.31 55.32 1u3r n LYS 482 Cb 0.86 -1.48 -0.00 0.00 -0.02 0.00 0.00 35.03 34.38 1u3r n LYS 482 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1u3r n ASN 483 N 0.01 -4.01 -0.12 4.39 4.13 0.34 -4.82 115.26 115.17 1u3r n ASN 483 Ca 0.14 0.00 0.13 0.00 1.68 0.00 0.00 54.58 56.54 1u3r n ASN 483 Cb 0.40 -3.37 0.38 0.00 -1.54 0.00 0.00 39.78 35.66 1u3r n ASN 483 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1u3r n VAL 484 N -3.62 0.00 -4.08 2.41 0.31 -1.10 -4.86 118.33 107.38 1u3r n VAL 484 Ca -0.11 -0.06 -0.14 0.00 -0.01 0.00 0.00 64.34 64.02 1u3r n VAL 484 Cb 0.59 0.21 -0.13 0.00 -0.91 0.00 0.00 33.84 33.60 1u3r n VAL 484 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1u3r s VAL 485 N -2.70 0.37 -0.48 2.52 -7.23 -1.26 -4.92 120.40 106.70 1u3r s VAL 485 Ca 0.20 -0.45 -0.28 0.00 -1.81 0.00 0.00 61.98 59.64 1u3r s VAL 485 Cb 0.19 -0.36 0.00 0.00 0.56 0.00 0.00 36.38 36.77 1u3r s VAL 485 CO 0.58 -0.06 1.52 -2.84 -0.31 0.00 0.00 175.10 173.98 1u3r s PRO 486 N -0.55 3.34 -0.93 4.82 0.02 -1.26 -4.89 135.00 135.56 1u3r s PRO 486 Ca -0.02 0.80 -0.15 0.00 0.02 0.00 0.00 61.00 61.65 1u3r s PRO 486 Cb -0.04 -4.13 0.20 0.00 0.02 0.00 0.00 34.50 30.55 1u3r s PRO 486 CO -0.00 -1.87 0.98 0.08 -0.33 0.00 0.00 177.00 175.86 1u3r s VAL 487 N 6.26 5.34 0.98 3.83 1.01 -1.26 -4.76 120.40 131.81 1u3r s VAL 487 Ca 0.61 -2.33 -0.16 0.00 0.00 0.00 0.00 61.98 60.11 1u3r s VAL 487 Cb -0.14 -4.62 -0.07 0.00 0.00 0.00 0.00 36.38 31.55 1u3r s VAL 487 CO 0.29 -1.25 -0.34 -1.22 0.00 0.00 0.00 175.10 172.58 1u3r n TYR 488 N 4.75 -3.49 0.03 5.22 4.02 -1.26 -4.39 117.16 122.05 1u3r n TYR 488 Ca 0.20 0.10 -0.12 0.00 -0.01 0.00 0.00 57.90 58.07 1u3r n TYR 488 Cb 0.46 -1.57 -0.06 0.00 -0.02 0.00 0.00 39.34 38.15 1u3r n TYR 488 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1u3r h ASP 489 N -1.25 -1.22 0.15 7.72 5.19 -1.98 0.18 116.42 125.20 1u3r h ASP 489 Ca -0.44 0.16 -0.01 0.00 -0.62 0.00 0.00 57.03 56.12 1u3r h ASP 489 Cb 1.30 0.49 0.00 0.00 0.18 0.00 0.00 39.33 41.30 1u3r h ASP 489 CO 0.28 -0.43 -0.07 0.25 -3.12 0.00 0.00 179.24 176.15 1u3r h LEU 490 N -0.51 -0.17 -0.88 1.55 6.46 -1.94 -1.52 115.31 118.29 1u3r h LEU 490 Ca 0.07 -0.11 0.06 0.00 -0.12 0.00 0.00 57.88 57.77 1u3r h LEU 490 Cb 0.62 0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.53 1u3r h LEU 490 CO -0.34 0.01 0.56 0.25 -0.62 0.00 0.00 178.44 178.29 1u3r h LEU 491 N -0.34 0.88 0.01 2.25 5.85 -1.87 -0.71 115.31 121.38 1u3r h LEU 491 Ca -0.02 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1u3r h LEU 491 Cb 0.27 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1u3r h LEU 491 CO 0.03 0.57 -0.03 0.25 -0.34 0.00 0.00 178.44 178.92 1u3r h LEU 492 N 1.02 -0.07 -0.75 2.25 5.85 -0.42 -0.85 115.31 122.34 1u3r h LEU 492 Ca 0.38 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.98 1u3r h LEU 492 Cb 0.16 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1u3r h LEU 492 CO -0.17 -0.04 -0.50 1.05 -0.34 0.00 0.00 178.44 178.44 1u3r h GLU 493 N -0.05 0.32 -0.26 1.25 4.11 -0.92 -0.62 114.58 118.41 1u3r h GLU 493 Ca 0.01 -0.18 -0.04 0.00 0.07 0.00 0.00 59.36 59.22 1u3r h GLU 493 Cb 0.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1u3r h GLU 493 CO -0.02 0.75 -0.01 0.52 0.07 0.00 0.00 179.01 180.31 1u3r h MET 494 N 0.25 0.39 0.23 1.06 2.86 -0.94 -1.08 114.93 117.71 1u3r h MET 494 Ca 0.01 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1u3r h MET 494 Cb 0.97 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1u3r h MET 494 CO 0.08 0.44 -0.11 1.25 1.06 0.00 0.00 176.91 179.63 1u3r h LEU 495 N 0.38 -0.26 -1.46 1.22 6.46 -0.63 -3.30 115.31 117.72 1u3r h LEU 495 Ca 0.09 -0.25 0.11 0.00 -0.12 0.00 0.00 57.88 57.71 1u3r h LEU 495 Cb 0.28 0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 40.23 1u3r h LEU 495 CO 0.01 0.25 0.49 0.78 -0.62 0.00 0.00 178.44 179.35 1u3r h ASN 496 N -0.92 0.53 -0.98 1.25 2.35 -0.98 -0.81 115.58 116.02 1u3r h ASN 496 Ca -0.03 0.02 0.11 0.00 -0.55 0.00 0.00 56.30 55.85 1u3r h ASN 496 Cb 0.50 -0.09 -0.08 0.00 0.05 0.00 0.00 38.32 38.69 1u3r h ASN 496 CO 0.05 0.31 0.62 0.00 -1.65 0.00 0.00 177.43 176.75 1u3r h ALA 497 N 1.63 1.46 0.30 -0.83 0.00 -1.27 0.24 119.26 120.79 1u3r h ALA 497 Ca 0.35 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1u3r h ALA 497 Cb 0.58 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1u3r h ALA 497 CO -0.13 0.24 -0.14 0.45 0.00 0.00 0.00 179.25 179.67 1u3r h HIS 498 N 0.99 -0.37 -0.98 0.00 3.86 -1.23 -2.79 115.15 114.63 1u3r h HIS 498 Ca 0.48 -0.01 0.20 0.00 -1.16 0.00 0.00 60.37 59.89 1u3r h HIS 498 Cb 0.44 0.12 -0.09 0.00 1.06 0.00 0.00 27.41 28.94 1u3r h HIS 498 CO -0.01 -0.06 0.62 0.28 0.86 0.00 0.00 177.93 179.62 1u3r h VAL 499 N -0.69 0.68 0.00 2.45 2.07 -1.07 -3.53 116.25 116.16 1u3r h VAL 499 Ca -0.04 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1u3r h VAL 499 Cb 0.48 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1u3r h VAL 499 CO 0.07 0.11 0.00 -0.11 0.02 0.00 0.00 177.57 177.66