#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uwm n LEU 432 N 0.00 0.00 -0.40 -2.12 4.32 -1.26 -4.68 117.00 112.87 2uwm n LEU 432 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2uwm n LEU 432 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 2uwm n LEU 432 CO 0.00 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.17 2uwm n TYR 433 N -0.97 0.00 0.00 -1.77 4.19 -1.26 -4.88 117.16 112.48 2uwm n TYR 433 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 2uwm n TYR 433 Cb 0.00 -1.85 0.00 0.00 0.49 0.00 0.00 39.34 37.98 2uwm n TYR 433 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2uwm n ALA 434 N -0.00 0.00 -3.18 2.98 0.00 -1.26 -4.99 120.51 114.06 2uwm n ALA 434 Ca 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 53.44 53.24 2uwm n ALA 434 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2uwm n ALA 434 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2uwm s ILE 435 N -0.28 0.04 0.35 0.00 1.10 -1.26 -4.99 121.20 116.15 2uwm s ILE 435 Ca 0.00 -0.36 0.01 0.00 -0.51 0.00 0.00 60.65 59.79 2uwm s ILE 435 Cb 0.00 -0.49 0.01 0.00 0.15 0.00 0.00 42.46 42.13 2uwm s ILE 435 CO 0.00 -0.20 0.11 -0.24 -2.11 0.00 0.00 174.94 172.50 2uwm n SER 436 N 1.89 2.61 -0.07 4.50 2.88 -1.26 -5.10 113.62 119.07 2uwm n SER 436 Ca -0.19 -2.37 -0.09 0.00 -1.33 0.00 0.00 58.87 54.89 2uwm n SER 436 Cb 0.57 0.13 -0.08 0.00 -0.75 0.00 0.00 64.21 64.08 2uwm n SER 436 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2uwm n THR 437 N -1.05 0.83 -1.54 2.46 -1.04 -1.26 -4.95 114.28 107.73 2uwm n THR 437 Ca -0.09 -0.38 -0.40 0.00 -2.04 0.00 0.00 64.05 61.14 2uwm n THR 437 Cb 0.42 -0.92 -0.05 0.00 -1.82 0.00 0.00 70.33 67.96 2uwm n THR 437 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2uwm n GLU 438 N -2.77 1.07 -1.33 -2.82 4.71 -1.26 -4.78 120.64 113.45 2uwm n GLU 438 Ca -0.24 0.14 -0.38 0.00 -0.01 0.00 0.00 57.16 56.67 2uwm n GLU 438 Cb 0.81 -3.00 -0.02 0.00 -1.01 0.00 0.00 31.44 28.22 2uwm n GLU 438 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2uwm n ARG 439 N 8.77 2.58 -3.21 3.49 5.12 -1.26 -4.57 116.66 127.58 2uwm n ARG 439 Ca 0.40 -2.14 -0.40 0.00 -1.93 0.00 0.00 57.85 53.79 2uwm n ARG 439 Cb 0.41 -2.95 -0.02 0.00 -1.16 0.00 0.00 32.46 28.74 2uwm n ARG 439 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2uwm n TYR 440 N 5.58 3.19 1.89 -1.55 9.36 -1.26 -4.79 117.16 129.58 2uwm n TYR 440 Ca 0.56 -3.25 0.15 0.00 3.32 0.00 0.00 57.90 58.68 2uwm n TYR 440 Cb 0.32 -1.18 0.82 0.00 -0.63 0.00 0.00 39.34 38.66 2uwm n TYR 440 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2uwm n GLN 441 N 1.55 1.14 0.12 2.98 10.64 -1.26 -3.38 117.38 129.18 2uwm n GLN 441 Ca 0.26 -0.21 0.09 0.00 -1.83 0.00 0.00 57.00 55.32 2uwm n GLN 441 Cb 0.36 -1.47 0.47 0.00 -0.86 0.00 0.00 30.24 28.73 2uwm n GLN 441 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2uwm n ALA 442 N -0.73 1.21 -0.04 2.61 0.00 -1.26 -1.66 120.51 120.64 2uwm n ALA 442 Ca 0.22 0.13 -0.12 0.00 0.00 0.00 0.00 53.44 53.67 2uwm n ALA 442 Cb 0.16 -1.28 -0.07 0.00 0.00 0.00 0.00 19.45 18.25 2uwm n ALA 442 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2uwm h TRP 443 N 0.00 0.22 -0.51 0.00 6.55 -1.99 -2.21 115.95 118.01 2uwm h TRP 443 Ca 0.00 -0.05 -0.04 0.00 0.95 0.00 0.00 58.89 59.76 2uwm h TRP 443 Cb 0.10 -0.05 -0.02 0.00 -0.86 0.00 0.00 29.16 28.32 2uwm h TRP 443 CO 0.00 0.50 0.16 2.35 -1.05 0.00 0.00 178.44 180.40 2uwm h TRP 444 N -0.13 0.76 -0.48 0.49 2.91 -1.59 -1.08 115.95 116.84 2uwm h TRP 444 Ca 0.03 -0.05 0.01 0.00 1.13 0.00 0.00 58.89 60.00 2uwm h TRP 444 Cb 0.43 -0.23 -0.02 0.00 -0.51 0.00 0.00 29.16 28.83 2uwm h TRP 444 CO 0.05 0.62 0.31 0.37 -1.03 0.00 0.00 178.44 178.77 2uwm h GLN 445 N 0.74 0.62 -0.02 2.65 4.15 -1.47 -0.35 115.11 121.42 2uwm h GLN 445 Ca 0.17 -0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.44 2uwm h GLN 445 Cb 0.22 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 2uwm h GLN 445 CO -0.01 0.41 -0.50 0.00 -1.93 0.00 0.00 178.83 176.79 2uwm h ALA 446 N 1.18 1.12 -0.04 3.38 0.00 -0.96 -1.74 119.26 122.20 2uwm h ALA 446 Ca 0.18 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 2uwm h ALA 446 Cb -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2uwm h ALA 446 CO -0.04 0.64 -0.08 0.28 0.00 0.00 0.00 179.25 180.05 2uwm h VAL 447 N 0.05 1.42 -0.50 0.00 2.07 -1.01 -2.29 116.25 116.00 2uwm h VAL 447 Ca -0.00 -1.38 0.09 0.00 0.82 0.00 0.00 66.70 66.23 2uwm h VAL 447 Cb 0.91 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 32.85 2uwm h VAL 447 CO 0.07 0.38 0.08 0.71 0.02 0.00 0.00 177.57 178.83 2uwm h THR 448 N -0.38 0.70 -0.30 2.57 1.35 -1.01 0.50 112.91 116.34 2uwm h THR 448 Ca 0.00 -0.07 0.06 0.00 -0.55 0.00 0.00 66.41 65.84 2uwm h THR 448 Cb 0.65 0.46 -0.05 0.00 -1.73 0.00 0.00 68.15 67.48 2uwm h THR 448 CO 0.02 0.04 -0.03 -0.09 -0.25 0.00 0.00 175.52 175.21 2uwm h ARG 449 N 0.22 0.05 -0.50 4.72 9.65 -1.34 0.19 114.38 127.37 2uwm h ARG 449 Ca 0.25 -0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 59.05 2uwm h ARG 449 Cb 0.35 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.90 2uwm h ARG 449 CO -0.34 0.03 -0.00 0.00 2.80 0.00 0.00 179.97 182.46 2uwm h ALA 450 N 1.28 0.68 -0.20 2.80 0.00 -0.87 -1.56 119.26 121.38 2uwm h ALA 450 Ca 0.14 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 2uwm h ALA 450 Cb 0.21 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2uwm h ALA 450 CO -0.27 0.49 -0.34 -0.07 0.00 0.00 0.00 179.25 179.06 2uwm h LEU 451 N 0.75 0.65 -0.67 0.00 3.38 -0.75 -0.68 115.31 118.00 2uwm h LEU 451 Ca 0.14 -0.53 0.04 0.00 0.09 0.00 0.00 57.88 57.62 2uwm h LEU 451 Cb 0.52 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2uwm h LEU 451 CO 0.03 1.06 0.40 -0.33 0.09 0.00 0.00 178.44 179.69 2uwm h GLU 452 N 0.27 0.75 -0.69 1.13 5.08 -0.95 0.26 114.58 120.44 2uwm h GLU 452 Ca 0.01 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2uwm h GLU 452 Cb 0.93 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 2uwm h GLU 452 CO 0.08 0.50 0.21 1.49 -1.00 0.00 0.00 179.01 180.28 2uwm h GLU 453 N 0.77 1.06 -0.15 2.33 4.81 -1.22 -2.30 114.58 119.87 2uwm h GLU 453 Ca 0.28 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 59.20 2uwm h GLU 453 Cb 0.08 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 2uwm h GLU 453 CO -0.13 0.91 -0.25 0.35 -0.73 0.00 0.00 179.01 179.16 2uwm h PHE 454 N 1.02 0.54 -0.02 0.92 3.57 -0.37 -3.01 116.94 119.59 2uwm h PHE 454 Ca 0.22 -0.19 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 2uwm h PHE 454 Cb 0.30 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2uwm h PHE 454 CO 0.02 0.87 -0.36 0.45 -2.23 0.00 0.00 178.31 177.07 2uwm h HIS 455 N 0.06 0.05 0.00 0.41 3.86 -0.39 0.27 115.15 119.40 2uwm h HIS 455 Ca 0.01 -0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 59.05 2uwm h HIS 455 Cb 0.82 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 29.26 2uwm h HIS 455 CO 0.09 0.40 -0.76 0.66 0.86 0.00 0.00 177.93 179.18 2uwm h SER 456 N 0.04 0.00 0.29 2.45 4.64 -1.49 -3.05 113.55 116.42 2uwm h SER 456 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.99 2uwm h SER 456 Cb 0.65 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.77 2uwm h SER 456 CO 0.05 0.76 -1.53 -0.09 -0.87 0.00 0.00 176.83 175.14 2uwm h ARG 457 N 0.00 0.48 -2.16 4.77 2.43 -1.33 -3.41 114.38 115.17 2uwm h ARG 457 Ca -0.01 -0.82 -0.59 0.00 -0.81 0.00 0.00 59.98 57.75 2uwm h ARG 457 Cb 1.37 0.30 -0.41 0.00 -0.42 0.00 0.00 29.97 30.81 2uwm h ARG 457 CO 0.10 1.39 -0.70 0.66 -1.51 0.00 0.00 179.97 179.91 2uwm n TYR 458 N -3.66 2.89 0.56 2.20 4.02 0.91 -4.92 117.16 119.16 2uwm n TYR 458 Ca -0.18 -4.04 0.09 0.00 -0.01 0.00 0.00 57.90 53.76 2uwm n TYR 458 Cb 1.09 -0.52 0.38 0.00 -0.02 0.00 0.00 39.34 40.28 2uwm n TYR 458 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2uwm n PRO 459 N 0.88 0.03 -0.61 -0.72 -0.04 -1.15 -2.30 135.00 131.09 2uwm n PRO 459 Ca 0.28 0.24 0.02 0.00 -0.04 0.00 0.00 63.50 64.00 2uwm n PRO 459 Cb 0.43 -1.56 0.22 0.00 -0.04 0.00 0.00 33.50 32.56 2uwm n PRO 459 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2uwm n LEU 460 N -1.63 4.00 -4.51 1.53 4.77 -1.26 -0.76 117.00 119.14 2uwm n LEU 460 Ca 0.04 -3.38 -0.28 0.00 -0.03 0.00 0.00 56.01 52.36 2uwm n LEU 460 Cb 0.21 -0.59 -0.11 0.00 -2.33 0.00 0.00 43.42 40.61 2uwm n LEU 460 CO 0.17 0.95 -0.46 -0.13 -1.33 0.00 0.00 177.39 176.59 2uwm s ARG 461 N -3.04 1.86 0.49 3.23 0.52 -0.97 -4.88 118.95 116.16 2uwm s ARG 461 Ca 0.43 -1.27 0.28 0.00 -0.52 0.00 0.00 55.73 54.65 2uwm s ARG 461 Cb 0.37 -2.09 0.94 0.00 0.52 0.00 0.00 34.95 34.70 2uwm s ARG 461 CO 0.04 0.45 1.83 -1.00 0.02 0.00 0.00 175.30 176.64 2uwm h PRO 462 N 3.29 0.00 0.00 3.54 0.13 -1.86 -3.45 132.00 133.65 2uwm h PRO 462 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2uwm h PRO 462 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2uwm h PRO 462 CO 0.50 0.05 0.00 0.41 -0.23 0.00 0.00 178.00 178.73 2uwm n GLY 463 N 0.42 -0.21 3.74 1.56 0.00 -1.26 -4.54 105.19 104.89 2uwm n GLY 463 Ca 0.02 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 2uwm n GLY 463 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2uwm s LEU 464 N 0.00 4.49 0.05 0.99 2.96 -0.72 -4.66 118.68 121.79 2uwm s LEU 464 Ca 0.00 2.13 -0.33 0.00 -0.22 0.00 0.00 54.13 55.71 2uwm s LEU 464 Cb 0.00 -3.61 -0.12 0.00 0.50 0.00 0.00 46.19 42.96 2uwm s LEU 464 CO 0.00 -0.23 1.75 0.00 -1.32 0.00 0.00 176.35 176.55 2uwm n ALA 465 N 2.24 1.30 -0.20 5.97 0.00 -1.26 -0.90 120.51 127.66 2uwm n ALA 465 Ca 0.02 0.35 0.15 0.00 0.00 0.00 0.00 53.44 53.97 2uwm n ALA 465 Cb 0.46 -2.46 0.48 0.00 0.00 0.00 0.00 19.45 17.92 2uwm n ALA 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uwm h ARG 466 N 7.81 0.46 -0.02 0.00 3.08 -1.25 0.14 114.38 124.61 2uwm h ARG 466 Ca -0.47 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.42 2uwm h ARG 466 Cb 1.26 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 2uwm h ARG 466 CO 0.92 0.31 -0.61 1.05 -1.07 0.00 0.00 179.97 180.57 2uwm h GLU 467 N 0.48 0.07 -0.35 0.04 9.09 -1.90 -1.17 114.58 120.84 2uwm h GLU 467 Ca 0.40 -0.05 -0.12 0.00 0.05 0.00 0.00 59.36 59.64 2uwm h GLU 467 Cb 0.86 0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 27.96 2uwm h GLU 467 CO -0.14 0.65 -0.24 1.49 0.05 0.00 0.00 179.01 180.81 2uwm h GLU 468 N 0.05 0.78 -0.41 1.06 4.81 -1.13 -1.44 114.58 118.28 2uwm h GLU 468 Ca -0.01 -0.37 -0.09 0.00 -0.13 0.00 0.00 59.36 58.76 2uwm h GLU 468 Cb 1.08 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2uwm h GLU 468 CO 0.08 1.00 -0.10 1.25 -0.73 0.00 0.00 179.01 180.51 2uwm h LEU 469 N 0.56 0.80 -0.33 1.64 5.85 -1.23 -2.26 115.31 120.34 2uwm h LEU 469 Ca 0.07 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.49 2uwm h LEU 469 Cb 0.81 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.54 2uwm h LEU 469 CO 0.07 0.98 -0.45 -0.09 -0.34 0.00 0.00 178.44 178.60 2uwm h ARG 470 N 0.62 -0.38 -0.01 1.25 9.65 -1.18 -2.60 114.38 121.73 2uwm h ARG 470 Ca 0.11 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.01 2uwm h ARG 470 Cb 0.62 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.29 2uwm h ARG 470 CO 0.04 -0.25 -0.01 -1.13 2.80 0.00 0.00 179.97 181.42 2uwm n SER 471 N -5.42 1.07 -0.06 -3.80 3.41 -0.55 -1.70 113.62 106.58 2uwm n SER 471 Ca -0.02 -1.33 -0.03 0.00 -0.26 0.00 0.00 58.87 57.22 2uwm n SER 471 Cb 0.36 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.18 2uwm n SER 471 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2uwm n ARG 472 N -0.18 1.16 0.00 4.33 1.74 -0.86 -4.60 116.66 118.26 2uwm n ARG 472 Ca 0.20 -0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 2uwm n ARG 472 Cb 0.29 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 2uwm n ARG 472 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2uwm n TYR 473 N -2.46 0.00 -2.77 -1.55 4.02 -0.99 -4.87 117.16 108.54 2uwm n TYR 473 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.69 2uwm n TYR 473 Cb 0.87 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 40.24 2uwm n TYR 473 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2uwm n PHE 474 N -0.35 0.83 -0.04 -0.72 3.72 -0.69 -4.97 117.46 115.25 2uwm n PHE 474 Ca 0.00 -1.85 -0.02 0.00 -0.05 0.00 0.00 57.45 55.53 2uwm n PHE 474 Cb 0.02 -0.09 -0.01 0.00 -0.94 0.00 0.00 39.48 38.46 2uwm n PHE 474 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2uwm h SER 475 N 2.23 0.00 -0.81 4.37 0.87 -1.71 -3.41 113.55 115.10 2uwm h SER 475 Ca -0.18 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.34 2uwm h SER 475 Cb 1.37 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.29 2uwm h SER 475 CO 0.14 0.41 0.35 0.03 -0.53 0.00 0.00 176.83 177.23 2uwm h ARG 476 N -0.58 1.19 -6.15 2.24 2.47 -1.92 -3.38 114.38 108.26 2uwm h ARG 476 Ca 0.00 -0.20 -0.57 0.00 -1.26 0.00 0.00 59.98 57.96 2uwm h ARG 476 Cb 0.24 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 2uwm h ARG 476 CO 0.00 0.94 1.37 -0.48 0.56 0.00 0.00 179.97 182.36 2uwm s LEU 477 N -9.74 3.83 -0.68 3.04 2.34 -1.26 -4.86 118.68 111.34 2uwm s LEU 477 Ca -0.12 2.12 -0.08 0.00 0.06 0.00 0.00 54.13 56.11 2uwm s LEU 477 Cb 0.16 -3.52 -0.07 0.00 -0.56 0.00 0.00 46.19 42.20 2uwm s LEU 477 CO 0.83 -1.58 1.84 -2.65 -1.06 0.00 0.00 176.35 173.74 2uwm n PRO 478 N 8.24 1.51 -2.88 1.48 -0.02 -1.26 -4.87 135.00 137.20 2uwm n PRO 478 Ca 0.25 -1.31 -0.43 0.00 -2.02 0.00 0.00 63.50 59.99 2uwm n PRO 478 Cb 0.44 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 2uwm n PRO 478 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2uwm s ALA 479 N 4.10 3.21 -0.37 3.55 0.00 -1.26 -4.81 121.76 126.18 2uwm s ALA 479 Ca 0.36 -1.17 0.23 0.00 0.00 0.00 0.00 51.96 51.37 2uwm s ALA 479 Cb 0.09 -3.65 0.22 0.00 0.00 0.00 0.00 23.12 19.78 2uwm s ALA 479 CO 0.01 -2.24 1.41 0.00 0.00 0.00 0.00 175.76 174.94 2uwm h ARG 480 N 9.20 0.00 0.00 0.00 3.08 -1.96 -3.32 114.38 121.38 2uwm h ARG 480 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2uwm h ARG 480 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2uwm h ARG 480 CO 1.05 0.00 0.00 1.33 -1.07 0.00 0.00 179.97 181.28 2uwm n VAL 481 N -2.94 0.08 -0.27 2.04 0.24 -1.26 -3.65 118.33 112.57 2uwm n VAL 481 Ca 0.03 0.02 0.07 0.00 -2.04 0.00 0.00 64.34 62.41 2uwm n VAL 481 Cb 0.54 -0.62 0.30 0.00 -1.47 0.00 0.00 33.84 32.59 2uwm n VAL 481 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 2uwm h TYR 482 N 0.00 0.92 -0.14 6.34 5.03 -1.97 0.34 116.97 127.49 2uwm h TYR 482 Ca 0.00 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.26 2uwm h TYR 482 Cb 0.07 -0.30 -0.00 0.00 1.55 0.00 0.00 36.73 38.05 2uwm h TYR 482 CO 0.00 0.45 -0.22 1.96 -1.32 0.00 0.00 178.16 179.03 2uwm h GLN 483 N 0.87 0.39 -0.67 1.82 7.50 -1.88 -1.23 115.11 121.91 2uwm h GLN 483 Ca 0.39 -0.24 0.03 0.00 0.50 0.00 0.00 58.65 59.33 2uwm h GLN 483 Cb 0.35 0.02 -0.04 0.00 0.05 0.00 0.00 27.48 27.87 2uwm h GLN 483 CO -0.16 0.82 0.44 0.00 -1.50 0.00 0.00 178.83 178.44 2uwm h ALA 484 N 0.56 1.61 -0.38 3.87 0.00 -1.67 -1.45 119.26 121.81 2uwm h ALA 484 Ca 0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2uwm h ALA 484 Cb 0.79 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2uwm h ALA 484 CO 0.05 0.32 0.09 1.25 0.00 0.00 0.00 179.25 180.96 2uwm h LEU 485 N 0.81 0.58 -0.63 0.00 6.46 -0.23 -1.69 115.31 120.62 2uwm h LEU 485 Ca 0.27 -0.24 0.01 0.00 -0.12 0.00 0.00 57.88 57.80 2uwm h LEU 485 Cb 0.05 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 39.80 2uwm h LEU 485 CO -0.07 0.67 0.42 -0.07 -0.62 0.00 0.00 178.44 178.76 2uwm h LEU 486 N 0.47 0.73 -0.70 2.25 4.07 -0.58 -2.33 115.31 119.22 2uwm h LEU 486 Ca 0.12 -0.02 -0.14 0.00 0.08 0.00 0.00 57.88 57.92 2uwm h LEU 486 Cb 0.31 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 41.85 2uwm h LEU 486 CO 0.00 0.53 -0.65 -0.33 -1.08 0.00 0.00 178.44 176.91 2uwm h GLU 487 N 0.86 0.02 0.33 1.13 5.08 -1.25 -0.65 114.58 120.10 2uwm h GLU 487 Ca 0.23 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2uwm h GLU 487 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2uwm h GLU 487 CO -0.05 0.66 -0.16 1.49 -1.00 0.00 0.00 179.01 179.95 2uwm h GLU 488 N 0.01 -0.43 -0.56 2.33 4.57 -1.09 0.20 114.58 119.61 2uwm h GLU 488 Ca -0.01 0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2uwm h GLU 488 Cb 1.15 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 2uwm h GLU 488 CO 0.09 -0.18 0.35 -1.49 -1.18 0.00 0.00 179.01 176.59 2uwm h TRP 489 N -0.61 0.72 -0.03 0.92 6.55 -1.41 -0.44 115.95 121.64 2uwm h TRP 489 Ca -0.05 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.80 2uwm h TRP 489 Cb 0.44 -0.24 -0.00 0.00 -0.86 0.00 0.00 29.16 28.50 2uwm h TRP 489 CO -0.01 0.48 0.02 1.03 -1.05 0.00 0.00 178.44 178.90 2uwm h SER 490 N 0.77 0.04 0.34 -3.49 0.87 -0.93 -1.25 113.55 109.89 2uwm h SER 490 Ca 0.20 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 2uwm h SER 490 Cb -0.04 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2uwm h SER 490 CO -0.04 0.09 -0.19 -0.09 -0.53 0.00 0.00 176.83 176.07 2uwm h ARG 491 N -0.02 0.00 0.00 2.24 2.43 -0.07 0.61 114.38 119.57 2uwm h ARG 491 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2uwm h ARG 491 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2uwm h ARG 491 CO -0.00 0.19 0.00 0.93 -1.51 0.00 0.00 179.97 179.58 2uwm h GLU 492 N 0.00 0.00 0.00 0.20 5.08 -0.91 -3.47 114.58 115.48 2uwm h GLU 492 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2uwm h GLU 492 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2uwm h GLU 492 CO 0.03 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 2uwm n GLY 493 N 0.19 0.44 0.03 -3.84 0.00 0.20 -4.94 105.19 97.28 2uwm n GLY 493 Ca 0.02 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.17 2uwm n GLY 493 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwm n ARG 494 N -2.58 0.30 -3.80 1.61 1.74 -0.50 -4.71 116.66 108.73 2uwm n ARG 494 Ca 0.00 -0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 2uwm n ARG 494 Cb 0.08 -1.60 -0.12 0.00 -1.02 0.00 0.00 32.46 29.81 2uwm n ARG 494 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2uwm s LEU 495 N -3.98 1.19 -0.27 0.55 2.96 -1.19 -1.98 118.68 115.96 2uwm s LEU 495 Ca 0.03 0.42 -0.10 0.00 -0.22 0.00 0.00 54.13 54.26 2uwm s LEU 495 Cb 0.14 0.72 -0.05 0.00 0.50 0.00 0.00 46.19 47.50 2uwm s LEU 495 CO 0.80 -0.07 0.16 -1.10 -1.32 0.00 0.00 176.35 174.82 2uwm s GLN 496 N 0.13 3.91 -0.25 1.98 -0.21 0.34 -4.37 119.66 121.19 2uwm s GLN 496 Ca -0.00 -0.34 -0.08 0.00 0.02 0.00 0.00 55.36 54.95 2uwm s GLN 496 Cb -0.02 -3.58 -0.04 0.00 1.00 0.00 0.00 33.01 30.38 2uwm s GLN 496 CO 0.00 -0.14 0.10 -0.51 -2.12 0.00 0.00 175.29 172.62 2uwm s LEU 497 N 1.62 3.66 0.00 2.90 1.43 -1.26 -0.71 118.68 126.31 2uwm s LEU 497 Ca 0.07 -0.11 0.09 0.00 -1.03 0.00 0.00 54.13 53.15 2uwm s LEU 497 Cb -0.15 -1.99 0.09 0.00 0.03 0.00 0.00 46.19 44.17 2uwm s LEU 497 CO 0.09 -0.01 0.76 0.00 0.23 0.00 0.00 176.35 177.41 2uwm n ALA 498 N 4.79 1.20 -0.30 4.21 0.00 -0.02 -5.03 120.51 125.37 2uwm n ALA 498 Ca -0.16 -2.17 -0.03 0.00 0.00 0.00 0.00 53.44 51.08 2uwm n ALA 498 Cb 0.52 0.64 0.09 0.00 0.00 0.00 0.00 19.45 20.70 2uwm n ALA 498 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uwm h ALA 499 N 0.20 1.05 0.00 0.00 0.00 -1.79 -3.34 119.26 115.39 2uwm h ALA 499 Ca -0.29 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2uwm h ALA 499 Cb 1.28 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2uwm h ALA 499 CO 0.42 0.40 -0.17 0.27 0.00 0.00 0.00 179.25 180.17 2uwm n ASN 500 N -4.55 0.62 -4.31 0.00 0.23 -0.96 -4.98 115.26 101.31 2uwm n ASN 500 Ca 0.09 -1.78 -0.20 0.00 -0.53 0.00 0.00 54.58 52.16 2uwm n ASN 500 Cb 0.05 -0.13 -0.11 0.00 -2.08 0.00 0.00 39.78 37.51 2uwm n ASN 500 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2uwm s THR 501 N -0.54 1.69 -0.02 5.53 -4.23 -1.25 -0.75 115.64 116.07 2uwm s THR 501 Ca 0.04 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 58.68 2uwm s THR 501 Cb 0.04 -1.81 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 2uwm s THR 501 CO 0.00 -0.39 -0.20 -0.69 -0.54 0.00 0.00 174.62 172.80 2uwm s VAL 502 N -2.25 1.58 -0.01 2.29 1.01 -0.08 -0.84 120.40 122.09 2uwm s VAL 502 Ca 0.15 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.31 2uwm s VAL 502 Cb -0.05 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 2uwm s VAL 502 CO 0.06 0.45 -0.07 0.00 0.00 0.00 0.00 175.10 175.53 2uwm s ALA 503 N -0.44 0.62 0.28 5.51 0.00 0.11 -1.75 121.76 126.09 2uwm s ALA 503 Ca 0.07 -0.32 -0.28 0.00 0.00 0.00 0.00 51.96 51.44 2uwm s ALA 503 Cb -0.08 -0.16 -0.15 0.00 0.00 0.00 0.00 23.12 22.73 2uwm s ALA 503 CO -0.01 0.15 0.84 1.28 0.00 0.00 0.00 175.76 178.03 2uwm n LEU 504 N 2.91 0.86 -4.73 0.00 4.32 -1.26 0.13 117.00 119.22 2uwm n LEU 504 Ca -0.13 1.14 -0.42 0.00 -0.02 0.00 0.00 56.01 56.58 2uwm n LEU 504 Cb 0.57 -1.19 -0.03 0.00 -1.62 0.00 0.00 43.42 41.16 2uwm n LEU 504 CO 0.25 -1.94 1.15 0.00 -1.22 0.00 0.00 177.39 175.63 2uwm s ALA 505 N -1.08 3.68 0.00 -1.18 0.00 -0.84 -2.49 121.76 119.86 2uwm s ALA 505 Ca 0.60 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.85 2uwm s ALA 505 Cb -0.75 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 18.79 2uwm s ALA 505 CO 0.59 -0.72 0.00 0.41 0.00 0.00 0.00 175.76 176.04 2uwm n GLY 506 N 3.20 2.57 3.72 0.00 0.00 -1.26 -4.95 105.19 108.48 2uwm n GLY 506 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2uwm n GLY 506 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2uwm s PHE 507 N -2.58 3.09 -0.09 1.61 5.36 -1.04 -5.02 117.98 119.31 2uwm s PHE 507 Ca 0.00 0.75 0.01 0.00 -0.96 0.00 0.00 56.93 56.73 2uwm s PHE 507 Cb 0.00 -3.86 0.02 0.00 -0.34 0.00 0.00 43.02 38.83 2uwm s PHE 507 CO 0.00 -3.10 -0.12 0.99 -1.46 0.00 0.00 175.22 171.53 2uwm s THR 508 N 0.97 1.23 0.61 0.12 2.01 -1.26 -5.03 115.64 114.28 2uwm s THR 508 Ca 0.67 -0.49 -0.18 0.00 0.31 0.00 0.00 61.69 62.00 2uwm s THR 508 Cb -0.42 -1.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.91 2uwm s THR 508 CO 0.33 0.39 1.19 -2.16 -0.69 0.00 0.00 174.62 173.68 2uwm s PRO 509 N 1.02 2.92 -0.12 4.92 0.04 -1.26 -4.86 135.00 137.65 2uwm s PRO 509 Ca -0.07 1.76 -0.03 0.00 0.04 0.00 0.00 61.00 62.70 2uwm s PRO 509 Cb -0.15 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.40 2uwm s PRO 509 CO -0.01 -1.23 2.78 -1.13 0.04 0.00 0.00 177.00 177.45 2uwm n SER 510 N -1.73 5.66 -4.85 6.66 3.41 0.06 -4.88 113.62 117.95 2uwm n SER 510 Ca 0.13 -2.67 -0.31 0.00 -0.26 0.00 0.00 58.87 55.76 2uwm n SER 510 Cb 0.50 -1.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.20 2uwm n SER 510 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2uwm s PHE 511 N -0.16 3.47 0.90 7.33 0.08 -1.26 -4.97 117.98 123.37 2uwm s PHE 511 Ca 0.41 1.37 -0.11 0.00 0.12 0.00 0.00 56.93 58.73 2uwm s PHE 511 Cb 0.23 -2.78 0.13 0.00 -0.57 0.00 0.00 43.02 40.03 2uwm s PHE 511 CO -0.04 -0.69 1.10 -1.54 -0.10 0.00 0.00 175.22 173.95 2uwm s SER 512 N -3.71 3.29 0.39 1.36 1.04 -1.26 -4.79 113.70 110.02 2uwm s SER 512 Ca 0.57 1.79 0.09 0.00 0.48 0.00 0.00 55.95 58.88 2uwm s SER 512 Cb -0.11 -2.40 0.80 0.00 0.10 0.00 0.00 66.02 64.40 2uwm s SER 512 CO 0.46 -2.80 1.94 -0.33 0.98 0.00 0.00 173.24 173.50 2uwm h GLU 513 N -1.66 0.31 -0.15 4.02 4.39 -1.99 0.91 114.58 120.41 2uwm h GLU 513 Ca -0.47 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.15 2uwm h GLU 513 Cb 1.27 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 2uwm h GLU 513 CO 0.49 0.38 0.01 1.15 -1.16 0.00 0.00 179.01 179.88 2uwm h THR 514 N 0.30 1.24 -0.96 1.13 2.02 -2.00 -2.54 112.91 112.11 2uwm h THR 514 Ca 0.07 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.45 2uwm h THR 514 Cb 0.28 1.48 -0.05 0.00 -1.74 0.00 0.00 68.15 68.12 2uwm h THR 514 CO 0.01 0.24 0.62 1.56 0.37 0.00 0.00 175.52 178.32 2uwm h GLN 515 N 0.02 1.28 -0.75 6.66 4.20 -1.83 -1.16 115.11 123.53 2uwm h GLN 515 Ca 0.04 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.67 2uwm h GLN 515 Cb 0.35 -0.28 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 2uwm h GLN 515 CO 0.01 0.86 0.49 0.87 -0.67 0.00 0.00 178.83 180.40 2uwm h LYS 516 N 1.31 0.99 -0.10 1.46 1.57 -0.72 -1.41 116.57 119.68 2uwm h LYS 516 Ca 0.35 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.99 2uwm h LYS 516 Cb -0.12 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 31.97 2uwm h LYS 516 CO -0.07 0.65 -0.24 -0.22 -0.57 0.00 0.00 179.45 179.00 2uwm h LYS 517 N 1.02 0.34 -0.75 3.15 3.11 -1.16 -2.91 116.57 119.35 2uwm h LYS 517 Ca 0.27 -0.23 0.12 0.00 -2.81 0.00 0.00 60.65 58.01 2uwm h LYS 517 Cb -0.11 0.03 -0.09 0.00 -1.00 0.00 0.00 32.23 31.06 2uwm h LYS 517 CO -0.06 0.84 0.34 -0.07 -2.81 0.00 0.00 179.45 177.69 2uwm h LEU 518 N -0.12 0.38 -0.54 5.20 3.38 -1.00 0.39 115.31 123.01 2uwm h LEU 518 Ca -0.00 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2uwm h LEU 518 Cb 0.85 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 2uwm h LEU 518 CO 0.05 0.18 0.30 -0.07 0.09 0.00 0.00 178.44 178.99 2uwm h LEU 519 N 0.53 0.45 0.07 1.67 3.38 -1.25 0.40 115.31 120.56 2uwm h LEU 519 Ca 0.40 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.38 2uwm h LEU 519 Cb 0.54 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2uwm h LEU 519 CO -0.35 0.31 -0.03 0.11 0.09 0.00 0.00 178.44 178.57 2uwm h LYS 520 N 0.58 -0.09 -0.80 1.13 1.57 -1.19 -1.73 116.57 116.04 2uwm h LYS 520 Ca 0.23 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.04 2uwm h LYS 520 Cb 0.09 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 2uwm h LYS 520 CO -0.13 0.03 0.53 -0.44 -0.57 0.00 0.00 179.45 178.86 2uwm h ASP 521 N -0.20 0.86 -0.37 0.86 3.32 -0.65 -1.98 116.42 118.27 2uwm h ASP 521 Ca -0.01 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.91 2uwm h ASP 521 Cb 0.17 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2uwm h ASP 521 CO 0.02 0.59 -0.24 -0.07 -1.72 0.00 0.00 179.24 177.82 2uwm h LEU 522 N 1.00 0.85 -0.44 1.55 3.38 -0.15 -1.91 115.31 119.58 2uwm h LEU 522 Ca 0.31 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2uwm h LEU 522 Cb 0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2uwm h LEU 522 CO -0.09 1.10 0.25 -0.08 0.09 0.00 0.00 178.44 179.70 2uwm h GLU 523 N 0.61 0.48 -0.32 1.13 4.81 -0.92 -2.22 114.58 118.14 2uwm h GLU 523 Ca 0.07 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2uwm h GLU 523 Cb 0.81 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2uwm h GLU 523 CO 0.07 0.32 0.07 -0.44 -0.73 0.00 0.00 179.01 178.30 2uwm h ASP 524 N 0.49 0.48 -0.51 1.04 3.32 -1.37 -1.53 116.42 118.35 2uwm h ASP 524 Ca 0.18 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 2uwm h ASP 524 Cb 0.05 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2uwm h ASP 524 CO -0.11 0.60 0.25 0.50 -1.72 0.00 0.00 179.24 178.76 2uwm h LYS 525 N 0.35 0.73 -0.42 3.56 3.64 -1.20 -0.96 116.57 122.28 2uwm h LYS 525 Ca 0.10 -0.11 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2uwm h LYS 525 Cb 0.30 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2uwm h LYS 525 CO 0.00 0.61 -0.24 1.88 -2.27 0.00 0.00 179.45 179.43 2uwm h TYR 526 N 0.68 0.98 0.00 1.91 -1.99 -1.38 -2.01 116.97 115.17 2uwm h TYR 526 Ca 0.18 -0.24 -0.00 0.00 2.00 0.00 0.00 58.73 60.67 2uwm h TYR 526 Cb 0.11 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.62 2uwm h TYR 526 CO -0.01 1.01 -0.00 -0.09 -0.00 0.00 0.00 178.16 179.07 2uwm h ARG 527 N 0.74 -0.00 -0.70 4.88 2.43 -1.07 -2.40 114.38 118.26 2uwm h ARG 527 Ca 0.09 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2uwm h ARG 527 Cb 0.79 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.31 2uwm h ARG 527 CO 0.07 0.07 0.23 0.28 -1.51 0.00 0.00 179.97 179.10 2uwm h VAL 528 N -0.07 1.25 0.00 0.20 2.07 -1.14 -2.99 116.25 115.56 2uwm h VAL 528 Ca -0.00 -0.85 -0.08 0.00 0.82 0.00 0.00 66.70 66.58 2uwm h VAL 528 Cb 0.07 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2uwm h VAL 528 CO 0.00 0.34 -0.40 0.28 0.02 0.00 0.00 177.57 177.80 2uwm h SER 529 N 1.03 0.00 0.00 0.57 0.02 -1.34 -3.47 113.55 110.36 2uwm h SER 529 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2uwm h SER 529 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2uwm h SER 529 CO -0.01 0.40 0.00 -1.14 -1.14 0.00 0.00 176.83 174.94 2uwm n ARG 530 N -3.55 0.00 0.00 3.45 0.63 -0.91 -1.20 116.66 115.08 2uwm n ARG 530 Ca -0.00 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.07 2uwm n ARG 530 Cb 0.53 0.00 0.60 0.00 0.45 0.00 0.00 32.46 34.04 2uwm n ARG 530 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2uwm n TRP 531 N 0.00 0.00 -2.97 -0.14 8.01 -1.26 -3.90 117.44 117.18 2uwm n TRP 531 Ca 0.00 0.00 -0.28 0.00 -1.31 0.00 0.00 57.50 55.91 2uwm n TRP 531 Cb 0.00 -0.21 -0.04 0.00 -2.01 0.00 0.00 31.31 29.05 2uwm n TRP 531 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 2uwm n GLN 532 N -1.04 3.31 -1.89 -0.99 3.00 -0.34 -4.96 117.38 114.46 2uwm n GLN 532 Ca 0.13 -4.84 -0.37 0.00 -0.01 0.00 0.00 57.00 51.91 2uwm n GLN 532 Cb 0.28 -2.26 0.04 0.00 0.00 0.00 0.00 30.24 28.30 2uwm n GLN 532 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2uwm s PRO 533 N -3.43 3.06 0.68 -1.09 0.04 -1.25 -4.83 135.00 128.18 2uwm s PRO 533 Ca 0.48 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.40 2uwm s PRO 533 Cb 0.26 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.70 2uwm s PRO 533 CO -0.13 -1.19 1.17 -1.25 0.04 0.00 0.00 177.00 175.64 2uwm s PRO 534 N -3.08 2.51 0.58 0.56 0.04 -1.26 -4.99 135.00 129.36 2uwm s PRO 534 Ca 0.74 1.62 -0.15 0.00 0.04 0.00 0.00 61.00 63.25 2uwm s PRO 534 Cb -0.36 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 2uwm s PRO 534 CO 0.41 -1.52 1.03 -1.54 0.04 0.00 0.00 177.00 175.42 2uwm s SER 535 N -2.18 6.06 0.24 6.66 1.04 -1.26 -4.58 113.70 119.68 2uwm s SER 535 Ca 0.72 1.68 -0.06 0.00 0.48 0.00 0.00 55.95 58.78 2uwm s SER 535 Cb -0.26 -2.52 0.46 0.00 0.10 0.00 0.00 66.02 63.80 2uwm s SER 535 CO 0.42 -0.98 1.67 0.15 0.98 0.00 0.00 173.24 175.48 2uwm h PHE 536 N 0.42 0.17 -0.35 5.02 3.57 -1.38 -0.57 116.94 123.83 2uwm h PHE 536 Ca -0.46 0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.00 2uwm h PHE 536 Cb 1.20 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 2uwm h PHE 536 CO 0.61 -0.14 -0.13 -0.22 -2.23 0.00 0.00 178.31 176.21 2uwm h LYS 537 N 0.21 0.70 -0.40 1.11 3.64 -1.93 0.71 116.57 120.61 2uwm h LYS 537 Ca 0.41 -0.29 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 2uwm h LYS 537 Cb 0.72 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 2uwm h LYS 537 CO -0.56 0.88 0.17 0.93 -2.27 0.00 0.00 179.45 178.61 2uwm h GLU 538 N 0.48 0.35 -0.39 1.90 5.08 -1.83 -1.98 114.58 118.19 2uwm h GLU 538 Ca 0.08 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2uwm h GLU 538 Cb 0.65 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 2uwm h GLU 538 CO 0.04 0.23 0.18 0.28 -1.00 0.00 0.00 179.01 178.74 2uwm h VAL 539 N 0.36 1.18 -0.37 3.13 2.07 -0.90 -0.45 116.25 121.28 2uwm h VAL 539 Ca 0.18 -0.53 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2uwm h VAL 539 Cb 0.12 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2uwm h VAL 539 CO -0.15 0.20 0.13 0.00 0.02 0.00 0.00 177.57 177.77 2uwm h ALA 540 N 1.02 0.43 -0.41 1.67 0.00 -0.75 -1.89 119.26 119.33 2uwm h ALA 540 Ca 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2uwm h ALA 540 Cb 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2uwm h ALA 540 CO -0.01 -0.26 0.23 0.78 0.00 0.00 0.00 179.25 179.99 2uwm h GLY 541 N 0.29 0.61 0.82 0.00 0.00 -1.18 0.11 103.07 103.72 2uwm h GLY 541 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 2uwm h GLY 541 CO -0.16 0.26 -0.19 0.23 0.00 0.00 0.00 176.54 176.67 2uwm h SER 542 N 0.54 -0.51 -0.03 0.19 0.87 -0.79 -2.64 113.55 111.18 2uwm h SER 542 Ca 0.15 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2uwm h SER 542 Cb 0.03 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2uwm h SER 542 CO -0.02 -0.30 0.00 0.49 -0.53 0.00 0.00 176.83 176.47 2uwm n PHE 543 N -5.32 0.02 -3.35 2.24 3.01 -0.74 -4.95 117.46 108.37 2uwm n PHE 543 Ca -0.09 -0.01 -0.16 0.00 1.01 0.00 0.00 57.45 58.20 2uwm n PHE 543 Cb 0.23 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.79 2uwm n PHE 543 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2uwm n ASN 544 N 0.19 -3.09 -4.54 4.37 2.85 0.10 -5.01 115.26 110.13 2uwm n ASN 544 Ca 0.19 -0.63 -0.28 0.00 -0.11 0.00 0.00 54.58 53.76 2uwm n ASN 544 Cb 0.35 -5.04 -0.10 0.00 1.24 0.00 0.00 39.78 36.24 2uwm n ASN 544 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2uwm s LEU 545 N -6.04 2.88 0.50 1.20 1.43 0.14 -5.03 118.68 113.77 2uwm s LEU 545 Ca 0.10 -0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 52.45 2uwm s LEU 545 Cb -0.01 -1.61 -0.08 0.00 0.03 0.00 0.00 46.19 44.51 2uwm s LEU 545 CO 0.71 0.13 0.98 -1.81 0.23 0.00 0.00 176.35 176.60 2uwm s ASP 546 N -2.60 6.63 0.34 2.29 1.11 -1.26 -4.60 116.67 118.57 2uwm s ASP 546 Ca 0.23 1.64 0.08 0.00 0.18 0.00 0.00 52.55 54.67 2uwm s ASP 546 Cb -0.09 -2.52 0.78 0.00 1.07 0.00 0.00 42.92 42.16 2uwm s ASP 546 CO 0.14 -0.58 1.86 -0.65 1.18 0.00 0.00 175.17 177.11 2uwm h PRO 547 N 1.16 0.71 -0.38 8.23 0.11 -1.98 -1.78 132.00 138.08 2uwm h PRO 547 Ca -0.47 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.65 2uwm h PRO 547 Cb 1.19 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.09 2uwm h PRO 547 CO 0.61 0.47 0.08 1.03 -0.21 0.00 0.00 178.00 179.98 2uwm h SER 548 N 0.73 0.02 -0.06 -2.05 0.87 -1.99 0.25 113.55 111.32 2uwm h SER 548 Ca 0.47 0.06 -0.18 0.00 -1.23 0.00 0.00 61.79 60.91 2uwm h SER 548 Cb 0.72 0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2uwm h SER 548 CO -0.23 0.05 -0.67 -0.08 -0.53 0.00 0.00 176.83 175.36 2uwm h GLU 549 N 0.20 0.57 -0.23 2.24 4.81 -1.74 -2.53 114.58 117.90 2uwm h GLU 549 Ca 0.18 -0.53 0.03 0.00 -0.13 0.00 0.00 59.36 58.91 2uwm h GLU 549 Cb 0.21 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 2uwm h GLU 549 CO -0.23 1.15 0.05 1.25 -0.73 0.00 0.00 179.01 180.50 2uwm h LEU 550 N 0.17 0.02 -0.46 1.64 5.85 -1.31 -1.44 115.31 119.78 2uwm h LEU 550 Ca -0.07 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.77 2uwm h LEU 550 Cb 1.34 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 42.34 2uwm h LEU 550 CO 0.14 0.04 0.01 -0.08 -0.34 0.00 0.00 178.44 178.21 2uwm h GLU 551 N 0.14 0.12 -0.64 1.25 4.57 -0.97 0.23 114.58 119.28 2uwm h GLU 551 Ca 0.10 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.31 2uwm h GLU 551 Cb 0.10 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.62 2uwm h GLU 551 CO -0.14 0.08 0.39 1.49 -1.18 0.00 0.00 179.01 179.66 2uwm h GLU 552 N 0.12 0.75 -0.17 1.92 4.81 -1.03 0.16 114.58 121.15 2uwm h GLU 552 Ca 0.23 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 2uwm h GLU 552 Cb 0.33 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 2uwm h GLU 552 CO -0.37 0.50 -0.13 -0.07 -0.73 0.00 0.00 179.01 178.20 2uwm h LEU 553 N 0.78 0.41 -0.86 1.64 3.38 -0.73 -2.41 115.31 117.52 2uwm h LEU 553 Ca 0.26 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 2uwm h LEU 553 Cb 0.02 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2uwm h LEU 553 CO -0.10 0.78 0.38 -0.07 0.09 0.00 0.00 178.44 179.51 2uwm h LEU 554 N 0.04 1.11 -1.25 1.67 3.38 -0.87 -2.60 115.31 116.79 2uwm h LEU 554 Ca 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2uwm h LEU 554 Cb 0.65 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2uwm h LEU 554 CO 0.03 0.94 0.35 -0.74 0.09 0.00 0.00 178.44 179.11 2uwm h HIS 555 N 1.19 0.84 -0.25 1.13 2.76 -0.94 0.49 115.15 120.37 2uwm h HIS 555 Ca 0.28 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.44 2uwm h HIS 555 Cb 0.15 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.82 2uwm h HIS 555 CO 0.02 0.58 0.12 -0.92 -1.30 0.00 0.00 177.93 176.43 2uwm h TYR 556 N 0.87 0.36 0.00 5.26 3.20 -1.13 -0.39 116.97 125.14 2uwm h TYR 556 Ca 0.22 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.00 2uwm h TYR 556 Cb 0.02 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2uwm h TYR 556 CO 0.00 0.35 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.43 2uwm h LEU 557 N 0.27 0.00 -0.09 2.82 3.38 -1.06 -1.70 115.31 118.93 2uwm h LEU 557 Ca 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2uwm h LEU 557 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2uwm h LEU 557 CO -0.01 0.38 -0.15 0.58 0.09 0.00 0.00 178.44 179.32 2uwm h VAL 558 N 0.00 1.39 -0.95 1.22 2.07 -0.74 0.02 116.25 119.25 2uwm h VAL 558 Ca -0.00 -1.41 0.08 0.00 0.82 0.00 0.00 66.70 66.18 2uwm h VAL 558 Cb 0.70 2.10 -0.07 0.00 -1.52 0.00 0.00 31.29 32.50 2uwm h VAL 558 CO 0.05 0.40 0.62 0.03 0.02 0.00 0.00 177.57 178.68 2uwm h ARG 559 N -0.18 1.03 0.00 1.57 3.08 -0.84 -2.27 114.38 116.76 2uwm h ARG 559 Ca 0.01 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 2uwm h ARG 559 Cb 0.72 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2uwm h ARG 559 CO 0.03 0.68 -0.37 1.49 -1.07 0.00 0.00 179.97 180.73 2uwm h GLU 560 N 1.06 0.00 0.00 0.04 4.81 -1.28 -3.40 114.58 115.81 2uwm h GLU 560 Ca 0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 2uwm h GLU 560 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2uwm h GLU 560 CO -0.18 0.37 0.00 0.41 -0.73 0.00 0.00 179.01 178.89 2uwm n GLY 561 N 0.78 0.85 0.13 1.92 0.00 -0.66 -2.27 105.19 105.95 2uwm n GLY 561 Ca 0.01 -0.13 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 2uwm n GLY 561 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2uwm h VAL 562 N 0.00 1.42 -2.43 1.61 2.07 -1.28 -3.42 116.25 114.22 2uwm h VAL 562 Ca 0.00 -2.51 -0.56 0.00 0.82 0.00 0.00 66.70 64.45 2uwm h VAL 562 Cb 0.00 3.03 -0.09 0.00 -1.52 0.00 0.00 31.29 32.71 2uwm h VAL 562 CO 0.00 0.73 -0.62 -0.76 0.02 0.00 0.00 177.57 176.94 2uwm s LEU 563 N -7.87 3.38 -0.05 2.57 1.43 -0.89 -0.84 118.68 116.41 2uwm s LEU 563 Ca -0.12 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 2uwm s LEU 563 Cb 0.03 -1.94 0.02 0.00 0.03 0.00 0.00 46.19 44.32 2uwm s LEU 563 CO 0.87 0.02 -0.07 -0.69 0.23 0.00 0.00 176.35 176.72 2uwm s VAL 564 N -2.08 0.70 -0.34 -1.59 1.01 0.24 -4.13 120.40 114.21 2uwm s VAL 564 Ca 0.30 -0.22 -0.26 0.00 0.00 0.00 0.00 61.98 61.80 2uwm s VAL 564 Cb -0.08 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.63 2uwm s VAL 564 CO 0.21 0.26 0.92 -0.75 0.00 0.00 0.00 175.10 175.73 2uwm s LYS 565 N 0.83 3.91 -0.15 2.72 2.20 -1.26 -0.53 119.74 127.46 2uwm s LYS 565 Ca -0.12 0.67 -0.25 0.00 -0.36 0.00 0.00 55.97 55.91 2uwm s LYS 565 Cb -0.15 -3.77 -0.24 0.00 -1.51 0.00 0.00 37.83 32.16 2uwm s LYS 565 CO 0.01 -0.87 0.60 0.82 -0.36 0.00 0.00 175.35 175.55 2uwm h ILE 566 N 5.75 1.46 -1.91 5.43 5.03 -1.30 -3.49 117.51 128.48 2uwm h ILE 566 Ca -0.23 -2.31 0.00 0.00 -0.12 0.00 0.00 64.86 62.20 2uwm h ILE 566 Cb 1.08 2.98 0.00 0.00 -3.03 0.00 0.00 36.82 37.85 2uwm h ILE 566 CO 0.97 0.53 0.00 -0.46 -0.68 0.00 0.00 178.15 178.51 2uwm n ASN 567 N -4.48 0.00 0.27 1.72 0.23 -0.90 -4.66 115.26 107.45 2uwm n ASN 567 Ca -0.18 -0.91 0.13 0.00 -0.53 0.00 0.00 54.58 53.10 2uwm n ASN 567 Cb 0.59 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 39.08 2uwm n ASN 567 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2uwm h ASP 568 N 0.00 0.00 0.17 0.53 3.45 -2.03 -2.94 116.42 115.61 2uwm h ASP 568 Ca 0.00 0.00 -0.36 0.00 0.43 0.00 0.00 57.03 57.10 2uwm h ASP 568 Cb 0.00 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.75 2uwm h ASP 568 CO 0.00 0.08 -1.95 -0.08 -1.57 0.00 0.00 179.24 175.72 2uwm h GLU 569 N 0.00 0.24 -5.10 3.56 4.81 -1.99 -3.44 114.58 112.67 2uwm h GLU 569 Ca -0.00 -0.42 -0.67 0.00 -0.13 0.00 0.00 59.36 58.14 2uwm h GLU 569 Cb 0.23 0.16 -0.32 0.00 0.63 0.00 0.00 28.75 29.44 2uwm h GLU 569 CO 0.01 1.14 -0.82 -0.06 -0.73 0.00 0.00 179.01 178.55 2uwm s PHE 570 N -2.56 2.80 -0.02 0.92 0.40 -1.11 -1.04 117.98 117.36 2uwm s PHE 570 Ca -0.20 -1.34 0.03 0.00 -0.60 0.00 0.00 56.93 54.82 2uwm s PHE 570 Cb 0.07 -1.93 -0.03 0.00 0.51 0.00 0.00 43.02 41.63 2uwm s PHE 570 CO 0.78 -0.66 -0.07 0.71 0.70 0.00 0.00 175.22 176.68 2uwm s TYR 571 N 1.16 2.89 -0.05 0.36 1.51 -1.26 -0.75 117.35 121.20 2uwm s TYR 571 Ca 0.01 -0.03 0.06 0.00 -1.01 0.00 0.00 57.07 56.10 2uwm s TYR 571 Cb -0.14 -1.63 -0.02 0.00 -0.11 0.00 0.00 41.96 40.06 2uwm s TYR 571 CO -0.07 0.35 -0.23 -1.58 -1.11 0.00 0.00 175.55 172.92 2uwm s TRP 572 N -0.94 2.48 0.25 2.71 0.52 0.31 -4.78 118.94 119.49 2uwm s TRP 572 Ca 0.16 -0.53 -0.31 0.00 0.02 0.00 0.00 56.10 55.43 2uwm s TRP 572 Cb -0.11 -1.59 -0.13 0.00 -1.15 0.00 0.00 33.47 30.49 2uwm s TRP 572 CO 0.06 -0.09 1.46 1.58 0.02 0.00 0.00 176.95 179.97 2uwm n HIS 573 N 2.72 2.31 -0.24 -1.98 -0.00 -1.26 -0.59 115.22 116.18 2uwm n HIS 573 Ca -0.17 0.39 0.04 0.00 -0.00 0.00 0.00 57.72 57.98 2uwm n HIS 573 Cb 0.52 -2.49 0.15 0.00 -0.00 0.00 0.00 29.99 28.17 2uwm n HIS 573 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 2uwm h ARG 574 N 4.43 0.17 -0.58 1.57 2.43 -1.24 -1.11 114.38 120.06 2uwm h ARG 574 Ca -0.45 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.66 2uwm h ARG 574 Cb 1.26 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 2uwm h ARG 574 CO 0.77 0.11 0.19 0.37 -1.51 0.00 0.00 179.97 179.91 2uwm h GLN 575 N 0.18 0.89 -0.08 0.20 4.15 -1.91 -1.00 115.11 117.53 2uwm h GLN 575 Ca 0.39 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.63 2uwm h GLN 575 Cb 0.67 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.23 2uwm h GLN 575 CO -0.56 0.79 0.05 0.00 -1.93 0.00 0.00 178.83 177.17 2uwm h ALA 576 N 1.05 0.11 -0.27 3.38 0.00 -1.68 -2.09 119.26 119.75 2uwm h ALA 576 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2uwm h ALA 576 Cb 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2uwm h ALA 576 CO -0.01 -0.36 0.18 1.25 0.00 0.00 0.00 179.25 180.32 2uwm h LEU 577 N 0.05 0.32 -0.78 0.00 5.85 -1.04 -0.91 115.31 118.79 2uwm h LEU 577 Ca 0.03 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.83 2uwm h LEU 577 Cb 0.07 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 2uwm h LEU 577 CO -0.00 0.24 0.43 1.23 -0.34 0.00 0.00 178.44 179.99 2uwm h GLY 578 N 0.37 1.21 1.10 3.75 0.00 -1.11 -0.58 103.07 107.81 2uwm h GLY 578 Ca 0.10 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.06 2uwm h GLY 578 CO -0.02 0.10 0.02 0.83 0.00 0.00 0.00 176.54 177.47 2uwm h GLU 579 N 0.72 1.07 -0.65 4.80 5.08 -0.95 -1.59 114.58 123.06 2uwm h GLU 579 Ca 0.38 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2uwm h GLU 579 Cb 0.37 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2uwm h GLU 579 CO -0.26 1.03 0.35 0.00 -1.00 0.00 0.00 179.01 179.13 2uwm h ALA 580 N 1.02 0.83 -0.79 3.43 0.00 -0.65 -2.29 119.26 120.83 2uwm h ALA 580 Ca 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2uwm h ALA 580 Cb 0.53 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2uwm h ALA 580 CO 0.03 0.36 0.33 0.00 0.00 0.00 0.00 179.25 179.97 2uwm h ARG 581 N 0.89 1.16 -0.06 0.00 3.08 -0.96 -1.21 114.38 117.28 2uwm h ARG 581 Ca 0.23 -0.19 0.01 0.00 0.07 0.00 0.00 59.98 60.10 2uwm h ARG 581 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2uwm h ARG 581 CO -0.04 0.92 -0.03 0.93 -1.07 0.00 0.00 179.97 180.68 2uwm h GLU 582 N 1.13 -0.03 -0.39 0.04 5.08 -1.13 0.14 114.58 119.42 2uwm h GLU 582 Ca 0.26 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.68 2uwm h GLU 582 Cb 0.18 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 2uwm h GLU 582 CO -0.03 -0.02 0.12 0.28 -1.00 0.00 0.00 179.01 178.36 2uwm h VAL 583 N -0.03 0.85 -0.29 3.13 2.07 -1.21 -2.34 116.25 118.43 2uwm h VAL 583 Ca 0.03 -0.09 -0.12 0.00 0.82 0.00 0.00 66.70 67.35 2uwm h VAL 583 Cb 0.08 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 2uwm h VAL 583 CO -0.08 0.05 -0.31 0.40 0.02 0.00 0.00 177.57 177.65 2uwm h ILE 584 N 0.26 1.28 -0.37 4.57 2.04 -1.12 -1.72 117.51 122.46 2uwm h ILE 584 Ca 0.18 -1.43 -0.02 0.00 1.00 0.00 0.00 64.86 64.60 2uwm h ILE 584 Cb 0.19 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2uwm h ILE 584 CO -0.21 0.46 0.16 0.50 0.00 0.00 0.00 178.15 179.06 2uwm h LYS 585 N 0.52 0.54 -0.69 2.37 3.64 -0.73 -0.42 116.57 121.80 2uwm h LYS 585 Ca 0.06 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2uwm h LYS 585 Cb 0.80 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 2uwm h LYS 585 CO 0.07 0.51 0.28 -0.97 -2.27 0.00 0.00 179.45 177.06 2uwm h ASN 586 N 0.45 0.94 -0.11 4.20 -1.24 -1.31 -2.39 115.58 116.12 2uwm h ASN 586 Ca 0.12 -0.17 0.03 0.00 0.71 0.00 0.00 56.30 57.00 2uwm h ASN 586 Cb 0.16 -0.24 -0.04 0.00 0.73 0.00 0.00 38.32 38.93 2uwm h ASN 586 CO -0.01 0.85 -0.10 0.25 -1.29 0.00 0.00 177.43 177.12 2uwm h LEU 587 N 0.97 -0.32 -0.05 0.34 5.85 -1.05 -2.90 115.31 118.16 2uwm h LEU 587 Ca 0.23 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.01 2uwm h LEU 587 Cb 0.20 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2uwm h LEU 587 CO -0.02 -0.14 0.00 0.00 -0.34 0.00 0.00 178.44 177.94 2uwm n ALA 588 N -2.45 1.69 0.33 1.25 0.00 -0.19 -2.92 120.51 118.22 2uwm n ALA 588 Ca -0.04 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.50 2uwm n ALA 588 Cb 0.17 -1.25 0.62 0.00 0.00 0.00 0.00 19.45 18.99 2uwm n ALA 588 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2uwm h SER 589 N 0.00 0.00 -0.54 0.00 4.64 -1.21 -2.20 113.55 114.24 2uwm h SER 589 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2uwm h SER 589 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2uwm h SER 589 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2uwm n THR 590 N -2.55 1.26 0.00 2.95 -2.24 -1.15 -5.08 114.28 107.47 2uwm n THR 590 Ca 0.01 -1.10 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 2uwm n THR 590 Cb 0.21 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2uwm n THR 590 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2uwm n GLY 591 N 0.97 1.22 3.73 3.38 0.00 -0.83 -5.07 105.19 108.60 2uwm n GLY 591 Ca 0.20 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.56 2uwm n GLY 591 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2uwm n PRO 592 N -1.11 1.98 -4.32 1.61 -0.02 -1.26 -4.38 135.00 127.50 2uwm n PRO 592 Ca 0.00 0.71 -0.25 0.00 -2.02 0.00 0.00 63.50 61.94 2uwm n PRO 592 Cb 0.00 -2.51 -0.13 0.00 -0.02 0.00 0.00 33.50 30.84 2uwm n PRO 592 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2uwm s PHE 593 N -1.22 1.90 0.59 6.00 -0.12 -0.21 -4.85 117.98 120.07 2uwm s PHE 593 Ca 0.63 -0.41 0.01 0.00 -0.05 0.00 0.00 56.93 57.12 2uwm s PHE 593 Cb -0.47 -1.04 0.06 0.00 -0.63 0.00 0.00 43.02 40.94 2uwm s PHE 593 CO 0.56 0.23 0.83 0.20 -0.05 0.00 0.00 175.22 176.99 2uwm s GLY 594 N -1.92 1.81 0.18 1.99 0.00 -1.26 -1.27 107.32 106.85 2uwm s GLY 594 Ca 0.08 -1.47 -0.14 0.00 0.00 0.00 0.00 44.72 43.19 2uwm s GLY 594 CO 0.05 -1.11 1.75 -2.00 0.00 0.00 0.00 173.10 171.79 2uwm h LEU 595 N -0.07 0.19 -0.63 0.66 5.85 -1.99 -1.60 115.31 117.72 2uwm h LEU 595 Ca -0.40 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2uwm h LEU 595 Cb 1.29 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 2uwm h LEU 595 CO 0.48 0.14 0.39 0.00 -0.34 0.00 0.00 178.44 179.12 2uwm h ALA 596 N 1.30 0.80 -0.68 1.25 0.00 -1.98 0.02 119.26 119.96 2uwm h ALA 596 Ca 0.22 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2uwm h ALA 596 Cb 0.21 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2uwm h ALA 596 CO -0.22 0.26 0.15 0.93 0.00 0.00 0.00 179.25 180.37 2uwm h GLU 597 N 0.85 1.10 -0.58 0.00 5.08 -1.89 0.48 114.58 119.62 2uwm h GLU 597 Ca 0.23 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 2uwm h GLU 597 Cb -0.05 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 2uwm h GLU 597 CO -0.05 0.98 0.10 0.00 -1.00 0.00 0.00 179.01 179.04 2uwm h ALA 598 N 1.12 0.77 -0.44 3.43 0.00 -0.99 -1.98 119.26 121.17 2uwm h ALA 598 Ca 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2uwm h ALA 598 Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2uwm h ALA 598 CO 0.00 0.51 0.19 -0.09 0.00 0.00 0.00 179.25 179.86 2uwm h ARG 599 N 0.85 0.64 -0.76 0.00 1.12 -0.63 -1.56 114.38 114.04 2uwm h ARG 599 Ca 0.18 -0.11 0.00 0.00 -1.11 0.00 0.00 59.98 58.94 2uwm h ARG 599 Cb 0.41 -0.11 -0.04 0.00 -0.01 0.00 0.00 29.97 30.22 2uwm h ARG 599 CO 0.01 0.58 0.49 -0.44 -3.11 0.00 0.00 179.97 177.49 2uwm h ASP 600 N 0.56 0.89 -0.36 -3.80 3.32 -0.85 -0.84 116.42 115.35 2uwm h ASP 600 Ca 0.15 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 2uwm h ASP 600 Cb 0.16 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 2uwm h ASP 600 CO -0.01 0.67 -0.11 0.00 -1.72 0.00 0.00 179.24 178.07 2uwm h ALA 601 N 1.26 0.97 -0.01 3.45 0.00 -1.09 -2.83 119.26 121.01 2uwm h ALA 601 Ca 0.28 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2uwm h ALA 601 Cb -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2uwm h ALA 601 CO -0.06 0.61 -0.12 1.28 0.00 0.00 0.00 179.25 180.96 2uwm n LEU 602 N -4.16 0.85 -3.57 0.00 4.77 -0.61 -4.95 117.00 109.34 2uwm n LEU 602 Ca 0.01 -0.20 -0.26 0.00 -0.03 0.00 0.00 56.01 55.53 2uwm n LEU 602 Cb 0.37 -0.11 0.02 0.00 -2.33 0.00 0.00 43.42 41.37 2uwm n LEU 602 CO 0.43 0.15 0.04 0.61 -1.33 0.00 0.00 177.39 177.30 2uwm n GLY 603 N 1.25 -0.50 0.00 -0.72 0.00 -0.40 -4.96 105.19 99.86 2uwm n GLY 603 Ca 0.15 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.32 2uwm n GLY 603 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2uwm n SER 604 N -2.60 0.24 -4.20 1.61 2.88 -0.70 -5.04 113.62 105.81 2uwm n SER 604 Ca -0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2uwm n SER 604 Cb 0.55 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.91 2uwm n SER 604 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2uwm s SER 605 N 0.21 0.49 0.26 -3.46 1.04 -1.26 -4.86 113.70 106.12 2uwm s SER 605 Ca 0.00 -1.29 -0.02 0.00 0.48 0.00 0.00 55.95 55.12 2uwm s SER 605 Cb 0.00 0.28 0.35 0.00 0.10 0.00 0.00 66.02 66.75 2uwm s SER 605 CO 0.00 -0.74 1.80 0.03 0.98 0.00 0.00 173.24 175.30 2uwm h ARG 606 N 2.70 0.86 -0.78 4.02 3.08 -1.97 -0.51 114.38 121.78 2uwm h ARG 606 Ca -0.36 -0.19 0.18 0.00 0.07 0.00 0.00 59.98 59.68 2uwm h ARG 606 Cb 1.22 -0.12 -0.14 0.00 0.08 0.00 0.00 29.97 31.02 2uwm h ARG 606 CO 0.58 0.79 0.02 -0.22 -1.07 0.00 0.00 179.97 180.08 2uwm h LYS 607 N 0.82 0.10 0.13 0.04 3.64 -2.01 -1.73 116.57 117.56 2uwm h LYS 607 Ca 0.17 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.22 2uwm h LYS 607 Cb 0.34 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2uwm h LYS 607 CO 0.00 0.07 -1.73 1.88 -2.27 0.00 0.00 179.45 177.41 2uwm h TYR 608 N 0.11 0.49 0.20 1.91 -1.99 -1.81 -3.41 116.97 112.48 2uwm h TYR 608 Ca 0.44 -0.36 -0.32 0.00 2.00 0.00 0.00 58.73 60.49 2uwm h TYR 608 Cb 0.79 -0.02 0.03 0.00 2.00 0.00 0.00 36.73 39.52 2uwm h TYR 608 CO -0.42 1.53 -1.39 0.28 -0.00 0.00 0.00 178.16 178.17 2uwm h VAL 609 N 0.07 1.35 0.25 -2.88 2.07 -0.82 -3.01 116.25 113.29 2uwm h VAL 609 Ca -0.32 -2.78 -0.01 0.00 0.82 0.00 0.00 66.70 64.41 2uwm h VAL 609 Cb 2.05 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 34.79 2uwm h VAL 609 CO 0.14 0.83 -0.12 0.25 0.02 0.00 0.00 177.57 178.69 2uwm h LEU 610 N 0.14 -0.29 -1.26 2.57 5.85 -1.55 -0.93 115.31 119.84 2uwm h LEU 610 Ca -0.21 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.60 2uwm h LEU 610 Cb 2.08 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 43.13 2uwm h LEU 610 CO 0.25 -0.21 0.55 -0.65 -0.34 0.00 0.00 178.44 178.04 2uwm h PRO 611 N -0.34 0.83 -0.08 5.25 0.11 -1.78 -1.21 132.00 134.77 2uwm h PRO 611 Ca -0.03 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.04 2uwm h PRO 611 Cb 0.26 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 2uwm h PRO 611 CO 0.06 0.55 -0.00 1.25 -0.21 0.00 0.00 178.00 179.65 2uwm h LEU 612 N 0.86 -0.03 -0.88 2.35 5.85 -1.33 -0.86 115.31 121.26 2uwm h LEU 612 Ca 0.38 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 59.02 2uwm h LEU 612 Cb 0.34 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2uwm h LEU 612 CO -0.15 -0.00 -0.23 -0.07 -0.34 0.00 0.00 178.44 177.65 2uwm h LEU 613 N 0.03 0.57 -0.49 2.25 3.38 -0.67 -0.04 115.31 120.33 2uwm h LEU 613 Ca 0.04 -0.19 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 2uwm h LEU 613 Cb 0.04 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2uwm h LEU 613 CO -0.07 0.79 -0.13 -0.33 0.09 0.00 0.00 178.44 178.80 2uwm h GLU 614 N 0.50 0.96 -0.39 1.13 5.08 -1.16 -1.76 114.58 118.94 2uwm h GLU 614 Ca 0.07 -0.37 0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2uwm h GLU 614 Cb 0.67 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 2uwm h GLU 614 CO 0.05 1.04 0.25 -0.92 -1.00 0.00 0.00 179.01 178.43 2uwm h TYR 615 N 0.82 0.47 0.00 4.33 3.20 -0.87 -2.47 116.97 122.45 2uwm h TYR 615 Ca 0.12 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2uwm h TYR 615 Cb 0.69 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 2uwm h TYR 615 CO 0.05 0.29 -0.17 -0.07 -1.64 0.00 0.00 178.16 176.62 2uwm h LEU 616 N 0.51 0.00 -0.41 2.82 3.38 -0.83 -1.55 115.31 119.23 2uwm h LEU 616 Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2uwm h LEU 616 Cb -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2uwm h LEU 616 CO -0.05 0.17 -0.02 0.44 0.09 0.00 0.00 178.44 179.08 2uwm h ASP 617 N 0.00 0.72 -0.26 -0.43 3.32 -1.20 0.11 116.42 118.68 2uwm h ASP 617 Ca -0.00 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 2uwm h ASP 617 Cb 0.33 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2uwm h ASP 617 CO 0.02 0.86 0.14 -0.61 -1.72 0.00 0.00 179.24 177.93 2uwm h GLN 618 N 0.56 0.36 -0.12 3.56 5.75 -0.84 -2.37 115.11 122.00 2uwm h GLN 618 Ca 0.11 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2uwm h GLN 618 Cb 0.51 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.99 2uwm h GLN 618 CO 0.02 0.33 0.00 1.33 -2.65 0.00 0.00 178.83 177.86 2uwm n VAL 619 N -4.84 0.16 -2.23 2.39 0.24 -0.68 -4.93 118.33 108.44 2uwm n VAL 619 Ca -0.03 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 61.90 2uwm n VAL 619 Cb 0.08 0.19 -0.01 0.00 -1.47 0.00 0.00 33.84 32.63 2uwm n VAL 619 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2uwm n LYS 620 N 0.02 -0.98 -0.00 7.34 5.02 -0.89 -4.92 118.16 123.75 2uwm n LYS 620 Ca 0.15 0.60 -0.17 0.00 -2.02 0.00 0.00 58.31 56.87 2uwm n LYS 620 Cb 0.25 -4.77 -0.10 0.00 -0.02 0.00 0.00 35.03 30.39 2uwm n LYS 620 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2uwm h PHE 621 N 0.00 0.66 -1.87 2.13 3.57 -1.04 -3.31 116.94 117.08 2uwm h PHE 621 Ca -0.29 -0.34 -0.55 0.00 3.53 0.00 0.00 57.97 60.32 2uwm h PHE 621 Cb 1.21 -0.08 -0.08 0.00 2.79 0.00 0.00 35.95 39.79 2uwm h PHE 621 CO 0.33 1.15 -0.54 0.95 -2.23 0.00 0.00 178.31 177.96 2uwm s THR 622 N -3.35 2.97 -0.06 4.41 -4.23 -0.75 -0.92 115.64 113.71 2uwm s THR 622 Ca -0.13 -1.71 -0.08 0.00 -1.18 0.00 0.00 61.69 58.59 2uwm s THR 622 Cb 0.04 -2.97 0.02 0.00 1.34 0.00 0.00 72.50 70.93 2uwm s THR 622 CO 0.83 -0.18 0.21 0.00 -0.54 0.00 0.00 174.62 174.94 2uwm s ARG 623 N -3.84 0.35 0.12 3.99 1.70 -0.54 -4.27 118.95 116.45 2uwm s ARG 623 Ca 0.38 0.10 -0.30 0.00 -0.47 0.00 0.00 55.73 55.44 2uwm s ARG 623 Cb -0.02 0.16 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 2uwm s ARG 623 CO 0.22 -0.06 1.18 1.03 -1.08 0.00 0.00 175.30 176.60 2uwm s ARG 624 N -0.35 4.48 -0.17 3.89 0.52 -1.26 -1.65 118.95 124.40 2uwm s ARG 624 Ca -0.05 1.80 0.00 0.00 -0.52 0.00 0.00 55.73 56.96 2uwm s ARG 624 Cb -0.03 -3.30 0.03 0.00 0.52 0.00 0.00 34.95 32.17 2uwm s ARG 624 CO 0.01 -0.15 -0.09 0.08 0.02 0.00 0.00 175.30 175.16 2uwm s VAL 625 N 0.51 1.38 0.00 3.52 1.01 0.10 -4.92 120.40 122.00 2uwm s VAL 625 Ca 0.55 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2uwm s VAL 625 Cb -0.30 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.64 2uwm s VAL 625 CO 0.32 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.29 2uwm n GLY 626 N 4.80 3.59 1.65 4.51 0.00 -1.26 -0.60 105.19 117.87 2uwm n GLY 626 Ca -0.14 0.04 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 2uwm n GLY 626 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2uwm n ASP 627 N 5.43 3.93 -2.06 1.61 3.85 -1.26 -4.96 116.55 123.09 2uwm n ASP 627 Ca 0.00 -3.39 -0.07 0.00 -0.71 0.00 0.00 54.79 50.63 2uwm n ASP 627 Cb 0.00 -0.70 -0.02 0.00 -1.35 0.00 0.00 41.12 39.05 2uwm n ASP 627 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2uwm n LYS 628 N -0.62 0.79 -4.13 0.11 5.02 0.23 -4.83 118.16 114.73 2uwm n LYS 628 Ca 0.39 -0.90 -0.12 0.00 -2.02 0.00 0.00 58.31 55.66 2uwm n LYS 628 Cb 1.27 0.51 -0.11 0.00 -0.02 0.00 0.00 35.03 36.68 2uwm n LYS 628 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2uwm s ARG 629 N -2.40 0.72 0.26 1.97 0.52 -0.39 -0.72 118.95 118.90 2uwm s ARG 629 Ca 0.06 -1.10 0.05 0.00 -0.52 0.00 0.00 55.73 54.21 2uwm s ARG 629 Cb 0.00 -0.27 -0.06 0.00 0.52 0.00 0.00 34.95 35.15 2uwm s ARG 629 CO 0.04 0.02 -0.02 0.14 0.02 0.00 0.00 175.30 175.50 2uwm s VAL 630 N -2.67 1.30 -0.21 3.52 -7.23 -0.66 -1.05 120.40 113.40 2uwm s VAL 630 Ca 0.03 -2.06 -0.15 0.00 -1.81 0.00 0.00 61.98 57.98 2uwm s VAL 630 Cb -0.01 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.45 2uwm s VAL 630 CO -0.02 -0.28 0.38 -0.69 -0.31 0.00 0.00 175.10 174.18 2uwm s VAL 631 N -3.24 5.20 0.00 1.32 1.01 -1.26 -1.47 120.40 121.96 2uwm s VAL 631 Ca 0.30 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.94 2uwm s VAL 631 Cb 0.05 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2uwm s VAL 631 CO 0.11 0.24 0.00 0.55 0.00 0.00 0.00 175.10 176.00 2uwm n VAL 632 N 4.46 0.00 0.72 2.92 3.14 -0.10 -4.95 118.33 124.52 2uwm n VAL 632 Ca -0.09 0.00 0.09 0.00 -2.96 0.00 0.00 64.34 61.38 2uwm n VAL 632 Cb 0.51 -0.20 0.07 0.00 -1.06 0.00 0.00 33.84 33.16 2uwm n VAL 632 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98