#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gkw h THR 314 N 0.00 0.20 0.14 5.53 1.35 -2.04 0.60 112.91 118.69 2gkw h THR 314 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2gkw h THR 314 Cb 0.00 0.48 -0.01 0.00 -1.73 0.00 0.00 68.15 66.88 2gkw h THR 314 CO 0.00 0.00 -0.14 1.23 -0.25 0.00 0.00 175.52 176.36 2gkw h GLY 315 N 0.00 -0.30 0.84 5.82 0.00 -2.04 1.37 103.07 108.76 2gkw h GLY 315 Ca 0.21 0.16 0.02 0.00 0.00 0.00 0.00 47.33 47.72 2gkw h GLY 315 CO -0.00 -0.14 0.11 1.41 0.00 0.00 0.00 176.54 177.91 2gkw h LEU 316 N -0.31 0.15 -0.10 3.11 4.07 -0.23 0.99 115.31 122.98 2gkw h LEU 316 Ca 0.00 0.02 0.02 0.00 0.08 0.00 0.00 57.88 58.00 2gkw h LEU 316 Cb 0.30 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 2gkw h LEU 316 CO -0.04 0.12 -0.02 -0.07 -1.08 0.00 0.00 178.44 177.35 2gkw h LEU 317 N 0.24 -0.09 -1.00 1.67 -0.00 -0.99 -0.32 115.31 114.83 2gkw h LEU 317 Ca 0.11 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 58.02 2gkw h LEU 317 Cb 0.05 0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 40.73 2gkw h LEU 317 CO -0.09 -0.03 0.58 -0.33 -0.00 0.00 0.00 178.44 178.57 2gkw h GLU 318 N 0.00 1.27 0.07 1.13 5.08 0.23 0.19 114.58 122.54 2gkw h GLU 318 Ca 0.05 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2gkw h GLU 318 Cb 0.07 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.05 2gkw h GLU 318 CO -0.10 0.87 -0.03 0.77 -1.00 0.00 0.00 179.01 179.52 2gkw h SER 319 N 1.29 -0.07 -0.26 1.42 0.02 0.16 0.30 113.55 116.40 2gkw h SER 319 Ca 0.34 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.26 2gkw h SER 319 Cb -0.08 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 2gkw h SER 319 CO -0.07 -0.00 0.10 1.56 -1.14 0.00 0.00 176.83 177.29 2gkw h GLN 320 N -0.14 0.22 -0.25 3.45 1.08 -0.62 0.12 115.11 118.96 2gkw h GLN 320 Ca -0.01 -0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.23 2gkw h GLN 320 Cb 0.12 -0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.45 2gkw h GLN 320 CO 0.01 0.15 -0.06 -0.07 -0.95 0.00 0.00 178.83 177.91 2gkw h LEU 321 N 0.23 -0.24 -0.39 1.46 3.38 -0.31 -0.09 115.31 119.35 2gkw h LEU 321 Ca 0.11 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.23 2gkw h LEU 321 Cb 0.06 0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 2gkw h LEU 321 CO -0.10 -0.09 -0.08 -1.28 0.09 0.00 0.00 178.44 176.99 2gkw h SER 322 N -0.00 -0.32 -0.07 -0.43 0.87 0.19 -0.35 113.55 113.43 2gkw h SER 322 Ca 0.12 0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.81 2gkw h SER 322 Cb 0.19 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.35 2gkw h SER 322 CO -0.26 -0.11 -0.04 -0.09 -0.53 0.00 0.00 176.83 175.79 2gkw h ARG 323 N 0.02 -0.04 -0.77 2.24 2.43 0.13 -2.23 114.38 116.16 2gkw h ARG 323 Ca 0.19 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.44 2gkw h ARG 323 Cb 0.28 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.78 2gkw h ARG 323 CO -0.38 -0.03 0.43 0.45 -1.51 0.00 0.00 179.97 178.93 2gkw h HIS 324 N -0.04 0.79 -0.53 2.20 3.86 -0.41 -1.76 115.15 119.26 2gkw h HIS 324 Ca 0.04 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.30 2gkw h HIS 324 Cb 0.10 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.30 2gkw h HIS 324 CO -0.15 0.35 0.32 0.22 0.86 0.00 0.00 177.93 179.53 2gkw h ASP 325 N 0.76 0.52 -0.60 2.45 1.82 -0.76 0.10 116.42 120.71 2gkw h ASP 325 Ca 0.36 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 57.01 2gkw h ASP 325 Cb 0.28 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.15 2gkw h ASP 325 CO -0.22 0.37 0.39 1.56 -1.61 0.00 0.00 179.24 179.73 2gkw h GLN 326 N 0.63 0.77 -0.08 0.28 4.20 -0.78 -1.33 115.11 118.80 2gkw h GLN 326 Ca 0.21 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.88 2gkw h GLN 326 Cb 0.02 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2gkw h GLN 326 CO -0.09 0.51 0.02 1.98 -0.67 0.00 0.00 178.83 180.58 2gkw h MET 327 N 0.79 0.06 -0.74 1.46 4.05 -0.54 -1.35 114.93 118.66 2gkw h MET 327 Ca 0.23 -0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.71 2gkw h MET 327 Cb -0.06 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.68 2gkw h MET 327 CO -0.06 0.04 0.48 -0.07 0.23 0.00 0.00 176.91 177.53 2gkw h LEU 328 N 0.06 0.66 -0.02 3.39 3.38 -0.47 0.25 115.31 122.55 2gkw h LEU 328 Ca 0.03 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2gkw h LEU 328 Cb 0.02 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2gkw h LEU 328 CO -0.04 0.42 0.01 0.28 0.09 0.00 0.00 178.44 179.20 2gkw h SER 329 N 0.75 0.03 -0.28 -0.43 0.02 -0.56 -0.75 113.55 112.33 2gkw h SER 329 Ca 0.32 -0.17 0.04 0.00 -0.84 0.00 0.00 61.79 61.14 2gkw h SER 329 Cb 0.29 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 2gkw h SER 329 CO -0.11 0.20 0.07 0.58 -1.14 0.00 0.00 176.83 176.42 2gkw h VAL 330 N -0.13 0.88 -0.76 2.27 2.07 -0.26 -1.80 116.25 118.52 2gkw h VAL 330 Ca 0.01 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 67.59 2gkw h VAL 330 Cb 0.17 0.69 -0.08 0.00 -1.52 0.00 0.00 31.29 30.55 2gkw h VAL 330 CO -0.00 0.03 0.36 0.45 0.02 0.00 0.00 177.57 178.43 2gkw h HIS 331 N 0.17 0.64 -0.69 1.57 -0.00 -0.28 0.24 115.15 116.80 2gkw h HIS 331 Ca 0.13 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.50 2gkw h HIS 331 Cb 0.12 -0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 27.33 2gkw h HIS 331 CO -0.16 0.17 0.32 -0.44 -0.00 0.00 0.00 177.93 177.83 2gkw h ASP 332 N 0.57 0.90 -0.04 2.45 3.32 -0.33 0.23 116.42 123.51 2gkw h ASP 332 Ca 0.40 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 2gkw h ASP 332 Cb 0.52 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 2gkw h ASP 332 CO -0.33 0.77 -0.04 0.40 -1.72 0.00 0.00 179.24 178.32 2gkw h ILE 333 N 0.98 1.37 -0.47 0.35 2.04 -0.53 -1.50 117.51 119.75 2gkw h ILE 333 Ca 0.24 -1.15 0.10 0.00 1.00 0.00 0.00 64.86 65.05 2gkw h ILE 333 Cb 0.12 2.05 -0.10 0.00 -0.74 0.00 0.00 36.82 38.15 2gkw h ILE 333 CO -0.03 0.31 -0.19 0.03 0.00 0.00 0.00 178.15 178.27 2gkw h ARG 334 N -0.34 -0.09 0.17 2.37 2.47 -0.07 0.16 114.38 119.05 2gkw h ARG 334 Ca 0.01 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2gkw h ARG 334 Cb 0.52 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.84 2gkw h ARG 334 CO 0.01 -0.06 -0.18 -0.07 0.56 0.00 0.00 179.97 180.24 2gkw h LEU 335 N -0.09 -0.47 -0.58 3.04 3.38 -0.51 -2.24 115.31 117.84 2gkw h LEU 335 Ca 0.22 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.30 2gkw h LEU 335 Cb 0.44 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 2gkw h LEU 335 CO -0.53 -0.26 0.27 0.00 0.09 0.00 0.00 178.44 178.01 2gkw h ALA 336 N 0.40 0.75 -0.41 1.53 0.00 -0.68 0.27 119.26 121.12 2gkw h ALA 336 Ca 0.00 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.06 2gkw h ALA 336 Cb 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2gkw h ALA 336 CO -0.05 -0.10 0.29 -0.44 0.00 0.00 0.00 179.25 178.96 2gkw h ASP 337 N 0.51 0.06 0.60 0.00 3.45 -0.35 -0.44 116.42 120.25 2gkw h ASP 337 Ca 0.27 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.51 2gkw h ASP 337 Cb 0.23 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 38.98 2gkw h ASP 337 CO -0.21 0.04 -0.97 0.24 -1.57 0.00 0.00 179.24 176.76 2gkw h MET 338 N 0.07 0.22 -0.78 3.56 2.86 -0.38 -1.69 114.93 118.78 2gkw h MET 338 Ca 0.19 -0.27 0.02 0.00 -2.06 0.00 0.00 59.70 57.58 2gkw h MET 338 Cb 0.68 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.39 2gkw h MET 338 CO -0.01 1.03 0.51 -0.44 1.06 0.00 0.00 176.91 179.05 2gkw h ASP 339 N 0.11 0.86 0.32 1.22 3.32 -0.31 0.59 116.42 122.52 2gkw h ASP 339 Ca -0.06 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2gkw h ASP 339 Cb 1.64 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.98 2gkw h ASP 339 CO 0.15 0.61 -0.15 0.25 -1.72 0.00 0.00 179.24 178.38 2gkw h LEU 340 N 1.01 -0.36 -0.53 1.55 7.12 -1.33 -0.88 115.31 121.88 2gkw h LEU 340 Ca 0.30 -0.04 0.09 0.00 0.13 0.00 0.00 57.88 58.35 2gkw h LEU 340 Cb -0.06 0.09 -0.07 0.00 -0.53 0.00 0.00 40.66 40.09 2gkw h LEU 340 CO -0.08 -0.19 0.13 -0.09 -0.13 0.00 0.00 178.44 178.08 2gkw h ARG 341 N -0.51 0.27 -0.33 1.25 2.43 -0.59 -0.70 114.38 116.20 2gkw h ARG 341 Ca -0.04 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2gkw h ARG 341 Cb 0.38 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 2gkw h ARG 341 CO 0.07 0.18 0.09 0.74 -1.51 0.00 0.00 179.97 179.54 2gkw h PHE 342 N 0.28 0.15 -0.03 2.20 -1.00 0.38 -0.31 116.94 118.60 2gkw h PHE 342 Ca 0.27 0.02 0.04 0.00 2.81 0.00 0.00 57.97 61.10 2gkw h PHE 342 Cb 0.36 -0.02 -0.05 0.00 3.61 0.00 0.00 35.95 39.85 2gkw h PHE 342 CO -0.22 0.05 -0.28 1.96 -1.61 0.00 0.00 178.31 178.22 2gkw h GLN 343 N 0.21 -0.39 -0.04 1.51 4.20 0.21 0.99 115.11 121.81 2gkw h GLN 343 Ca 0.15 0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.91 2gkw h GLN 343 Cb 0.15 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 2gkw h GLN 343 CO -0.18 -0.26 -0.13 0.28 -0.67 0.00 0.00 178.83 177.87 2gkw h VAL 344 N -0.40 0.67 -0.70 -0.54 2.07 -0.98 -2.12 116.25 114.25 2gkw h VAL 344 Ca 0.07 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.64 2gkw h VAL 344 Cb 0.50 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 2gkw h VAL 344 CO -0.26 0.00 0.41 0.25 0.02 0.00 0.00 177.57 177.99 2gkw h LEU 345 N -0.20 0.64 -0.16 2.57 5.85 -0.54 -0.82 115.31 122.66 2gkw h LEU 345 Ca 0.06 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2gkw h LEU 345 Cb 0.28 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.19 2gkw h LEU 345 CO -0.16 0.43 0.00 -0.62 -0.34 0.00 0.00 178.44 177.75 2gkw n GLU 346 N -4.73 0.03 -0.13 1.25 1.02 0.34 -2.82 120.64 115.61 2gkw n GLU 346 Ca 0.08 0.34 0.06 0.00 -0.02 0.00 0.00 57.16 57.63 2gkw n GLU 346 Cb 0.14 -1.57 0.09 0.00 -0.02 0.00 0.00 31.44 30.08 2gkw n GLU 346 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2gkw n THR 347 N -1.63 1.33 -2.37 2.62 -2.24 -0.37 -5.06 114.28 106.56 2gkw n THR 347 Ca 0.02 -1.57 -0.37 0.00 -2.27 0.00 0.00 64.05 59.86 2gkw n THR 347 Cb 0.14 0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 2gkw n THR 347 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gkw s ALA 348 N -1.94 3.06 -0.03 6.98 0.00 -0.87 -4.97 121.76 123.98 2gkw s ALA 348 Ca 0.20 0.86 0.02 0.00 0.00 0.00 0.00 51.96 53.03 2gkw s ALA 348 Cb 0.17 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.96 2gkw s ALA 348 CO 0.02 -0.46 -0.08 0.45 0.00 0.00 0.00 175.76 175.68 2gkw s SER 349 N -1.37 1.21 -0.08 0.00 0.15 -1.26 -5.05 113.70 107.30 2gkw s SER 349 Ca 0.60 -0.19 0.11 0.00 0.70 0.00 0.00 55.95 57.17 2gkw s SER 349 Cb -0.27 -0.40 0.27 0.00 -1.71 0.00 0.00 66.02 63.91 2gkw s SER 349 CO 0.33 0.04 1.19 -1.22 1.20 0.00 0.00 173.24 174.78 2gkw n TYR 350 N 3.49 0.31 -0.58 3.44 4.02 -1.26 -0.15 117.16 126.43 2gkw n TYR 350 Ca -0.20 -0.72 0.08 0.00 -0.01 0.00 0.00 57.90 57.05 2gkw n TYR 350 Cb 0.53 -0.13 0.29 0.00 -0.02 0.00 0.00 39.34 40.01 2gkw n TYR 350 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2gkw n ASN 351 N -0.55 4.11 -0.02 7.72 0.23 -1.19 -2.40 115.26 123.16 2gkw n ASN 351 Ca 0.12 -2.43 -0.00 0.00 -0.53 0.00 0.00 54.58 51.74 2gkw n ASN 351 Cb 0.54 -0.48 -0.00 0.00 -2.08 0.00 0.00 39.78 37.76 2gkw n ASN 351 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2gkw n GLY 352 N 0.68 0.47 3.22 4.83 0.00 0.15 -4.87 105.19 109.67 2gkw n GLY 352 Ca 0.21 -0.34 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 2gkw n GLY 352 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gkw s VAL 353 N -1.98 1.74 -0.02 1.61 1.01 -1.26 -0.61 120.40 120.88 2gkw s VAL 353 Ca 0.00 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.12 2gkw s VAL 353 Cb 0.00 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 2gkw s VAL 353 CO 0.00 0.49 -0.20 -0.22 0.00 0.00 0.00 175.10 175.17 2gkw s LEU 354 N -0.27 2.01 -0.24 3.92 2.96 -0.30 -4.79 118.68 121.99 2gkw s LEU 354 Ca 0.02 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 2gkw s LEU 354 Cb -0.11 -1.04 0.06 0.00 0.50 0.00 0.00 46.19 45.60 2gkw s LEU 354 CO 0.01 0.23 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.56 2gkw s ILE 355 N -0.34 1.69 -0.23 6.68 -1.09 -1.26 -1.13 121.20 125.52 2gkw s ILE 355 Ca 0.05 -1.29 -0.06 0.00 -2.23 0.00 0.00 60.65 57.11 2gkw s ILE 355 Cb -0.09 -1.90 -0.02 0.00 -1.58 0.00 0.00 42.46 38.87 2gkw s ILE 355 CO 0.00 -0.05 0.04 0.86 -1.23 0.00 0.00 174.94 174.56 2gkw s TRP 356 N 1.33 3.06 -0.31 3.97 -0.00 0.20 -4.97 118.94 122.20 2gkw s TRP 356 Ca -0.06 -0.50 -0.10 0.00 -0.00 0.00 0.00 56.10 55.44 2gkw s TRP 356 Cb -0.19 -2.18 -0.01 0.00 -0.00 0.00 0.00 33.47 31.09 2gkw s TRP 356 CO -0.06 -0.35 0.18 0.21 -0.00 0.00 0.00 176.95 176.93 2gkw s LYS 357 N 1.43 3.43 -0.30 5.86 2.20 -1.26 -0.13 119.74 130.97 2gkw s LYS 357 Ca 0.05 -0.66 -0.07 0.00 -0.36 0.00 0.00 55.97 54.93 2gkw s LYS 357 Cb -0.15 -3.63 0.01 0.00 -1.51 0.00 0.00 37.83 32.56 2gkw s LYS 357 CO 0.02 -0.40 0.08 0.42 -0.36 0.00 0.00 175.35 175.11 2gkw s ILE 358 N 1.65 3.91 0.34 5.43 1.01 -0.28 -5.00 121.20 128.26 2gkw s ILE 358 Ca 0.05 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 59.95 2gkw s ILE 358 Cb -0.17 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2gkw s ILE 358 CO 0.08 0.05 0.54 -0.60 0.00 0.00 0.00 174.94 175.00 2gkw s ARG 359 N 1.48 3.45 -1.05 2.79 6.06 -1.26 -1.20 118.95 129.21 2gkw s ARG 359 Ca 0.02 -0.40 -0.04 0.00 -2.50 0.00 0.00 55.73 52.81 2gkw s ARG 359 Cb -0.17 -2.68 0.00 0.00 0.06 0.00 0.00 34.95 32.16 2gkw s ARG 359 CO 0.02 0.15 0.50 -0.25 -2.50 0.00 0.00 175.30 173.22 2gkw n ASP 360 N -1.76 -4.78 -0.32 -2.12 10.43 0.24 -4.87 116.55 113.37 2gkw n ASP 360 Ca -0.05 -0.23 0.02 0.00 2.57 0.00 0.00 54.79 57.10 2gkw n ASP 360 Cb 0.56 -3.59 0.09 0.00 1.84 0.00 0.00 41.12 40.02 2gkw n ASP 360 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 2gkw h TYR 361 N -1.14 -0.62 0.57 1.24 5.03 -1.33 -0.64 116.97 120.08 2gkw h TYR 361 Ca -0.37 0.08 -0.02 0.00 2.58 0.00 0.00 58.73 61.00 2gkw h TYR 361 Cb 1.25 0.41 -0.02 0.00 1.55 0.00 0.00 36.73 39.93 2gkw h TYR 361 CO 0.36 -0.39 -0.49 -0.22 -1.32 0.00 0.00 178.16 176.10 2gkw h LYS 362 N -0.02 -1.00 -0.48 1.82 3.64 -1.92 0.39 116.57 119.00 2gkw h LYS 362 Ca 0.39 0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.90 2gkw h LYS 362 Cb 0.63 0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.63 2gkw h LYS 362 CO -0.91 -0.67 0.18 -0.09 -2.27 0.00 0.00 179.45 175.69 2gkw h ARG 363 N -1.04 0.35 -0.20 1.90 2.43 -1.83 -1.63 114.38 114.36 2gkw h ARG 363 Ca -0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 2gkw h ARG 363 Cb 0.88 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 2gkw h ARG 363 CO -0.02 0.23 0.09 0.00 -1.51 0.00 0.00 179.97 178.77 2gkw h ARG 364 N 0.36 0.29 -0.86 0.20 3.08 -1.01 -1.54 114.38 114.91 2gkw h ARG 364 Ca 0.22 -0.05 0.12 0.00 0.07 0.00 0.00 59.98 60.34 2gkw h ARG 364 Cb 0.22 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.13 2gkw h ARG 364 CO -0.22 0.33 0.48 -0.22 -1.07 0.00 0.00 179.97 179.28 2gkw h LYS 365 N 0.18 0.74 -0.81 0.04 1.63 0.11 0.31 116.57 118.78 2gkw h LYS 365 Ca 0.07 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.78 2gkw h LYS 365 Cb 0.14 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 31.57 2gkw h LYS 365 CO -0.01 0.49 0.34 1.96 -3.45 0.00 0.00 179.45 178.79 2gkw h GLN 366 N 0.76 1.19 0.00 1.90 1.08 -0.92 -0.85 115.11 118.27 2gkw h GLN 366 Ca 0.43 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.42 2gkw h GLN 366 Cb 0.48 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.71 2gkw h GLN 366 CO -0.29 0.95 -0.07 0.93 -0.95 0.00 0.00 178.83 179.39 2gkw h GLU 367 N 1.17 0.00 0.38 1.46 5.08 0.04 -0.72 114.58 121.98 2gkw h GLU 367 Ca 0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2gkw h GLU 367 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2gkw h GLU 367 CO -0.03 0.07 -0.18 0.00 -1.00 0.00 0.00 179.01 177.88 2gkw h ALA 368 N 1.93 -0.51 -0.35 3.43 0.00 0.01 0.33 119.26 124.10 2gkw h ALA 368 Ca -0.00 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.85 2gkw h ALA 368 Cb 0.28 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.18 2gkw h ALA 368 CO 0.01 -0.48 -0.39 0.28 0.00 0.00 0.00 179.25 178.67 2gkw h VAL 369 N -1.12 0.16 -0.55 0.00 2.07 -1.03 0.19 116.25 115.98 2gkw h VAL 369 Ca -0.05 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.53 2gkw h VAL 369 Cb 0.42 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 2gkw h VAL 369 CO 0.09 0.00 0.36 0.24 0.02 0.00 0.00 177.57 178.28 2gkw h MET 370 N -0.33 0.48 0.00 1.57 2.07 -1.23 -3.46 114.93 114.03 2gkw h MET 370 Ca 0.14 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.74 2gkw h MET 370 Cb 0.57 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.20 2gkw h MET 370 CO -0.53 0.32 0.00 0.41 1.07 0.00 0.00 176.91 178.18 2gkw n GLY 371 N -1.50 1.21 0.11 8.32 0.00 0.66 -4.96 105.19 109.04 2gkw n GLY 371 Ca 0.08 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 2gkw n GLY 371 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gkw h LYS 372 N 0.00 0.21 -2.16 1.61 1.57 -0.63 -3.42 116.57 113.75 2gkw h LYS 372 Ca 0.00 -0.36 -0.40 0.00 -1.87 0.00 0.00 60.65 58.01 2gkw h LYS 372 Cb 0.17 0.14 -0.33 0.00 0.08 0.00 0.00 32.23 32.28 2gkw h LYS 372 CO 0.00 1.07 -0.71 0.99 -0.57 0.00 0.00 179.45 180.23 2gkw s THR 373 N -2.63 -0.25 0.36 -0.16 2.01 -0.65 -5.01 115.64 109.31 2gkw s THR 373 Ca -0.08 -0.98 0.11 0.00 0.31 0.00 0.00 61.69 61.06 2gkw s THR 373 Cb 0.07 -0.85 0.09 0.00 0.01 0.00 0.00 72.50 71.83 2gkw s THR 373 CO 0.85 -0.63 1.82 -0.07 -0.69 0.00 0.00 174.62 175.90 2gkw h LEU 374 N 7.43 0.08 -8.37 4.42 3.38 -1.82 -3.24 115.31 117.20 2gkw h LEU 374 Ca -0.01 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2gkw h LEU 374 Cb 1.04 -0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.65 2gkw h LEU 374 CO 0.26 0.42 -0.36 -0.94 0.09 0.00 0.00 178.44 177.91 2gkw s SER 375 N -6.92 0.03 0.00 -0.43 1.04 -1.26 -4.18 113.70 101.99 2gkw s SER 375 Ca -0.04 -1.12 0.01 0.00 0.48 0.00 0.00 55.95 55.29 2gkw s SER 375 Cb 0.14 0.48 -0.01 0.00 0.10 0.00 0.00 66.02 66.73 2gkw s SER 375 CO 0.73 -0.98 -0.03 -0.76 0.98 0.00 0.00 173.24 173.19 2gkw s LEU 376 N -3.07 2.05 0.06 2.42 1.43 -0.03 -4.97 118.68 116.57 2gkw s LEU 376 Ca 0.29 -0.14 0.08 0.00 -1.03 0.00 0.00 54.13 53.32 2gkw s LEU 376 Cb 0.03 -0.12 -0.03 0.00 0.03 0.00 0.00 46.19 46.11 2gkw s LEU 376 CO 0.09 -0.02 -0.21 -0.72 0.23 0.00 0.00 176.35 175.71 2gkw s TYR 377 N -0.34 1.84 0.99 0.29 -0.85 -1.26 -0.29 117.35 117.73 2gkw s TYR 377 Ca -0.02 -0.38 -0.14 0.00 -0.52 0.00 0.00 57.07 56.01 2gkw s TYR 377 Cb -0.03 -1.08 0.18 0.00 0.38 0.00 0.00 41.96 41.42 2gkw s TYR 377 CO -0.00 0.12 1.13 -1.54 -1.52 0.00 0.00 175.55 173.74 2gkw s SER 378 N -1.34 2.79 0.82 -0.18 1.04 0.65 -4.95 113.70 112.54 2gkw s SER 378 Ca 0.08 0.92 -0.11 0.00 0.48 0.00 0.00 55.95 57.32 2gkw s SER 378 Cb -0.09 -1.44 0.08 0.00 0.10 0.00 0.00 66.02 64.67 2gkw s SER 378 CO 0.02 -2.99 1.09 0.00 0.98 0.00 0.00 173.24 172.34 2gkw s GLN 379 N -5.25 1.90 0.57 4.02 0.00 -1.26 -4.61 119.66 115.04 2gkw s GLN 379 Ca 0.66 0.82 -0.17 0.00 -0.00 0.00 0.00 55.36 56.67 2gkw s GLN 379 Cb -0.14 -1.88 -0.05 0.00 0.00 0.00 0.00 33.01 30.94 2gkw s GLN 379 CO 0.55 -1.79 1.05 -2.14 0.00 0.00 0.00 175.29 172.96 2gkw s PRO 380 N -5.03 3.43 0.08 9.60 0.02 -1.26 -4.63 135.00 137.20 2gkw s PRO 380 Ca 0.61 1.22 0.01 0.00 0.02 0.00 0.00 61.00 62.86 2gkw s PRO 380 Cb -0.16 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.27 2gkw s PRO 380 CO 0.56 -0.72 -0.05 -0.59 -0.33 0.00 0.00 177.00 175.86 2gkw s PHE 381 N -2.37 0.73 0.21 6.54 -0.71 0.55 -4.47 117.98 118.45 2gkw s PHE 381 Ca 0.64 -0.97 0.06 0.00 -1.04 0.00 0.00 56.93 55.63 2gkw s PHE 381 Cb -0.16 -0.46 -0.05 0.00 -1.21 0.00 0.00 43.02 41.14 2gkw s PHE 381 CO 0.34 -0.24 -0.10 0.71 -1.34 0.00 0.00 175.22 174.58 2gkw s TYR 382 N -3.68 1.67 -0.55 3.49 1.51 0.78 -1.02 117.35 119.54 2gkw s TYR 382 Ca 0.09 -0.67 0.24 0.00 -1.01 0.00 0.00 57.07 55.72 2gkw s TYR 382 Cb 0.06 -0.85 0.41 0.00 -0.11 0.00 0.00 41.96 41.48 2gkw s TYR 382 CO -0.07 0.25 1.46 1.79 -1.11 0.00 0.00 175.55 177.87 2gkw h THR 383 N 2.53 0.00 -1.76 -0.71 1.35 -1.72 0.43 112.91 113.02 2gkw h THR 383 Ca -0.38 -0.68 0.29 0.00 -0.55 0.00 0.00 66.41 65.09 2gkw h THR 383 Cb 1.22 1.45 -0.10 0.00 -1.73 0.00 0.00 68.15 68.99 2gkw h THR 383 CO 0.64 0.00 0.77 -0.83 -0.25 0.00 0.00 175.52 175.84 2gkw s GLY 384 N -3.87 -0.31 0.30 5.82 0.00 -1.01 -4.16 107.32 104.10 2gkw s GLY 384 Ca 0.06 0.43 0.06 0.00 0.00 0.00 0.00 44.72 45.28 2gkw s GLY 384 CO 0.69 1.03 1.75 -0.97 0.00 0.00 0.00 173.10 175.59 2gkw h TYR 385 N 2.00 0.97 -0.15 1.90 0.99 -1.93 -2.58 116.97 118.17 2gkw h TYR 385 Ca -0.28 0.04 -0.13 0.00 2.00 0.00 0.00 58.73 60.35 2gkw h TYR 385 Cb 1.21 -0.28 -0.15 0.00 1.00 0.00 0.00 36.73 38.51 2gkw h TYR 385 CO 0.56 0.13 -0.66 1.19 -0.00 0.00 0.00 178.16 179.37 2gkw n PHE 386 N -4.86 0.54 -1.71 4.88 3.01 -1.26 -5.06 117.46 113.00 2gkw n PHE 386 Ca 0.24 -1.50 0.00 0.00 1.01 0.00 0.00 57.45 57.20 2gkw n PHE 386 Cb 0.63 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 2gkw n PHE 386 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2gkw n GLY 387 N -0.78 2.17 3.77 1.37 0.00 -0.97 -4.72 105.19 106.03 2gkw n GLY 387 Ca 0.21 -1.99 -0.40 0.00 0.00 0.00 0.00 46.02 43.83 2gkw n GLY 387 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gkw s TYR 388 N 2.29 2.50 -0.21 1.61 2.02 -1.26 -4.76 117.35 119.54 2gkw s TYR 388 Ca 0.00 1.20 -0.08 0.00 -0.37 0.00 0.00 57.07 57.82 2gkw s TYR 388 Cb 0.00 -3.99 -0.04 0.00 -0.40 0.00 0.00 41.96 37.53 2gkw s TYR 388 CO 0.00 -3.02 0.09 0.21 -1.57 0.00 0.00 175.55 171.26 2gkw s LYS 389 N -2.28 3.98 0.22 -0.62 2.20 -1.26 -2.74 119.74 119.23 2gkw s LYS 389 Ca 0.57 -0.33 -0.02 0.00 -0.36 0.00 0.00 55.97 55.83 2gkw s LYS 389 Cb -0.45 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.51 2gkw s LYS 389 CO 0.60 0.17 0.19 -1.64 -0.36 0.00 0.00 175.35 174.32 2gkw s MET 390 N 0.68 1.30 0.25 4.03 -1.94 -0.19 -0.89 119.30 122.55 2gkw s MET 390 Ca 0.05 -1.61 -0.22 0.00 -1.71 0.00 0.00 55.69 52.20 2gkw s MET 390 Cb -0.13 0.30 0.03 0.00 2.01 0.00 0.00 34.83 37.05 2gkw s MET 390 CO 0.01 -0.45 0.78 0.00 -0.01 0.00 0.00 175.02 175.36 2gkw s ALA 392 N -3.69 2.97 -0.06 0.00 0.00 -1.26 -0.64 121.76 119.09 2gkw s ALA 392 Ca 0.12 -1.31 0.03 0.00 0.00 0.00 0.00 51.96 50.80 2gkw s ALA 392 Cb -0.05 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 22.21 2gkw s ALA 392 CO 0.06 0.59 -0.15 0.50 0.00 0.00 0.00 175.76 176.76 2gkw s ARG 393 N -2.43 1.79 0.09 0.00 3.52 -0.58 -0.25 118.95 121.09 2gkw s ARG 393 Ca 0.23 -0.52 0.06 0.00 -0.13 0.00 0.00 55.73 55.37 2gkw s ARG 393 Cb -0.10 -1.50 -0.03 0.00 -1.56 0.00 0.00 34.95 31.76 2gkw s ARG 393 CO 0.14 0.14 -0.16 0.54 -0.81 0.00 0.00 175.30 175.15 2gkw s VAL 394 N 0.34 1.34 -0.24 7.11 0.11 0.60 0.06 120.40 129.71 2gkw s VAL 394 Ca -0.10 -1.46 0.01 0.00 -2.93 0.00 0.00 61.98 57.50 2gkw s VAL 394 Cb -0.14 -1.31 0.06 0.00 -1.53 0.00 0.00 36.38 33.47 2gkw s VAL 394 CO 0.03 -0.21 -0.04 -0.31 -3.33 0.00 0.00 175.10 171.24 2gkw s TYR 395 N -1.40 2.44 0.42 1.54 1.51 -0.00 -0.86 117.35 121.00 2gkw s TYR 395 Ca 0.03 -1.82 0.19 0.00 -1.01 0.00 0.00 57.07 54.46 2gkw s TYR 395 Cb -0.09 -1.64 1.11 0.00 -0.11 0.00 0.00 41.96 41.23 2gkw s TYR 395 CO 0.03 -0.79 1.99 -0.07 -1.11 0.00 0.00 175.55 175.60 2gkw h LEU 396 N 7.94 0.00 -3.01 -1.29 3.38 -1.85 -1.48 115.31 119.00 2gkw h LEU 396 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2gkw h LEU 396 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 2gkw h LEU 396 CO 0.42 0.20 0.00 -3.20 0.09 0.00 0.00 178.44 175.95 2gkw n ASN 397 N -4.02 3.28 0.00 -0.43 5.15 -1.26 -4.59 115.26 113.38 2gkw n ASN 397 Ca -0.02 -2.34 0.00 0.00 -0.60 0.00 0.00 54.58 51.62 2gkw n ASN 397 Cb 0.28 -0.34 0.00 0.00 -0.53 0.00 0.00 39.78 39.19 2gkw n ASN 397 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2gkw n GLY 398 N 0.20 -2.01 3.17 8.20 0.00 -0.14 0.14 105.19 114.75 2gkw n GLY 398 Ca 0.15 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 2gkw n GLY 398 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gkw s ASP 399 N -2.74 1.29 1.02 1.61 2.15 -1.26 -4.20 116.67 114.53 2gkw s ASP 399 Ca 0.00 -0.90 0.00 0.00 0.43 0.00 0.00 52.55 52.08 2gkw s ASP 399 Cb 0.00 0.05 0.00 0.00 -0.30 0.00 0.00 42.92 42.67 2gkw s ASP 399 CO 0.00 -0.36 0.00 0.61 -0.17 0.00 0.00 175.17 175.25 2gkw n GLY 400 N 0.29 2.85 0.02 2.66 0.00 -1.26 -1.36 105.19 108.39 2gkw n GLY 400 Ca -0.14 -0.23 0.02 0.00 0.00 0.00 0.00 46.02 45.66 2gkw n GLY 400 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2gkw n MET 401 N 14.00 0.02 -0.10 1.61 2.81 -1.26 -1.78 117.12 132.41 2gkw n MET 401 Ca 0.00 0.49 0.06 0.00 -1.81 0.00 0.00 57.70 56.44 2gkw n MET 401 Cb 0.00 -1.56 0.11 0.00 -0.71 0.00 0.00 33.22 31.06 2gkw n MET 401 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gkw n GLY 402 N -1.31 1.34 3.72 3.03 0.00 -0.46 -4.96 105.19 106.55 2gkw n GLY 402 Ca 0.00 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 2gkw n GLY 402 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gkw n LYS 403 N 0.62 2.66 -0.17 1.61 4.81 -0.74 0.04 118.16 126.99 2gkw n LYS 403 Ca 0.10 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.49 2gkw n LYS 403 Cb 0.37 -2.77 0.00 0.00 0.02 0.00 0.00 35.03 32.65 2gkw n LYS 403 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2gkw n GLY 404 N 3.37 2.45 0.00 3.14 0.00 0.37 -4.69 105.19 109.83 2gkw n GLY 404 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2gkw n GLY 404 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gkw n THR 405 N -2.00 0.00 -4.45 2.61 -2.24 -0.55 -4.98 114.28 102.68 2gkw n THR 405 Ca 0.00 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.55 2gkw n THR 405 Cb 0.00 0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.16 2gkw n THR 405 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2gkw s HIS 406 N -1.45 1.76 -0.18 4.78 3.76 0.11 0.39 115.29 124.45 2gkw s HIS 406 Ca 0.00 -1.29 -0.05 0.00 -0.15 0.00 0.00 55.06 53.57 2gkw s HIS 406 Cb 0.00 -1.07 -0.03 0.00 1.11 0.00 0.00 32.58 32.59 2gkw s HIS 406 CO 0.00 -0.35 0.01 -1.17 -0.85 0.00 0.00 174.74 172.38 2gkw s LEU 407 N -3.52 3.46 -0.06 0.89 0.20 -0.57 -0.97 118.68 118.11 2gkw s LEU 407 Ca 0.29 -0.07 -0.03 0.00 0.69 0.00 0.00 54.13 55.00 2gkw s LEU 407 Cb 0.04 -1.86 -0.04 0.00 -0.43 0.00 0.00 46.19 43.90 2gkw s LEU 407 CO 0.16 0.14 0.11 -0.44 -0.29 0.00 0.00 176.35 176.03 2gkw s SER 408 N 0.57 6.00 -0.05 3.68 0.01 -0.60 -2.90 113.70 120.41 2gkw s SER 408 Ca 0.00 0.30 -0.01 0.00 1.31 0.00 0.00 55.95 57.55 2gkw s SER 408 Cb -0.14 -1.83 0.03 0.00 0.21 0.00 0.00 66.02 64.29 2gkw s SER 408 CO 0.02 0.33 0.01 -0.22 0.41 0.00 0.00 173.24 173.79 2gkw s LEU 409 N -1.41 0.78 0.17 2.44 1.98 -1.02 -0.82 118.68 120.79 2gkw s LEU 409 Ca 0.20 -0.03 0.07 0.00 -2.89 0.00 0.00 54.13 51.47 2gkw s LEU 409 Cb -0.12 -0.30 -0.04 0.00 0.66 0.00 0.00 46.19 46.38 2gkw s LEU 409 CO 0.10 -0.16 -0.14 -0.36 -1.89 0.00 0.00 176.35 173.90 2gkw s PHE 410 N 1.57 1.55 0.02 5.38 0.40 0.11 -1.42 117.98 125.59 2gkw s PHE 410 Ca -0.02 -0.60 -0.01 0.00 -0.60 0.00 0.00 56.93 55.69 2gkw s PHE 410 Cb -0.13 -0.76 -0.04 0.00 0.51 0.00 0.00 43.02 42.61 2gkw s PHE 410 CO -0.03 0.25 0.18 0.12 0.70 0.00 0.00 175.22 176.44 2gkw s PHE 411 N -2.81 3.51 -0.03 0.36 5.36 0.23 -1.53 117.98 123.07 2gkw s PHE 411 Ca 0.18 0.30 0.00 0.00 -0.96 0.00 0.00 56.93 56.45 2gkw s PHE 411 Cb -0.01 -1.79 0.03 0.00 -0.34 0.00 0.00 43.02 40.90 2gkw s PHE 411 CO 0.05 0.62 -0.00 0.08 -1.46 0.00 0.00 175.22 174.50 2gkw s VAL 412 N -1.38 0.21 -0.10 3.12 1.01 0.19 -1.71 120.40 121.74 2gkw s VAL 412 Ca 0.30 0.08 -0.16 0.00 0.00 0.00 0.00 61.98 62.20 2gkw s VAL 412 Cb -0.13 -0.31 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 2gkw s VAL 412 CO 0.22 0.16 0.42 -0.63 0.00 0.00 0.00 175.10 175.27 2gkw s ILE 413 N 1.12 5.17 0.33 2.22 -1.09 -1.26 -1.51 121.20 126.19 2gkw s ILE 413 Ca -0.08 0.84 0.08 0.00 -2.23 0.00 0.00 60.65 59.26 2gkw s ILE 413 Cb -0.13 -3.75 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 2gkw s ILE 413 CO -0.02 0.40 0.13 -0.04 -1.23 0.00 0.00 174.94 174.18 2gkw s MET 414 N 0.20 2.36 -0.26 2.79 -1.94 -0.06 -0.51 119.30 121.87 2gkw s MET 414 Ca 0.23 -1.54 -0.29 0.00 -1.71 0.00 0.00 55.69 52.38 2gkw s MET 414 Cb -0.15 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.52 2gkw s MET 414 CO 0.10 0.13 1.23 0.50 -0.01 0.00 0.00 175.02 176.97 2gkw s ARG 415 N -3.83 4.06 0.09 2.03 3.52 0.33 -4.45 118.95 120.72 2gkw s ARG 415 Ca 0.37 1.35 0.01 0.00 -0.13 0.00 0.00 55.73 57.32 2gkw s ARG 415 Cb -0.03 -3.80 -0.04 0.00 -1.56 0.00 0.00 34.95 29.52 2gkw s ARG 415 CO 0.22 -0.92 0.24 0.20 -0.81 0.00 0.00 175.30 174.24 2gkw s GLY 416 N 2.22 2.04 0.60 8.12 0.00 -1.26 -4.92 107.32 114.10 2gkw s GLY 416 Ca 0.53 -0.89 0.30 0.00 0.00 0.00 0.00 44.72 44.66 2gkw s GLY 416 CO 0.18 -0.87 2.18 0.83 0.00 0.00 0.00 173.10 175.41 2gkw h GLU 417 N 2.76 0.00 -0.25 2.90 4.39 -1.94 -2.65 114.58 119.79 2gkw h GLU 417 Ca -0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 2gkw h GLU 417 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 2gkw h GLU 417 CO 0.73 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 179.24 2gkw n TYR 418 N -3.76 0.83 -0.34 4.33 4.02 -1.26 -4.71 117.16 116.27 2gkw n TYR 418 Ca -0.01 -0.83 0.15 0.00 -0.01 0.00 0.00 57.90 57.20 2gkw n TYR 418 Cb 0.21 -0.27 0.35 0.00 -0.02 0.00 0.00 39.34 39.60 2gkw n TYR 418 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2gkw h ASP 419 N 1.72 0.66 -0.29 7.72 3.45 -1.81 0.20 116.42 128.08 2gkw h ASP 419 Ca 0.00 0.12 0.08 0.00 0.43 0.00 0.00 57.03 57.67 2gkw h ASP 419 Cb 1.33 0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 40.10 2gkw h ASP 419 CO 0.18 0.15 0.36 0.00 -1.57 0.00 0.00 179.24 178.37 2gkw h ALA 420 N 1.69 1.90 0.00 3.45 0.00 -1.85 -0.86 119.26 123.59 2gkw h ALA 420 Ca 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.50 2gkw h ALA 420 Cb 1.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2gkw h ALA 420 CO -0.45 -0.51 -1.81 1.28 0.00 0.00 0.00 179.25 177.77 2gkw n LEU 421 N -3.59 0.17 -4.84 0.00 4.77 0.69 -4.98 117.00 109.22 2gkw n LEU 421 Ca 0.04 0.01 -0.32 0.00 -0.03 0.00 0.00 56.01 55.71 2gkw n LEU 421 Cb 0.50 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.54 2gkw n LEU 421 CO 0.25 -0.01 0.60 -0.76 -1.33 0.00 0.00 177.39 176.14 2gkw s LEU 422 N -4.51 3.79 0.44 2.23 1.02 -0.33 -5.05 118.68 116.28 2gkw s LEU 422 Ca -0.06 1.49 -0.23 0.00 0.02 0.00 0.00 54.13 55.34 2gkw s LEU 422 Cb 0.14 -4.38 -0.08 0.00 0.02 0.00 0.00 46.19 41.89 2gkw s LEU 422 CO 0.89 -0.45 1.15 -2.84 0.02 0.00 0.00 176.35 175.12 2gkw s PRO 423 N -3.67 3.86 0.00 1.29 0.02 -1.26 -4.98 135.00 130.26 2gkw s PRO 423 Ca 0.58 1.74 -0.03 0.00 0.02 0.00 0.00 61.00 63.31 2gkw s PRO 423 Cb -0.10 -2.46 -0.01 0.00 0.02 0.00 0.00 34.50 31.96 2gkw s PRO 423 CO 0.25 -0.46 0.04 -1.58 -0.33 0.00 0.00 177.00 174.92 2gkw s TRP 424 N -1.55 0.11 1.11 6.54 0.52 -1.26 -4.37 118.94 120.05 2gkw s TRP 424 Ca 0.62 -0.24 -0.16 0.00 0.02 0.00 0.00 56.10 56.34 2gkw s TRP 424 Cb -0.28 -0.10 0.24 0.00 -1.15 0.00 0.00 33.47 32.19 2gkw s TRP 424 CO 0.34 -0.18 1.10 -2.14 0.02 0.00 0.00 176.95 176.09 2gkw s PRO 425 N -1.06 -0.49 0.02 4.98 0.02 -1.26 -5.05 135.00 132.16 2gkw s PRO 425 Ca -0.12 0.20 -0.30 0.00 0.02 0.00 0.00 61.00 60.80 2gkw s PRO 425 Cb -0.07 -1.66 -0.05 0.00 0.02 0.00 0.00 34.50 32.74 2gkw s PRO 425 CO 0.00 -3.28 1.30 0.12 -0.33 0.00 0.00 177.00 174.81 2gkw s PHE 426 N -2.99 3.15 -0.00 6.54 2.19 0.85 -4.90 117.98 122.82 2gkw s PHE 426 Ca 0.68 1.05 0.00 0.00 0.33 0.00 0.00 56.93 59.00 2gkw s PHE 426 Cb -0.14 -3.55 0.00 0.00 -1.31 0.00 0.00 43.02 38.02 2gkw s PHE 426 CO 0.57 -1.88 0.86 0.36 1.83 0.00 0.00 175.22 176.96 2gkw n LYS 427 N 4.71 2.14 -2.27 10.12 2.85 -1.26 -4.75 118.16 129.71 2gkw n LYS 427 Ca 0.11 -1.22 -0.40 0.00 -1.05 0.00 0.00 58.31 55.76 2gkw n LYS 427 Cb 0.45 -0.86 -0.03 0.00 -0.65 0.00 0.00 35.03 33.94 2gkw n LYS 427 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2gkw s GLN 428 N -0.72 4.35 0.07 -1.58 1.11 -1.26 -4.59 119.66 117.04 2gkw s GLN 428 Ca 0.00 1.99 -0.31 0.00 0.01 0.00 0.00 55.36 57.06 2gkw s GLN 428 Cb 0.00 -2.99 -0.06 0.00 -1.01 0.00 0.00 33.01 28.95 2gkw s GLN 428 CO 0.00 -0.11 1.20 0.21 0.01 0.00 0.00 175.29 176.60 2gkw s LYS 429 N -1.84 4.44 -0.07 2.91 2.20 -1.26 -4.24 119.74 121.88 2gkw s LYS 429 Ca 0.50 1.78 0.01 0.00 -0.36 0.00 0.00 55.97 57.90 2gkw s LYS 429 Cb -0.35 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 32.61 2gkw s LYS 429 CO 0.45 -0.25 -0.09 0.08 -0.36 0.00 0.00 175.35 175.19 2gkw s VAL 430 N 0.98 3.54 -0.25 4.02 1.01 -0.67 -0.92 120.40 128.11 2gkw s VAL 430 Ca 0.58 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2gkw s VAL 430 Cb -0.30 -2.44 0.06 0.00 0.00 0.00 0.00 36.38 33.71 2gkw s VAL 430 CO 0.30 0.59 -0.06 -0.89 0.00 0.00 0.00 175.10 175.04 2gkw s THR 431 N -0.72 1.73 0.14 3.92 2.01 0.73 -1.47 115.64 121.98 2gkw s THR 431 Ca 0.11 -1.40 -0.16 0.00 0.31 0.00 0.00 61.69 60.56 2gkw s THR 431 Cb -0.11 -1.97 -0.07 0.00 0.01 0.00 0.00 72.50 70.36 2gkw s THR 431 CO 0.01 -0.12 0.57 -0.76 -0.69 0.00 0.00 174.62 173.63 2gkw s LEU 432 N 1.29 4.37 -0.16 4.42 1.43 0.23 -1.01 118.68 129.25 2gkw s LEU 432 Ca -0.06 1.14 -0.29 0.00 -1.03 0.00 0.00 54.13 53.90 2gkw s LEU 432 Cb -0.19 -3.22 0.11 0.00 0.03 0.00 0.00 46.19 42.92 2gkw s LEU 432 CO -0.06 0.13 0.92 0.00 0.23 0.00 0.00 176.35 177.56 2gkw s MET 433 N -1.79 0.69 -0.20 1.70 0.23 -0.49 0.11 119.30 119.56 2gkw s MET 433 Ca 0.36 0.30 -0.04 0.00 -1.03 0.00 0.00 55.69 55.28 2gkw s MET 433 Cb -0.16 0.33 -0.02 0.00 -1.53 0.00 0.00 34.83 33.45 2gkw s MET 433 CO 0.19 -0.19 -0.02 -1.17 -2.03 0.00 0.00 175.02 171.80 2gkw s LEU 434 N -0.79 3.12 0.36 0.18 2.96 0.27 -0.27 118.68 124.50 2gkw s LEU 434 Ca -0.03 -0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 53.37 2gkw s LEU 434 Cb -0.01 -1.78 -0.09 0.00 0.50 0.00 0.00 46.19 44.80 2gkw s LEU 434 CO 0.02 0.06 1.03 -0.04 -1.32 0.00 0.00 176.35 176.10 2gkw s MET 435 N 1.03 4.37 -0.39 1.98 -1.94 0.01 -0.81 119.30 123.54 2gkw s MET 435 Ca 0.01 1.52 -0.16 0.00 -1.71 0.00 0.00 55.69 55.35 2gkw s MET 435 Cb -0.14 -2.74 0.01 0.00 2.01 0.00 0.00 34.83 33.97 2gkw s MET 435 CO 0.01 0.04 0.38 0.34 -0.01 0.00 0.00 175.02 175.78 2gkw s ASP 436 N -1.44 6.17 0.00 3.03 2.15 -1.26 -4.63 116.67 120.69 2gkw s ASP 436 Ca 0.53 -0.59 0.19 0.00 0.43 0.00 0.00 52.55 53.11 2gkw s ASP 436 Cb -0.23 -2.20 1.11 0.00 -0.30 0.00 0.00 42.92 41.30 2gkw s ASP 436 CO 0.29 -0.48 1.62 0.00 -0.17 0.00 0.00 175.17 176.44 2gkw n GLN 437 N 5.45 0.86 -1.65 4.34 6.02 -0.76 -4.38 117.38 127.26 2gkw n GLN 437 Ca -0.09 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.59 2gkw n GLN 437 Cb 0.48 -1.34 0.04 0.00 1.02 0.00 0.00 30.24 30.45 2gkw n GLN 437 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2gkw s GLY 438 N -1.72 1.75 0.57 1.08 0.00 -0.75 -4.94 107.32 103.32 2gkw s GLY 438 Ca 0.28 0.15 0.26 0.00 0.00 0.00 0.00 44.72 45.41 2gkw s GLY 438 CO 0.21 0.46 2.20 0.23 0.00 0.00 0.00 173.10 176.20 2gkw h SER 439 N -0.51 0.00 1.84 1.64 0.87 -1.91 -1.12 113.55 114.35 2gkw h SER 439 Ca -0.44 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.09 2gkw h SER 439 Cb 1.21 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.17 2gkw h SER 439 CO 0.57 0.00 -0.16 0.28 -0.53 0.00 0.00 176.83 176.99 2gkw h SER 440 N 0.00 0.00 -6.22 6.23 0.02 -1.92 -3.48 113.55 108.19 2gkw h SER 440 Ca 0.02 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.53 2gkw h SER 440 Cb 0.11 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.66 2gkw h SER 440 CO -0.00 0.10 -0.84 0.54 -1.14 0.00 0.00 176.83 175.50 2gkw n ARG 441 N -3.10 -4.56 -2.94 3.45 1.74 -0.43 -4.89 116.66 105.93 2gkw n ARG 441 Ca 0.03 0.56 -0.44 0.00 -0.77 0.00 0.00 57.85 57.24 2gkw n ARG 441 Cb 0.57 -5.05 0.00 0.00 -1.02 0.00 0.00 32.46 26.96 2gkw n ARG 441 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2gkw n ARG 442 N -4.35 3.48 -2.07 5.56 0.63 -1.26 -4.86 116.66 113.79 2gkw n ARG 442 Ca -0.26 -3.95 -0.39 0.00 -0.92 0.00 0.00 57.85 52.33 2gkw n ARG 442 Cb 0.66 -2.91 -0.00 0.00 0.45 0.00 0.00 32.46 30.65 2gkw n ARG 442 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2gkw s HIS 443 N 0.70 2.81 -0.06 -0.14 3.76 -1.26 -4.57 115.29 116.52 2gkw s HIS 443 Ca 0.40 1.43 -0.13 0.00 -0.15 0.00 0.00 55.06 56.60 2gkw s HIS 443 Cb -0.02 -3.64 -0.05 0.00 1.11 0.00 0.00 32.58 29.98 2gkw s HIS 443 CO -0.01 -2.04 0.34 -0.51 -0.85 0.00 0.00 174.74 171.67 2gkw s LEU 444 N -2.55 4.40 0.21 0.89 1.43 0.01 -4.94 118.68 118.13 2gkw s LEU 444 Ca 0.58 0.77 -0.23 0.00 -1.03 0.00 0.00 54.13 54.22 2gkw s LEU 444 Cb -0.37 -2.45 0.04 0.00 0.03 0.00 0.00 46.19 43.45 2gkw s LEU 444 CO 0.47 0.28 0.79 -0.83 0.23 0.00 0.00 176.35 177.29 2gkw s GLY 445 N -0.67 -0.22 -0.20 -3.19 0.00 -1.26 0.96 107.32 102.74 2gkw s GLY 445 Ca 0.21 0.00 -0.20 0.00 0.00 0.00 0.00 44.72 44.73 2gkw s GLY 445 CO 0.09 -0.00 0.57 -0.35 0.00 0.00 0.00 173.10 173.41 2gkw s ASP 446 N -2.88 -0.59 0.29 1.64 -1.08 0.31 -4.94 116.67 109.42 2gkw s ASP 446 Ca 0.10 1.09 0.12 0.00 -0.52 0.00 0.00 52.55 53.34 2gkw s ASP 446 Cb -0.04 1.10 -0.05 0.00 -1.46 0.00 0.00 42.92 42.48 2gkw s ASP 446 CO 0.02 -0.23 -0.18 0.00 0.52 0.00 0.00 175.17 175.30 2gkw s ALA 447 N 0.16 2.79 -0.01 3.66 0.00 -1.26 0.76 121.76 127.85 2gkw s ALA 447 Ca -0.01 -1.90 -0.28 0.00 0.00 0.00 0.00 51.96 49.77 2gkw s ALA 447 Cb -0.04 -0.25 0.09 0.00 0.00 0.00 0.00 23.12 22.92 2gkw s ALA 447 CO 0.01 0.26 0.80 -0.59 0.00 0.00 0.00 175.76 176.24 2gkw s PHE 448 N -2.52 -0.46 -0.24 0.00 -0.12 -0.54 -4.99 117.98 109.11 2gkw s PHE 448 Ca 0.30 0.53 -0.06 0.00 -0.05 0.00 0.00 56.93 57.65 2gkw s PHE 448 Cb -0.04 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 42.82 2gkw s PHE 448 CO 0.15 -0.58 0.03 0.21 -0.05 0.00 0.00 175.22 174.99 2gkw s LYS 449 N -2.40 3.57 0.11 1.99 2.20 -1.26 -1.67 119.74 122.28 2gkw s LYS 449 Ca -0.01 -0.52 -0.25 0.00 -0.36 0.00 0.00 55.97 54.83 2gkw s LYS 449 Cb -0.01 -3.22 -0.14 0.00 -1.51 0.00 0.00 37.83 32.95 2gkw s LYS 449 CO -0.03 -0.19 0.54 -2.30 -0.36 0.00 0.00 175.35 173.01 2gkw n PRO 450 N 4.87 0.00 -2.75 4.03 -0.02 -1.26 -4.85 135.00 135.01 2gkw n PRO 450 Ca -0.17 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.89 2gkw n PRO 450 Cb 0.51 -0.90 -0.04 0.00 -0.02 0.00 0.00 33.50 33.05 2gkw n PRO 450 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2gkw s ASP 451 N -0.53 6.35 0.05 2.55 2.15 -1.26 -4.90 116.67 121.08 2gkw s ASP 451 Ca 0.56 -0.27 0.01 0.00 0.43 0.00 0.00 52.55 53.28 2gkw s ASP 451 Cb -0.81 -2.47 0.06 0.00 -0.30 0.00 0.00 42.92 39.39 2gkw s ASP 451 CO 0.44 -1.34 0.71 -0.81 -0.17 0.00 0.00 175.17 173.99 2gkw n PRO 452 N 7.85 0.01 0.00 4.34 -0.04 -1.26 0.18 135.00 146.08 2gkw n PRO 452 Ca 0.03 0.21 0.08 0.00 -0.04 0.00 0.00 63.50 63.78 2gkw n PRO 452 Cb 0.48 -1.90 0.05 0.00 -0.04 0.00 0.00 33.50 32.08 2gkw n PRO 452 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2gkw n ASN 453 N -1.27 2.08 -4.71 3.54 4.13 -1.26 -4.87 115.26 112.90 2gkw n ASN 453 Ca -0.00 -1.54 -0.41 0.00 1.68 0.00 0.00 54.58 54.31 2gkw n ASN 453 Cb 0.38 0.14 -0.04 0.00 -1.54 0.00 0.00 39.78 38.72 2gkw n ASN 453 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2gkw s SER 454 N -1.46 7.23 0.00 6.41 0.15 0.13 -4.90 113.70 121.26 2gkw s SER 454 Ca 0.17 1.49 0.03 0.00 0.70 0.00 0.00 55.95 58.34 2gkw s SER 454 Cb 0.13 -2.51 0.19 0.00 -1.71 0.00 0.00 66.02 62.11 2gkw s SER 454 CO 0.25 -0.22 0.51 -1.54 1.20 0.00 0.00 173.24 173.45 2gkw n SER 455 N 3.90 0.00 0.10 5.45 3.41 -1.26 -1.51 113.62 123.71 2gkw n SER 455 Ca 0.04 -0.36 0.10 0.00 -0.26 0.00 0.00 58.87 58.38 2gkw n SER 455 Cb 0.51 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.46 2gkw n SER 455 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2gkw h SER 456 N 0.00 0.00 -0.17 4.04 0.02 -1.91 -3.33 113.55 112.20 2gkw h SER 456 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2gkw h SER 456 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2gkw h SER 456 CO 0.00 0.06 0.00 0.49 -1.14 0.00 0.00 176.83 176.24 2gkw n PHE 457 N -2.71 0.60 -2.12 3.45 3.72 -0.57 -4.49 117.46 115.34 2gkw n PHE 457 Ca -0.01 -0.91 -0.30 0.00 -0.05 0.00 0.00 57.45 56.18 2gkw n PHE 457 Cb 0.58 -0.25 0.01 0.00 -0.94 0.00 0.00 39.48 38.87 2gkw n PHE 457 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2gkw s LYS 458 N -2.81 3.59 -0.02 -1.08 3.01 -1.24 -0.10 119.74 121.09 2gkw s LYS 458 Ca 0.38 0.59 -0.30 0.00 -1.01 0.00 0.00 55.97 55.63 2gkw s LYS 458 Cb 0.32 -2.17 -0.07 0.00 -1.01 0.00 0.00 37.83 34.89 2gkw s LYS 458 CO 0.07 -0.45 1.85 0.21 0.51 0.00 0.00 175.35 177.54 2gkw s LYS 459 N -5.00 4.09 0.49 1.68 2.20 -1.26 -4.85 119.74 117.09 2gkw s LYS 459 Ca 0.53 2.39 -0.20 0.00 -0.36 0.00 0.00 55.97 58.33 2gkw s LYS 459 Cb -0.11 -4.10 -0.11 0.00 -1.51 0.00 0.00 37.83 32.00 2gkw s LYS 459 CO 0.50 -0.99 0.57 -2.30 -0.36 0.00 0.00 175.35 172.78 2gkw n PRO 460 N 7.46 0.61 0.00 4.03 -0.02 -1.26 -4.94 135.00 140.88 2gkw n PRO 460 Ca 0.19 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2gkw n PRO 460 Cb 0.42 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 2gkw n PRO 460 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2gkw n THR 461 N -1.22 0.00 -2.81 3.45 -2.24 -1.26 -4.99 114.28 105.20 2gkw n THR 461 Ca 0.11 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.67 2gkw n THR 461 Cb 0.43 -0.58 0.09 0.00 -2.10 0.00 0.00 70.33 68.17 2gkw n THR 461 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2gkw s GLY 462 N -4.07 1.73 0.34 3.38 0.00 -1.26 -4.98 107.32 102.46 2gkw s GLY 462 Ca 0.00 -2.01 0.09 0.00 0.00 0.00 0.00 44.72 42.80 2gkw s GLY 462 CO 0.00 -1.45 1.83 0.83 0.00 0.00 0.00 173.10 174.30 2gkw h GLU 463 N -0.26 0.68 -2.82 2.90 4.39 -1.97 -3.37 114.58 114.12 2gkw h GLU 463 Ca -0.32 -0.04 -0.13 0.00 0.34 0.00 0.00 59.36 59.21 2gkw h GLU 463 Cb 1.27 -0.15 -0.24 0.00 -0.10 0.00 0.00 28.75 29.53 2gkw h GLU 463 CO 0.39 0.45 -0.26 0.00 -1.16 0.00 0.00 179.01 178.42 2gkw s MET 464 N -5.72 0.47 1.16 2.33 0.23 -1.26 -0.51 119.30 115.99 2gkw s MET 464 Ca -0.10 0.46 -0.18 0.00 -1.03 0.00 0.00 55.69 54.84 2gkw s MET 464 Cb 0.23 0.23 0.27 0.00 -1.53 0.00 0.00 34.83 34.03 2gkw s MET 464 CO 0.80 -0.07 1.12 -0.80 -2.03 0.00 0.00 175.02 174.04 2gkw s ASN 465 N 0.04 1.33 -0.05 -1.18 -0.87 0.33 -4.97 114.94 109.57 2gkw s ASN 465 Ca -0.01 0.67 -0.30 0.00 -1.57 0.00 0.00 52.86 51.65 2gkw s ASN 465 Cb -0.03 -0.95 -0.04 0.00 -0.02 0.00 0.00 41.25 40.21 2gkw s ASN 465 CO 0.01 -3.88 1.26 -0.63 -2.57 0.00 0.00 177.10 171.29 2gkw s ILE 466 N -3.08 4.11 0.59 0.60 1.01 -1.26 -4.72 121.20 118.46 2gkw s ILE 466 Ca 0.70 1.45 -0.19 0.00 0.00 0.00 0.00 60.65 62.61 2gkw s ILE 466 Cb -0.10 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.40 2gkw s ILE 466 CO 0.56 -0.01 1.23 0.00 0.00 0.00 0.00 174.94 176.71 2gkw s ALA 467 N 2.37 2.55 0.01 9.38 0.00 -1.26 -4.40 121.76 130.40 2gkw s ALA 467 Ca 0.58 1.06 0.03 0.00 0.00 0.00 0.00 51.96 53.62 2gkw s ALA 467 Cb -0.26 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.38 2gkw s ALA 467 CO 0.23 -1.22 -0.08 -1.12 0.00 0.00 0.00 175.76 173.56 2gkw s SER 468 N -1.52 0.95 0.00 0.00 0.01 -0.70 -4.92 113.70 107.52 2gkw s SER 468 Ca 0.78 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.78 2gkw s SER 468 Cb -0.32 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 65.84 2gkw s SER 468 CO 0.35 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.63 2gkw n GLY 469 N 2.49 -0.83 3.05 3.44 0.00 -1.26 0.75 105.19 112.82 2gkw n GLY 469 Ca -0.16 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 2gkw n GLY 469 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gkw h PRO 471 N 7.72 0.00 -1.99 0.00 0.11 -1.85 -2.61 132.00 133.38 2gkw h PRO 471 Ca -0.14 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.30 2gkw h PRO 471 Cb 1.03 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.78 2gkw h PRO 471 CO 0.48 0.00 -0.01 1.33 -0.21 0.00 0.00 178.00 179.59 2gkw n VAL 472 N -4.48 3.56 0.15 3.15 0.24 -1.26 -4.04 118.33 115.65 2gkw n VAL 472 Ca -0.03 -5.22 -0.14 0.00 -2.04 0.00 0.00 64.34 56.91 2gkw n VAL 472 Cb 0.09 -1.36 -0.08 0.00 -1.47 0.00 0.00 33.84 31.02 2gkw n VAL 472 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 2gkw h PHE 473 N 3.10 -0.30 -3.07 6.34 3.57 -1.34 -3.45 116.94 121.78 2gkw h PHE 473 Ca 0.35 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.71 2gkw h PHE 473 Cb 0.50 0.10 -0.22 0.00 2.79 0.00 0.00 35.95 39.12 2gkw h PHE 473 CO 1.00 -0.15 -0.33 0.14 -2.23 0.00 0.00 178.31 176.73 2gkw s VAL 474 N -5.93 0.04 0.32 1.41 -7.23 -1.22 -5.01 120.40 102.77 2gkw s VAL 474 Ca -0.15 -0.31 -0.29 0.00 -1.81 0.00 0.00 61.98 59.43 2gkw s VAL 474 Cb 0.05 -0.52 -0.10 0.00 0.56 0.00 0.00 36.38 36.37 2gkw s VAL 474 CO 0.64 -0.17 1.26 0.00 -0.31 0.00 0.00 175.10 176.52 2gkw s ALA 475 N -0.73 3.48 0.43 1.32 0.00 -1.26 -1.51 121.76 123.49 2gkw s ALA 475 Ca -0.08 1.18 0.10 0.00 0.00 0.00 0.00 51.96 53.16 2gkw s ALA 475 Cb -0.04 -3.44 0.97 0.00 0.00 0.00 0.00 23.12 20.60 2gkw s ALA 475 CO 0.02 -0.53 2.05 1.96 0.00 0.00 0.00 175.76 179.26 2gkw h GLN 476 N 3.52 0.42 0.72 0.00 4.20 -0.35 -1.40 115.11 122.21 2gkw h GLN 476 Ca -0.48 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.17 2gkw h GLN 476 Cb 1.22 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 28.91 2gkw h GLN 476 CO 0.66 0.28 -0.34 1.79 -0.67 0.00 0.00 178.83 180.54 2gkw h THR 477 N 0.43 0.18 -0.49 -0.54 1.35 -1.90 -1.67 112.91 110.27 2gkw h THR 477 Ca 0.17 -0.20 0.09 0.00 -0.55 0.00 0.00 66.41 65.91 2gkw h THR 477 Cb 0.12 0.22 -0.10 0.00 -1.73 0.00 0.00 68.15 66.67 2gkw h THR 477 CO -0.04 0.02 -0.37 0.58 -0.25 0.00 0.00 175.52 175.45 2gkw h VAL 478 N -1.13 0.16 0.00 6.82 2.07 -1.84 -0.33 116.25 122.01 2gkw h VAL 478 Ca -0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2gkw h VAL 478 Cb 0.76 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2gkw h VAL 478 CO 0.16 0.00 0.00 -0.11 0.02 0.00 0.00 177.57 177.64 2gkw n LEU 479 N -5.42 0.00 0.23 2.57 7.94 -0.57 -1.09 117.00 120.67 2gkw n LEU 479 Ca 0.02 0.66 0.17 0.00 -1.11 0.00 0.00 56.01 55.74 2gkw n LEU 479 Cb 0.35 -0.16 0.74 0.00 0.53 0.00 0.00 43.42 44.87 2gkw n LEU 479 CO 0.03 -0.16 1.14 -0.33 -1.11 0.00 0.00 177.39 176.96 2gkw h GLU 480 N 0.00 0.00 -0.22 1.96 5.08 -1.16 0.20 114.58 120.45 2gkw h GLU 480 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2gkw h GLU 480 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2gkw h GLU 480 CO 0.00 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.10 2gkw n ASN 481 N -3.18 3.23 -2.58 1.42 4.13 -0.15 -4.95 115.26 113.18 2gkw n ASN 481 Ca 0.02 -1.99 -0.04 0.00 1.68 0.00 0.00 54.58 54.25 2gkw n ASN 481 Cb 0.53 -0.13 0.01 0.00 -1.54 0.00 0.00 39.78 38.65 2gkw n ASN 481 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gkw n GLY 482 N 1.43 2.32 2.17 7.41 0.00 0.70 -5.02 105.19 114.19 2gkw n GLY 482 Ca 0.17 -2.17 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 2gkw n GLY 482 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gkw n THR 483 N -1.07 3.30 0.03 2.61 -2.24 -1.26 -4.37 114.28 111.27 2gkw n THR 483 Ca 0.02 -2.90 -0.19 0.00 -2.27 0.00 0.00 64.05 58.71 2gkw n THR 483 Cb 0.12 -0.95 -0.14 0.00 -2.10 0.00 0.00 70.33 67.26 2gkw n THR 483 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 2gkw h TYR 484 N 1.74 0.46 -3.27 4.78 0.05 -1.82 -1.80 116.97 117.11 2gkw h TYR 484 Ca 0.55 -0.34 -0.57 0.00 0.05 0.00 0.00 58.73 58.42 2gkw h TYR 484 Cb 1.40 -0.02 -0.05 0.00 1.01 0.00 0.00 36.73 39.07 2gkw h TYR 484 CO 1.36 1.58 -0.03 0.42 -1.05 0.00 0.00 178.16 180.44 2gkw s ILE 485 N -2.58 4.84 -0.21 -2.88 1.01 -1.26 -4.18 121.20 115.94 2gkw s ILE 485 Ca -0.16 1.22 -0.12 0.00 0.00 0.00 0.00 60.65 61.59 2gkw s ILE 485 Cb 0.07 -3.91 0.07 0.00 0.01 0.00 0.00 42.46 38.69 2gkw s ILE 485 CO 0.81 0.48 0.51 -0.75 0.00 0.00 0.00 174.94 175.99 2gkw s LYS 486 N -0.61 0.50 -1.40 2.79 2.20 -0.84 -4.90 119.74 117.48 2gkw s LYS 486 Ca 0.30 0.94 -0.09 0.00 -0.36 0.00 0.00 55.97 56.76 2gkw s LYS 486 Cb -0.19 0.04 0.03 0.00 -1.51 0.00 0.00 37.83 36.20 2gkw s LYS 486 CO 0.18 -0.15 1.07 -0.25 -0.36 0.00 0.00 175.35 175.84 2gkw n ASP 487 N 4.27 -5.13 -3.59 1.43 9.92 -1.26 -2.07 116.55 120.13 2gkw n ASP 487 Ca -0.22 -0.64 -0.27 0.00 -0.53 0.00 0.00 54.79 53.13 2gkw n ASP 487 Cb 0.57 -4.61 0.03 0.00 -0.64 0.00 0.00 41.12 36.46 2gkw n ASP 487 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2gkw n ASP 488 N -2.97 -5.00 -3.76 -2.24 4.64 -1.26 -4.80 116.55 101.16 2gkw n ASP 488 Ca -0.03 -0.57 -0.13 0.00 -1.38 0.00 0.00 54.79 52.68 2gkw n ASP 488 Cb 0.57 -4.02 -0.09 0.00 -1.04 0.00 0.00 41.12 36.54 2gkw n ASP 488 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 2gkw s THR 489 N -3.19 0.04 0.23 5.18 -1.32 -0.88 -0.59 115.64 115.10 2gkw s THR 489 Ca 0.53 -0.30 0.05 0.00 -1.21 0.00 0.00 61.69 60.76 2gkw s THR 489 Cb -0.26 -0.57 -0.05 0.00 -1.51 0.00 0.00 72.50 70.11 2gkw s THR 489 CO 0.65 -0.16 -0.05 0.27 -2.21 0.00 0.00 174.62 173.12 2gkw s ILE 490 N -0.77 1.32 -0.12 5.08 -4.36 -0.34 -2.00 121.20 120.01 2gkw s ILE 490 Ca -0.09 -2.09 0.00 0.00 -0.26 0.00 0.00 60.65 58.22 2gkw s ILE 490 Cb -0.04 -2.24 0.02 0.00 1.25 0.00 0.00 42.46 41.45 2gkw s ILE 490 CO 0.03 -0.43 -0.10 -0.36 0.24 0.00 0.00 174.94 174.32 2gkw s PHE 491 N -3.23 1.65 -0.10 1.37 0.40 -1.26 -1.12 117.98 115.68 2gkw s PHE 491 Ca 0.26 -0.84 -0.05 0.00 -0.60 0.00 0.00 56.93 55.71 2gkw s PHE 491 Cb 0.04 -1.31 -0.04 0.00 0.51 0.00 0.00 43.02 42.22 2gkw s PHE 491 CO 0.08 -0.53 0.08 0.42 0.70 0.00 0.00 175.22 175.97 2gkw s ILE 492 N 1.56 4.96 -0.04 0.64 1.01 0.82 -0.81 121.20 129.35 2gkw s ILE 492 Ca 0.03 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.71 2gkw s ILE 492 Cb -0.13 -3.14 0.00 0.00 0.01 0.00 0.00 42.46 39.21 2gkw s ILE 492 CO -0.08 0.61 -0.13 -0.75 0.00 0.00 0.00 174.94 174.59 2gkw s LYS 493 N -0.98 1.38 0.02 2.79 2.20 0.63 0.59 119.74 126.37 2gkw s LYS 493 Ca 0.14 -0.45 0.08 0.00 -0.36 0.00 0.00 55.97 55.38 2gkw s LYS 493 Cb -0.12 -1.23 -0.02 0.00 -1.51 0.00 0.00 37.83 34.95 2gkw s LYS 493 CO 0.03 0.17 -0.23 0.08 -0.36 0.00 0.00 175.35 175.05 2gkw s VAL 494 N 0.14 1.85 -0.16 4.02 1.01 -0.29 -1.40 120.40 125.58 2gkw s VAL 494 Ca -0.04 -1.19 -0.02 0.00 0.00 0.00 0.00 61.98 60.74 2gkw s VAL 494 Cb -0.10 -1.58 0.05 0.00 0.00 0.00 0.00 36.38 34.75 2gkw s VAL 494 CO 0.01 0.35 0.01 -0.63 0.00 0.00 0.00 175.10 174.85 2gkw s ILE 495 N -0.71 0.63 -0.21 2.22 1.01 -0.18 -1.15 121.20 122.81 2gkw s ILE 495 Ca 0.09 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.20 2gkw s ILE 495 Cb -0.09 -1.00 -0.05 0.00 0.01 0.00 0.00 42.46 41.34 2gkw s ILE 495 CO 0.01 -0.04 0.11 -0.69 0.00 0.00 0.00 174.94 174.32 2gkw s VAL 496 N 1.83 5.09 0.07 2.92 1.01 0.22 -0.19 120.40 131.34 2gkw s VAL 496 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 61.98 61.76 2gkw s VAL 496 Cb -0.16 -3.33 -0.07 0.00 0.00 0.00 0.00 36.38 32.83 2gkw s VAL 496 CO -0.07 0.41 1.33 -0.62 0.00 0.00 0.00 175.10 176.15 2gkw s ASP 497 N 0.65 6.91 -0.00 3.32 2.15 -0.10 -4.70 116.67 124.90 2gkw s ASP 497 Ca 0.06 2.17 0.09 0.00 0.43 0.00 0.00 52.55 55.30 2gkw s ASP 497 Cb -0.13 -2.58 -0.10 0.00 -0.30 0.00 0.00 42.92 39.81 2gkw s ASP 497 CO 0.01 -0.61 0.34 0.35 -0.17 0.00 0.00 175.17 175.10 2gkw n THR 498 N 4.10 0.00 -0.01 1.71 -2.24 -1.26 -4.51 114.28 112.07 2gkw n THR 498 Ca 0.11 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.52 2gkw n THR 498 Cb 0.44 0.89 -0.03 0.00 -2.10 0.00 0.00 70.33 69.53 2gkw n THR 498 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2gkw h SER 499 N 0.00 -0.36 -0.82 3.42 4.64 -1.99 -2.22 113.55 116.22 2gkw h SER 499 Ca 0.00 0.07 0.18 0.00 -0.47 0.00 0.00 61.79 61.57 2gkw h SER 499 Cb 0.24 0.18 -0.16 0.00 -0.31 0.00 0.00 62.40 62.36 2gkw h SER 499 CO 0.00 -0.15 -0.15 -0.67 -0.87 0.00 0.00 176.83 174.99 2gkw n ASP 500 N -5.26 -0.25 -4.62 4.97 -0.08 -1.26 -4.23 116.55 105.82 2gkw n ASP 500 Ca -0.03 1.41 -0.48 0.00 -1.51 0.00 0.00 54.79 54.18 2gkw n ASP 500 Cb 0.18 -0.45 -0.05 0.00 2.34 0.00 0.00 41.12 43.14 2gkw n ASP 500 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2gkw n LEU 501 N -5.30 3.14 0.00 -2.67 4.77 -0.84 -4.90 117.00 111.21 2gkw n LEU 501 Ca 0.15 0.73 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 2gkw n LEU 501 Cb 0.47 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.18 2gkw n LEU 501 CO -0.09 -0.30 0.47 -2.65 -1.33 0.00 0.00 177.39 173.49 2gkw n PRO 502 N 7.34 0.00 -2.71 3.23 -0.02 -1.26 -4.58 135.00 137.00 2gkw n PRO 502 Ca 0.28 0.78 -0.08 0.00 -2.02 0.00 0.00 63.50 62.46 2gkw n PRO 502 Cb 0.31 -1.44 0.11 0.00 -0.02 0.00 0.00 33.50 32.45 2gkw n PRO 502 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2gkw n ASP 503 N -2.46 -1.99 0.00 2.55 8.00 -1.26 -5.12 116.55 116.27 2gkw n ASP 503 Ca 0.00 -2.77 0.01 0.00 0.71 0.00 0.00 54.79 52.75 2gkw n ASP 503 Cb 0.00 1.23 0.09 0.00 -0.02 0.00 0.00 41.12 42.42 2gkw n ASP 503 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16