#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3s n SER 264 N 0.00 -0.30 -0.26 1.96 3.41 -1.26 -4.73 113.62 112.43 1u3s n SER 264 Ca 0.00 0.33 0.03 0.00 -0.26 0.00 0.00 58.87 58.97 1u3s n SER 264 Cb 0.00 -1.41 0.16 0.00 -0.26 0.00 0.00 64.21 62.70 1u3s n SER 264 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1u3s h PRO 265 N -1.95 0.60 -0.61 4.33 0.11 -1.92 -1.52 132.00 131.05 1u3s h PRO 265 Ca -0.45 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1u3s h PRO 265 Cb 1.28 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1u3s h PRO 265 CO 0.41 0.40 0.31 1.49 -0.21 0.00 0.00 178.00 180.40 1u3s h GLU 266 N 0.62 0.85 -0.05 1.05 4.81 -1.93 -0.77 114.58 119.16 1u3s h GLU 266 Ca 0.38 -0.10 -0.13 0.00 -0.13 0.00 0.00 59.36 59.38 1u3s h GLU 266 Cb 0.43 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1u3s h GLU 266 CO -0.29 0.64 -0.55 1.96 -0.73 0.00 0.00 179.01 180.04 1u3s h GLN 267 N 0.85 0.15 -0.39 1.92 4.20 -1.64 0.20 115.11 120.42 1u3s h GLN 267 Ca 0.21 -0.10 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1u3s h GLN 267 Cb 0.06 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1u3s h GLN 267 CO -0.03 0.67 -0.27 1.25 -0.67 0.00 0.00 178.83 179.78 1u3s h LEU 268 N 0.12 0.91 0.06 1.46 5.85 -0.57 -0.34 115.31 122.80 1u3s h LEU 268 Ca -0.00 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.28 1u3s h LEU 268 Cb 1.02 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1u3s h LEU 268 CO 0.08 1.15 -0.03 0.58 -0.34 0.00 0.00 178.44 179.88 1u3s h VAL 269 N 0.68 1.08 -1.01 1.05 2.07 -0.97 0.04 116.25 119.19 1u3s h VAL 269 Ca 0.08 -0.49 0.13 0.00 0.82 0.00 0.00 66.70 67.23 1u3s h VAL 269 Cb 0.84 1.41 -0.09 0.00 -1.52 0.00 0.00 31.29 31.93 1u3s h VAL 269 CO 0.07 0.12 0.63 -0.07 0.02 0.00 0.00 177.57 178.35 1u3s h LEU 270 N -0.30 0.92 -0.35 2.57 4.07 -0.90 0.12 115.31 121.44 1u3s h LEU 270 Ca -0.01 0.05 -0.13 0.00 0.08 0.00 0.00 57.88 57.87 1u3s h LEU 270 Cb 0.27 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1u3s h LEU 270 CO 0.01 0.48 -0.29 0.74 -1.08 0.00 0.00 178.44 178.30 1u3s h THR 271 N 0.98 1.29 -0.13 0.22 2.02 -0.78 -2.55 112.91 113.96 1u3s h THR 271 Ca 0.51 -1.45 -0.09 0.00 0.77 0.00 0.00 66.41 66.15 1u3s h THR 271 Cb 0.52 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1u3s h THR 271 CO -0.28 0.48 -0.31 -0.07 0.37 0.00 0.00 175.52 175.71 1u3s h LEU 272 N 0.60 0.24 -0.80 2.58 3.38 0.14 -1.66 115.31 119.79 1u3s h LEU 272 Ca 0.06 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1u3s h LEU 272 Cb 0.86 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1u3s h LEU 272 CO 0.07 0.55 -0.25 0.25 0.09 0.00 0.00 178.44 179.15 1u3s h LEU 273 N 0.21 0.64 -0.25 1.67 6.46 -0.67 -2.76 115.31 120.62 1u3s h LEU 273 Ca 0.03 -0.23 -0.20 0.00 -0.12 0.00 0.00 57.88 57.36 1u3s h LEU 273 Cb 0.66 -0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1u3s h LEU 273 CO 0.05 0.87 -0.66 -0.08 -0.62 0.00 0.00 178.44 178.00 1u3s h GLU 274 N 0.55 0.82 0.00 1.25 4.81 -1.16 -3.15 114.58 117.69 1u3s h GLU 274 Ca 0.08 -0.59 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1u3s h GLU 274 Cb 0.72 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1u3s h GLU 274 CO 0.06 1.21 0.00 0.00 -0.73 0.00 0.00 179.01 179.55 1u3s n ALA 275 N -2.58 1.56 -1.66 2.92 0.00 -0.65 -4.80 120.51 115.30 1u3s n ALA 275 Ca -0.06 -0.04 -0.49 0.00 0.00 0.00 0.00 53.44 52.85 1u3s n ALA 275 Cb 0.68 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.91 1u3s n ALA 275 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u3s n GLU 276 N -1.41 1.85 -1.84 0.00 -0.58 -1.06 -4.70 120.64 112.90 1u3s n GLU 276 Ca 0.04 0.67 -0.32 0.00 -0.42 0.00 0.00 57.16 57.12 1u3s n GLU 276 Cb 0.11 -2.42 0.03 0.00 -0.57 0.00 0.00 31.44 28.59 1u3s n GLU 276 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1u3s s PRO 277 N 1.64 3.07 0.45 3.49 0.04 -1.26 -5.00 135.00 137.42 1u3s s PRO 277 Ca 0.84 1.19 -0.22 0.00 0.04 0.00 0.00 61.00 62.85 1u3s s PRO 277 Cb -0.78 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 31.68 1u3s s PRO 277 CO 0.45 -1.01 1.08 -1.25 0.04 0.00 0.00 177.00 176.30 1u3s s PRO 278 N -4.32 3.90 0.19 0.56 0.04 -1.26 -4.95 135.00 129.15 1u3s s PRO 278 Ca 0.63 1.53 -0.31 0.00 0.04 0.00 0.00 61.00 62.89 1u3s s PRO 278 Cb -0.17 -2.33 -0.10 0.00 0.04 0.00 0.00 34.50 31.94 1u3s s PRO 278 CO 0.43 -0.38 1.51 -1.01 0.04 0.00 0.00 177.00 177.59 1u3s s HIS 279 N -1.74 3.06 -0.14 0.56 3.76 -1.26 -4.95 115.29 114.59 1u3s s HIS 279 Ca 0.63 0.79 -0.29 0.00 -0.15 0.00 0.00 55.06 56.04 1u3s s HIS 279 Cb -0.22 -3.87 -0.01 0.00 1.11 0.00 0.00 32.58 29.59 1u3s s HIS 279 CO 0.27 -3.09 0.99 0.08 -0.85 0.00 0.00 174.74 172.14 1u3s s VAL 280 N 0.75 4.77 -0.26 -0.90 1.01 -1.26 -5.01 120.40 119.51 1u3s s VAL 280 Ca 0.66 2.00 -0.19 0.00 0.00 0.00 0.00 61.98 64.45 1u3s s VAL 280 Cb -0.43 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 31.64 1u3s s VAL 280 CO 0.35 -0.03 0.56 -0.76 0.00 0.00 0.00 175.10 175.22 1u3s s LEU 281 N 2.25 4.07 -0.02 3.92 1.43 -1.26 -4.70 118.68 124.37 1u3s s LEU 281 Ca 0.46 0.56 0.02 0.00 -1.03 0.00 0.00 54.13 54.15 1u3s s LEU 281 Cb -0.17 -2.73 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1u3s s LEU 281 CO 0.15 -0.33 -0.06 -0.51 0.23 0.00 0.00 176.35 175.83 1u3s s ILE 282 N 2.40 0.56 0.14 -0.59 2.07 -1.26 -5.11 121.20 119.40 1u3s s ILE 282 Ca 0.23 -0.25 -0.19 0.00 -1.41 0.00 0.00 60.65 59.03 1u3s s ILE 282 Cb -0.16 -0.51 -0.07 0.00 0.13 0.00 0.00 42.46 41.85 1u3s s ILE 282 CO 0.09 0.18 0.64 -0.44 -1.91 0.00 0.00 174.94 173.50 1u3s s SER 283 N 0.20 7.07 0.29 4.50 0.01 -1.26 -3.99 113.70 120.52 1u3s s SER 283 Ca -0.02 1.33 -0.29 0.00 1.31 0.00 0.00 55.95 58.27 1u3s s SER 283 Cb -0.07 -2.38 -0.10 0.00 0.21 0.00 0.00 66.02 63.68 1u3s s SER 283 CO -0.00 0.17 1.12 -0.60 0.41 0.00 0.00 173.24 174.35 1u3s s ARG 284 N -1.48 4.57 0.53 12.44 3.52 -1.20 -4.92 118.95 132.40 1u3s s ARG 284 Ca 0.35 1.84 -0.21 0.00 -0.13 0.00 0.00 55.73 57.58 1u3s s ARG 284 Cb -0.19 -3.13 -0.07 0.00 -1.56 0.00 0.00 34.95 30.01 1u3s s ARG 284 CO 0.21 0.13 1.10 -0.35 -0.81 0.00 0.00 175.30 175.58 1u3s n PRO 285 N 1.05 1.29 0.09 5.12 -0.04 -1.26 -4.91 135.00 136.34 1u3s n PRO 285 Ca -0.01 0.48 -0.15 0.00 -0.04 0.00 0.00 63.50 63.78 1u3s n PRO 285 Cb 0.45 -2.26 -0.09 0.00 -0.04 0.00 0.00 33.50 31.56 1u3s n PRO 285 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1u3s h SER 286 N 1.11 -1.50 -4.40 3.54 0.02 -2.02 -3.44 113.55 106.85 1u3s h SER 286 Ca -0.48 0.17 -0.46 0.00 -0.84 0.00 0.00 61.79 60.17 1u3s h SER 286 Cb 1.34 0.57 0.12 0.00 0.14 0.00 0.00 62.40 64.56 1u3s h SER 286 CO 0.55 -0.52 0.37 0.00 -1.14 0.00 0.00 176.83 176.08 1u3s s ALA 287 N -5.81 2.28 0.24 3.77 0.00 -1.26 -5.00 121.76 115.98 1u3s s ALA 287 Ca -0.16 -0.68 -0.30 0.00 0.00 0.00 0.00 51.96 50.82 1u3s s ALA 287 Cb 0.07 -2.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.13 1u3s s ALA 287 CO 0.62 -2.01 1.37 -2.14 0.00 0.00 0.00 175.76 173.60 1u3s s PRO 288 N -5.52 4.33 0.30 0.00 0.02 -1.26 -4.91 135.00 127.96 1u3s s PRO 288 Ca 0.64 2.20 -0.26 0.00 0.02 0.00 0.00 61.00 63.60 1u3s s PRO 288 Cb -0.11 -3.13 -0.15 0.00 0.02 0.00 0.00 34.50 31.13 1u3s s PRO 288 CO 0.51 -0.32 0.67 1.19 -0.33 0.00 0.00 177.00 178.73 1u3s n PHE 289 N 2.19 0.04 -4.56 6.54 3.72 -1.26 -5.03 117.46 119.10 1u3s n PHE 289 Ca 0.05 0.76 -0.29 0.00 -0.05 0.00 0.00 57.45 57.92 1u3s n PHE 289 Cb 0.41 -2.06 -0.09 0.00 -0.94 0.00 0.00 39.48 36.81 1u3s n PHE 289 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1u3s s THR 290 N -1.18 1.71 0.12 4.37 -4.23 -1.26 -4.95 115.64 110.22 1u3s s THR 290 Ca 0.62 -1.92 -0.23 0.00 -1.18 0.00 0.00 61.69 58.97 1u3s s THR 290 Cb -0.75 -2.63 -0.05 0.00 1.34 0.00 0.00 72.50 70.41 1u3s s THR 290 CO 0.58 0.00 1.67 -0.08 -0.54 0.00 0.00 174.62 176.25 1u3s h GLU 291 N 1.50 -0.23 0.32 3.99 4.81 -1.93 -2.25 114.58 120.80 1u3s h GLU 291 Ca -0.43 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.80 1u3s h GLU 291 Cb 1.27 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1u3s h GLU 291 CO 0.75 -0.15 -0.16 0.00 -0.73 0.00 0.00 179.01 178.73 1u3s h ALA 292 N 0.75 -0.43 -0.42 2.92 0.00 -1.85 -2.29 119.26 117.93 1u3s h ALA 292 Ca 0.07 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.93 1u3s h ALA 292 Cb 0.33 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1u3s h ALA 292 CO -0.19 -0.62 0.47 0.66 0.00 0.00 0.00 179.25 179.58 1u3s h SER 293 N -0.69 0.00 0.16 0.00 4.64 -1.91 0.37 113.55 116.12 1u3s h SER 293 Ca -0.04 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.02 1u3s h SER 293 Cb 0.48 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.59 1u3s h SER 293 CO 0.07 0.00 -1.20 -0.03 -0.87 0.00 0.00 176.83 174.80 1u3s h MET 294 N 0.00 0.33 0.00 4.77 -1.53 -1.27 -2.76 114.93 114.47 1u3s h MET 294 Ca 0.20 -0.57 -0.08 0.00 -3.44 0.00 0.00 59.70 55.81 1u3s h MET 294 Cb 1.15 0.21 -0.01 0.00 -0.55 0.00 0.00 31.60 32.40 1u3s h MET 294 CO -0.00 1.27 -0.38 0.52 0.14 0.00 0.00 176.91 178.46 1u3s h MET 295 N -0.22 0.00 0.00 0.39 2.07 -0.38 -0.90 114.93 115.89 1u3s h MET 295 Ca -0.23 0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.24 1u3s h MET 295 Cb 1.81 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 31.52 1u3s h MET 295 CO 0.15 0.38 -0.75 1.98 1.07 0.00 0.00 176.91 179.74 1u3s h MET 296 N 0.00 0.00 0.15 1.72 4.05 -0.47 -2.10 114.93 118.28 1u3s h MET 296 Ca -0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1u3s h MET 296 Cb 0.70 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.50 1u3s h MET 296 CO 0.05 0.71 -0.07 0.77 0.23 0.00 0.00 176.91 178.60 1u3s h SER 297 N 0.00 -0.17 -0.76 1.39 0.02 -1.15 -1.52 113.55 111.37 1u3s h SER 297 Ca -0.01 -0.38 0.04 0.00 -0.84 0.00 0.00 61.79 60.60 1u3s h SER 297 Cb 1.57 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 64.10 1u3s h SER 297 CO 0.09 0.36 0.48 -0.07 -1.14 0.00 0.00 176.83 176.55 1u3s h LEU 298 N -0.76 0.78 -0.28 5.07 3.38 -1.26 -1.03 115.31 121.21 1u3s h LEU 298 Ca -0.02 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.76 1u3s h LEU 298 Cb 0.53 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1u3s h LEU 298 CO 0.03 0.53 -0.59 0.71 0.09 0.00 0.00 178.44 179.22 1u3s h THR 299 N 0.92 1.28 -0.56 0.22 1.35 -1.45 -1.14 112.91 113.53 1u3s h THR 299 Ca 0.31 -1.78 -0.01 0.00 -0.55 0.00 0.00 66.41 64.39 1u3s h THR 299 Cb 0.04 1.70 -0.03 0.00 -1.73 0.00 0.00 68.15 68.13 1u3s h THR 299 CO -0.12 0.58 0.33 0.11 -0.25 0.00 0.00 175.52 176.16 1u3s h LYS 300 N 0.64 0.76 -0.47 4.72 1.57 -0.99 0.11 116.57 122.91 1u3s h LYS 300 Ca 0.00 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 1u3s h LYS 300 Cb 1.20 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.34 1u3s h LYS 300 CO 0.13 0.56 0.06 1.25 -0.57 0.00 0.00 179.45 180.89 1u3s h LEU 301 N 0.75 0.76 -0.49 2.94 5.85 -1.15 -2.17 115.31 121.79 1u3s h LEU 301 Ca 0.20 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1u3s h LEU 301 Cb 0.01 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1u3s h LEU 301 CO -0.04 0.84 0.14 0.00 -0.34 0.00 0.00 178.44 179.04 1u3s h ALA 302 N 0.95 0.64 -0.19 1.25 0.00 -0.92 -0.97 119.26 120.03 1u3s h ALA 302 Ca 0.14 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1u3s h ALA 302 Cb 0.41 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1u3s h ALA 302 CO 0.01 0.31 0.09 0.22 0.00 0.00 0.00 179.25 179.88 1u3s h ASP 303 N 0.66 0.14 -0.47 0.00 3.58 -0.66 -0.77 116.42 118.90 1u3s h ASP 303 Ca 0.16 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.56 1u3s h ASP 303 Cb 0.29 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 1u3s h ASP 303 CO -0.00 0.11 0.11 0.11 -2.88 0.00 0.00 179.24 176.69 1u3s h LYS 304 N 0.20 0.82 -0.03 0.28 1.57 -1.27 -2.80 116.57 115.34 1u3s h LYS 304 Ca 0.08 -0.17 -0.11 0.00 -1.87 0.00 0.00 60.65 58.57 1u3s h LYS 304 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1u3s h LYS 304 CO -0.05 0.75 -0.50 0.93 -0.57 0.00 0.00 179.45 180.01 1u3s h GLU 305 N 0.79 0.08 -0.91 3.15 5.08 -0.75 -2.93 114.58 119.08 1u3s h GLU 305 Ca 0.17 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1u3s h GLU 305 Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 1u3s h GLU 305 CO 0.00 0.56 0.51 -0.07 -1.00 0.00 0.00 179.01 179.01 1u3s h LEU 306 N 0.06 1.13 -0.59 1.33 3.38 -0.88 0.15 115.31 119.90 1u3s h LEU 306 Ca -0.00 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.90 1u3s h LEU 306 Cb 0.90 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1u3s h LEU 306 CO 0.07 0.90 0.37 0.58 0.09 0.00 0.00 178.44 180.45 1u3s h VAL 307 N 1.28 1.09 -0.12 1.22 2.07 -1.47 -1.90 116.25 118.41 1u3s h VAL 307 Ca 0.32 -0.25 -0.15 0.00 0.82 0.00 0.00 66.70 67.44 1u3s h VAL 307 Cb 0.01 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1u3s h VAL 307 CO -0.05 0.13 -0.57 0.45 0.02 0.00 0.00 177.57 177.55 1u3s h HIS 308 N 0.74 0.48 -0.85 1.57 3.86 -1.34 -3.14 115.15 116.47 1u3s h HIS 308 Ca 0.23 -0.17 0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1u3s h HIS 308 Cb -0.01 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.33 1u3s h HIS 308 CO -0.05 0.86 0.56 1.98 0.86 0.00 0.00 177.93 182.13 1u3s h MET 309 N 0.29 1.08 -0.35 2.45 -1.53 -0.13 0.34 114.93 117.08 1u3s h MET 309 Ca 0.00 -0.07 -0.05 0.00 -3.44 0.00 0.00 59.70 56.15 1u3s h MET 309 Cb 1.08 -0.24 -0.02 0.00 -0.55 0.00 0.00 31.60 31.87 1u3s h MET 309 CO 0.10 0.72 0.01 0.82 0.14 0.00 0.00 176.91 178.69 1u3s h ILE 310 N 1.12 1.20 -0.12 1.77 2.04 -1.32 0.11 117.51 122.31 1u3s h ILE 310 Ca 0.32 -0.79 -0.19 0.00 1.00 0.00 0.00 64.86 65.21 1u3s h ILE 310 Cb -0.08 0.93 0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1u3s h ILE 310 CO -0.08 0.27 -0.65 0.28 0.00 0.00 0.00 178.15 177.97 1u3s h SER 311 N 0.53 0.79 -0.09 1.72 0.02 -1.42 -2.88 113.55 112.21 1u3s h SER 311 Ca 0.11 -0.64 0.03 0.00 -0.84 0.00 0.00 61.79 60.46 1u3s h SER 311 Cb 0.33 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1u3s h SER 311 CO 0.01 1.30 -0.12 -0.25 -1.14 0.00 0.00 176.83 176.63 1u3s h TRP 312 N 0.33 -0.30 -0.79 3.45 7.01 -0.32 -2.45 115.95 122.87 1u3s h TRP 312 Ca -0.05 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.04 1u3s h TRP 312 Cb 1.29 0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 28.44 1u3s h TRP 312 CO 0.10 -0.18 0.52 0.00 -2.79 0.00 0.00 178.44 176.09 1u3s h ALA 313 N 0.88 1.65 0.00 2.65 0.00 -0.80 -0.53 119.26 123.12 1u3s h ALA 313 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1u3s h ALA 313 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1u3s h ALA 313 CO -0.19 0.22 0.00 1.63 0.00 0.00 0.00 179.25 180.91 1u3s n LYS 314 N -4.49 0.03 0.00 0.00 5.02 -0.93 -1.70 118.16 116.09 1u3s n LYS 314 Ca 0.12 0.25 0.10 0.00 -2.02 0.00 0.00 58.31 56.76 1u3s n LYS 314 Cb 0.23 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.73 1u3s n LYS 314 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1u3s n LYS 315 N -1.46 1.33 -2.48 1.97 5.02 -0.22 -4.61 118.16 117.71 1u3s n LYS 315 Ca 0.04 -0.89 -0.43 0.00 -2.02 0.00 0.00 58.31 55.01 1u3s n LYS 315 Cb 0.15 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1u3s n LYS 315 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1u3s s ILE 316 N -2.32 4.35 -0.45 -0.18 1.01 -0.69 -4.87 121.20 118.05 1u3s s ILE 316 Ca 0.16 1.61 -0.42 0.00 0.00 0.00 0.00 60.65 62.00 1u3s s ILE 316 Cb 0.16 -4.11 -0.18 0.00 0.01 0.00 0.00 42.46 38.35 1u3s s ILE 316 CO 0.53 -0.22 1.56 -2.65 0.00 0.00 0.00 174.94 174.16 1u3s n PRO 317 N 6.69 0.00 -0.69 2.79 -0.02 -1.26 -0.94 135.00 141.57 1u3s n PRO 317 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1u3s n PRO 317 Cb 0.45 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1u3s n PRO 317 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u3s n GLY 318 N 4.35 1.26 0.12 -1.23 0.00 -1.26 -4.92 105.19 103.51 1u3s n GLY 318 Ca 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.23 1u3s n GLY 318 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u3s h PHE 319 N 0.00 0.31 0.00 1.61 3.57 -1.31 -2.72 116.94 118.40 1u3s h PHE 319 Ca 0.00 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1u3s h PHE 319 Cb 0.00 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.66 1u3s h PHE 319 CO 0.00 0.56 0.00 1.33 -2.23 0.00 0.00 178.31 177.97 1u3s n VAL 320 N -4.70 1.41 1.34 1.41 0.24 -1.26 -1.41 118.33 115.36 1u3s n VAL 320 Ca -0.06 0.43 0.14 0.00 -2.04 0.00 0.00 64.34 62.81 1u3s n VAL 320 Cb 0.26 -1.34 0.56 0.00 -1.47 0.00 0.00 33.84 31.85 1u3s n VAL 320 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1u3s n GLU 321 N -1.70 0.62 -2.37 7.34 1.02 -1.03 -4.86 120.64 119.67 1u3s n GLU 321 Ca 0.01 -0.23 -0.29 0.00 -0.02 0.00 0.00 57.16 56.62 1u3s n GLU 321 Cb 0.08 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1u3s n GLU 321 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1u3s s LEU 322 N -2.54 3.51 0.64 -4.62 1.43 -0.50 -5.02 118.68 111.58 1u3s s LEU 322 Ca 0.26 1.19 -0.18 0.00 -1.03 0.00 0.00 54.13 54.38 1u3s s LEU 322 Cb 0.20 -4.17 -0.01 0.00 0.03 0.00 0.00 46.19 42.24 1u3s s LEU 322 CO 0.50 -0.66 1.23 -0.94 0.23 0.00 0.00 176.35 176.70 1u3s s SER 323 N -3.92 4.81 0.26 2.29 1.04 -1.26 -4.81 113.70 112.11 1u3s s SER 323 Ca 0.52 2.43 -0.02 0.00 0.48 0.00 0.00 55.95 59.36 1u3s s SER 323 Cb -0.11 -2.60 0.49 0.00 0.10 0.00 0.00 66.02 63.90 1u3s s SER 323 CO 0.45 -1.85 1.79 0.25 0.98 0.00 0.00 173.24 174.86 1u3s h LEU 324 N 0.51 0.66 -1.33 2.42 5.85 -1.95 -1.45 115.31 120.02 1u3s h LEU 324 Ca -0.50 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.34 1u3s h LEU 324 Cb 1.31 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1u3s h LEU 324 CO 0.53 0.33 0.49 -0.26 -0.34 0.00 0.00 178.44 179.20 1u3s h PHE 325 N 0.75 0.83 -0.24 1.25 0.04 -2.00 -1.13 116.94 116.44 1u3s h PHE 325 Ca 0.45 0.02 -0.19 0.00 2.80 0.00 0.00 57.97 61.05 1u3s h PHE 325 Cb 0.52 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.40 1u3s h PHE 325 CO -0.06 0.45 -0.59 -0.44 -0.60 0.00 0.00 178.31 177.07 1u3s h ASP 326 N 0.83 0.93 -0.81 2.17 3.32 -1.63 -1.91 116.42 119.31 1u3s h ASP 326 Ca 0.32 -0.56 0.03 0.00 0.02 0.00 0.00 57.03 56.83 1u3s h ASP 326 Cb 0.19 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.42 1u3s h ASP 326 CO -0.10 1.33 0.52 1.56 -1.72 0.00 0.00 179.24 180.82 1u3s h GLN 327 N 0.58 0.99 -0.50 3.56 4.20 -0.95 0.14 115.11 123.13 1u3s h GLN 327 Ca -0.01 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.56 1u3s h GLN 327 Cb 1.20 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 1u3s h GLN 327 CO 0.13 0.65 -0.01 0.28 -0.67 0.00 0.00 178.83 179.21 1u3s h VAL 328 N 1.02 1.26 -0.44 -0.54 2.07 -1.16 -2.26 116.25 116.20 1u3s h VAL 328 Ca 0.32 -1.09 -0.12 0.00 0.82 0.00 0.00 66.70 66.63 1u3s h VAL 328 Cb 0.01 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1u3s h VAL 328 CO -0.11 0.38 -0.20 0.03 0.02 0.00 0.00 177.57 177.69 1u3s h ARG 329 N 0.75 0.88 0.28 1.57 3.08 -0.62 -0.96 114.38 119.36 1u3s h ARG 329 Ca 0.14 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1u3s h ARG 329 Cb 0.53 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1u3s h ARG 329 CO 0.03 1.00 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.72 1u3s h LEU 330 N 0.77 -0.32 -0.67 3.04 3.38 -0.67 -2.14 115.31 118.70 1u3s h LEU 330 Ca 0.11 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1u3s h LEU 330 Cb 0.73 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1u3s h LEU 330 CO 0.06 -0.04 0.44 -0.07 0.09 0.00 0.00 178.44 178.92 1u3s h LEU 331 N -0.61 0.75 -1.51 1.67 3.38 -1.38 -0.94 115.31 116.68 1u3s h LEU 331 Ca -0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1u3s h LEU 331 Cb 0.44 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1u3s h LEU 331 CO 0.06 0.54 -0.25 -0.33 0.09 0.00 0.00 178.44 178.55 1u3s h GLU 332 N 0.89 0.00 0.01 1.13 5.08 -1.20 0.03 114.58 120.52 1u3s h GLU 332 Ca 0.25 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.38 1u3s h GLU 332 Cb -0.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1u3s h GLU 332 CO -0.06 0.25 -1.12 1.03 -1.00 0.00 0.00 179.01 178.11 1u3s h SER 333 N 0.00 0.02 -0.00 1.42 0.87 -0.74 -3.40 113.55 111.73 1u3s h SER 333 Ca -0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1u3s h SER 333 Cb 0.49 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1u3s h SER 333 CO 0.03 1.02 -0.08 0.00 -0.53 0.00 0.00 176.83 177.28 1u3s h TRP 335 N 0.21 0.07 -0.38 0.00 5.08 -1.21 0.24 115.95 119.96 1u3s h TRP 335 Ca 0.00 0.06 -0.10 0.00 1.08 0.00 0.00 58.89 59.93 1u3s h TRP 335 Cb 0.08 0.10 -0.02 0.00 -3.00 0.00 0.00 29.16 26.33 1u3s h TRP 335 CO 0.00 -0.28 -0.18 1.98 -1.28 0.00 0.00 178.44 178.67 1u3s h MET 336 N 0.11 0.72 -0.39 0.12 4.05 -1.87 -0.96 114.93 116.71 1u3s h MET 336 Ca 0.51 -0.27 -0.02 0.00 -0.28 0.00 0.00 59.70 59.64 1u3s h MET 336 Cb 0.98 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 1u3s h MET 336 CO -0.73 0.86 0.18 0.93 0.23 0.00 0.00 176.91 178.37 1u3s h GLU 337 N 0.64 0.57 -0.30 0.39 5.08 -1.31 0.62 114.58 120.26 1u3s h GLU 337 Ca 0.10 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1u3s h GLU 337 Cb 0.66 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1u3s h GLU 337 CO 0.05 0.51 0.17 0.28 -1.00 0.00 0.00 179.01 179.02 1u3s h VAL 338 N 0.49 1.12 -0.45 3.13 2.07 -1.05 0.26 116.25 121.82 1u3s h VAL 338 Ca 0.13 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1u3s h VAL 338 Cb 0.14 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1u3s h VAL 338 CO -0.02 0.12 0.23 -0.07 0.02 0.00 0.00 177.57 177.85 1u3s h LEU 339 N 0.38 0.33 -0.98 2.57 3.38 -0.84 -0.60 115.31 119.54 1u3s h LEU 339 Ca 0.11 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1u3s h LEU 339 Cb 0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1u3s h LEU 339 CO -0.02 0.23 -0.14 0.24 0.09 0.00 0.00 178.44 178.85 1u3s h MET 340 N 0.45 0.58 -0.28 1.13 2.86 -0.39 -0.42 114.93 118.86 1u3s h MET 340 Ca 0.20 -0.18 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 1u3s h MET 340 Cb 0.10 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1u3s h MET 340 CO -0.14 0.70 -0.31 1.98 1.06 0.00 0.00 176.91 180.20 1u3s h MET 341 N 0.53 0.59 -0.15 1.72 1.85 -0.09 0.40 114.93 119.78 1u3s h MET 341 Ca 0.09 -0.26 -0.02 0.00 -0.61 0.00 0.00 59.70 58.91 1u3s h MET 341 Cb 0.55 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.55 1u3s h MET 341 CO 0.03 0.83 0.02 0.78 -0.40 0.00 0.00 176.91 178.17 1u3s h GLY 342 N 1.02 0.28 0.41 1.39 0.00 -0.58 -2.12 103.07 103.47 1u3s h GLY 342 Ca 0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1u3s h GLY 342 CO 0.06 0.17 -0.50 -2.00 0.00 0.00 0.00 176.54 174.28 1u3s h LEU 343 N 0.03 -1.41 -1.04 3.11 5.85 -0.82 -1.29 115.31 119.74 1u3s h LEU 343 Ca 0.05 0.13 0.22 0.00 0.84 0.00 0.00 57.88 59.12 1u3s h LEU 343 Cb 0.32 0.48 -0.11 0.00 0.37 0.00 0.00 40.66 41.72 1u3s h LEU 343 CO 0.00 -0.62 0.61 0.24 -0.34 0.00 0.00 178.44 178.33 1u3s h MET 344 N -0.91 0.62 -0.33 1.25 2.86 -0.88 0.12 114.93 117.65 1u3s h MET 344 Ca -0.04 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.44 1u3s h MET 344 Cb 0.83 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1u3s h MET 344 CO -0.13 0.41 -0.30 2.35 1.06 0.00 0.00 176.91 180.30 1u3s h TRP 345 N 0.64 0.82 0.00 -0.22 2.91 -0.92 -1.77 115.95 117.41 1u3s h TRP 345 Ca 0.61 -0.21 -0.02 0.00 1.13 0.00 0.00 58.89 60.40 1u3s h TRP 345 Cb 1.12 -0.19 -0.00 0.00 -0.51 0.00 0.00 29.16 29.58 1u3s h TRP 345 CO -0.00 0.93 -0.10 0.00 -1.03 0.00 0.00 178.44 178.23 1u3s h ARG 346 N 0.60 0.00 -0.23 2.65 3.08 0.35 -2.93 114.38 117.90 1u3s h ARG 346 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1u3s h ARG 346 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1u3s h ARG 346 CO 0.07 0.10 0.00 0.43 -1.07 0.00 0.00 179.97 179.50 1u3s n SER 347 N -3.22 3.28 -0.02 7.04 7.64 -0.41 -4.62 113.62 123.30 1u3s n SER 347 Ca 0.01 -2.00 0.04 0.00 1.01 0.00 0.00 58.87 57.93 1u3s n SER 347 Cb 0.38 -0.14 0.42 0.00 -1.01 0.00 0.00 64.21 63.86 1u3s n SER 347 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1u3s h ILE 348 N 4.59 1.10 -0.94 0.44 2.10 -1.13 -2.57 117.51 121.10 1u3s h ILE 348 Ca 0.00 -0.20 -0.55 0.00 1.08 0.00 0.00 64.86 65.19 1u3s h ILE 348 Cb 1.00 0.47 -0.29 0.00 -1.09 0.00 0.00 36.82 36.91 1u3s h ILE 348 CO 0.00 0.11 0.63 0.47 -1.08 0.00 0.00 178.15 178.28 1u3s n ASP 349 N -4.47 5.18 -3.02 2.19 8.00 -1.26 -4.60 116.55 118.57 1u3s n ASP 349 Ca 0.04 -3.70 -0.17 0.00 0.71 0.00 0.00 54.79 51.67 1u3s n ASP 349 Cb 0.07 -0.86 -0.02 0.00 -0.02 0.00 0.00 41.12 40.29 1u3s n ASP 349 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1u3s n HIS 350 N -1.05 -1.62 -1.57 1.24 8.25 -0.97 -5.13 115.22 114.37 1u3s n HIS 350 Ca 0.58 -2.80 -0.47 0.00 -0.26 0.00 0.00 57.72 54.77 1u3s n HIS 350 Cb 1.22 0.45 -0.03 0.00 1.12 0.00 0.00 29.99 32.76 1u3s n HIS 350 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1u3s n PRO 351 N 1.59 1.18 0.00 -0.41 -0.04 -1.26 -0.93 135.00 135.13 1u3s n PRO 351 Ca 0.17 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 1u3s n PRO 351 Cb 0.57 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1u3s n PRO 351 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u3s n GLY 352 N 1.71 2.97 3.66 0.55 0.00 -1.26 -5.02 105.19 107.80 1u3s n GLY 352 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 1u3s n GLY 352 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u3s s LYS 353 N -0.31 2.38 -0.31 1.61 1.02 -0.11 -4.23 119.74 119.79 1u3s s LYS 353 Ca 0.00 -1.17 0.02 0.00 0.02 0.00 0.00 55.97 54.84 1u3s s LYS 353 Cb 0.00 -2.32 0.09 0.00 -0.52 0.00 0.00 37.83 35.08 1u3s s LYS 353 CO 0.00 0.44 0.02 -0.51 -0.92 0.00 0.00 175.35 174.38 1u3s s LEU 354 N -3.09 3.76 -0.95 3.17 1.43 -1.08 -4.81 118.68 117.10 1u3s s LEU 354 Ca 0.28 -1.80 -0.20 0.00 -1.03 0.00 0.00 54.13 51.38 1u3s s LEU 354 Cb -0.09 -1.40 0.10 0.00 0.03 0.00 0.00 46.19 44.83 1u3s s LEU 354 CO 0.19 -0.34 1.23 -0.63 0.23 0.00 0.00 176.35 177.03 1u3s s ILE 355 N 1.14 4.43 0.14 -0.59 1.09 -1.26 -2.36 121.20 123.79 1u3s s ILE 355 Ca 0.05 -1.24 0.25 0.00 -1.10 0.00 0.00 60.65 58.61 1u3s s ILE 355 Cb -0.19 -4.87 0.25 0.00 -1.06 0.00 0.00 42.46 36.59 1u3s s ILE 355 CO -0.11 -1.65 1.84 -0.26 -0.10 0.00 0.00 174.94 174.66 1u3s h PHE 356 N 9.19 0.00 -1.75 3.97 -1.00 -1.85 -3.42 116.94 122.08 1u3s h PHE 356 Ca 0.15 0.00 0.22 0.00 2.81 0.00 0.00 57.97 61.15 1u3s h PHE 356 Cb 1.02 0.00 -0.16 0.00 3.61 0.00 0.00 35.95 40.42 1u3s h PHE 356 CO 1.20 0.21 0.71 0.00 -1.61 0.00 0.00 178.31 178.81 1u3s s ALA 357 N -3.67 -2.00 0.24 2.45 0.00 -1.17 -4.98 121.76 112.63 1u3s s ALA 357 Ca 0.00 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 1u3s s ALA 357 Cb 0.10 0.14 0.34 0.00 0.00 0.00 0.00 23.12 23.70 1u3s s ALA 357 CO 0.63 -0.71 1.60 -1.35 0.00 0.00 0.00 175.76 175.93 1u3s h PRO 358 N 2.00 0.00 -0.35 0.00 0.11 -1.86 -1.73 132.00 130.18 1u3s h PRO 358 Ca -0.16 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1u3s h PRO 358 Cb 1.20 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1u3s h PRO 358 CO 0.26 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.58 1u3s n ASP 359 N -5.50 3.38 -3.61 -2.05 2.03 -1.26 -4.59 116.55 104.95 1u3s n ASP 359 Ca 0.11 -1.98 -0.28 0.00 0.52 0.00 0.00 54.79 53.17 1u3s n ASP 359 Cb 0.41 -0.22 -0.09 0.00 -0.72 0.00 0.00 41.12 40.49 1u3s n ASP 359 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1u3s n LEU 360 N 1.43 3.59 -4.34 -2.67 7.94 -0.65 -3.25 117.00 119.05 1u3s n LEU 360 Ca 0.18 -5.36 -0.46 0.00 -1.11 0.00 0.00 56.01 49.26 1u3s n LEU 360 Cb 0.59 -0.72 -0.01 0.00 0.53 0.00 0.00 43.42 43.81 1u3s n LEU 360 CO 0.15 1.94 0.58 -0.69 -1.11 0.00 0.00 177.39 178.27 1u3s s VAL 361 N -2.13 5.70 0.30 1.96 1.01 -1.25 -2.58 120.40 123.40 1u3s s VAL 361 Ca 0.35 -2.75 -0.29 0.00 0.00 0.00 0.00 61.98 59.28 1u3s s VAL 361 Cb 0.08 -4.53 -0.10 0.00 0.00 0.00 0.00 36.38 31.82 1u3s s VAL 361 CO -0.06 -1.11 1.31 -0.76 0.00 0.00 0.00 175.10 174.47 1u3s s LEU 362 N -0.18 4.43 0.44 3.92 1.43 -1.00 -4.89 118.68 122.83 1u3s s LEU 362 Ca 0.23 2.61 -0.02 0.00 -1.03 0.00 0.00 54.13 55.93 1u3s s LEU 362 Cb -0.10 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.46 1u3s s LEU 362 CO -0.09 -0.53 0.68 -0.62 0.23 0.00 0.00 176.35 176.03 1u3s s ASP 363 N -0.28 6.07 0.27 2.29 3.68 -1.26 -2.65 116.67 124.79 1u3s s ASP 363 Ca 0.51 0.54 0.02 0.00 2.13 0.00 0.00 52.55 55.76 1u3s s ASP 363 Cb -0.39 -1.90 0.37 0.00 -1.45 0.00 0.00 42.92 39.56 1u3s s ASP 363 CO 0.49 -0.57 1.69 -0.09 0.13 0.00 0.00 175.17 176.82 1u3s h ARG 364 N 0.42 0.47 -0.03 4.34 1.12 -1.97 -3.02 114.38 115.71 1u3s h ARG 364 Ca -0.47 -0.19 -0.11 0.00 -1.11 0.00 0.00 59.98 58.10 1u3s h ARG 364 Cb 1.23 -0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.16 1u3s h ARG 364 CO 0.60 0.72 -0.48 0.38 -3.11 0.00 0.00 179.97 178.09 1u3s h ASP 365 N 0.41 0.07 0.23 -3.80 -0.00 -1.94 -2.63 116.42 108.75 1u3s h ASP 365 Ca 0.05 -0.03 0.00 0.00 -0.00 0.00 0.00 57.03 57.05 1u3s h ASP 365 Cb 0.74 -0.02 0.00 0.00 -0.00 0.00 0.00 39.33 40.05 1u3s h ASP 365 CO 0.06 0.54 0.00 -0.62 -0.00 0.00 0.00 179.24 179.21 1u3s n GLU 366 N -3.97 0.15 0.00 4.15 1.02 -1.14 -2.03 120.64 118.82 1u3s n GLU 366 Ca -0.02 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 1u3s n GLU 366 Cb 0.50 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.00 1u3s n GLU 366 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1u3s n GLY 367 N -0.89 -0.00 0.09 0.62 0.00 -0.99 -3.31 105.19 100.69 1u3s n GLY 367 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1u3s n GLY 367 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1u3s n LYS 368 N -0.27 0.64 0.00 1.61 4.76 -0.86 -3.42 118.16 120.62 1u3s n LYS 368 Ca 0.00 0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.70 1u3s n LYS 368 Cb 0.08 -1.75 0.00 0.00 -1.84 0.00 0.00 35.03 31.52 1u3s n LYS 368 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1u3s s VAL 370 N -1.83 -0.35 -0.08 0.00 1.01 -1.26 -2.88 120.40 115.02 1u3s s VAL 370 Ca 0.00 0.29 -0.33 0.00 0.00 0.00 0.00 61.98 61.95 1u3s s VAL 370 Cb 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 36.38 35.88 1u3s s VAL 370 CO 0.00 0.12 1.96 1.21 0.00 0.00 0.00 175.10 178.38 1u3s n GLU 371 N 5.34 2.31 -1.00 2.72 4.07 -1.26 -2.76 120.64 130.06 1u3s n GLU 371 Ca -0.05 0.83 0.00 0.00 -0.06 0.00 0.00 57.16 57.87 1u3s n GLU 371 Cb 0.50 -2.79 0.00 0.00 -0.06 0.00 0.00 31.44 29.09 1u3s n GLU 371 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1u3s n GLY 372 N 4.67 0.44 0.08 8.31 0.00 -1.26 -4.91 105.19 112.53 1u3s n GLY 372 Ca 0.23 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.37 1u3s n GLY 372 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1u3s n ILE 373 N -2.86 0.41 -0.21 -0.61 3.06 -1.11 -4.05 119.36 114.00 1u3s n ILE 373 Ca 0.00 -0.51 -0.01 0.00 -2.50 0.00 0.00 62.75 59.73 1u3s n ILE 373 Cb 0.06 -0.20 0.20 0.00 0.54 0.00 0.00 39.64 40.24 1u3s n ILE 373 CO 0.00 0.00 0.00 0.25 -2.50 0.00 0.00 176.55 174.30 1u3s h LEU 374 N 0.00 0.88 -0.32 9.51 5.85 -1.77 0.50 115.31 129.96 1u3s h LEU 374 Ca 0.00 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1u3s h LEU 374 Cb 0.97 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1u3s h LEU 374 CO 0.00 0.73 0.18 -0.08 -0.34 0.00 0.00 178.44 178.92 1u3s h GLU 375 N 0.99 0.44 -0.70 1.25 4.81 -1.92 0.13 114.58 119.58 1u3s h GLU 375 Ca 0.25 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 1u3s h GLU 375 Cb 0.05 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1u3s h GLU 375 CO -0.04 0.37 0.23 0.82 -0.73 0.00 0.00 179.01 179.66 1u3s h ILE 376 N 0.40 1.25 -0.70 2.32 2.04 -1.57 -2.36 117.51 118.89 1u3s h ILE 376 Ca 0.11 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.07 1u3s h ILE 376 Cb 0.05 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 1u3s h ILE 376 CO -0.02 0.34 0.29 -0.26 0.00 0.00 0.00 178.15 178.50 1u3s h PHE 377 N 1.03 1.04 -0.59 1.37 -1.00 -0.51 -2.45 116.94 115.83 1u3s h PHE 377 Ca 0.23 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.90 1u3s h PHE 377 Cb 0.28 -0.32 -0.03 0.00 3.61 0.00 0.00 35.95 39.50 1u3s h PHE 377 CO 0.02 0.78 0.20 -0.44 -1.61 0.00 0.00 178.31 177.27 1u3s h ASP 378 N 1.01 0.84 0.11 2.17 3.32 -0.28 -0.37 116.42 123.23 1u3s h ASP 378 Ca 0.24 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1u3s h ASP 378 Cb 0.17 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1u3s h ASP 378 CO -0.02 0.81 -0.05 0.24 -1.72 0.00 0.00 179.24 178.49 1u3s h MET 379 N 0.83 -0.15 -0.48 3.56 2.86 -1.24 0.35 114.93 120.66 1u3s h MET 379 Ca 0.19 0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.93 1u3s h MET 379 Cb 0.26 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 31.87 1u3s h MET 379 CO -0.01 -0.06 -0.00 -0.07 1.06 0.00 0.00 176.91 177.82 1u3s h LEU 380 N -0.19 -0.21 -0.89 1.22 3.38 -1.24 0.38 115.31 117.77 1u3s h LEU 380 Ca -0.02 0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1u3s h LEU 380 Cb 0.15 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1u3s h LEU 380 CO 0.03 -0.07 -0.14 -0.07 0.09 0.00 0.00 178.44 178.27 1u3s h LEU 381 N 0.11 0.66 0.48 1.67 3.38 -0.77 0.52 115.31 121.35 1u3s h LEU 381 Ca 0.24 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1u3s h LEU 381 Cb 0.36 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1u3s h LEU 381 CO -0.40 0.82 -0.23 0.00 0.09 0.00 0.00 178.44 178.72 1u3s h ALA 382 N 1.24 -0.65 -0.63 1.53 0.00 0.11 -1.67 119.26 119.19 1u3s h ALA 382 Ca 0.10 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1u3s h ALA 382 Cb 0.59 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1u3s h ALA 382 CO 0.04 -0.74 0.42 1.15 0.00 0.00 0.00 179.25 180.12 1u3s h THR 383 N -0.90 1.11 -0.62 0.00 2.02 -0.25 -1.91 112.91 112.35 1u3s h THR 383 Ca -0.07 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 1u3s h THR 383 Cb 0.59 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1u3s h THR 383 CO 0.11 0.14 0.20 0.74 0.37 0.00 0.00 175.52 177.08 1u3s h THR 384 N 0.78 1.24 -0.26 3.16 2.02 -0.78 -1.69 112.91 117.38 1u3s h THR 384 Ca 0.25 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.55 1u3s h THR 384 Cb 0.03 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1u3s h THR 384 CO -0.06 0.32 -0.07 0.28 0.37 0.00 0.00 175.52 176.35 1u3s h SER 385 N 0.89 0.39 -0.46 4.18 0.02 -0.61 0.14 113.55 118.10 1u3s h SER 385 Ca 0.20 -0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 60.99 1u3s h SER 385 Cb 0.28 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1u3s h SER 385 CO -0.01 0.51 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.07 1u3s h ARG 386 N 0.39 0.84 -0.52 3.45 9.65 -0.78 0.31 114.38 127.72 1u3s h ARG 386 Ca 0.08 -0.28 -0.09 0.00 -1.10 0.00 0.00 59.98 58.59 1u3s h ARG 386 Cb 0.38 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.87 1u3s h ARG 386 CO 0.02 0.90 -0.04 0.74 2.80 0.00 0.00 179.97 184.39 1u3s h PHE 387 N 0.68 1.00 -0.44 2.20 0.04 -0.53 -1.31 116.94 118.57 1u3s h PHE 387 Ca 0.13 -0.17 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1u3s h PHE 387 Cb 0.55 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 1u3s h PHE 387 CO 0.04 0.92 0.23 -0.09 -0.60 0.00 0.00 178.31 178.81 1u3s h ARG 388 N 0.84 0.62 -0.79 1.51 2.43 -0.50 -0.57 114.38 117.92 1u3s h ARG 388 Ca 0.15 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1u3s h ARG 388 Cb 0.55 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1u3s h ARG 388 CO 0.03 0.51 0.44 1.49 -1.51 0.00 0.00 179.97 180.93 1u3s h GLU 389 N 0.57 1.09 0.00 0.20 4.81 -0.61 0.04 114.58 120.68 1u3s h GLU 389 Ca 0.15 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1u3s h GLU 389 Cb 0.08 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.24 1u3s h GLU 389 CO -0.02 0.79 0.00 1.28 -0.73 0.00 0.00 179.01 180.33 1u3s n LEU 390 N -4.36 0.25 -3.32 1.64 4.77 -0.52 -4.92 117.00 110.53 1u3s n LEU 390 Ca 0.08 0.53 -0.16 0.00 -0.03 0.00 0.00 56.01 56.43 1u3s n LEU 390 Cb 0.09 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 40.79 1u3s n LEU 390 CO 0.38 -0.14 0.05 0.29 -1.33 0.00 0.00 177.39 176.64 1u3s n LYS 391 N -1.75 -3.68 -1.70 3.23 5.02 0.00 -4.89 118.16 114.40 1u3s n LYS 391 Ca 0.06 0.85 -0.44 0.00 -2.02 0.00 0.00 58.31 56.76 1u3s n LYS 391 Cb 0.32 -5.80 -0.02 0.00 -0.02 0.00 0.00 35.03 29.51 1u3s n LYS 391 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1u3s n LEU 392 N -3.56 3.56 -4.88 -0.35 7.94 -0.77 -4.98 117.00 113.96 1u3s n LEU 392 Ca -0.14 1.15 -0.33 0.00 -1.11 0.00 0.00 56.01 55.58 1u3s n LEU 392 Cb 0.64 -1.49 -0.05 0.00 0.53 0.00 0.00 43.42 43.05 1u3s n LEU 392 CO 0.60 -0.28 -0.18 -1.10 -1.11 0.00 0.00 177.39 175.32 1u3s s GLN 393 N -0.62 3.34 0.26 1.96 -1.52 -1.26 -4.97 119.66 116.84 1u3s s GLN 393 Ca 0.65 -0.39 -0.10 0.00 -1.95 0.00 0.00 55.36 53.57 1u3s s GLN 393 Cb -0.59 -3.02 0.38 0.00 -0.22 0.00 0.00 33.01 29.55 1u3s s GLN 393 CO 0.51 0.65 1.58 1.25 -0.25 0.00 0.00 175.29 179.03 1u3s h HIS 394 N 3.73 -0.51 -0.26 0.91 2.76 -1.99 0.28 115.15 120.08 1u3s h HIS 394 Ca -0.48 0.08 -0.04 0.00 -2.20 0.00 0.00 60.37 57.73 1u3s h HIS 394 Cb 1.18 0.36 -0.01 0.00 1.55 0.00 0.00 27.41 30.49 1u3s h HIS 394 CO 0.65 -0.38 -0.03 0.87 -1.30 0.00 0.00 177.93 177.74 1u3s h LYS 395 N -0.00 0.39 -0.23 5.26 6.56 -2.00 -1.50 116.57 125.04 1u3s h LYS 395 Ca 0.42 -0.08 -0.14 0.00 -1.06 0.00 0.00 60.65 59.79 1u3s h LYS 395 Cb 0.64 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.24 1u3s h LYS 395 CO -0.91 0.44 -0.42 0.93 -2.06 0.00 0.00 179.45 177.43 1u3s h GLU 396 N 0.38 0.69 -0.33 3.15 5.08 -0.94 -3.07 114.58 119.53 1u3s h GLU 396 Ca 0.08 -0.44 0.05 0.00 -1.00 0.00 0.00 59.36 58.06 1u3s h GLU 396 Cb 0.29 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 1u3s h GLU 396 CO 0.01 1.06 0.06 -0.92 -1.00 0.00 0.00 179.01 178.21 1u3s h TYR 397 N 0.40 0.09 -0.54 4.33 3.20 -0.51 0.15 116.97 124.10 1u3s h TYR 397 Ca 0.01 0.02 0.08 0.00 3.14 0.00 0.00 58.73 61.99 1u3s h TYR 397 Cb 1.02 0.01 -0.07 0.00 1.54 0.00 0.00 36.73 39.23 1u3s h TYR 397 CO 0.08 0.01 0.16 -0.07 -1.64 0.00 0.00 178.16 176.70 1u3s h LEU 398 N 0.17 0.12 -0.24 2.82 3.38 -1.27 -1.19 115.31 119.11 1u3s h LEU 398 Ca 0.16 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 1u3s h LEU 398 Cb 0.18 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1u3s h LEU 398 CO -0.22 0.09 -0.03 0.00 0.09 0.00 0.00 178.44 178.37 1u3s h VAL 400 N 0.20 0.93 -0.64 0.00 2.07 -0.61 -0.27 116.25 117.92 1u3s h VAL 400 Ca 0.06 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1u3s h VAL 400 Cb 0.47 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1u3s h VAL 400 CO 0.02 0.02 0.43 0.50 0.02 0.00 0.00 177.57 178.55 1u3s h LYS 401 N 0.11 0.80 -0.02 1.57 3.64 -1.26 -0.42 116.57 120.99 1u3s h LYS 401 Ca 0.08 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.24 1u3s h LYS 401 Cb 0.07 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1u3s h LYS 401 CO -0.10 0.53 -0.75 0.00 -2.27 0.00 0.00 179.45 176.86 1u3s h ALA 402 N 1.61 0.71 -0.29 5.00 0.00 -1.29 -3.00 119.26 122.00 1u3s h ALA 402 Ca 0.25 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.38 1u3s h ALA 402 Cb -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1u3s h ALA 402 CO -0.06 0.86 -0.35 0.52 0.00 0.00 0.00 179.25 180.22 1u3s h MET 403 N 0.09 0.65 -0.17 0.00 2.86 0.24 -1.52 114.93 117.08 1u3s h MET 403 Ca -0.02 -0.31 0.04 0.00 -2.06 0.00 0.00 59.70 57.35 1u3s h MET 403 Cb 1.31 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.93 1u3s h MET 403 CO 0.11 0.91 -0.07 0.82 1.06 0.00 0.00 176.91 179.73 1u3s h ILE 404 N 0.55 0.76 -0.68 -1.22 2.04 -1.00 0.21 117.51 118.16 1u3s h ILE 404 Ca 0.06 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 1u3s h ILE 404 Cb 0.86 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1u3s h ILE 404 CO 0.07 0.00 0.30 0.25 0.00 0.00 0.00 178.15 178.78 1u3s h LEU 405 N -0.05 0.92 -0.07 1.44 5.85 -1.40 -2.07 115.31 119.93 1u3s h LEU 405 Ca 0.09 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1u3s h LEU 405 Cb 0.18 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1u3s h LEU 405 CO -0.20 0.82 0.00 0.18 -0.34 0.00 0.00 178.44 178.90 1u3s n LEU 406 N -4.42 0.69 -0.00 2.25 4.77 -0.59 -3.64 117.00 116.06 1u3s n LEU 406 Ca 0.05 0.57 0.09 0.00 -0.03 0.00 0.00 56.01 56.69 1u3s n LEU 406 Cb 0.15 -0.37 -0.11 0.00 -2.33 0.00 0.00 43.42 40.77 1u3s n LEU 406 CO 0.39 -0.20 -0.18 -3.20 -1.33 0.00 0.00 177.39 172.88 1u3s n ASN 407 N -2.16 0.83 0.07 -1.43 4.05 0.69 -4.15 115.26 113.17 1u3s n ASN 407 Ca 0.05 -0.74 0.04 0.00 0.45 0.00 0.00 54.58 54.39 1u3s n ASN 407 Cb 0.40 1.17 0.23 0.00 1.23 0.00 0.00 39.78 42.80 1u3s n ASN 407 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1u3s n SER 408 N -1.56 0.22 0.00 1.20 3.41 -0.79 -5.06 113.62 111.04 1u3s n SER 408 Ca 0.02 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1u3s n SER 408 Cb 0.32 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1u3s n SER 408 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1u3s n SER 409 N -1.77 0.00 0.00 4.04 7.64 -1.26 -4.98 113.62 117.30 1u3s n SER 409 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1u3s n SER 409 Cb 0.09 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1u3s n SER 409 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1u3s n SER 422 N 0.00 0.00 0.00 6.43 2.88 -1.26 -5.14 113.62 116.53 1u3s n SER 422 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 1u3s n SER 422 Cb 0.00 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 63.72 1u3s n SER 422 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1u3s h SER 423 N 0.00 0.49 1.22 -3.46 0.87 -2.01 -2.05 113.55 108.61 1u3s h SER 423 Ca 0.00 -0.12 -0.07 0.00 -1.23 0.00 0.00 61.79 60.37 1u3s h SER 423 Cb 0.00 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1u3s h SER 423 CO 0.00 0.62 -0.33 0.03 -0.53 0.00 0.00 176.83 176.62 1u3s h ARG 424 N 0.48 0.00 0.00 2.24 -0.00 -2.05 -3.01 114.38 112.04 1u3s h ARG 424 Ca 0.09 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.57 1u3s h ARG 424 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.41 1u3s h ARG 424 CO 0.02 0.33 -0.03 -0.22 0.00 0.00 0.00 179.97 180.07 1u3s h LYS 425 N 0.00 0.00 0.11 0.04 3.64 -1.83 -2.92 116.57 115.61 1u3s h LYS 425 Ca -0.00 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.10 1u3s h LYS 425 Cb 1.03 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1u3s h LYS 425 CO 0.04 0.03 -1.32 1.25 -2.27 0.00 0.00 179.45 177.18 1u3s h LEU 426 N 0.00 0.37 -0.56 5.20 5.85 -1.33 -3.02 115.31 121.82 1u3s h LEU 426 Ca -0.00 -0.43 -0.12 0.00 0.84 0.00 0.00 57.88 58.18 1u3s h LEU 426 Cb 0.93 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1u3s h LEU 426 CO 0.00 1.34 -0.12 0.00 -0.34 0.00 0.00 178.44 179.32 1u3s h ALA 427 N 0.60 0.76 0.00 1.25 0.00 -1.47 -0.90 119.26 119.51 1u3s h ALA 427 Ca -0.16 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 1u3s h ALA 427 Cb 1.97 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 1u3s h ALA 427 CO 0.18 0.67 -0.16 1.25 0.00 0.00 0.00 179.25 181.20 1u3s h HIS 428 N 0.91 0.00 -0.01 0.00 -0.00 -1.61 -1.94 115.15 112.50 1u3s h HIS 428 Ca 0.14 0.00 -0.24 0.00 -0.00 0.00 0.00 60.37 60.27 1u3s h HIS 428 Cb 0.69 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.11 1u3s h HIS 428 CO 0.05 0.16 -0.96 -0.07 -0.00 0.00 0.00 177.93 177.11 1u3s h LEU 429 N 0.00 0.66 -0.42 0.26 4.07 -1.32 -1.96 115.31 116.60 1u3s h LEU 429 Ca -0.00 -0.52 -0.18 0.00 0.08 0.00 0.00 57.88 57.26 1u3s h LEU 429 Cb 0.85 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 1u3s h LEU 429 CO 0.02 1.32 -0.64 0.25 -1.08 0.00 0.00 178.44 178.31 1u3s h LEU 430 N 0.29 0.64 -0.62 1.67 5.85 -1.01 -2.66 115.31 119.47 1u3s h LEU 430 Ca -0.09 -0.38 -0.15 0.00 0.84 0.00 0.00 57.88 58.10 1u3s h LEU 430 Cb 1.59 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.43 1u3s h LEU 430 CO 0.17 1.12 -0.53 0.78 -0.34 0.00 0.00 178.44 179.65 1u3s h ASN 431 N 0.41 0.49 -0.29 1.25 4.21 -1.37 0.18 115.58 120.45 1u3s h ASN 431 Ca -0.01 -0.25 0.01 0.00 1.21 0.00 0.00 56.30 57.25 1u3s h ASN 431 Cb 1.21 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 38.25 1u3s h ASN 431 CO 0.12 0.92 0.19 0.00 -1.29 0.00 0.00 177.43 177.37 1u3s h ALA 432 N 1.09 0.37 -0.13 -0.83 0.00 -1.24 0.40 119.26 118.92 1u3s h ALA 432 Ca 0.01 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1u3s h ALA 432 Cb 1.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1u3s h ALA 432 CO 0.09 -0.18 -0.61 0.28 0.00 0.00 0.00 179.25 178.83 1u3s h VAL 433 N 0.38 1.35 -0.32 0.00 2.07 -1.37 -1.89 116.25 116.46 1u3s h VAL 433 Ca 0.11 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 1u3s h VAL 433 Cb -0.03 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1u3s h VAL 433 CO -0.03 0.59 0.17 0.74 0.02 0.00 0.00 177.57 179.06 1u3s h THR 434 N 0.34 1.14 -0.99 2.57 2.02 -0.51 -0.71 112.91 116.76 1u3s h THR 434 Ca -0.01 -0.38 0.09 0.00 0.77 0.00 0.00 66.41 66.88 1u3s h THR 434 Cb 1.16 0.80 -0.08 0.00 -1.74 0.00 0.00 68.15 68.30 1u3s h THR 434 CO 0.11 0.15 0.64 0.44 0.37 0.00 0.00 175.52 177.22 1u3s h ASP 435 N 0.40 0.97 -0.04 4.18 3.32 -0.03 -0.35 116.42 124.87 1u3s h ASP 435 Ca 0.11 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 1u3s h ASP 435 Cb 0.08 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1u3s h ASP 435 CO -0.02 0.57 0.01 0.00 -1.72 0.00 0.00 179.24 178.08 1u3s h ALA 436 N 1.50 0.05 -0.97 3.45 0.00 -0.69 0.59 119.26 123.20 1u3s h ALA 436 Ca 0.46 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.34 1u3s h ALA 436 Cb 0.34 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.04 1u3s h ALA 436 CO -0.22 -0.32 0.61 1.25 0.00 0.00 0.00 179.25 180.57 1u3s h LEU 437 N -0.17 0.91 -0.74 0.00 5.85 -0.46 0.19 115.31 120.89 1u3s h LEU 437 Ca 0.01 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1u3s h LEU 437 Cb 0.25 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1u3s h LEU 437 CO 0.00 0.52 0.17 0.58 -0.34 0.00 0.00 178.44 179.37 1u3s h VAL 438 N 1.01 1.26 -0.39 1.05 2.07 -0.78 -1.72 116.25 118.75 1u3s h VAL 438 Ca 0.46 -0.97 -0.14 0.00 0.82 0.00 0.00 66.70 66.86 1u3s h VAL 438 Cb 0.37 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1u3s h VAL 438 CO -0.24 0.37 -0.33 -0.25 0.02 0.00 0.00 177.57 177.15 1u3s h TRP 439 N 1.06 1.03 -0.15 1.57 7.01 0.75 -1.92 115.95 125.31 1u3s h TRP 439 Ca 0.22 -0.29 -0.01 0.00 2.11 0.00 0.00 58.89 60.92 1u3s h TRP 439 Cb 0.37 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.20 1u3s h TRP 439 CO 0.03 1.08 0.05 0.28 -2.79 0.00 0.00 178.44 177.09 1u3s h VAL 440 N 0.73 1.18 -0.70 2.65 2.07 -0.46 -2.05 116.25 119.69 1u3s h VAL 440 Ca 0.07 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1u3s h VAL 440 Cb 0.90 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.92 1u3s h VAL 440 CO 0.08 0.17 0.31 0.40 0.02 0.00 0.00 177.57 178.55 1u3s h ILE 441 N 0.06 1.23 0.00 4.57 2.04 -1.33 -2.20 117.51 121.87 1u3s h ILE 441 Ca 0.05 -0.67 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1u3s h ILE 441 Cb 0.22 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1u3s h ILE 441 CO -0.00 0.28 -0.24 0.00 0.00 0.00 0.00 178.15 178.19 1u3s h ALA 442 N 1.35 1.57 0.00 1.87 0.00 -1.17 -2.03 119.26 120.86 1u3s h ALA 442 Ca 0.24 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1u3s h ALA 442 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1u3s h ALA 442 CO -0.03 0.30 0.00 1.17 0.00 0.00 0.00 179.25 180.69 1u3s n LYS 443 N -4.21 0.89 0.05 0.00 4.81 -0.79 -2.71 118.16 116.21 1u3s n LYS 443 Ca -0.02 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.53 1u3s n LYS 443 Cb 0.30 -1.13 -0.01 0.00 0.02 0.00 0.00 35.03 34.21 1u3s n LYS 443 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1u3s n SER 444 N -0.63 0.60 0.00 3.14 3.41 -0.76 -4.98 113.62 114.40 1u3s n SER 444 Ca 0.05 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1u3s n SER 444 Cb 0.02 0.82 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 1u3s n SER 444 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u3s n GLY 445 N 1.27 1.33 3.74 5.00 0.00 -1.10 -5.05 105.19 110.39 1u3s n GLY 445 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1u3s n GLY 445 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1u3s s ILE 446 N -2.88 2.70 0.88 -0.61 -4.36 -1.26 -4.93 121.20 110.74 1u3s s ILE 446 Ca 0.00 0.33 -0.14 0.00 -0.26 0.00 0.00 60.65 60.58 1u3s s ILE 446 Cb 0.00 -2.86 -0.01 0.00 1.25 0.00 0.00 42.46 40.84 1u3s s ILE 446 CO 0.00 -0.20 0.32 -1.54 0.24 0.00 0.00 174.94 173.77 1u3s n SER 447 N -2.64 -2.21 -0.19 4.36 3.41 -1.26 -4.61 113.62 110.48 1u3s n SER 447 Ca 0.12 0.40 0.04 0.00 -0.26 0.00 0.00 58.87 59.17 1u3s n SER 447 Cb 0.51 -1.16 0.32 0.00 -0.26 0.00 0.00 64.21 63.61 1u3s n SER 447 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1u3s h SER 448 N -1.11 0.73 -0.48 4.04 0.87 -1.99 -0.39 113.55 115.21 1u3s h SER 448 Ca -0.44 -0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.05 1u3s h SER 448 Cb 1.31 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 63.08 1u3s h SER 448 CO 0.36 0.49 0.06 -0.61 -0.53 0.00 0.00 176.83 176.60 1u3s h GLN 449 N 0.84 0.80 0.00 2.24 -0.00 -2.01 -2.56 115.11 114.42 1u3s h GLN 449 Ca 0.30 -0.23 0.00 0.00 -0.00 0.00 0.00 58.65 58.72 1u3s h GLN 449 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 27.48 27.51 1u3s h GLN 449 CO -0.09 0.82 0.00 1.96 0.00 0.00 0.00 178.83 181.52 1u3s h GLN 450 N 0.67 0.00 -0.11 1.69 1.08 -1.68 -2.26 115.11 114.51 1u3s h GLN 450 Ca 0.14 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 57.11 1u3s h GLN 450 Cb 0.42 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.86 1u3s h GLN 450 CO 0.01 0.00 -0.86 1.96 -0.95 0.00 0.00 178.83 178.99 1u3s h GLN 451 N 0.00 0.76 -0.39 1.46 4.20 -0.70 -1.79 115.11 118.65 1u3s h GLN 451 Ca 0.00 -0.68 -0.09 0.00 0.06 0.00 0.00 58.65 57.94 1u3s h GLN 451 Cb 0.57 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 1u3s h GLN 451 CO 0.00 1.27 -0.11 0.77 -0.67 0.00 0.00 178.83 180.09 1u3s h SER 452 N 0.49 0.77 -0.78 1.46 0.02 -1.21 -1.45 113.55 112.86 1u3s h SER 452 Ca -0.08 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.45 1u3s h SER 452 Cb 1.50 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.79 1u3s h SER 452 CO 0.17 0.97 0.28 -0.03 -1.14 0.00 0.00 176.83 177.08 1u3s h MET 453 N 0.57 1.18 -0.26 3.45 -1.53 -1.42 -1.13 114.93 115.79 1u3s h MET 453 Ca 0.10 -0.23 -0.14 0.00 -3.44 0.00 0.00 59.70 55.98 1u3s h MET 453 Cb 0.64 -0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.50 1u3s h MET 453 CO 0.04 0.97 -0.43 -0.09 0.14 0.00 0.00 176.91 177.55 1u3s h ARG 454 N 1.14 0.64 -0.67 0.39 2.43 -1.21 0.32 114.38 117.41 1u3s h ARG 454 Ca 0.26 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1u3s h ARG 454 Cb 0.26 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 1u3s h ARG 454 CO -0.02 0.94 0.34 1.25 -1.51 0.00 0.00 179.97 180.98 1u3s h LEU 455 N 0.52 0.86 -0.09 3.80 5.85 -0.97 -0.78 115.31 124.50 1u3s h LEU 455 Ca 0.04 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1u3s h LEU 455 Cb 0.95 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1u3s h LEU 455 CO 0.09 0.74 -0.01 0.00 -0.34 0.00 0.00 178.44 178.91 1u3s h ALA 456 N 1.16 0.12 -0.43 1.25 0.00 -0.97 -2.18 119.26 118.21 1u3s h ALA 456 Ca 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1u3s h ALA 456 Cb 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1u3s h ALA 456 CO -0.03 -0.18 0.23 -0.91 0.00 0.00 0.00 179.25 178.35 1u3s h ASN 457 N -0.15 0.52 -0.05 0.00 2.35 -0.72 -1.01 115.58 116.52 1u3s h ASN 457 Ca 0.02 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1u3s h ASN 457 Cb 0.39 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1u3s h ASN 457 CO 0.01 0.43 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.01 1u3s h LEU 458 N 0.59 0.20 -1.26 1.61 3.38 -1.10 -3.31 115.31 115.42 1u3s h LEU 458 Ca 0.15 -0.61 -0.07 0.00 0.09 0.00 0.00 57.88 57.44 1u3s h LEU 458 Cb 0.03 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1u3s h LEU 458 CO -0.02 0.78 -0.34 -0.07 0.09 0.00 0.00 178.44 178.87 1u3s h LEU 459 N -0.37 0.00 -1.80 1.67 3.38 -1.14 -2.80 115.31 114.25 1u3s h LEU 459 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1u3s h LEU 459 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1u3s h LEU 459 CO 0.03 0.34 0.09 0.24 0.09 0.00 0.00 178.44 179.22 1u3s h MET 460 N 0.00 0.22 0.00 1.13 2.86 -1.27 -1.23 114.93 116.63 1u3s h MET 460 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1u3s h MET 460 Cb 0.70 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.31 1u3s h MET 460 CO 0.04 0.16 0.00 -0.07 1.06 0.00 0.00 176.91 178.11 1u3s h LEU 461 N 0.22 0.00 -1.16 1.22 3.38 -1.61 -3.00 115.31 114.36 1u3s h LEU 461 Ca 0.06 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.08 1u3s h LEU 461 Cb 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 1u3s h LEU 461 CO -0.01 0.00 0.58 -0.07 0.09 0.00 0.00 178.44 179.03 1u3s h LEU 462 N 0.00 0.92 -0.40 1.67 3.38 -1.37 -2.13 115.31 117.38 1u3s h LEU 462 Ca 0.00 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1u3s h LEU 462 Cb 0.28 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1u3s h LEU 462 CO 0.00 0.61 0.21 0.28 0.09 0.00 0.00 178.44 179.63 1u3s h SER 463 N 1.05 0.32 -0.54 -0.43 0.02 -1.72 -0.64 113.55 111.60 1u3s h SER 463 Ca 0.37 0.01 0.03 0.00 -0.84 0.00 0.00 61.79 61.37 1u3s h SER 463 Cb 0.12 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 1u3s h SER 463 CO -0.12 0.23 0.31 0.45 -1.14 0.00 0.00 176.83 176.55 1u3s h HIS 464 N 0.42 0.57 -0.79 3.45 3.86 -1.58 0.11 115.15 121.20 1u3s h HIS 464 Ca 0.17 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1u3s h HIS 464 Cb 0.05 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.31 1u3s h HIS 464 CO -0.09 0.31 0.46 0.28 0.86 0.00 0.00 177.93 179.75 1u3s h VAL 465 N 0.60 1.23 -0.35 2.45 2.07 -0.92 -0.45 116.25 120.88 1u3s h VAL 465 Ca 0.23 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 1u3s h VAL 465 Cb 0.07 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.96 1u3s h VAL 465 CO -0.12 0.24 -0.13 -0.09 0.02 0.00 0.00 177.57 177.49 1u3s h ARG 466 N 1.08 0.62 -0.08 1.57 9.65 -0.27 -0.55 114.38 126.41 1u3s h ARG 466 Ca 0.28 -0.20 -0.02 0.00 -1.10 0.00 0.00 59.98 58.94 1u3s h ARG 466 Cb -0.02 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.50 1u3s h ARG 466 CO -0.05 0.74 -0.04 1.25 2.80 0.00 0.00 179.97 184.66 1u3s h HIS 467 N 0.57 0.20 -0.72 2.20 2.76 -0.24 -1.58 115.15 118.34 1u3s h HIS 467 Ca 0.10 -0.05 0.04 0.00 -2.20 0.00 0.00 60.37 58.26 1u3s h HIS 467 Cb 0.56 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.42 1u3s h HIS 467 CO 0.02 0.55 0.45 0.00 -1.30 0.00 0.00 177.93 177.65 1u3s h ALA 468 N 0.63 0.96 -0.52 5.26 0.00 -0.97 -0.74 119.26 123.87 1u3s h ALA 468 Ca 0.02 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1u3s h ALA 468 Cb 0.50 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1u3s h ALA 468 CO 0.01 0.21 0.21 1.03 0.00 0.00 0.00 179.25 180.71 1u3s h SER 469 N 0.86 0.25 -0.04 0.00 0.87 -0.94 0.44 113.55 114.98 1u3s h SER 469 Ca 0.30 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.92 1u3s h SER 469 Cb 0.07 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 1u3s h SER 469 CO -0.13 0.17 -0.01 0.78 -0.53 0.00 0.00 176.83 177.11 1u3s h ASN 470 N 0.41 -0.05 -0.66 6.23 -0.26 -0.21 0.15 115.58 121.19 1u3s h ASN 470 Ca 0.24 0.01 -0.08 0.00 -0.56 0.00 0.00 56.30 55.92 1u3s h ASN 470 Cb 0.23 0.03 -0.03 0.00 -1.06 0.00 0.00 38.32 37.50 1u3s h ASN 470 CO -0.22 -0.02 0.12 0.11 -1.06 0.00 0.00 177.43 176.36 1u3s h LYS 471 N -0.00 1.10 -0.59 0.81 1.79 -0.71 -1.89 116.57 117.07 1u3s h LYS 471 Ca 0.02 -0.28 -0.07 0.00 -2.18 0.00 0.00 60.65 58.14 1u3s h LYS 471 Cb 0.04 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.53 1u3s h LYS 471 CO -0.05 0.99 0.10 0.78 -1.08 0.00 0.00 179.45 180.20 1u3s h GLY 472 N 1.06 1.06 1.45 3.86 0.00 0.19 -1.09 103.07 109.59 1u3s h GLY 472 Ca 0.21 -0.71 -0.19 0.00 0.00 0.00 0.00 47.33 46.64 1u3s h GLY 472 CO 0.01 0.65 -0.71 -0.33 0.00 0.00 0.00 176.54 176.16 1u3s h MET 473 N 0.89 0.55 -0.43 4.80 2.86 -0.60 -0.94 114.93 122.06 1u3s h MET 473 Ca 0.18 -0.43 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1u3s h MET 473 Cb 0.42 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1u3s h MET 473 CO 0.01 1.06 0.17 1.49 1.06 0.00 0.00 176.91 180.70 1u3s h GLU 474 N 0.38 0.64 0.14 1.72 4.57 -1.28 -0.66 114.58 120.10 1u3s h GLU 474 Ca -0.03 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1u3s h GLU 474 Cb 1.30 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1u3s h GLU 474 CO 0.13 0.59 -0.09 1.25 -1.18 0.00 0.00 179.01 179.71 1u3s h HIS 475 N 0.55 -0.24 -0.39 0.92 2.76 -1.11 -1.68 115.15 115.97 1u3s h HIS 475 Ca 0.14 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.37 1u3s h HIS 475 Cb 0.19 0.09 -0.05 0.00 1.55 0.00 0.00 27.41 29.18 1u3s h HIS 475 CO 0.00 -0.15 0.06 1.25 -1.30 0.00 0.00 177.93 177.79 1u3s h LEU 476 N -0.23 -0.03 -1.38 0.26 5.85 -0.98 0.74 115.31 119.54 1u3s h LEU 476 Ca -0.01 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1u3s h LEU 476 Cb 0.20 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1u3s h LEU 476 CO 0.01 0.02 0.45 0.25 -0.34 0.00 0.00 178.44 178.83 1u3s h LEU 477 N 0.18 0.69 -0.32 2.25 5.85 -0.97 -0.91 115.31 122.08 1u3s h LEU 477 Ca 0.19 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 1u3s h LEU 477 Cb 0.23 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1u3s h LEU 477 CO -0.26 0.47 0.12 0.78 -0.34 0.00 0.00 178.44 179.21 1u3s h ASN 478 N 0.80 0.44 0.34 1.25 -0.26 -0.16 -2.01 115.58 115.97 1u3s h ASN 478 Ca 0.28 -0.17 -0.03 0.00 -0.56 0.00 0.00 56.30 55.82 1u3s h ASN 478 Cb 0.11 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1u3s h ASN 478 CO -0.08 0.49 -0.14 0.24 -1.06 0.00 0.00 177.43 176.88 1u3s h MET 479 N 0.37 0.00 -0.10 0.81 2.86 0.11 -1.31 114.93 117.67 1u3s h MET 479 Ca 0.11 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.54 1u3s h MET 479 Cb 0.19 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.86 1u3s h MET 479 CO -0.01 0.14 -0.76 -0.22 1.06 0.00 0.00 176.91 177.12 1u3s h LYS 480 N 0.00 0.68 0.00 1.72 3.64 -0.72 -2.89 116.57 119.01 1u3s h LYS 480 Ca -0.00 -0.61 -0.06 0.00 -1.27 0.00 0.00 60.65 58.71 1u3s h LYS 480 Cb 0.34 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1u3s h LYS 480 CO 0.02 1.21 -0.30 0.00 -2.27 0.00 0.00 179.45 178.11 1u3s h LYS 482 N 0.00 0.00 0.00 0.00 6.56 -1.23 -3.47 116.57 118.44 1u3s h LYS 482 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1u3s h LYS 482 Cb 0.57 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.23 1u3s h LYS 482 CO 0.04 0.22 0.00 0.09 -2.06 0.00 0.00 179.45 177.73 1u3s n ASN 483 N -3.27 0.00 0.10 0.86 5.03 -0.93 -4.90 115.26 112.15 1u3s n ASN 483 Ca 0.01 0.00 0.04 0.00 0.87 0.00 0.00 54.58 55.50 1u3s n ASN 483 Cb 0.50 0.00 0.21 0.00 -1.02 0.00 0.00 39.78 39.46 1u3s n ASN 483 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 1u3s n VAL 484 N -2.00 0.79 -3.65 2.41 0.31 -1.11 -4.53 118.33 110.56 1u3s n VAL 484 Ca 0.00 0.65 0.00 0.00 -0.01 0.00 0.00 64.34 64.98 1u3s n VAL 484 Cb 0.00 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.22 1u3s n VAL 484 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1u3s s VAL 485 N -3.02 0.00 0.01 2.52 0.11 -1.26 -4.55 120.40 114.22 1u3s s VAL 485 Ca -0.01 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.74 1u3s s VAL 485 Cb 0.02 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.80 1u3s s VAL 485 CO 0.07 0.00 1.73 -2.16 -3.33 0.00 0.00 175.10 171.41 1u3s s PRO 486 N 0.89 4.18 -0.57 1.54 0.04 -1.26 -4.70 135.00 135.12 1u3s s PRO 486 Ca -0.05 2.34 -0.21 0.00 0.04 0.00 0.00 61.00 63.12 1u3s s PRO 486 Cb -0.03 -3.89 0.07 0.00 0.04 0.00 0.00 34.50 30.68 1u3s s PRO 486 CO -0.12 -0.83 0.80 0.08 0.04 0.00 0.00 177.00 176.97 1u3s s VAL 487 N 3.65 4.62 1.00 -0.36 1.01 -1.26 -5.01 120.40 124.05 1u3s s VAL 487 Ca 0.77 -0.38 -0.17 0.00 0.00 0.00 0.00 61.98 62.20 1u3s s VAL 487 Cb -0.38 -4.49 -0.05 0.00 0.00 0.00 0.00 36.38 31.47 1u3s s VAL 487 CO 0.33 -1.10 -0.35 -1.22 0.00 0.00 0.00 175.10 172.76 1u3s n TYR 488 N 6.88 -2.65 0.21 5.22 4.01 -1.26 -4.45 117.16 125.12 1u3s n TYR 488 Ca -0.05 0.19 -0.15 0.00 -0.16 0.00 0.00 57.90 57.73 1u3s n TYR 488 Cb 0.45 -1.57 -0.08 0.00 -0.31 0.00 0.00 39.34 37.84 1u3s n TYR 488 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1u3s h ASP 489 N -1.39 -1.06 -0.25 7.72 3.32 -1.98 0.35 116.42 123.13 1u3s h ASP 489 Ca -0.45 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 1u3s h ASP 489 Cb 1.32 0.37 -0.01 0.00 0.22 0.00 0.00 39.33 41.23 1u3s h ASP 489 CO 0.29 -0.51 0.03 0.25 -1.72 0.00 0.00 179.24 177.59 1u3s h LEU 490 N -0.74 0.40 -1.52 1.55 5.85 -1.97 -1.83 115.31 117.05 1u3s h LEU 490 Ca -0.02 -0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.50 1u3s h LEU 490 Cb 0.69 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1u3s h LEU 490 CO -0.10 0.57 0.41 0.25 -0.34 0.00 0.00 178.44 179.22 1u3s h LEU 491 N 0.22 0.51 -0.15 2.25 5.85 -1.88 -2.08 115.31 120.03 1u3s h LEU 491 Ca 0.07 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.64 1u3s h LEU 491 Cb 0.34 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.27 1u3s h LEU 491 CO 0.01 0.33 -0.51 0.25 -0.34 0.00 0.00 178.44 178.18 1u3s h LEU 492 N 0.59 0.71 -0.13 2.25 5.85 -0.03 -1.86 115.31 122.68 1u3s h LEU 492 Ca 0.27 -0.60 0.04 0.00 0.84 0.00 0.00 57.88 58.42 1u3s h LEU 492 Cb 0.31 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1u3s h LEU 492 CO -0.08 1.19 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.77 1u3s h GLU 493 N 0.27 -0.12 -0.62 1.25 5.08 -0.80 -1.07 114.58 118.58 1u3s h GLU 493 Ca -0.02 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1u3s h GLU 493 Cb 1.14 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 1u3s h GLU 493 CO 0.11 -0.08 0.39 0.52 -1.00 0.00 0.00 179.01 178.95 1u3s h MET 494 N -0.12 0.84 -0.97 2.33 2.86 -1.43 0.23 114.93 118.66 1u3s h MET 494 Ca 0.09 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.71 1u3s h MET 494 Cb 0.25 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.67 1u3s h MET 494 CO -0.21 0.59 0.63 1.25 1.06 0.00 0.00 176.91 180.22 1u3s h LEU 495 N 0.84 1.01 0.17 1.22 6.46 -0.81 -3.05 115.31 121.16 1u3s h LEU 495 Ca 0.23 0.00 -0.32 0.00 -0.12 0.00 0.00 57.88 57.66 1u3s h LEU 495 Cb -0.05 -0.22 0.01 0.00 -0.73 0.00 0.00 40.66 39.67 1u3s h LEU 495 CO -0.04 0.67 -1.56 0.78 -0.62 0.00 0.00 178.44 177.66 1u3s h ASN 496 N 1.16 0.56 0.00 1.25 -0.26 -0.75 -3.50 115.58 114.05 1u3s h ASN 496 Ca 0.40 -0.73 0.00 0.00 -0.56 0.00 0.00 56.30 55.41 1u3s h ASN 496 Cb 0.11 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.19 1u3s h ASN 496 CO -0.14 1.60 0.00 0.00 -1.06 0.00 0.00 177.43 177.83