#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qk1 n HIS 314 N 0.00 0.00 0.00 7.33 -0.00 -1.26 -5.28 115.22 116.01 2qk1 n HIS 314 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2qk1 n HIS 314 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2qk1 n HIS 314 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qk1 n ALA 316 N -3.00 -0.52 -3.69 1.59 0.00 -1.26 -5.36 120.51 108.27 2qk1 n ALA 316 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2qk1 n ALA 316 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 2qk1 n ALA 316 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qk1 s SER 317 N 0.00 1.07 -0.15 0.00 0.01 -1.26 -5.26 113.70 108.11 2qk1 s SER 317 Ca 0.00 -0.10 -0.02 0.00 1.31 0.00 0.00 55.95 57.14 2qk1 s SER 317 Cb 0.00 -0.41 -0.02 0.00 0.21 0.00 0.00 66.02 65.80 2qk1 s SER 317 CO 0.00 -0.11 -0.08 -0.22 0.41 0.00 0.00 173.24 173.24 2qk1 s LEU 319 N 1.29 2.95 0.50 2.44 2.96 -1.26 -5.28 118.68 122.28 2qk1 s LEU 319 Ca -0.05 -0.26 -0.22 0.00 -0.22 0.00 0.00 54.13 53.37 2qk1 s LEU 319 Cb -0.13 -1.70 -0.06 0.00 0.50 0.00 0.00 46.19 44.80 2qk1 s LEU 319 CO -0.02 0.14 1.26 -2.84 -1.32 0.00 0.00 176.35 173.57 2qk1 s PRO 320 N 0.54 3.44 0.45 0.98 0.02 -1.26 -5.00 135.00 134.16 2qk1 s PRO 320 Ca -0.06 2.00 -0.15 0.00 0.02 0.00 0.00 61.00 62.81 2qk1 s PRO 320 Cb -0.15 -2.32 -0.08 0.00 0.02 0.00 0.00 34.50 31.97 2qk1 s PRO 320 CO 0.03 -0.88 0.89 -1.83 -0.33 0.00 0.00 177.00 174.88 2qk1 s GLU 321 N -2.82 3.94 0.25 5.54 -1.05 -1.26 -4.71 118.70 118.59 2qk1 s GLU 321 Ca 0.68 0.80 0.11 0.00 -0.15 0.00 0.00 54.97 56.41 2qk1 s GLU 321 Cb -0.34 -2.25 -0.05 0.00 -0.44 0.00 0.00 34.13 31.05 2qk1 s GLU 321 CO 0.41 -0.12 -0.20 -1.21 0.95 0.00 0.00 175.26 175.08 2qk1 s GLU 322 N -3.76 1.59 0.11 -4.83 2.02 0.12 -4.86 118.70 109.09 2qk1 s GLU 322 Ca 0.57 -1.68 0.10 0.00 0.02 0.00 0.00 54.97 53.98 2qk1 s GLU 322 Cb -0.10 -1.70 -0.04 0.00 0.10 0.00 0.00 34.13 32.39 2qk1 s GLU 322 CO 0.27 0.33 -0.26 0.95 0.02 0.00 0.00 175.26 176.57 2qk1 s THR 323 N -2.36 2.31 0.00 3.63 -4.23 -1.26 -1.00 115.64 112.73 2qk1 s THR 323 Ca 0.27 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 2qk1 s THR 323 Cb -0.05 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.78 2qk1 s THR 323 CO 0.13 0.14 0.00 2.30 -0.54 0.00 0.00 174.62 176.65 2qk1 n ILE 324 N 1.05 0.00 0.16 2.99 -5.35 -1.26 -4.78 119.36 112.18 2qk1 n ILE 324 Ca -0.18 0.00 0.05 0.00 -0.27 0.00 0.00 62.75 62.36 2qk1 n ILE 324 Cb 0.53 0.18 0.51 0.00 -1.74 0.00 0.00 39.64 39.11 2qk1 n ILE 324 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2qk1 h LEU 325 N 0.00 0.15 -0.03 7.28 3.38 -1.98 -0.03 115.31 124.08 2qk1 h LEU 325 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qk1 h LEU 325 Cb 0.06 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2qk1 h LEU 325 CO 0.00 0.20 0.00 -0.90 0.09 0.00 0.00 178.44 177.83 2qk1 n ASP 326 N -4.42 0.06 -1.00 -0.43 5.75 -1.26 -2.95 116.55 112.31 2qk1 n ASP 326 Ca -0.01 0.51 0.10 0.00 -0.01 0.00 0.00 54.79 55.38 2qk1 n ASP 326 Cb 0.16 -0.52 0.18 0.00 -1.03 0.00 0.00 41.12 39.90 2qk1 n ASP 326 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qk1 n LYS 327 N -1.56 2.29 -2.41 0.11 5.02 -0.03 -4.94 118.16 116.64 2qk1 n LYS 327 Ca 0.05 -2.10 -0.42 0.00 -2.02 0.00 0.00 58.31 53.82 2qk1 n LYS 327 Cb 0.27 -1.44 -0.03 0.00 -0.02 0.00 0.00 35.03 33.80 2qk1 n LYS 327 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qk1 s LEU 328 N -1.39 4.34 0.55 -0.35 1.43 -1.15 -4.98 118.68 117.13 2qk1 s LEU 328 Ca 0.33 1.98 -0.21 0.00 -1.03 0.00 0.00 54.13 55.20 2qk1 s LEU 328 Cb 0.20 -3.57 -0.06 0.00 0.03 0.00 0.00 46.19 42.79 2qk1 s LEU 328 CO 0.27 -0.53 1.15 -2.65 0.23 0.00 0.00 176.35 174.83 2qk1 n PRO 329 N 4.40 1.32 0.31 1.29 -0.02 -1.26 -4.86 135.00 136.18 2qk1 n PRO 329 Ca 0.10 0.49 0.20 0.00 -2.02 0.00 0.00 63.50 62.27 2qk1 n PRO 329 Cb 0.46 -2.33 0.99 0.00 -0.02 0.00 0.00 33.50 32.60 2qk1 n PRO 329 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2qk1 h LYS 330 N 1.08 0.00 -0.62 -0.52 2.10 -1.98 -1.50 116.57 115.12 2qk1 h LYS 330 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2qk1 h LYS 330 Cb 1.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 2qk1 h LYS 330 CO 0.55 0.01 0.00 -0.40 -2.00 0.00 0.00 179.45 177.61 2qk1 n ASP 331 N -3.16 4.71 -0.03 7.07 5.75 -1.26 -4.53 116.55 125.10 2qk1 n ASP 331 Ca -0.02 -2.47 -0.11 0.00 -0.01 0.00 0.00 54.79 52.18 2qk1 n ASP 331 Cb 0.16 -0.57 -0.05 0.00 -1.03 0.00 0.00 41.12 39.63 2qk1 n ASP 331 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 2qk1 h PHE 332 N 3.92 0.20 -0.62 2.11 3.57 -1.62 -0.92 116.94 123.59 2qk1 h PHE 332 Ca 0.00 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2qk1 h PHE 332 Cb 1.44 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 40.07 2qk1 h PHE 332 CO 0.75 0.24 0.32 0.37 -2.23 0.00 0.00 178.31 177.76 2qk1 h GLN 333 N 0.10 0.58 -0.12 1.11 5.75 -1.81 0.14 115.11 120.87 2qk1 h GLN 333 Ca 0.05 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 2qk1 h GLN 333 Cb 0.11 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.53 2qk1 h GLN 333 CO -0.01 0.39 0.02 1.49 -2.65 0.00 0.00 178.83 178.07 2qk1 h GLU 334 N 0.60 0.20 -0.40 1.69 4.81 -1.82 -2.93 114.58 116.72 2qk1 h GLU 334 Ca 0.28 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 59.31 2qk1 h GLU 334 Cb 0.20 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2qk1 h GLU 334 CO -0.19 0.38 -0.35 0.00 -0.73 0.00 0.00 179.01 178.12 2qk1 h ARG 335 N -0.02 0.94 0.00 1.92 3.08 -0.88 -2.76 114.38 116.66 2qk1 h ARG 335 Ca 0.04 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.62 2qk1 h ARG 335 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2qk1 h ARG 335 CO 0.00 1.13 0.00 0.97 -1.07 0.00 0.00 179.97 181.00 2qk1 h ILE 336 N 0.78 0.00 -0.43 2.04 6.09 -0.75 -2.34 117.51 122.90 2qk1 h ILE 336 Ca 0.07 -0.37 0.00 0.00 -1.37 0.00 0.00 64.86 63.19 2qk1 h ILE 336 Cb 0.93 1.33 0.00 0.00 0.47 0.00 0.00 36.82 39.56 2qk1 h ILE 336 CO 0.09 0.00 0.00 0.35 -3.07 0.00 0.00 178.15 175.52 2qk1 n THR 337 N -2.99 0.85 -2.16 2.19 -2.24 -1.11 -4.85 114.28 103.98 2qk1 n THR 337 Ca -0.00 -0.93 -0.34 0.00 -2.27 0.00 0.00 64.05 60.51 2qk1 n THR 337 Cb 0.24 0.62 0.01 0.00 -2.10 0.00 0.00 70.33 69.10 2qk1 n THR 337 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2qk1 s SER 338 N -1.05 5.66 0.45 3.42 0.15 -0.88 -4.94 113.70 116.51 2qk1 s SER 338 Ca 0.31 2.07 0.25 0.00 0.70 0.00 0.00 55.95 59.28 2qk1 s SER 338 Cb 0.17 -2.57 0.58 0.00 -1.71 0.00 0.00 66.02 62.49 2qk1 s SER 338 CO 0.22 -1.26 1.69 0.77 1.20 0.00 0.00 173.24 175.87 2qk1 h SER 339 N 0.90 0.00 -3.12 5.45 4.64 -1.92 -3.44 113.55 116.06 2qk1 h SER 339 Ca -0.49 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.27 2qk1 h SER 339 Cb 1.25 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.31 2qk1 h SER 339 CO 0.57 0.07 0.69 -0.54 -0.87 0.00 0.00 176.83 176.75 2qk1 s LYS 340 N -3.31 4.35 0.18 4.77 1.02 -1.26 -4.94 119.74 120.55 2qk1 s LYS 340 Ca 0.05 1.56 -0.13 0.00 0.02 0.00 0.00 55.97 57.47 2qk1 s LYS 340 Cb 0.07 -3.58 0.16 0.00 -0.52 0.00 0.00 37.83 33.96 2qk1 s LYS 340 CO 0.65 -0.45 1.77 -1.49 -0.92 0.00 0.00 175.35 174.91 2qk1 h TRP 341 N 7.43 0.42 -0.38 3.18 4.06 -1.98 -2.33 115.95 126.35 2qk1 h TRP 341 Ca -0.31 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.67 2qk1 h TRP 341 Cb 1.14 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 29.17 2qk1 h TRP 341 CO 0.73 0.18 0.25 0.87 -3.56 0.00 0.00 178.44 176.91 2qk1 h LYS 342 N 0.45 0.50 -0.38 0.49 1.57 -1.97 -1.85 116.57 115.37 2qk1 h LYS 342 Ca 0.24 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2qk1 h LYS 342 Cb 0.20 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2qk1 h LYS 342 CO -0.20 0.33 0.13 -0.44 -0.57 0.00 0.00 179.45 178.70 2qk1 h ASP 343 N 0.51 0.55 -0.22 0.86 3.32 -1.73 -0.85 116.42 118.86 2qk1 h ASP 343 Ca 0.14 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 2qk1 h ASP 343 Cb -0.05 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2qk1 h ASP 343 CO -0.03 0.59 -0.06 0.03 -1.72 0.00 0.00 179.24 178.05 2qk1 h ARG 344 N 0.47 0.43 -0.44 3.56 3.08 -1.36 -2.55 114.38 117.58 2qk1 h ARG 344 Ca 0.13 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 2qk1 h ARG 344 Cb 0.23 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2qk1 h ARG 344 CO -0.01 0.68 0.10 0.28 -1.07 0.00 0.00 179.97 179.95 2qk1 h VAL 345 N 0.16 1.24 -0.85 2.04 2.07 -1.33 -1.27 116.25 118.30 2qk1 h VAL 345 Ca 0.05 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 2qk1 h VAL 345 Cb 0.53 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2qk1 h VAL 345 CO 0.02 0.29 0.44 -0.33 0.02 0.00 0.00 177.57 178.02 2qk1 h GLU 346 N 0.58 1.20 -0.34 1.57 5.08 -1.18 0.42 114.58 121.90 2qk1 h GLU 346 Ca 0.14 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2qk1 h GLU 346 Cb 0.34 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2qk1 h GLU 346 CO 0.00 0.90 0.09 0.00 -1.00 0.00 0.00 179.01 179.01 2qk1 h ALA 347 N 1.28 0.45 -0.13 3.43 0.00 -1.27 -0.54 119.26 122.49 2qk1 h ALA 347 Ca 0.30 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2qk1 h ALA 347 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qk1 h ALA 347 CO -0.04 0.11 -0.03 -0.07 0.00 0.00 0.00 179.25 179.22 2qk1 h LEU 348 N 0.40 0.25 -0.62 0.00 3.38 -0.78 -2.76 115.31 115.18 2qk1 h LEU 348 Ca 0.11 -0.37 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 2qk1 h LEU 348 Cb 0.28 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2qk1 h LEU 348 CO -0.00 0.56 -0.08 -0.08 0.09 0.00 0.00 178.44 178.93 2qk1 h GLU 349 N -0.06 1.00 -0.39 1.13 4.81 -0.16 -1.31 114.58 119.60 2qk1 h GLU 349 Ca 0.03 -0.35 -0.12 0.00 -0.13 0.00 0.00 59.36 58.79 2qk1 h GLU 349 Cb 0.45 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2qk1 h GLU 349 CO 0.01 1.03 -0.26 0.93 -0.73 0.00 0.00 179.01 180.00 2qk1 h GLU 350 N 0.90 0.81 -0.29 1.92 5.08 -1.15 0.19 114.58 122.04 2qk1 h GLU 350 Ca 0.15 -0.35 -0.14 0.00 -1.00 0.00 0.00 59.36 58.02 2qk1 h GLU 350 Cb 0.63 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2qk1 h GLU 350 CO 0.04 0.98 -0.40 0.35 -1.00 0.00 0.00 179.01 178.98 2qk1 h PHE 351 N 0.70 0.81 0.21 4.33 3.57 -1.39 -1.93 116.94 123.23 2qk1 h PHE 351 Ca 0.09 -0.24 -0.01 0.00 3.53 0.00 0.00 57.97 61.34 2qk1 h PHE 351 Cb 0.79 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.36 2qk1 h PHE 351 CO 0.04 0.97 -0.10 2.35 -2.23 0.00 0.00 178.31 179.34 2qk1 h TRP 352 N 0.56 -0.26 -0.20 0.41 2.91 -0.97 -0.60 115.95 117.80 2qk1 h TRP 352 Ca 0.05 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.08 2qk1 h TRP 352 Cb 0.92 0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 29.64 2qk1 h TRP 352 CO 0.04 0.09 0.08 -0.44 -1.03 0.00 0.00 178.44 177.18 2qk1 h ASP 353 N -0.66 0.11 1.20 2.65 3.32 -0.64 0.75 116.42 123.15 2qk1 h ASP 353 Ca -0.03 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 2qk1 h ASP 353 Cb 0.47 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2qk1 h ASP 353 CO 0.05 0.09 -0.82 0.28 -1.72 0.00 0.00 179.24 177.12 2qk1 h SER 354 N 0.19 0.00 0.00 6.45 0.02 -1.45 -3.42 113.55 115.34 2qk1 h SER 354 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2qk1 h SER 354 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2qk1 h SER 354 CO -0.07 0.13 0.00 0.52 -1.14 0.00 0.00 176.83 176.27 2qk1 n VAL 355 N -2.84 0.33 -0.05 2.27 0.31 -0.30 -4.86 118.33 113.19 2qk1 n VAL 355 Ca -0.01 0.11 -0.10 0.00 -0.01 0.00 0.00 64.34 64.33 2qk1 n VAL 355 Cb 0.60 -1.09 -0.04 0.00 -0.91 0.00 0.00 33.84 32.41 2qk1 n VAL 355 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2qk1 h LEU 356 N 0.00 0.24 -2.30 7.52 3.38 -1.36 -3.07 115.31 119.72 2qk1 h LEU 356 Ca 0.00 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2qk1 h LEU 356 Cb 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 2qk1 h LEU 356 CO 0.00 0.22 0.23 0.77 0.09 0.00 0.00 178.44 179.75 2qk1 h SER 357 N 0.24 0.00 -0.15 -0.43 4.64 -1.09 -0.63 113.55 116.13 2qk1 h SER 357 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2qk1 h SER 357 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2qk1 h SER 357 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 2qk1 n GLN 358 N -3.19 1.81 -2.23 4.77 1.13 -1.16 -5.00 117.38 113.52 2qk1 n GLN 358 Ca -0.01 -1.77 -0.41 0.00 -1.94 0.00 0.00 57.00 52.87 2qk1 n GLN 358 Cb 0.31 -1.37 -0.03 0.00 0.11 0.00 0.00 30.24 29.26 2qk1 n GLN 358 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2qk1 s THR 359 N -1.40 3.23 -0.07 5.09 2.01 -0.25 -4.95 115.64 119.30 2qk1 s THR 359 Ca 0.25 1.01 0.08 0.00 0.31 0.00 0.00 61.69 63.34 2qk1 s THR 359 Cb 0.16 -3.65 -0.11 0.00 0.01 0.00 0.00 72.50 68.92 2qk1 s THR 359 CO 0.23 0.15 0.06 0.29 -0.69 0.00 0.00 174.62 174.67 2qk1 n LYS 360 N 2.60 2.22 -3.62 4.92 5.02 -1.26 -4.99 118.16 123.04 2qk1 n LYS 360 Ca 0.06 -0.02 -0.01 0.00 -2.02 0.00 0.00 58.31 56.32 2qk1 n LYS 360 Cb 0.43 -1.21 -0.04 0.00 -0.02 0.00 0.00 35.03 34.18 2qk1 n LYS 360 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2qk1 s LYS 361 N -2.28 0.56 -0.07 1.97 2.20 -1.26 -4.88 119.74 115.98 2qk1 s LYS 361 Ca -0.04 1.36 -0.07 0.00 -0.36 0.00 0.00 55.97 56.86 2qk1 s LYS 361 Cb 0.03 0.78 -0.04 0.00 -1.51 0.00 0.00 37.83 37.09 2qk1 s LYS 361 CO 0.35 -0.19 0.20 -0.51 -0.36 0.00 0.00 175.35 174.84 2qk1 s LEU 362 N 2.76 4.40 0.15 5.43 1.43 -0.19 0.12 118.68 132.76 2qk1 s LEU 362 Ca -0.06 0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 53.28 2qk1 s LEU 362 Cb -0.11 -2.31 -0.07 0.00 0.03 0.00 0.00 46.19 43.73 2qk1 s LEU 362 CO -0.19 0.35 0.93 -0.75 0.23 0.00 0.00 176.35 176.93 2qk1 s LYS 363 N -1.28 4.73 -0.25 1.70 2.20 -0.17 -4.67 119.74 122.01 2qk1 s LYS 363 Ca 0.20 1.43 -0.07 0.00 -0.36 0.00 0.00 55.97 57.17 2qk1 s LYS 363 Cb -0.13 -3.34 -0.17 0.00 -1.51 0.00 0.00 37.83 32.68 2qk1 s LYS 363 CO 0.09 0.32 -0.17 -1.13 -0.36 0.00 0.00 175.35 174.11 2qk1 n SER 364 N 2.35 1.98 -4.69 1.43 3.41 -1.26 -4.72 113.62 112.13 2qk1 n SER 364 Ca 0.00 0.12 -0.51 0.00 -0.26 0.00 0.00 58.87 58.23 2qk1 n SER 364 Cb 0.49 -0.66 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 2qk1 n SER 364 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2qk1 n THR 365 N -3.73 0.48 -1.46 6.66 -1.04 -1.26 -1.62 114.28 112.30 2qk1 n THR 365 Ca -0.46 -0.09 -0.16 0.00 -2.04 0.00 0.00 64.05 61.30 2qk1 n THR 365 Cb 0.94 -1.69 -0.07 0.00 -1.82 0.00 0.00 70.33 67.69 2qk1 n THR 365 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2qk1 n SER 366 N 6.13 -5.48 -4.18 8.00 7.64 -1.26 -4.95 113.62 119.51 2qk1 n SER 366 Ca 0.23 0.40 -0.36 0.00 1.01 0.00 0.00 58.87 60.15 2qk1 n SER 366 Cb 0.25 -4.39 -0.13 0.00 -1.01 0.00 0.00 64.21 58.94 2qk1 n SER 366 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2qk1 s GLN 367 N -3.33 2.36 -0.62 1.43 -1.52 -0.64 -5.06 119.66 112.28 2qk1 s GLN 367 Ca 0.00 -1.39 -0.19 0.00 -1.95 0.00 0.00 55.36 51.83 2qk1 s GLN 367 Cb 0.00 -3.35 0.11 0.00 -0.22 0.00 0.00 33.01 29.54 2qk1 s GLN 367 CO 0.00 -0.75 0.74 1.21 -0.25 0.00 0.00 175.29 176.24 2qk1 s ASN 368 N 1.44 6.22 0.00 5.90 3.04 -1.26 -4.89 114.94 125.39 2qk1 s ASN 368 Ca -0.01 -1.47 0.31 0.00 0.04 0.00 0.00 52.86 51.73 2qk1 s ASN 368 Cb -0.21 -2.31 1.68 0.00 -1.54 0.00 0.00 41.25 38.88 2qk1 s ASN 368 CO -0.01 -1.12 2.10 -1.22 -3.04 0.00 0.00 177.10 173.81 2qk1 n TYR 369 N 6.37 0.00 -0.15 0.43 4.02 -1.26 -4.34 117.16 122.23 2qk1 n TYR 369 Ca -0.07 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.79 2qk1 n TYR 369 Cb 0.43 -0.02 0.06 0.00 -0.02 0.00 0.00 39.34 39.79 2qk1 n TYR 369 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2qk1 h SER 370 N 0.53 0.05 -0.05 7.72 4.64 -1.98 -0.57 113.55 123.89 2qk1 h SER 370 Ca 0.00 0.08 0.02 0.00 -0.47 0.00 0.00 61.79 61.41 2qk1 h SER 370 Cb 0.13 0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2qk1 h SER 370 CO 0.00 0.06 -0.06 -1.13 -0.87 0.00 0.00 176.83 174.83 2qk1 h ASN 371 N 0.26 -0.19 -0.24 4.97 -0.00 -1.99 0.37 115.58 118.76 2qk1 h ASN 371 Ca 0.23 0.04 -0.02 0.00 -0.00 0.00 0.00 56.30 56.55 2qk1 h ASN 371 Cb 0.29 0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.69 2qk1 h ASN 371 CO -0.28 -0.09 0.09 0.25 -0.00 0.00 0.00 177.43 177.40 2qk1 h LEU 372 N -0.09 0.33 -1.17 0.34 5.85 -1.79 -0.99 115.31 117.80 2qk1 h LEU 372 Ca 0.04 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 2qk1 h LEU 372 Cb 0.14 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2qk1 h LEU 372 CO -0.10 0.42 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.26 2qk1 h LEU 373 N 0.23 0.45 -0.73 2.25 3.38 -0.97 -1.46 115.31 118.45 2qk1 h LEU 373 Ca 0.08 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2qk1 h LEU 373 Cb 0.19 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2qk1 h LEU 373 CO -0.01 0.58 -0.03 1.23 0.09 0.00 0.00 178.44 180.31 2qk1 h GLY 374 N 0.88 1.01 0.93 0.83 0.00 0.02 0.15 103.07 106.89 2qk1 h GLY 374 Ca 0.09 -0.74 -0.03 0.00 0.00 0.00 0.00 47.33 46.65 2qk1 h GLY 374 CO 0.02 0.68 0.13 -2.22 0.00 0.00 0.00 176.54 175.15 2qk1 h ILE 375 N 0.86 1.20 -0.61 2.60 2.04 -0.63 -0.57 117.51 122.40 2qk1 h ILE 375 Ca 0.15 -0.64 -0.05 0.00 1.00 0.00 0.00 64.86 65.33 2qk1 h ILE 375 Cb 0.55 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 2qk1 h ILE 375 CO 0.03 0.22 0.20 1.88 0.00 0.00 0.00 178.15 180.48 2qk1 h TYR 376 N 0.44 0.97 -0.73 1.37 0.99 -0.95 -1.79 116.97 117.28 2qk1 h TYR 376 Ca 0.12 -0.10 -0.01 0.00 2.00 0.00 0.00 58.73 60.75 2qk1 h TYR 376 Cb 0.22 -0.28 -0.03 0.00 1.00 0.00 0.00 36.73 37.63 2qk1 h TYR 376 CO 0.00 0.80 0.42 0.78 -0.00 0.00 0.00 178.16 180.17 2qk1 h GLY 377 N 0.87 1.08 0.98 3.88 0.00 -0.47 0.03 103.07 109.43 2qk1 h GLY 377 Ca 0.20 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 2qk1 h GLY 377 CO -0.01 0.45 0.20 0.84 0.00 0.00 0.00 176.54 178.02 2qk1 h HIS 378 N 1.00 0.81 -0.12 5.60 -0.00 -0.86 -0.80 115.15 120.78 2qk1 h HIS 378 Ca 0.26 -0.07 -0.00 0.00 -0.00 0.00 0.00 60.37 60.56 2qk1 h HIS 378 Cb 0.00 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.16 2qk1 h HIS 378 CO -0.01 0.67 0.07 0.82 -0.00 0.00 0.00 177.93 179.48 2qk1 h ILE 379 N 0.71 1.07 -0.86 6.26 2.04 -0.91 0.14 117.51 125.97 2qk1 h ILE 379 Ca 0.17 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.87 2qk1 h ILE 379 Cb 0.21 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 2qk1 h ILE 379 CO -0.01 0.07 0.55 0.40 0.00 0.00 0.00 178.15 179.16 2qk1 h ILE 380 N 0.11 1.13 -0.08 -0.67 2.04 -0.81 -0.11 117.51 119.13 2qk1 h ILE 380 Ca 0.04 -0.37 -0.18 0.00 1.00 0.00 0.00 64.86 65.36 2qk1 h ILE 380 Cb 0.05 -0.03 0.01 0.00 -0.74 0.00 0.00 36.82 36.11 2qk1 h ILE 380 CO -0.01 0.20 -0.64 -0.61 0.00 0.00 0.00 178.15 177.09 2qk1 h GLN 381 N 1.07 0.57 0.00 2.37 5.75 -0.85 -3.42 115.11 120.59 2qk1 h GLN 381 Ca 0.34 -0.51 0.00 0.00 -0.15 0.00 0.00 58.65 58.34 2qk1 h GLN 381 Cb 0.02 0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.69 2qk1 h GLN 381 CO -0.12 1.13 -0.53 1.63 -2.65 0.00 0.00 178.83 178.29 2qk1 n LYS 382 N -4.13 3.18 -1.71 1.69 5.02 0.47 -4.97 118.16 117.70 2qk1 n LYS 382 Ca -0.09 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.78 2qk1 n LYS 382 Cb 0.67 -0.76 -0.03 0.00 -0.02 0.00 0.00 35.03 34.90 2qk1 n LYS 382 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2qk1 n ASP 383 N -1.24 3.78 0.18 4.39 -0.08 -0.06 -4.87 116.55 118.65 2qk1 n ASP 383 Ca 0.00 1.09 0.13 0.00 -1.51 0.00 0.00 54.79 54.50 2qk1 n ASP 383 Cb 0.00 -1.55 0.42 0.00 2.34 0.00 0.00 41.12 42.32 2qk1 n ASP 383 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qk1 h ALA 384 N 6.08 1.00 -2.12 -1.67 0.00 -1.97 -3.42 119.26 117.16 2qk1 h ALA 384 Ca -0.44 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.79 2qk1 h ALA 384 Cb 1.22 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.83 2qk1 h ALA 384 CO 0.90 0.00 0.05 1.21 0.00 0.00 0.00 179.25 181.41 2qk1 s ASN 385 N -5.22 6.24 0.44 0.00 2.47 -1.26 -4.93 114.94 112.68 2qk1 s ASN 385 Ca 0.06 -0.79 0.30 0.00 0.42 0.00 0.00 52.86 52.85 2qk1 s ASN 385 Cb 0.09 -2.29 1.54 0.00 -1.45 0.00 0.00 41.25 39.14 2qk1 s ASN 385 CO 0.57 -0.86 1.93 0.16 -3.72 0.00 0.00 177.10 175.17 2qk1 h ILE 386 N 5.86 0.00 -0.05 -5.21 3.07 -1.99 -1.13 117.51 118.05 2qk1 h ILE 386 Ca -0.27 -0.11 -0.20 0.00 1.55 0.00 0.00 64.86 65.83 2qk1 h ILE 386 Cb 1.10 0.86 -0.00 0.00 -0.27 0.00 0.00 36.82 38.50 2qk1 h ILE 386 CO 0.94 0.00 -0.80 -0.61 -1.05 0.00 0.00 178.15 176.63 2qk1 h GLN 387 N 0.00 0.41 -0.29 0.16 5.75 -1.97 -1.13 115.11 118.03 2qk1 h GLN 387 Ca 0.00 -0.37 -0.14 0.00 -0.15 0.00 0.00 58.65 57.99 2qk1 h GLN 387 Cb 0.14 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 2qk1 h GLN 387 CO 0.00 1.02 -0.40 0.00 -2.65 0.00 0.00 178.83 176.80 2qk1 h ALA 388 N 0.87 0.74 -0.24 3.38 0.00 -1.64 -2.25 119.26 120.13 2qk1 h ALA 388 Ca -0.05 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2qk1 h ALA 388 Cb 1.40 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2qk1 h ALA 388 CO 0.14 0.66 0.16 0.28 0.00 0.00 0.00 179.25 180.48 2qk1 h VAL 389 N 0.58 1.07 -0.57 0.00 2.07 -1.23 -0.66 116.25 117.52 2qk1 h VAL 389 Ca 0.05 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.42 2qk1 h VAL 389 Cb 0.94 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 2qk1 h VAL 389 CO 0.09 0.07 0.37 0.00 0.02 0.00 0.00 177.57 178.12 2qk1 h ALA 390 N 1.07 0.72 -0.77 1.67 0.00 -1.08 -0.51 119.26 120.36 2qk1 h ALA 390 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2qk1 h ALA 390 Cb -0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2qk1 h ALA 390 CO -0.02 0.16 0.31 -0.07 0.00 0.00 0.00 179.25 179.63 2qk1 h LEU 391 N 0.77 1.07 -0.46 0.00 3.38 -1.16 -0.58 115.31 118.33 2qk1 h LEU 391 Ca 0.21 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2qk1 h LEU 391 Cb -0.09 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.37 2qk1 h LEU 391 CO -0.04 0.95 -0.00 0.00 0.09 0.00 0.00 178.44 179.43 2qk1 h ALA 392 N 1.16 0.62 -0.45 1.53 0.00 -0.77 -1.07 119.26 120.28 2qk1 h ALA 392 Ca 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qk1 h ALA 392 Cb 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2qk1 h ALA 392 CO -0.02 0.42 0.26 0.00 0.00 0.00 0.00 179.25 179.91 2qk1 h ALA 393 N 0.91 0.57 -0.92 0.00 0.00 -0.82 -0.32 119.26 118.68 2qk1 h ALA 393 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qk1 h ALA 393 Cb 0.50 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2qk1 h ALA 393 CO 0.02 0.08 0.53 0.37 0.00 0.00 0.00 179.25 180.26 2qk1 h GLN 394 N 0.59 1.27 -0.39 0.00 4.15 -0.96 -1.16 115.11 118.61 2qk1 h GLN 394 Ca 0.16 -0.13 -0.11 0.00 0.77 0.00 0.00 58.65 59.34 2qk1 h GLN 394 Cb 0.03 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 2qk1 h GLN 394 CO -0.03 0.91 -0.17 0.77 -1.93 0.00 0.00 178.83 178.38 2qk1 h SER 395 N 1.28 0.83 -0.50 -0.69 0.02 -0.76 -2.15 113.55 111.59 2qk1 h SER 395 Ca 0.33 -0.40 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2qk1 h SER 395 Cb -0.01 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 2qk1 h SER 395 CO -0.06 1.04 0.21 0.58 -1.14 0.00 0.00 176.83 177.46 2qk1 h VAL 396 N 0.62 1.21 -0.56 2.27 2.07 -0.78 -1.68 116.25 119.40 2qk1 h VAL 396 Ca 0.09 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 67.02 2qk1 h VAL 396 Cb 0.72 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2qk1 h VAL 396 CO 0.05 0.24 0.29 -0.08 0.02 0.00 0.00 177.57 178.10 2qk1 h GLU 397 N 0.66 0.54 -0.13 1.57 4.22 -1.11 -1.54 114.58 118.79 2qk1 h GLU 397 Ca 0.17 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 59.57 2qk1 h GLU 397 Cb 0.18 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2qk1 h GLU 397 CO -0.01 0.36 0.06 1.25 -2.18 0.00 0.00 179.01 178.49 2qk1 h LEU 398 N 0.56 0.17 -0.81 1.64 7.12 -1.12 -1.49 115.31 121.37 2qk1 h LEU 398 Ca 0.25 -0.12 0.01 0.00 0.13 0.00 0.00 57.88 58.14 2qk1 h LEU 398 Cb 0.15 -0.04 -0.04 0.00 -0.53 0.00 0.00 40.66 40.19 2qk1 h LEU 398 CO -0.17 0.25 0.53 0.40 -0.13 0.00 0.00 178.44 179.32 2qk1 h ILE 399 N 0.09 1.21 -0.19 4.05 2.04 -0.98 -0.32 117.51 123.40 2qk1 h ILE 399 Ca 0.05 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 2qk1 h ILE 399 Cb 0.12 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 2qk1 h ILE 399 CO -0.01 0.21 0.03 0.00 0.00 0.00 0.00 178.15 178.38 2qk1 h ASP 401 N 0.11 0.15 0.23 0.00 3.58 -0.98 0.14 116.42 119.64 2qk1 h ASP 401 Ca 0.06 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2qk1 h ASP 401 Cb 0.32 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2qk1 h ASP 401 CO 0.00 0.38 -1.26 0.29 -2.88 0.00 0.00 179.24 175.78 2qk1 n LYS 402 N -4.22 0.31 -0.05 0.28 4.76 -0.16 -4.23 118.16 114.85 2qk1 n LYS 402 Ca -0.01 -0.05 -0.20 0.00 -2.87 0.00 0.00 58.31 55.18 2qk1 n LYS 402 Cb 0.32 -1.56 -0.13 0.00 -1.84 0.00 0.00 35.03 31.82 2qk1 n LYS 402 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2qk1 n LEU 403 N -1.93 2.74 0.00 -0.35 7.94 -0.37 -1.03 117.00 124.00 2qk1 n LEU 403 Ca 0.01 0.08 0.00 0.00 -1.11 0.00 0.00 56.01 54.99 2qk1 n LEU 403 Cb 0.44 -1.03 0.00 0.00 0.53 0.00 0.00 43.42 43.37 2qk1 n LEU 403 CO 0.42 0.87 0.00 0.29 -1.11 0.00 0.00 177.39 177.86 2qk1 n LYS 404 N -3.44 0.00 -3.90 1.96 5.02 0.48 -4.50 118.16 113.77 2qk1 n LYS 404 Ca -0.38 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.61 2qk1 n LYS 404 Cb 1.01 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.98 2qk1 n LYS 404 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2qk1 s THR 405 N 0.00 5.36 -1.57 -0.18 -4.23 -1.26 -0.25 115.64 113.50 2qk1 s THR 405 Ca 0.00 -0.41 0.30 0.00 -1.18 0.00 0.00 61.69 60.40 2qk1 s THR 405 Cb 0.00 -3.65 0.55 0.00 1.34 0.00 0.00 72.50 70.74 2qk1 s THR 405 CO 0.00 0.09 2.01 -0.81 -0.54 0.00 0.00 174.62 175.37 2qk1 n PRO 406 N 0.12 0.59 -0.12 3.99 -0.04 -1.26 -4.91 135.00 133.36 2qk1 n PRO 406 Ca -0.05 -0.08 -0.07 0.00 -0.04 0.00 0.00 63.50 63.26 2qk1 n PRO 406 Cb 0.52 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2qk1 n PRO 406 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2qk1 h GLY 407 N 4.99 -0.11 -7.27 0.55 0.00 -1.74 -3.21 103.07 96.26 2qk1 h GLY 407 Ca 0.00 0.36 -0.56 0.00 0.00 0.00 0.00 47.33 47.12 2qk1 h GLY 407 CO 0.00 -0.21 1.20 -0.12 0.00 0.00 0.00 176.54 177.41 2qk1 s PHE 408 N -6.05 2.38 0.84 5.60 5.36 0.65 -4.97 117.98 121.79 2qk1 s PHE 408 Ca -0.15 -0.34 -0.12 0.00 -0.96 0.00 0.00 56.93 55.36 2qk1 s PHE 408 Cb 0.14 -4.65 0.10 0.00 -0.34 0.00 0.00 43.02 38.27 2qk1 s PHE 408 CO 0.69 -2.02 1.17 -1.54 -1.46 0.00 0.00 175.22 172.06 2qk1 s SER 409 N 4.17 4.23 0.40 6.13 1.04 -1.22 -4.70 113.70 123.76 2qk1 s SER 409 Ca 0.39 0.82 0.17 0.00 0.48 0.00 0.00 55.95 57.81 2qk1 s SER 409 Cb -0.05 -1.33 0.85 0.00 0.10 0.00 0.00 66.02 65.59 2qk1 s SER 409 CO 0.06 -2.08 1.84 0.11 0.98 0.00 0.00 173.24 174.15 2qk1 h LYS 410 N -1.18 0.00 -0.52 4.02 1.79 -1.93 -0.44 116.57 118.32 2qk1 h LYS 410 Ca -0.47 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 57.93 2qk1 h LYS 410 Cb 1.33 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.96 2qk1 h LYS 410 CO 0.65 0.33 0.06 -0.44 -1.08 0.00 0.00 179.45 178.96 2qk1 h ASP 411 N 0.00 0.84 -0.59 0.86 3.32 -1.99 -1.09 116.42 117.78 2qk1 h ASP 411 Ca -0.00 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 2qk1 h ASP 411 Cb 0.67 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 2qk1 h ASP 411 CO 0.04 0.91 0.22 1.88 -1.72 0.00 0.00 179.24 180.57 2qk1 h TYR 412 N 0.75 0.91 -0.95 4.55 0.05 -1.70 -2.67 116.97 117.90 2qk1 h TYR 412 Ca 0.15 -0.07 0.06 0.00 0.05 0.00 0.00 58.73 58.92 2qk1 h TYR 412 Cb 0.44 -0.27 -0.07 0.00 1.01 0.00 0.00 36.73 37.84 2qk1 h TYR 412 CO 0.03 0.74 0.61 0.28 -1.05 0.00 0.00 178.16 178.77 2qk1 h VAL 413 N 0.82 1.07 0.00 -2.88 2.07 -0.74 -1.68 116.25 114.91 2qk1 h VAL 413 Ca 0.19 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2qk1 h VAL 413 Cb 0.22 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 2qk1 h VAL 413 CO -0.01 0.20 -0.02 0.77 0.02 0.00 0.00 177.57 178.53 2qk1 h SER 414 N 1.10 0.00 1.85 0.57 4.64 -0.85 0.87 113.55 121.74 2qk1 h SER 414 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 2qk1 h SER 414 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2qk1 h SER 414 CO -0.17 0.02 0.00 -0.07 -0.87 0.00 0.00 176.83 175.74 2qk1 h LEU 415 N 0.00 0.00 0.00 5.97 3.38 -1.27 -3.40 115.31 119.99 2qk1 h LEU 415 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qk1 h LEU 415 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2qk1 h LEU 415 CO 0.00 0.00 -0.59 1.33 0.09 0.00 0.00 178.44 179.27 2qk1 n VAL 416 N -3.03 0.00 0.35 1.22 0.24 -0.60 -4.29 118.33 112.21 2qk1 n VAL 416 Ca 0.04 -0.01 -0.16 0.00 -2.04 0.00 0.00 64.34 62.17 2qk1 n VAL 416 Cb 0.50 0.32 -0.08 0.00 -1.47 0.00 0.00 33.84 33.10 2qk1 n VAL 416 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 2qk1 h PHE 417 N 0.00 -0.82 -0.97 6.34 3.57 -1.08 -2.00 116.94 121.97 2qk1 h PHE 417 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2qk1 h PHE 417 Cb 0.00 0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 2qk1 h PHE 417 CO 0.00 -0.47 0.61 1.15 -2.23 0.00 0.00 178.31 177.37 2qk1 h THR 418 N -1.07 1.26 -0.71 4.41 2.02 -1.83 -0.79 112.91 116.20 2qk1 h THR 418 Ca -0.09 -0.53 0.05 0.00 0.77 0.00 0.00 66.41 66.62 2qk1 h THR 418 Cb 0.72 -0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 2qk1 h THR 418 CO 0.15 0.26 0.41 -0.65 0.37 0.00 0.00 175.52 176.06 2qk1 h PRO 419 N 1.33 0.74 -0.37 6.66 0.11 -1.86 0.12 132.00 138.74 2qk1 h PRO 419 Ca 0.35 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.38 2qk1 h PRO 419 Cb -0.10 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.83 2qk1 h PRO 419 CO -0.07 0.49 0.08 -0.07 -0.21 0.00 0.00 178.00 178.22 2qk1 h LEU 420 N 0.76 0.57 -0.72 2.35 3.38 -0.66 -0.73 115.31 120.27 2qk1 h LEU 420 Ca 0.31 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2qk1 h LEU 420 Cb 0.16 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2qk1 h LEU 420 CO -0.17 0.66 0.40 -0.07 0.09 0.00 0.00 178.44 179.35 2qk1 h LEU 421 N 0.45 0.88 -0.94 1.67 3.38 -0.70 -2.38 115.31 117.67 2qk1 h LEU 421 Ca 0.12 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2qk1 h LEU 421 Cb 0.32 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2qk1 h LEU 421 CO 0.00 0.71 0.12 0.44 0.09 0.00 0.00 178.44 179.80 2qk1 h ASP 422 N 0.98 0.84 -0.00 -0.43 3.32 -0.58 -2.76 116.42 117.79 2qk1 h ASP 422 Ca 0.25 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2qk1 h ASP 422 Cb 0.02 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.34 2qk1 h ASP 422 CO -0.04 0.83 0.00 -1.14 -1.72 0.00 0.00 179.24 177.17 2qk1 n ARG 423 N -4.25 1.01 0.00 3.56 3.00 -0.30 -3.47 116.66 116.21 2qk1 n ARG 423 Ca 0.04 -0.02 0.09 0.00 -0.00 0.00 0.00 57.85 57.96 2qk1 n ARG 423 Cb 0.25 -1.23 0.51 0.00 0.00 0.00 0.00 32.46 31.98 2qk1 n ARG 423 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2qk1 n THR 424 N -0.72 0.00 0.26 5.15 -2.24 -1.04 -2.17 114.28 113.52 2qk1 n THR 424 Ca 0.11 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 62.05 2qk1 n THR 424 Cb 0.05 -0.68 0.58 0.00 -2.10 0.00 0.00 70.33 68.19 2qk1 n THR 424 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2qk1 h LYS 425 N 0.00 0.00 -6.89 -0.78 2.10 -1.81 -3.38 116.57 105.81 2qk1 h LYS 425 Ca 0.00 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 58.12 2qk1 h LYS 425 Cb 0.00 0.00 0.08 0.00 -0.90 0.00 0.00 32.23 31.41 2qk1 h LYS 425 CO 0.00 0.02 0.69 -1.21 -2.00 0.00 0.00 179.45 176.95 2qk1 s GLU 426 N -3.59 4.28 -0.01 0.07 0.41 -0.92 -4.89 118.70 114.03 2qk1 s GLU 426 Ca 0.02 2.33 0.12 0.00 -0.41 0.00 0.00 54.97 57.03 2qk1 s GLU 426 Cb 0.08 -3.04 -0.18 0.00 -1.78 0.00 0.00 34.13 29.21 2qk1 s GLU 426 CO 0.57 -0.31 0.32 1.63 -0.49 0.00 0.00 175.26 176.99 2qk1 n LYS 427 N 0.80 0.93 -1.66 1.61 5.02 -1.26 -4.63 118.16 118.98 2qk1 n LYS 427 Ca 0.01 -0.09 -0.43 0.00 -2.02 0.00 0.00 58.31 55.78 2qk1 n LYS 427 Cb 0.41 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 34.14 2qk1 n LYS 427 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2qk1 n LYS 428 N -1.80 2.76 -0.33 1.97 4.81 -1.26 -4.83 118.16 119.48 2qk1 n LYS 428 Ca -0.01 1.00 -0.08 0.00 -0.87 0.00 0.00 58.31 58.35 2qk1 n LYS 428 Cb 0.30 -3.01 -0.07 0.00 0.02 0.00 0.00 35.03 32.27 2qk1 n LYS 428 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2qk1 n PRO 429 N 7.60 -0.33 -0.03 1.64 -0.02 -1.26 -1.15 135.00 141.45 2qk1 n PRO 429 Ca 0.21 1.20 -0.01 0.00 -2.02 0.00 0.00 63.50 62.88 2qk1 n PRO 429 Cb 0.40 -1.76 0.27 0.00 -0.02 0.00 0.00 33.50 32.39 2qk1 n PRO 429 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qk1 h SER 430 N 0.00 0.56 0.04 2.55 4.64 -1.99 -0.79 113.55 118.56 2qk1 h SER 430 Ca 0.14 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2qk1 h SER 430 Cb 0.34 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2qk1 h SER 430 CO -0.75 0.61 -0.02 0.58 -0.87 0.00 0.00 176.83 176.38 2qk1 h VAL 431 N 0.58 1.34 -0.19 0.95 2.07 -1.49 -2.71 116.25 116.80 2qk1 h VAL 431 Ca 0.13 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.22 2qk1 h VAL 431 Cb 0.31 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 2qk1 h VAL 431 CO 0.01 0.34 -0.15 -0.29 0.02 0.00 0.00 177.57 177.49 2qk1 h ILE 432 N -0.67 1.21 -0.65 4.57 6.09 -1.11 -1.88 117.51 125.06 2qk1 h ILE 432 Ca -0.01 -0.92 -0.06 0.00 -1.37 0.00 0.00 64.86 62.50 2qk1 h ILE 432 Cb 0.60 1.23 -0.03 0.00 0.47 0.00 0.00 36.82 39.09 2qk1 h ILE 432 CO 0.01 0.29 0.15 -0.08 -3.07 0.00 0.00 178.15 175.45 2qk1 h GLU 433 N 0.29 1.03 -0.56 2.19 4.57 -1.18 0.19 114.58 121.12 2qk1 h GLU 433 Ca 0.06 -0.24 -0.10 0.00 -1.18 0.00 0.00 59.36 57.89 2qk1 h GLU 433 Cb 0.44 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 2qk1 h GLU 433 CO 0.03 0.92 -0.06 0.00 -1.18 0.00 0.00 179.01 178.72 2qk1 h ALA 434 N 1.18 0.84 -0.40 2.92 0.00 -1.08 -1.41 119.26 121.32 2qk1 h ALA 434 Ca 0.21 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2qk1 h ALA 434 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2qk1 h ALA 434 CO 0.00 0.66 -0.09 0.82 0.00 0.00 0.00 179.25 180.64 2qk1 h ILE 435 N 0.91 1.27 -0.16 0.00 2.04 -0.95 -2.37 117.51 118.25 2qk1 h ILE 435 Ca 0.15 -1.17 0.02 0.00 1.00 0.00 0.00 64.86 64.86 2qk1 h ILE 435 Cb 0.61 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2qk1 h ILE 435 CO 0.04 0.39 0.03 0.03 0.00 0.00 0.00 178.15 178.64 2qk1 h ARG 436 N 0.58 0.09 -0.79 2.37 3.08 -0.41 -1.68 114.38 117.63 2qk1 h ARG 436 Ca 0.10 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.16 2qk1 h ARG 436 Cb 0.61 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 2qk1 h ARG 436 CO 0.04 0.06 0.51 0.87 -1.07 0.00 0.00 179.97 180.38 2qk1 h LYS 437 N 0.09 1.00 -0.57 0.04 1.57 -1.21 0.09 116.57 117.58 2qk1 h LYS 437 Ca 0.07 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2qk1 h LYS 437 Cb 0.06 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2qk1 h LYS 437 CO -0.09 0.66 0.17 0.00 -0.57 0.00 0.00 179.45 179.62 2qk1 h ALA 438 N 1.30 0.74 -0.51 3.86 0.00 -1.15 -1.32 119.26 122.19 2qk1 h ALA 438 Ca 0.30 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2qk1 h ALA 438 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2qk1 h ALA 438 CO -0.08 0.42 0.11 -0.07 0.00 0.00 0.00 179.25 179.63 2qk1 h LEU 439 N 0.80 0.79 -0.71 0.00 3.38 -0.87 -1.26 115.31 117.44 2qk1 h LEU 439 Ca 0.18 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2qk1 h LEU 439 Cb 0.30 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2qk1 h LEU 439 CO -0.00 0.83 0.17 -0.07 0.09 0.00 0.00 178.44 179.46 2qk1 h LEU 440 N 0.72 1.07 -0.31 1.67 3.38 -0.83 -1.20 115.31 119.81 2qk1 h LEU 440 Ca 0.16 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 2qk1 h LEU 440 Cb 0.36 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2qk1 h LEU 440 CO 0.00 1.03 0.03 0.74 0.09 0.00 0.00 178.44 180.33 2qk1 h THR 441 N 1.07 1.25 -0.90 0.22 2.02 -1.09 -1.41 112.91 114.07 2qk1 h THR 441 Ca 0.22 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.53 2qk1 h THR 441 Cb 0.37 1.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.96 2qk1 h THR 441 CO 0.00 0.28 0.57 0.40 0.37 0.00 0.00 175.52 177.14 2qk1 h ILE 442 N 0.33 1.24 0.00 3.11 2.04 -1.06 -1.45 117.51 121.72 2qk1 h ILE 442 Ca 0.09 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.47 2qk1 h ILE 442 Cb 0.39 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2qk1 h ILE 442 CO 0.01 0.24 0.00 0.00 0.00 0.00 0.00 178.15 178.40 2qk1 h LYS 444 N 0.00 0.47 0.00 0.00 3.64 -0.18 -3.00 116.57 117.50 2qk1 h LYS 444 Ca 0.00 -0.64 -0.19 0.00 -1.27 0.00 0.00 60.65 58.55 2qk1 h LYS 444 Cb 0.48 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 2qk1 h LYS 444 CO 0.00 1.27 -0.92 1.88 -2.27 0.00 0.00 179.45 179.41 2qk1 h TYR 445 N -0.02 0.00 -2.90 1.91 0.05 -1.20 -3.38 116.97 111.43 2qk1 h TYR 445 Ca -0.15 0.00 -0.61 0.00 0.05 0.00 0.00 58.73 58.02 2qk1 h TYR 445 Cb 1.68 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 39.01 2qk1 h TYR 445 CO 0.15 0.91 -0.73 0.71 -1.05 0.00 0.00 178.16 178.16 2qk1 s TYR 446 N -2.75 2.45 -0.16 4.88 2.02 0.11 -4.95 117.35 118.95 2qk1 s TYR 446 Ca 0.02 -2.80 -0.29 0.00 -0.37 0.00 0.00 57.07 53.63 2qk1 s TYR 446 Cb 0.10 -2.03 -0.05 0.00 -0.40 0.00 0.00 41.96 39.58 2qk1 s TYR 446 CO 0.81 -0.70 1.98 0.34 -1.57 0.00 0.00 175.55 176.41 2qk1 s ASP 447 N -0.45 5.97 0.54 2.29 2.15 -1.13 -4.32 116.67 121.72 2qk1 s ASP 447 Ca 0.24 2.00 0.21 0.00 0.43 0.00 0.00 52.55 55.43 2qk1 s ASP 447 Cb -0.10 -2.52 1.39 0.00 -0.30 0.00 0.00 42.92 41.38 2qk1 s ASP 447 CO -0.11 -1.53 2.12 -0.65 -0.17 0.00 0.00 175.17 174.83 2qk1 h PRO 448 N 12.67 0.00 -0.48 4.34 0.11 -1.81 -0.70 132.00 146.12 2qk1 h PRO 448 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2qk1 h PRO 448 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qk1 h PRO 448 CO 0.97 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 180.04 2qk1 n LEU 449 N -4.37 2.53 -4.59 2.35 4.77 -1.26 -4.14 117.00 112.29 2qk1 n LEU 449 Ca 0.00 -1.27 -0.54 0.00 -0.03 0.00 0.00 56.01 54.18 2qk1 n LEU 449 Cb 0.23 -0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 2qk1 n LEU 449 CO 0.33 0.57 0.88 0.00 -1.33 0.00 0.00 177.39 177.84 2qk1 n ALA 450 N 0.73 -1.37 0.30 -1.18 0.00 -0.27 -4.38 120.51 114.34 2qk1 n ALA 450 Ca 0.15 0.52 0.16 0.00 0.00 0.00 0.00 53.44 54.27 2qk1 n ALA 450 Cb 0.43 -2.03 0.93 0.00 0.00 0.00 0.00 19.45 18.78 2qk1 n ALA 450 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qk1 h SER 451 N 4.48 0.00 0.47 0.00 4.64 -1.82 -0.69 113.55 120.62 2qk1 h SER 451 Ca -0.48 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 2qk1 h SER 451 Cb 1.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2qk1 h SER 451 CO 0.77 0.03 -0.07 0.77 -0.87 0.00 0.00 176.83 177.46 2qk1 h SER 452 N 0.00 0.00 0.00 4.97 4.64 -1.95 -3.45 113.55 117.76 2qk1 h SER 452 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qk1 h SER 452 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2qk1 h SER 452 CO 0.00 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.65 2qk1 n GLY 453 N -0.56 1.23 0.28 -0.77 0.00 -0.27 -4.90 105.19 100.19 2qk1 n GLY 453 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.13 2qk1 n GLY 453 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qk1 h ARG 454 N 2.99 0.00 -0.39 1.61 3.08 -1.89 -2.84 114.38 116.93 2qk1 h ARG 454 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2qk1 h ARG 454 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 2qk1 h ARG 454 CO 0.00 0.02 0.04 0.09 -1.07 0.00 0.00 179.97 179.06 2qk1 n ASN 455 N -4.05 3.75 0.27 7.04 3.02 -1.26 -4.56 115.26 119.47 2qk1 n ASN 455 Ca -0.03 -3.26 0.14 0.00 -0.03 0.00 0.00 54.58 51.41 2qk1 n ASN 455 Cb 0.11 -0.61 0.78 0.00 -0.61 0.00 0.00 39.78 39.44 2qk1 n ASN 455 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2qk1 h GLU 456 N 1.79 0.00 -0.45 3.52 5.08 -1.66 -1.82 114.58 121.05 2qk1 h GLU 456 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2qk1 h GLU 456 Cb 1.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.96 2qk1 h GLU 456 CO 0.38 0.09 0.00 -0.40 -1.00 0.00 0.00 179.01 178.08 2qk1 n ASP 457 N -3.51 0.29 0.00 1.42 5.75 -1.26 -0.51 116.55 118.74 2qk1 n ASP 457 Ca -0.02 -0.46 0.00 0.00 -0.01 0.00 0.00 54.79 54.30 2qk1 n ASP 457 Cb 0.23 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2qk1 n ASP 457 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2qk1 n LEU 459 N 0.46 0.00 -0.08 -2.12 7.94 -0.69 -2.00 117.00 120.52 2qk1 n LEU 459 Ca 0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.89 2qk1 n LEU 459 Cb 0.07 0.00 0.26 0.00 0.53 0.00 0.00 43.42 44.28 2qk1 n LEU 459 CO 0.00 0.00 1.01 0.11 -1.11 0.00 0.00 177.39 177.40 2qk1 h LYS 460 N 0.00 0.70 -0.45 1.96 1.57 -1.08 -0.23 116.57 119.04 2qk1 h LYS 460 Ca 0.00 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 2qk1 h LYS 460 Cb 0.00 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2qk1 h LYS 460 CO 0.00 0.62 0.11 0.22 -0.57 0.00 0.00 179.45 179.83 2qk1 h ASP 461 N 0.68 0.69 -0.17 0.86 1.82 -1.65 0.04 116.42 118.69 2qk1 h ASP 461 Ca 0.16 -0.24 -0.02 0.00 -0.39 0.00 0.00 57.03 56.55 2qk1 h ASP 461 Cb 0.22 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.05 2qk1 h ASP 461 CO -0.01 0.74 0.04 0.40 -1.61 0.00 0.00 179.24 178.81 2qk1 h ILE 462 N 0.60 1.20 -0.95 2.25 2.04 -1.73 -1.94 117.51 118.98 2qk1 h ILE 462 Ca 0.14 -0.63 0.02 0.00 1.00 0.00 0.00 64.86 65.40 2qk1 h ILE 462 Cb 0.33 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 2qk1 h ILE 462 CO 0.00 0.19 0.63 -0.07 0.00 0.00 0.00 178.15 178.90 2qk1 h LEU 463 N 0.08 1.07 -0.85 1.44 3.38 -0.90 -1.84 115.31 117.69 2qk1 h LEU 463 Ca 0.05 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2qk1 h LEU 463 Cb 0.25 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2qk1 h LEU 463 CO 0.00 0.76 0.12 -0.33 0.09 0.00 0.00 178.44 179.08 2qk1 h GLU 464 N 1.25 0.97 -2.44 1.13 5.08 -0.81 -3.15 114.58 116.62 2qk1 h GLU 464 Ca 0.36 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 58.37 2qk1 h GLU 464 Cb -0.08 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.00 2qk1 h GLU 464 CO -0.09 0.89 0.05 0.72 -1.00 0.00 0.00 179.01 179.58 2qk1 n HIS 465 N -4.24 0.04 0.00 4.33 8.25 -0.69 -2.96 115.22 119.95 2qk1 n HIS 465 Ca 0.04 -0.93 0.00 0.00 -0.26 0.00 0.00 57.72 56.58 2qk1 n HIS 465 Cb 0.26 -1.13 0.00 0.00 1.12 0.00 0.00 29.99 30.24 2qk1 n HIS 465 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qk1 n LYS 467 N 2.75 0.00 -1.70 -0.41 5.02 -1.19 -3.71 118.16 118.92 2qk1 n LYS 467 Ca 0.26 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.18 2qk1 n LYS 467 Cb 0.53 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.61 2qk1 n LYS 467 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2qk1 n HIS 468 N 0.00 1.67 0.20 2.13 -0.00 -1.16 -4.91 115.22 113.15 2qk1 n HIS 468 Ca 0.00 0.42 0.04 0.00 0.46 0.00 0.00 57.72 58.65 2qk1 n HIS 468 Cb 0.00 -2.24 0.41 0.00 -0.12 0.00 0.00 29.99 28.04 2qk1 n HIS 468 CO 0.00 0.00 0.00 1.57 0.46 0.00 0.00 176.34 178.37 2qk1 h LYS 469 N 0.55 0.00 -6.28 1.57 2.10 -1.93 -3.42 116.57 109.16 2qk1 h LYS 469 Ca -0.50 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 57.57 2qk1 h LYS 469 Cb 1.34 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.61 2qk1 h LYS 469 CO 0.53 0.33 0.85 0.99 -2.00 0.00 0.00 179.45 180.14 2qk1 s THR 470 N -4.16 4.51 0.23 0.07 2.01 -1.26 -4.95 115.64 112.09 2qk1 s THR 470 Ca -0.03 1.75 -0.06 0.00 0.31 0.00 0.00 61.69 63.67 2qk1 s THR 470 Cb 0.14 -4.38 0.20 0.00 0.01 0.00 0.00 72.50 68.46 2qk1 s THR 470 CO 0.70 -0.44 1.74 1.55 -0.69 0.00 0.00 174.62 177.48 2qk1 h PRO 471 N 8.07 0.44 -0.93 4.92 0.13 -2.00 -2.03 132.00 140.60 2qk1 h PRO 471 Ca -0.21 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 64.95 2qk1 h PRO 471 Cb 1.06 -0.10 -0.06 0.00 0.13 0.00 0.00 31.00 32.04 2qk1 h PRO 471 CO 1.03 0.29 0.61 0.37 -0.23 0.00 0.00 178.00 180.07 2qk1 h GLN 472 N 0.45 1.08 -0.28 0.86 5.75 -1.91 -2.40 115.11 118.66 2qk1 h GLN 472 Ca 0.38 -0.07 -0.07 0.00 -0.15 0.00 0.00 58.65 58.75 2qk1 h GLN 472 Cb 0.54 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 2qk1 h GLN 472 CO -0.37 0.72 -0.09 0.82 -2.65 0.00 0.00 178.83 177.26 2qk1 h ILE 473 N 1.12 1.29 0.00 2.39 2.04 -1.56 -0.90 117.51 121.88 2qk1 h ILE 473 Ca 0.39 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 65.10 2qk1 h ILE 473 Cb 0.10 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 2qk1 h ILE 473 CO -0.13 0.36 0.00 0.54 0.00 0.00 0.00 178.15 178.92 2qk1 n ARG 474 N -4.48 0.00 0.00 2.37 1.74 -0.91 -0.92 116.66 114.47 2qk1 n ARG 474 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2qk1 n ARG 474 Cb 0.33 -0.96 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 2qk1 n ARG 474 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2qk1 n GLU 476 N 0.29 0.00 0.13 5.56 -0.58 -0.34 -1.44 120.64 124.25 2qk1 n GLU 476 Ca 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.72 2qk1 n GLU 476 Cb 0.00 0.00 0.15 0.00 -0.57 0.00 0.00 31.44 31.02 2qk1 n GLU 476 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qk1 h THR 478 N 0.00 1.32 -0.45 0.00 2.02 -1.45 -1.37 112.91 112.97 2qk1 h THR 478 Ca -0.01 -1.76 -0.08 0.00 0.77 0.00 0.00 66.41 65.33 2qk1 h THR 478 Cb 1.16 1.73 -0.02 0.00 -1.74 0.00 0.00 68.15 69.28 2qk1 h THR 478 CO 0.08 0.55 -0.06 1.56 0.37 0.00 0.00 175.52 178.02 2qk1 h GLN 479 N 0.45 0.78 -0.35 6.66 4.20 -1.74 -0.10 115.11 125.01 2qk1 h GLN 479 Ca 0.01 -0.24 -0.03 0.00 0.06 0.00 0.00 58.65 58.46 2qk1 h GLN 479 Cb 1.07 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 2qk1 h GLN 479 CO 0.10 0.83 0.12 1.25 -0.67 0.00 0.00 178.83 180.46 2qk1 h LEU 480 N 0.72 0.50 -0.71 1.46 5.85 -0.98 -1.60 115.31 120.55 2qk1 h LEU 480 Ca 0.13 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2qk1 h LEU 480 Cb 0.53 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2qk1 h LEU 480 CO 0.03 0.57 0.46 0.15 -0.34 0.00 0.00 178.44 179.30 2qk1 h PHE 481 N 0.42 0.91 -0.86 1.25 3.57 -0.94 -1.88 116.94 119.40 2qk1 h PHE 481 Ca 0.11 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2qk1 h PHE 481 Cb 0.24 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2qk1 h PHE 481 CO 0.01 0.58 0.50 -0.91 -2.23 0.00 0.00 178.31 176.26 2qk1 h ASN 482 N 0.96 1.05 -0.77 0.41 2.35 -0.77 -2.04 115.58 116.77 2qk1 h ASN 482 Ca 0.26 -0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.89 2qk1 h ASN 482 Cb -0.09 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 37.98 2qk1 h ASN 482 CO -0.05 0.82 0.32 0.00 -1.65 0.00 0.00 177.43 176.87 2qk1 h ALA 483 N 1.35 1.00 0.00 -0.83 0.00 -0.70 -1.05 119.26 119.03 2qk1 h ALA 483 Ca 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qk1 h ALA 483 Cb -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.47 2qk1 h ALA 483 CO -0.05 0.61 0.00 0.43 0.00 0.00 0.00 179.25 180.24 2qk1 n SER 484 N -4.32 0.34 0.00 0.00 7.64 -0.76 -0.97 113.62 115.55 2qk1 n SER 484 Ca 0.07 -0.31 0.00 0.00 1.01 0.00 0.00 58.87 59.64 2qk1 n SER 484 Cb 0.17 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2qk1 n SER 484 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2qk1 n LYS 486 N 0.72 0.00 0.21 1.43 5.02 -0.40 -1.89 118.16 123.25 2qk1 n LYS 486 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2qk1 n LYS 486 Cb 0.06 0.00 0.30 0.00 -0.02 0.00 0.00 35.03 35.37 2qk1 n LYS 486 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2qk1 h GLU 487 N 0.00 0.00 -6.34 1.97 4.39 -1.31 -3.46 114.58 109.83 2qk1 h GLU 487 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2qk1 h GLU 487 Cb 0.00 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2qk1 h GLU 487 CO 0.00 0.00 1.23 -2.00 -1.16 0.00 0.00 179.01 177.08 2qk1 s GLU 488 N -3.26 4.11 0.00 2.33 2.56 -0.79 -4.80 118.70 118.85 2qk1 s GLU 488 Ca 0.07 2.56 0.00 0.00 0.00 0.00 0.00 54.97 57.60 2qk1 s GLU 488 Cb 0.07 -4.16 0.00 0.00 2.00 0.00 0.00 34.13 32.04 2qk1 s GLU 488 CO 0.63 -0.99 0.52 1.63 -0.56 0.00 0.00 175.26 176.50 2qk1 n LYS 489 N 7.56 0.26 -0.75 4.30 4.76 -1.26 -4.85 118.16 128.18 2qk1 n LYS 489 Ca 0.20 -0.57 0.03 0.00 -2.87 0.00 0.00 58.31 55.10 2qk1 n LYS 489 Cb 0.41 -0.55 0.19 0.00 -1.84 0.00 0.00 35.03 33.25 2qk1 n LYS 489 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2qk1 n ASP 490 N -0.04 2.00 0.00 4.39 8.00 -1.26 -5.05 116.55 124.58 2qk1 n ASP 490 Ca 0.00 -3.86 0.00 0.00 0.71 0.00 0.00 54.79 51.64 2qk1 n ASP 490 Cb 0.47 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 2qk1 n ASP 490 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qk1 n GLY 491 N -1.06 3.60 0.95 0.44 0.00 -1.26 -4.61 105.19 103.26 2qk1 n GLY 491 Ca 0.21 -1.28 0.10 0.00 0.00 0.00 0.00 46.02 45.06 2qk1 n GLY 491 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qk1 n TYR 492 N 0.37 0.29 -0.19 1.61 4.01 -1.26 -4.65 117.16 117.33 2qk1 n TYR 492 Ca 0.00 -0.17 -0.00 0.00 -0.16 0.00 0.00 57.90 57.57 2qk1 n TYR 492 Cb 0.00 -0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.13 2qk1 n TYR 492 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2qk1 h SER 493 N 3.98 0.15 -0.39 7.72 4.64 -1.93 0.11 113.55 127.83 2qk1 h SER 493 Ca 0.00 0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 2qk1 h SER 493 Cb 0.89 0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 2qk1 h SER 493 CO 0.00 0.10 -0.08 0.74 -0.87 0.00 0.00 176.83 176.72 2qk1 h THR 494 N 0.36 1.27 -0.77 2.95 2.02 -1.83 -2.09 112.91 114.82 2qk1 h THR 494 Ca 0.30 -1.15 0.04 0.00 0.77 0.00 0.00 66.41 66.37 2qk1 h THR 494 Cb 0.39 1.23 -0.05 0.00 -1.74 0.00 0.00 68.15 67.97 2qk1 h THR 494 CO -0.32 0.38 0.48 0.25 0.37 0.00 0.00 175.52 176.68 2qk1 h LEU 495 N 0.55 0.77 -1.03 2.58 5.85 -1.65 -2.03 115.31 120.35 2qk1 h LEU 495 Ca 0.10 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2qk1 h LEU 495 Cb 0.59 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2qk1 h LEU 495 CO 0.04 0.52 0.14 -0.61 -0.34 0.00 0.00 178.44 178.18 2qk1 h GLN 496 N 0.91 0.84 -0.18 1.25 4.15 -0.74 0.26 115.11 121.59 2qk1 h GLN 496 Ca 0.32 -0.17 -0.04 0.00 0.77 0.00 0.00 58.65 59.53 2qk1 h GLN 496 Cb 0.07 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 2qk1 h GLN 496 CO -0.13 0.75 -0.08 0.00 -1.93 0.00 0.00 178.83 177.43 2qk1 h ARG 497 N 0.81 0.28 0.00 1.69 3.08 -0.68 -2.60 114.38 116.96 2qk1 h ARG 497 Ca 0.18 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2qk1 h ARG 497 Cb 0.28 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.29 2qk1 h ARG 497 CO -0.00 0.38 -0.74 0.66 -1.07 0.00 0.00 179.97 179.21 2qk1 n TYR 498 N -4.30 0.21 0.00 3.04 4.02 -0.91 -4.71 117.16 114.52 2qk1 n TYR 498 Ca -0.00 0.06 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 2qk1 n TYR 498 Cb 0.25 -0.39 0.00 0.00 -0.02 0.00 0.00 39.34 39.18 2qk1 n TYR 498 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 2qk1 n LEU 499 N -1.79 0.00 -0.00 7.72 7.94 0.03 -0.89 117.00 130.01 2qk1 n LEU 499 Ca 0.04 0.91 -0.11 0.00 -1.11 0.00 0.00 56.01 55.74 2qk1 n LEU 499 Cb 0.39 -0.41 0.02 0.00 0.53 0.00 0.00 43.42 43.95 2qk1 n LEU 499 CO 0.38 -0.41 0.42 0.11 -1.11 0.00 0.00 177.39 176.78 2qk1 h LYS 500 N 0.00 0.60 0.00 1.96 1.79 -1.84 0.93 116.57 120.01 2qk1 h LYS 500 Ca 0.00 -0.41 -0.14 0.00 -2.18 0.00 0.00 60.65 57.92 2qk1 h LYS 500 Cb 0.00 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.69 2qk1 h LYS 500 CO 0.00 1.03 -1.08 -0.44 -1.08 0.00 0.00 179.45 177.88 2qk1 h ASP 501 N 0.44 0.00 0.00 0.86 3.32 -1.84 -3.40 116.42 115.80 2qk1 h ASP 501 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2qk1 h ASP 501 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2qk1 h ASP 501 CO 0.12 0.55 -0.90 -0.62 -1.72 0.00 0.00 179.24 176.67 2qk1 n GLU 502 N -3.02 0.00 0.07 3.56 -0.58 -0.55 -4.81 120.64 115.32 2qk1 n GLU 502 Ca -0.05 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.59 2qk1 n GLU 502 Cb 0.80 -0.61 -0.07 0.00 -0.57 0.00 0.00 31.44 30.99 2qk1 n GLU 502 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2qk1 h VAL 503 N 0.00 0.73 -0.62 2.62 2.07 -0.83 -3.29 116.25 116.93 2qk1 h VAL 503 Ca 0.00 -1.05 0.09 0.00 0.82 0.00 0.00 66.70 66.56 2qk1 h VAL 503 Cb 0.90 1.23 -0.07 0.00 -1.52 0.00 0.00 31.29 31.83 2qk1 h VAL 503 CO 0.00 0.19 0.26 0.58 0.02 0.00 0.00 177.57 178.61 2qk1 h VAL 504 N -0.89 0.81 -0.79 2.57 2.07 -1.04 -0.68 116.25 118.30 2qk1 h VAL 504 Ca -0.03 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.41 2qk1 h VAL 504 Cb 0.51 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 2qk1 h VAL 504 CO 0.04 0.08 0.52 -0.65 0.02 0.00 0.00 177.57 177.58 2qk1 h PRO 505 N 0.46 0.79 -0.06 1.57 0.11 -1.78 0.42 132.00 133.52 2qk1 h PRO 505 Ca 0.31 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.23 2qk1 h PRO 505 Cb 0.35 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.29 2qk1 h PRO 505 CO -0.28 0.52 -0.52 0.82 -0.21 0.00 0.00 178.00 178.34 2qk1 h ILE 506 N 0.82 1.40 -0.60 4.15 2.04 -1.41 -2.92 117.51 120.99 2qk1 h ILE 506 Ca 0.35 -1.91 0.00 0.00 1.00 0.00 0.00 64.86 64.29 2qk1 h ILE 506 Cb 0.30 2.38 -0.03 0.00 -0.74 0.00 0.00 36.82 38.73 2qk1 h ILE 506 CO -0.13 0.56 0.37 0.58 0.00 0.00 0.00 178.15 179.54 2qk1 h VAL 507 N -0.01 1.16 -0.77 1.67 2.07 -0.66 -0.83 116.25 118.88 2qk1 h VAL 507 Ca -0.05 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 2qk1 h VAL 507 Cb 1.19 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2qk1 h VAL 507 CO 0.10 0.16 0.41 0.40 0.02 0.00 0.00 177.57 178.67 2qk1 h ILE 508 N 0.82 1.23 -0.59 4.57 2.04 -0.92 0.64 117.51 125.31 2qk1 h ILE 508 Ca 0.22 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 2qk1 h ILE 508 Cb -0.06 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.21 2qk1 h ILE 508 CO -0.04 0.26 0.10 1.56 0.00 0.00 0.00 178.15 180.03 2qk1 h GLN 509 N 1.07 0.94 -0.23 2.37 4.20 -1.00 -1.46 115.11 121.01 2qk1 h GLN 509 Ca 0.27 -0.23 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 2qk1 h GLN 509 Cb 0.05 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 2qk1 h GLN 509 CO -0.04 0.87 -0.03 0.82 -0.67 0.00 0.00 178.83 179.78 2qk1 h ILE 510 N 0.89 1.27 -0.13 2.54 1.08 -0.64 -2.56 117.51 119.98 2qk1 h ILE 510 Ca 0.18 -0.98 -0.01 0.00 -0.39 0.00 0.00 64.86 63.67 2qk1 h ILE 510 Cb 0.39 1.46 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 2qk1 h ILE 510 CO 0.01 0.30 0.04 0.58 -0.69 0.00 0.00 178.15 178.39 2qk1 h VAL 511 N 0.17 1.06 -0.36 1.67 2.07 -0.69 -1.96 116.25 118.21 2qk1 h VAL 511 Ca 0.06 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2qk1 h VAL 511 Cb 0.46 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2qk1 h VAL 511 CO 0.02 0.07 0.00 0.59 0.02 0.00 0.00 177.57 178.27 2qk1 n ASN 512 N -4.47 2.49 -4.73 0.57 3.02 -0.57 -4.77 115.26 106.80 2qk1 n ASN 512 Ca -0.01 -1.90 -0.36 0.00 -0.03 0.00 0.00 54.58 52.27 2qk1 n ASN 512 Cb 0.12 -0.24 0.07 0.00 -0.61 0.00 0.00 39.78 39.12 2qk1 n ASN 512 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qk1 s ASP 513 N -1.30 4.60 0.44 6.41 -1.08 -0.74 -4.91 116.67 120.09 2qk1 s ASP 513 Ca 0.34 2.53 0.24 0.00 -0.52 0.00 0.00 52.55 55.14 2qk1 s ASP 513 Cb 0.18 -2.61 0.71 0.00 -1.46 0.00 0.00 42.92 39.75 2qk1 s ASP 513 CO 0.26 -2.00 1.74 0.71 0.52 0.00 0.00 175.17 176.39 2qk1 h THR 514 N 0.42 0.33 -3.34 1.71 1.35 -1.91 -3.44 112.91 108.03 2qk1 h THR 514 Ca -0.50 -1.15 -0.58 0.00 -0.55 0.00 0.00 66.41 63.64 2qk1 h THR 514 Cb 1.32 1.89 -0.07 0.00 -1.73 0.00 0.00 68.15 69.56 2qk1 h THR 514 CO 0.53 0.16 0.28 -1.10 -0.25 0.00 0.00 175.52 175.14 2qk1 s GLN 515 N -3.41 4.32 0.36 4.72 -1.52 -1.26 -4.97 119.66 117.90 2qk1 s GLN 515 Ca 0.03 0.94 0.03 0.00 -1.95 0.00 0.00 55.36 54.41 2qk1 s GLN 515 Cb 0.08 -3.54 0.68 0.00 -0.22 0.00 0.00 33.01 30.00 2qk1 s GLN 515 CO 0.64 -0.22 2.02 -1.00 -0.25 0.00 0.00 175.29 176.48 2qk1 h PRO 516 N 7.22 0.78 -0.69 2.91 0.13 -2.00 -1.77 132.00 138.59 2qk1 h PRO 516 Ca -0.32 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.71 2qk1 h PRO 516 Cb 1.15 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 32.07 2qk1 h PRO 516 CO 0.81 0.52 0.24 0.00 -0.23 0.00 0.00 178.00 179.33 2qk1 h ALA 517 N 1.63 1.13 -0.18 -0.56 0.00 -1.97 -1.18 119.26 118.12 2qk1 h ALA 517 Ca 0.22 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2qk1 h ALA 517 Cb -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2qk1 h ALA 517 CO -0.05 0.61 -0.42 0.82 0.00 0.00 0.00 179.25 180.21 2qk1 h ILE 518 N 1.00 1.33 -0.85 0.00 2.04 -1.80 -3.10 117.51 116.13 2qk1 h ILE 518 Ca 0.23 -1.67 0.06 0.00 1.00 0.00 0.00 64.86 64.48 2qk1 h ILE 518 Cb 0.25 1.93 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 2qk1 h ILE 518 CO -0.01 0.51 0.53 0.03 0.00 0.00 0.00 178.15 179.21 2qk1 h ARG 519 N 0.27 0.95 -0.74 2.37 3.08 -1.05 -1.88 114.38 117.37 2qk1 h ARG 519 Ca -0.00 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.05 2qk1 h ARG 519 Cb 1.03 -0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.81 2qk1 h ARG 519 CO 0.09 0.63 0.43 1.15 -1.07 0.00 0.00 179.97 181.20 2qk1 h THR 520 N 0.98 0.99 -0.41 2.04 2.02 -1.19 0.83 112.91 118.17 2qk1 h THR 520 Ca 0.37 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 67.20 2qk1 h THR 520 Cb 0.16 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.68 2qk1 h THR 520 CO -0.17 0.14 -0.09 0.40 0.37 0.00 0.00 175.52 176.18 2qk1 h ILE 521 N 0.79 1.25 -0.57 3.11 1.08 -1.35 -2.25 117.51 119.56 2qk1 h ILE 521 Ca 0.33 -1.10 -0.08 0.00 -0.39 0.00 0.00 64.86 63.62 2qk1 h ILE 521 Cb 0.19 1.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.95 2qk1 h ILE 521 CO -0.18 0.38 0.04 1.23 -0.69 0.00 0.00 178.15 178.93 2qk1 h GLY 522 N 0.97 1.03 1.31 5.37 0.00 -0.37 -1.21 103.07 110.16 2qk1 h GLY 522 Ca 0.12 -0.70 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 2qk1 h GLY 522 CO 0.03 0.64 0.09 0.74 0.00 0.00 0.00 176.54 178.05 2qk1 h PHE 523 N 0.89 0.90 -0.54 5.60 0.04 -0.55 -1.82 116.94 121.47 2qk1 h PHE 523 Ca 0.17 -0.10 -0.04 0.00 2.80 0.00 0.00 57.97 60.80 2qk1 h PHE 523 Cb 0.46 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 2qk1 h PHE 523 CO 0.03 0.77 0.18 1.49 -0.60 0.00 0.00 178.31 180.18 2qk1 h GLU 524 N 0.82 0.83 -0.32 1.51 4.81 -0.99 -0.52 114.58 120.74 2qk1 h GLU 524 Ca 0.17 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2qk1 h GLU 524 Cb 0.36 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2qk1 h GLU 524 CO 0.01 0.76 0.20 0.77 -0.73 0.00 0.00 179.01 180.02 2qk1 h SER 525 N 0.75 0.34 -0.40 1.04 0.02 -0.72 -0.53 113.55 114.06 2qk1 h SER 525 Ca 0.18 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.01 2qk1 h SER 525 Cb 0.26 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2qk1 h SER 525 CO -0.01 0.25 -0.16 0.15 -1.14 0.00 0.00 176.83 175.92 2qk1 h PHE 526 N 0.41 0.98 -0.49 3.45 -0.00 -1.18 -1.62 116.94 118.50 2qk1 h PHE 526 Ca 0.12 -0.21 -0.03 0.00 -0.00 0.00 0.00 57.97 57.86 2qk1 h PHE 526 Cb -0.03 -0.24 -0.02 0.00 -0.00 0.00 0.00 35.95 35.66 2qk1 h PHE 526 CO -0.06 0.96 0.21 0.00 -0.00 0.00 0.00 178.31 179.42 2qk1 h ALA 527 N 1.04 0.63 -0.54 2.41 0.00 -0.80 -0.77 119.26 121.22 2qk1 h ALA 527 Ca 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2qk1 h ALA 527 Cb 0.69 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2qk1 h ALA 527 CO 0.05 0.23 0.31 0.82 0.00 0.00 0.00 179.25 180.66 2qk1 h ILE 528 N 0.64 1.17 -0.62 0.00 2.04 -0.94 -1.30 117.51 118.51 2qk1 h ILE 528 Ca 0.16 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 2qk1 h ILE 528 Cb 0.17 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2qk1 h ILE 528 CO -0.02 0.18 0.33 -0.07 0.00 0.00 0.00 178.15 178.57 2qk1 h LEU 529 N 0.72 0.76 -0.45 1.44 3.38 -0.91 -1.60 115.31 118.66 2qk1 h LEU 529 Ca 0.19 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.94 2qk1 h LEU 529 Cb 0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2qk1 h LEU 529 CO -0.03 0.62 -0.42 0.40 0.09 0.00 0.00 178.44 179.10 2qk1 h ILE 530 N 0.86 1.28 0.00 1.22 2.04 -0.66 -0.53 117.51 121.73 2qk1 h ILE 530 Ca 0.22 -1.60 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 2qk1 h ILE 530 Cb 0.04 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2qk1 h ILE 530 CO -0.03 0.53 -0.27 0.11 0.00 0.00 0.00 178.15 178.48 2qk1 h LYS 531 N 0.66 0.00 0.00 2.37 1.79 -0.71 0.26 116.57 120.94 2qk1 h LYS 531 Ca 0.05 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.49 2qk1 h LYS 531 Cb 1.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.64 2qk1 h LYS 531 CO 0.10 0.27 -0.20 0.82 -1.08 0.00 0.00 179.45 179.36 2qk1 h ILE 532 N 0.00 0.83 0.00 1.86 2.04 -1.06 -3.41 117.51 117.77 2qk1 h ILE 532 Ca -0.00 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.18 2qk1 h ILE 532 Cb 0.56 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 2qk1 h ILE 532 CO 0.04 0.28 -1.13 0.49 0.00 0.00 0.00 178.15 177.82 2qk1 n PHE 533 N -4.66 0.03 -0.50 1.37 3.72 -0.23 -5.11 117.46 112.09 2qk1 n PHE 533 Ca -0.08 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 2qk1 n PHE 533 Cb 0.30 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2qk1 n PHE 533 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qk1 n GLY 534 N 1.44 0.98 3.72 1.37 0.00 0.92 -4.71 105.19 108.90 2qk1 n GLY 534 Ca 0.03 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2qk1 n GLY 534 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qk1 n ASN 536 N 0.49 0.00 0.18 1.61 3.02 -1.26 -4.38 115.26 114.92 2qk1 n ASN 536 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.68 2qk1 n ASN 536 Cb 0.00 0.00 0.61 0.00 -0.61 0.00 0.00 39.78 39.78 2qk1 n ASN 536 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qk1 h THR 537 N 0.00 0.00 -0.27 3.41 1.03 -2.00 -2.65 112.91 112.43 2qk1 h THR 537 Ca 0.00 -0.19 0.00 0.00 -0.01 0.00 0.00 66.41 66.21 2qk1 h THR 537 Cb 0.00 0.91 0.00 0.00 -1.07 0.00 0.00 68.15 67.99 2qk1 h THR 537 CO 0.00 0.00 0.00 0.49 -0.01 0.00 0.00 175.52 176.00 2qk1 n PHE 538 N -2.45 0.35 -0.16 0.00 3.72 -1.26 -4.70 117.46 112.96 2qk1 n PHE 538 Ca 0.00 -0.32 -0.02 0.00 -0.05 0.00 0.00 57.45 57.06 2qk1 n PHE 538 Cb 0.17 -0.01 0.05 0.00 -0.94 0.00 0.00 39.48 38.74 2qk1 n PHE 538 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 2qk1 h VAL 539 N 2.42 0.52 -0.36 -4.37 3.04 -1.85 0.62 116.25 116.28 2qk1 h VAL 539 Ca 0.00 -0.01 0.04 0.00 -1.01 0.00 0.00 66.70 65.72 2qk1 h VAL 539 Cb 0.69 0.49 -0.04 0.00 -2.01 0.00 0.00 31.29 30.41 2qk1 h VAL 539 CO 0.00 0.01 0.12 0.50 -1.01 0.00 0.00 177.57 177.19 2qk1 h LYS 540 N 0.03 0.26 -0.24 4.17 3.64 -1.84 0.79 116.57 123.39 2qk1 h LYS 540 Ca 0.25 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 2qk1 h LYS 540 Cb 0.38 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2qk1 h LYS 540 CO -0.49 0.17 0.07 1.15 -2.27 0.00 0.00 179.45 178.07 2qk1 h THR 541 N 0.27 1.20 -0.82 1.00 2.02 -1.71 -2.88 112.91 112.00 2qk1 h THR 541 Ca 0.17 -0.65 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 2qk1 h THR 541 Cb 0.15 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 2qk1 h THR 541 CO -0.18 0.21 0.43 -0.07 0.37 0.00 0.00 175.52 176.28 2qk1 h LEU 542 N 0.21 1.03 -1.56 2.58 3.38 -0.60 -2.03 115.31 118.32 2qk1 h LEU 542 Ca 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qk1 h LEU 542 Cb 0.26 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2qk1 h LEU 542 CO -0.00 0.84 0.00 -0.33 0.09 0.00 0.00 178.44 179.04 2qk1 h GLU 543 N 1.15 0.00 0.00 1.13 4.39 -0.75 -2.79 114.58 117.70 2qk1 h GLU 543 Ca 0.29 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.89 2qk1 h GLU 543 Cb 0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2qk1 h GLU 543 CO -0.04 0.00 -1.10 1.25 -1.16 0.00 0.00 179.01 177.96 2qk1 h HIS 544 N 0.00 0.00 -3.95 4.33 2.76 -1.15 -3.47 115.15 113.66 2qk1 h HIS 544 Ca 0.00 0.00 -0.47 0.00 -2.20 0.00 0.00 60.37 57.70 2qk1 h HIS 544 Cb 0.40 0.00 0.16 0.00 1.55 0.00 0.00 27.41 29.52 2qk1 h HIS 544 CO 0.00 0.34 0.21 -0.51 -1.30 0.00 0.00 177.93 176.67 2qk1 s LEU 545 N -5.73 1.99 0.42 0.26 1.43 -1.05 -4.96 118.68 111.04 2qk1 s LEU 545 Ca -0.01 1.47 -0.25 0.00 -1.03 0.00 0.00 54.13 54.31 2qk1 s LEU 545 Cb 0.09 -3.78 -0.08 0.00 0.03 0.00 0.00 46.19 42.44 2qk1 s LEU 545 CO 0.79 -2.95 1.29 -1.81 0.23 0.00 0.00 176.35 173.90 2qk1 s ASP 546 N -3.28 6.21 0.26 2.29 1.01 -1.26 -4.83 116.67 117.08 2qk1 s ASP 546 Ca 0.65 2.63 -0.01 0.00 0.71 0.00 0.00 52.55 56.52 2qk1 s ASP 546 Cb -0.19 -2.63 0.56 0.00 1.01 0.00 0.00 42.92 41.66 2qk1 s ASP 546 CO 0.58 -0.91 1.71 -1.13 0.21 0.00 0.00 175.17 175.63 2qk1 h ASN 547 N 2.52 0.25 -0.52 0.27 -1.24 -1.92 -1.69 115.58 113.25 2qk1 h ASN 547 Ca -0.50 0.13 0.01 0.00 0.71 0.00 0.00 56.30 56.66 2qk1 h ASN 547 Cb 1.25 0.12 -0.03 0.00 0.73 0.00 0.00 38.32 40.40 2qk1 h ASN 547 CO 0.62 0.05 0.33 0.25 -1.29 0.00 0.00 177.43 177.38 2qk1 h LEU 548 N 0.40 0.56 -0.80 0.34 6.46 -2.00 -2.02 115.31 118.26 2qk1 h LEU 548 Ca 0.47 -0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 58.13 2qk1 h LEU 548 Cb 0.80 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.58 2qk1 h LEU 548 CO -0.47 0.40 -0.10 0.11 -0.62 0.00 0.00 178.44 177.76 2qk1 h LYS 549 N 0.67 0.80 -0.31 1.25 1.57 -1.70 -1.21 116.57 117.63 2qk1 h LYS 549 Ca 0.20 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qk1 h LYS 549 Cb -0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2qk1 h LYS 549 CO -0.06 0.87 0.18 -0.09 -0.57 0.00 0.00 179.45 179.78 2qk1 h ARG 550 N 0.73 0.43 -0.54 3.15 2.43 -1.08 -1.30 114.38 118.20 2qk1 h ARG 550 Ca 0.12 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 2qk1 h ARG 550 Cb 0.58 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 2qk1 h ARG 550 CO 0.04 0.36 0.18 0.87 -1.51 0.00 0.00 179.97 179.90 2qk1 h LYS 551 N 0.39 0.79 -0.65 0.20 1.57 -1.14 -1.70 116.57 116.02 2qk1 h LYS 551 Ca 0.11 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 2qk1 h LYS 551 Cb 0.05 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2qk1 h LYS 551 CO -0.02 0.68 0.25 -0.22 -0.57 0.00 0.00 179.45 179.57 2qk1 h LYS 552 N 0.78 0.99 -0.33 3.15 1.63 -0.74 -1.42 116.57 120.63 2qk1 h LYS 552 Ca 0.18 -0.19 -0.04 0.00 -0.85 0.00 0.00 60.65 59.75 2qk1 h LYS 552 Cb 0.21 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 2qk1 h LYS 552 CO -0.01 0.84 0.04 0.82 -3.45 0.00 0.00 179.45 177.69 2qk1 h ILE 553 N 0.93 1.24 -0.86 2.00 2.04 -0.77 -1.15 117.51 120.93 2qk1 h ILE 553 Ca 0.22 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 65.23 2qk1 h ILE 553 Cb 0.23 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.43 2qk1 h ILE 553 CO -0.02 0.28 0.55 -0.33 0.00 0.00 0.00 178.15 178.64 2qk1 h GLU 554 N 0.38 1.15 -0.50 2.37 5.08 -1.16 -0.68 114.58 121.21 2qk1 h GLU 554 Ca 0.10 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2qk1 h GLU 554 Cb 0.37 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2qk1 h GLU 554 CO 0.01 0.78 -0.01 1.49 -1.00 0.00 0.00 179.01 180.28 2qk1 h GLU 555 N 1.18 0.85 -0.11 2.33 4.57 -1.10 -2.67 114.58 119.62 2qk1 h GLU 555 Ca 0.31 -0.24 -0.10 0.00 -1.18 0.00 0.00 59.36 58.15 2qk1 h GLU 555 Cb -0.10 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.39 2qk1 h GLU 555 CO -0.06 0.86 -0.39 1.15 -1.18 0.00 0.00 179.01 179.39 2qk1 h THR 556 N 0.79 1.30 -0.31 0.32 2.02 -0.44 -2.29 112.91 114.30 2qk1 h THR 556 Ca 0.15 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.87 2qk1 h THR 556 Cb 0.49 1.64 -0.02 0.00 -1.74 0.00 0.00 68.15 68.52 2qk1 h THR 556 CO 0.02 0.44 0.20 0.58 0.37 0.00 0.00 175.52 177.13 2qk1 h VAL 557 N 0.21 1.08 0.10 3.16 2.07 -0.79 -2.02 116.25 120.05 2qk1 h VAL 557 Ca 0.02 -0.14 -0.28 0.00 0.82 0.00 0.00 66.70 67.12 2qk1 h VAL 557 Cb 0.78 0.63 0.02 0.00 -1.52 0.00 0.00 31.29 31.20 2qk1 h VAL 557 CO 0.06 0.08 -1.19 0.11 0.02 0.00 0.00 177.57 176.65 2qk1 h LYS 558 N 0.42 0.51 0.00 1.57 1.57 -1.38 -3.50 116.57 115.75 2qk1 h LYS 558 Ca 0.11 -0.68 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2qk1 h LYS 558 Cb -0.05 0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2qk1 h LYS 558 CO -0.02 1.29 0.00 2.41 -0.57 0.00 0.00 179.45 182.56