#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hv9 h PRO 430 N 0.00 -0.01 -0.40 -0.53 0.11 -2.05 -1.81 132.00 127.31 3hv9 h PRO 430 Ca 0.00 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.16 3hv9 h PRO 430 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 3hv9 h PRO 430 CO 0.00 -0.01 0.14 0.00 -0.21 0.00 0.00 178.00 177.93 3hv9 h ALA 431 N 1.37 0.47 -0.93 -0.75 0.00 -2.05 0.10 119.26 117.48 3hv9 h ALA 431 Ca 0.19 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.26 3hv9 h ALA 431 Cb 0.29 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 3hv9 h ALA 431 CO -0.40 -0.24 0.59 1.49 0.00 0.00 0.00 179.25 180.69 3hv9 h GLU 432 N 0.31 0.85 0.15 0.00 4.81 -1.83 -1.43 114.58 117.43 3hv9 h GLU 432 Ca 0.18 -0.05 -0.30 0.00 -0.13 0.00 0.00 59.36 59.06 3hv9 h GLU 432 Cb 0.16 -0.19 0.03 0.00 0.63 0.00 0.00 28.75 29.37 3hv9 h GLU 432 CO -0.18 0.56 -1.30 0.93 -0.73 0.00 0.00 179.01 178.30 3hv9 h GLU 433 N 0.88 0.57 -0.14 1.92 5.08 -0.48 -1.07 114.58 121.33 3hv9 h GLU 433 Ca 0.45 -0.81 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 3hv9 h GLU 433 Cb 0.50 0.28 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 3hv9 h GLU 433 CO -0.21 1.37 0.09 1.25 -1.00 0.00 0.00 179.01 180.51 3hv9 h LEU 434 N 0.23 0.16 -0.63 1.33 6.46 -0.85 0.42 115.31 122.42 3hv9 h LEU 434 Ca -0.20 -0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.56 3hv9 h LEU 434 Cb 1.98 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 41.84 3hv9 h LEU 434 CO 0.24 0.12 0.39 0.00 -0.62 0.00 0.00 178.44 178.57 3hv9 h ALA 435 N 1.05 0.80 -0.52 1.25 0.00 -1.27 -0.22 119.26 120.35 3hv9 h ALA 435 Ca 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hv9 h ALA 435 Cb -0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3hv9 h ALA 435 CO -0.01 0.27 0.28 0.00 0.00 0.00 0.00 179.25 179.78 3hv9 h ALA 436 N 1.20 0.66 -0.31 0.00 0.00 -0.84 -1.36 119.26 118.62 3hv9 h ALA 436 Ca 0.23 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3hv9 h ALA 436 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3hv9 h ALA 436 CO -0.04 0.19 0.11 0.00 0.00 0.00 0.00 179.25 179.51 3hv9 h ALA 437 N 1.11 0.40 -0.76 0.00 0.00 -0.52 -2.25 119.26 117.24 3hv9 h ALA 437 Ca 0.18 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3hv9 h ALA 437 Cb 0.07 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3hv9 h ALA 437 CO -0.03 0.01 0.47 0.00 0.00 0.00 0.00 179.25 179.70 3hv9 h ALA 438 N 0.95 1.03 -0.01 0.00 0.00 -0.95 -0.04 119.26 120.25 3hv9 h ALA 438 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hv9 h ALA 438 Cb 0.20 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hv9 h ALA 438 CO -0.01 0.21 0.00 0.37 0.00 0.00 0.00 179.25 179.83 3hv9 h GLN 439 N 0.87 0.00 -0.00 0.00 5.75 -0.94 -1.26 115.11 119.53 3hv9 h GLN 439 Ca 0.33 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.83 3hv9 h GLN 439 Cb 0.12 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.67 3hv9 h GLN 439 CO -0.15 0.00 -0.00 0.54 -2.65 0.00 0.00 178.83 176.57 3hv9 n ARG 440 N -4.34 0.45 -0.53 1.69 1.74 -0.06 -4.90 116.66 110.71 3hv9 n ARG 440 Ca -0.03 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 3hv9 n ARG 440 Cb 0.09 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 3hv9 n ARG 440 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hv9 n GLY 441 N 1.28 0.74 3.56 -0.13 0.00 -0.47 -5.00 105.19 105.16 3hv9 n GLY 441 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3hv9 n GLY 441 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hv9 s ASP 442 N -2.01 5.45 0.36 1.61 3.68 -1.05 -4.83 116.67 119.87 3hv9 s ASP 442 Ca 0.00 0.58 0.11 0.00 2.13 0.00 0.00 52.55 55.37 3hv9 s ASP 442 Cb 0.00 -2.53 0.66 0.00 -1.45 0.00 0.00 42.92 39.61 3hv9 s ASP 442 CO 0.00 -2.19 1.80 0.58 0.13 0.00 0.00 175.17 175.49 3hv9 h VAL 443 N 6.86 1.28 -0.47 1.11 2.07 -1.92 0.17 116.25 125.35 3hv9 h VAL 443 Ca -0.28 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 65.89 3hv9 h VAL 443 Cb 1.16 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 3hv9 h VAL 443 CO 1.17 0.38 0.18 0.40 0.02 0.00 0.00 177.57 179.73 3hv9 h ILE 444 N 0.04 1.21 -0.57 4.57 2.04 -1.89 0.68 117.51 123.59 3hv9 h ILE 444 Ca 0.00 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.18 3hv9 h ILE 444 Cb 0.69 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 3hv9 h ILE 444 CO 0.05 0.24 0.22 0.00 0.00 0.00 0.00 178.15 178.66 3hv9 h ALA 445 N 1.03 0.74 -0.80 1.87 0.00 -1.73 -1.05 119.26 119.32 3hv9 h ALA 445 Ca 0.16 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hv9 h ALA 445 Cb 0.20 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 3hv9 h ALA 445 CO -0.01 0.37 0.49 0.82 0.00 0.00 0.00 179.25 180.92 3hv9 h ILE 446 N 0.79 1.04 -0.42 0.00 2.04 -0.59 -0.61 117.51 119.76 3hv9 h ILE 446 Ca 0.19 -0.31 -0.07 0.00 1.00 0.00 0.00 64.86 65.67 3hv9 h ILE 446 Cb 0.22 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 3hv9 h ILE 446 CO -0.01 0.17 0.01 -0.07 0.00 0.00 0.00 178.15 178.24 3hv9 h LEU 447 N 0.91 0.73 -0.77 1.44 3.38 -0.58 -0.47 115.31 119.95 3hv9 h LEU 447 Ca 0.35 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3hv9 h LEU 447 Cb 0.14 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3hv9 h LEU 447 CO -0.16 0.85 -0.10 1.56 0.09 0.00 0.00 178.44 180.68 3hv9 h GLN 448 N 0.58 0.82 -0.02 1.13 4.20 -0.76 -2.57 115.11 118.49 3hv9 h GLN 448 Ca 0.12 -0.28 -0.20 0.00 0.06 0.00 0.00 58.65 58.35 3hv9 h GLN 448 Cb 0.48 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 3hv9 h GLN 448 CO 0.02 0.89 -0.86 0.37 -0.67 0.00 0.00 178.83 178.59 3hv9 h GLN 449 N 0.75 0.35 -0.13 1.46 4.15 -1.00 -3.22 115.11 117.47 3hv9 h GLN 449 Ca 0.13 -0.35 -0.09 0.00 0.77 0.00 0.00 58.65 59.11 3hv9 h GLN 449 Cb 0.60 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 3hv9 h GLN 449 CO 0.04 1.02 -0.30 0.00 -1.93 0.00 0.00 178.83 177.66 3hv9 h ALA 450 N 0.86 1.25 0.00 3.38 0.00 -0.78 -0.85 119.26 123.12 3hv9 h ALA 450 Ca -0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3hv9 h ALA 450 Cb 1.47 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 3hv9 h ALA 450 CO 0.14 0.51 -0.11 -0.07 0.00 0.00 0.00 179.25 179.72 3hv9 h LEU 451 N 0.22 0.00 -1.42 0.00 3.38 -1.48 -1.97 115.31 114.05 3hv9 h LEU 451 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3hv9 h LEU 451 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3hv9 h LEU 451 CO 0.05 0.11 -0.12 -0.62 0.09 0.00 0.00 178.44 177.94 3hv9 n GLU 452 N -3.43 1.52 -0.15 1.13 -0.58 -0.42 -4.51 120.64 114.20 3hv9 n GLU 452 Ca -0.01 -1.31 0.00 0.00 -0.42 0.00 0.00 57.16 55.42 3hv9 n GLU 452 Cb 0.27 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3hv9 n GLU 452 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3hv9 n THR 453 N 0.62 0.13 -3.98 2.62 -2.24 -0.64 -5.02 114.28 105.77 3hv9 n THR 453 Ca 0.09 -0.14 -0.30 0.00 -2.27 0.00 0.00 64.05 61.44 3hv9 n THR 453 Cb 0.41 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 3hv9 n THR 453 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3hv9 n ASN 454 N -0.08 -2.99 -0.61 3.42 3.02 -0.78 -4.86 115.26 112.39 3hv9 n ASN 454 Ca 0.01 -0.89 0.07 0.00 -0.03 0.00 0.00 54.58 53.73 3hv9 n ASN 454 Cb 0.55 -3.44 0.23 0.00 -0.61 0.00 0.00 39.78 36.51 3hv9 n ASN 454 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3hv9 n SER 455 N -2.85 1.78 -4.91 6.41 7.64 -1.00 -4.79 113.62 115.90 3hv9 n SER 455 Ca -0.07 -1.90 -0.28 0.00 1.01 0.00 0.00 58.87 57.63 3hv9 n SER 455 Cb 0.57 -0.19 0.05 0.00 -1.01 0.00 0.00 64.21 63.63 3hv9 n SER 455 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3hv9 s PHE 456 N -1.62 3.18 -0.03 1.43 0.08 -1.26 -2.42 117.98 117.34 3hv9 s PHE 456 Ca 0.26 0.74 -0.00 0.00 0.12 0.00 0.00 56.93 58.05 3hv9 s PHE 456 Cb 0.14 -3.00 0.03 0.00 -0.57 0.00 0.00 43.02 39.62 3hv9 s PHE 456 CO 0.19 -1.13 0.02 0.50 -0.10 0.00 0.00 175.22 174.70 3hv9 s ARG 457 N -5.21 0.10 -0.04 0.44 6.06 0.46 -4.90 118.95 115.87 3hv9 s ARG 457 Ca 0.57 0.16 -0.14 0.00 -2.50 0.00 0.00 55.73 53.83 3hv9 s ARG 457 Cb -0.11 -0.38 -0.05 0.00 0.06 0.00 0.00 34.95 34.47 3hv9 s ARG 457 CO 0.47 -0.17 0.36 -0.51 -2.50 0.00 0.00 175.30 172.95 3hv9 s LEU 458 N 1.17 4.44 0.28 -0.88 1.02 -1.26 -0.68 118.68 122.77 3hv9 s LEU 458 Ca -0.08 0.85 0.11 0.00 0.02 0.00 0.00 54.13 55.03 3hv9 s LEU 458 Cb -0.13 -2.49 -0.05 0.00 0.02 0.00 0.00 46.19 43.53 3hv9 s LEU 458 CO -0.03 0.31 -0.17 -0.76 0.02 0.00 0.00 176.35 175.73 3hv9 s LEU 459 N -0.89 2.61 -0.05 1.79 1.43 0.36 -4.61 118.68 119.32 3hv9 s LEU 459 Ca 0.22 -1.07 0.01 0.00 -1.03 0.00 0.00 54.13 52.26 3hv9 s LEU 459 Cb -0.16 -1.01 0.02 0.00 0.03 0.00 0.00 46.19 45.08 3hv9 s LEU 459 CO 0.11 -0.05 -0.05 -0.36 0.23 0.00 0.00 176.35 176.24 3hv9 s PHE 460 N -2.61 0.79 -0.20 0.29 0.08 0.10 -0.57 117.98 115.86 3hv9 s PHE 460 Ca 0.29 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 57.12 3hv9 s PHE 460 Cb -0.03 -0.71 0.03 0.00 -0.57 0.00 0.00 43.02 41.74 3hv9 s PHE 460 CO 0.14 -0.21 -0.17 -1.14 -0.10 0.00 0.00 175.22 173.74 3hv9 s GLN 461 N 1.01 2.86 0.34 0.44 0.74 -0.34 -1.53 119.66 123.18 3hv9 s GLN 461 Ca -0.10 -0.92 -0.28 0.00 0.05 0.00 0.00 55.36 54.11 3hv9 s GLN 461 Cb -0.14 -2.67 -0.12 0.00 1.10 0.00 0.00 33.01 31.18 3hv9 s GLN 461 CO -0.00 -0.29 1.35 -2.30 -0.55 0.00 0.00 175.29 173.51 3hv9 n PRO 462 N 4.60 2.26 -3.78 1.67 -0.02 -1.26 -1.28 135.00 137.18 3hv9 n PRO 462 Ca -0.19 0.79 -0.36 0.00 -2.02 0.00 0.00 63.50 61.72 3hv9 n PRO 462 Cb 0.48 -2.42 -0.12 0.00 -0.02 0.00 0.00 33.50 31.43 3hv9 n PRO 462 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hv9 s VAL 463 N -0.95 4.63 -0.12 -1.45 1.01 0.18 -4.62 120.40 119.07 3hv9 s VAL 463 Ca 0.57 -0.07 -0.14 0.00 0.00 0.00 0.00 61.98 62.34 3hv9 s VAL 463 Cb -0.55 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 3hv9 s VAL 463 CO 0.61 0.35 0.33 -0.63 0.00 0.00 0.00 175.10 175.75 3hv9 s ILE 464 N 1.38 5.26 -0.15 2.22 1.09 0.12 -4.30 121.20 126.81 3hv9 s ILE 464 Ca 0.06 0.64 -0.17 0.00 -1.10 0.00 0.00 60.65 60.08 3hv9 s ILE 464 Cb -0.15 -3.66 -0.04 0.00 -1.06 0.00 0.00 42.46 37.55 3hv9 s ILE 464 CO 0.05 0.43 0.43 -0.55 -0.10 0.00 0.00 174.94 175.19 3hv9 s SER 465 N 0.14 6.57 0.02 3.58 0.15 -1.26 -1.26 113.70 121.63 3hv9 s SER 465 Ca 0.19 0.68 0.22 0.00 0.70 0.00 0.00 55.95 57.74 3hv9 s SER 465 Cb -0.14 -2.25 -0.17 0.00 -1.71 0.00 0.00 66.02 61.75 3hv9 s SER 465 CO 0.06 -0.01 0.79 0.18 1.20 0.00 0.00 173.24 175.46 3hv9 n LEU 466 N 3.92 0.47 -0.66 3.45 4.77 -0.62 -4.54 117.00 123.80 3hv9 n LEU 466 Ca -0.08 -0.08 0.07 0.00 -0.03 0.00 0.00 56.01 55.88 3hv9 n LEU 466 Cb 0.51 -0.04 0.21 0.00 -2.33 0.00 0.00 43.42 41.78 3hv9 n LEU 466 CO 0.42 0.05 0.64 0.54 -1.33 0.00 0.00 177.39 177.71 3hv9 n ARG 467 N -2.04 2.11 -1.07 3.23 3.00 -1.24 -4.97 116.66 115.68 3hv9 n ARG 467 Ca -0.00 -2.85 0.00 0.00 -0.01 0.00 0.00 57.85 54.98 3hv9 n ARG 467 Cb 0.48 -1.72 0.00 0.00 0.00 0.00 0.00 32.46 31.22 3hv9 n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3hv9 n GLY 468 N -0.96 0.77 3.69 -0.13 0.00 -1.26 -5.04 105.19 102.26 3hv9 n GLY 468 Ca 0.22 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 3hv9 n GLY 468 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hv9 s ASP 469 N -2.67 6.85 0.28 1.61 -1.08 -1.26 -4.88 116.67 115.51 3hv9 s ASP 469 Ca 0.00 2.16 0.12 0.00 -0.52 0.00 0.00 52.55 54.31 3hv9 s ASP 469 Cb 0.00 -2.57 0.34 0.00 -1.46 0.00 0.00 42.92 39.23 3hv9 s ASP 469 CO 0.00 -0.70 1.59 0.77 0.52 0.00 0.00 175.17 177.35 3hv9 h SER 470 N 7.60 0.00 -4.08 -0.34 4.64 -1.92 -3.44 113.55 116.01 3hv9 h SER 470 Ca -0.39 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.37 3hv9 h SER 470 Cb 1.19 0.00 0.15 0.00 -0.31 0.00 0.00 62.40 63.43 3hv9 h SER 470 CO 0.89 0.61 0.54 1.41 -0.87 0.00 0.00 176.83 179.41 3hv9 n HIS 471 N -3.65 2.05 -2.95 4.77 8.25 -1.26 -4.91 115.22 117.51 3hv9 n HIS 471 Ca -0.01 0.42 -0.44 0.00 -0.26 0.00 0.00 57.72 57.44 3hv9 n HIS 471 Cb 0.64 -2.30 -0.02 0.00 1.12 0.00 0.00 29.99 29.43 3hv9 n HIS 471 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3hv9 s GLU 472 N -3.24 3.60 -0.16 -0.41 2.02 0.05 -4.97 118.70 115.60 3hv9 s GLU 472 Ca 0.80 -1.81 -0.27 0.00 0.02 0.00 0.00 54.97 53.72 3hv9 s GLU 472 Cb -0.39 -4.89 -0.01 0.00 0.10 0.00 0.00 34.13 28.94 3hv9 s GLU 472 CO 0.43 -1.74 0.89 -0.80 0.02 0.00 0.00 175.26 174.06 3hv9 s ASN 473 N 3.54 7.03 0.00 -0.19 -0.87 -1.26 -1.52 114.94 121.67 3hv9 s ASN 473 Ca 0.32 1.27 0.05 0.00 -1.57 0.00 0.00 52.86 52.93 3hv9 s ASN 473 Cb -0.05 -2.48 -0.01 0.00 -0.02 0.00 0.00 41.25 38.68 3hv9 s ASN 473 CO -0.09 -0.44 -0.16 -0.31 -2.57 0.00 0.00 177.10 173.52 3hv9 s TYR 474 N 2.25 1.43 -0.04 2.20 2.02 -0.39 0.49 117.35 125.30 3hv9 s TYR 474 Ca 0.41 -0.29 -0.17 0.00 -0.37 0.00 0.00 57.07 56.64 3hv9 s TYR 474 Cb -0.17 -0.90 -0.05 0.00 -0.40 0.00 0.00 41.96 40.44 3hv9 s TYR 474 CO 0.13 -0.00 0.48 -2.00 -1.57 0.00 0.00 175.55 172.58 3hv9 s GLU 475 N -0.57 4.18 -0.03 -0.62 2.12 -0.41 -0.47 118.70 122.91 3hv9 s GLU 475 Ca 0.06 0.50 -0.13 0.00 0.36 0.00 0.00 54.97 55.76 3hv9 s GLU 475 Cb -0.07 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 3hv9 s GLU 475 CO -0.00 0.42 0.35 0.54 -0.54 0.00 0.00 175.26 176.02 3hv9 s VAL 476 N -0.24 5.14 0.01 3.70 0.11 -0.28 -1.20 120.40 127.64 3hv9 s VAL 476 Ca 0.26 0.69 0.05 0.00 -2.93 0.00 0.00 61.98 60.06 3hv9 s VAL 476 Cb -0.17 -3.64 -0.02 0.00 -1.53 0.00 0.00 36.38 31.03 3hv9 s VAL 476 CO 0.13 0.58 -0.16 -0.76 -3.33 0.00 0.00 175.10 171.57 3hv9 s LEU 477 N -1.03 2.09 -0.13 2.54 1.43 0.27 -4.64 118.68 119.20 3hv9 s LEU 477 Ca 0.22 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.92 3hv9 s LEU 477 Cb -0.16 -0.78 -0.03 0.00 0.03 0.00 0.00 46.19 45.25 3hv9 s LEU 477 CO 0.11 0.15 0.01 -0.22 0.23 0.00 0.00 176.35 176.63 3hv9 s LEU 478 N -0.69 3.58 0.11 1.79 2.96 -1.26 -0.49 118.68 124.68 3hv9 s LEU 478 Ca 0.05 0.07 0.07 0.00 -0.22 0.00 0.00 54.13 54.10 3hv9 s LEU 478 Cb -0.07 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 3hv9 s LEU 478 CO 0.00 0.28 -0.17 -0.13 -1.32 0.00 0.00 176.35 175.01 3hv9 s ARG 479 N -0.29 1.05 -0.09 1.98 1.81 0.15 -4.97 118.95 118.58 3hv9 s ARG 479 Ca 0.07 -1.16 0.04 0.00 -1.72 0.00 0.00 55.73 52.95 3hv9 s ARG 479 Cb -0.12 -1.14 -0.01 0.00 -0.45 0.00 0.00 34.95 33.23 3hv9 s ARG 479 CO 0.02 0.25 -0.22 -1.17 -0.68 0.00 0.00 175.30 173.50 3hv9 s LEU 480 N -2.07 2.24 -0.12 2.53 2.96 -1.26 -0.40 118.68 122.55 3hv9 s LEU 480 Ca 0.06 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.43 3hv9 s LEU 480 Cb -0.08 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.12 3hv9 s LEU 480 CO 0.04 0.19 0.08 -0.76 -1.32 0.00 0.00 176.35 174.58 3hv9 s LEU 481 N 0.17 4.04 0.81 -0.68 2.01 -1.02 -1.20 118.68 122.80 3hv9 s LEU 481 Ca -0.12 0.30 -0.11 0.00 0.01 0.00 0.00 54.13 54.21 3hv9 s LEU 481 Cb -0.16 -1.97 0.09 0.00 0.01 0.00 0.00 46.19 44.16 3hv9 s LEU 481 CO 0.07 0.36 1.16 0.54 1.01 0.00 0.00 176.35 179.49 3hv9 s ASN 482 N -0.74 4.41 0.50 2.29 2.20 0.53 -4.85 114.94 119.27 3hv9 s ASN 482 Ca 0.13 0.64 0.19 0.00 -0.94 0.00 0.00 52.86 52.88 3hv9 s ASN 482 Cb -0.12 -1.11 1.24 0.00 -2.00 0.00 0.00 41.25 39.26 3hv9 s ASN 482 CO 0.03 -1.94 2.04 -0.65 -2.94 0.00 0.00 177.10 173.63 3hv9 h PRO 483 N -1.03 0.13 -0.75 3.55 0.11 -1.88 0.14 132.00 132.26 3hv9 h PRO 483 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hv9 h PRO 483 Cb 1.32 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3hv9 h PRO 483 CO 0.61 0.08 0.00 0.00 -0.21 0.00 0.00 178.00 178.49 3hv9 n GLN 484 N -4.45 2.18 -0.94 1.05 0.00 -1.26 -4.86 117.38 109.09 3hv9 n GLN 484 Ca 0.06 -1.03 0.00 0.00 0.00 0.00 0.00 57.00 56.03 3hv9 n GLN 484 Cb 0.37 -1.66 0.00 0.00 0.00 0.00 0.00 30.24 28.96 3hv9 n GLN 484 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hv9 n GLY 485 N 0.33 0.91 3.87 2.61 0.00 0.48 -5.01 105.19 108.38 3hv9 n GLY 485 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3hv9 n GLY 485 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hv9 s GLN 486 N -0.06 3.77 0.12 1.61 -2.07 -1.26 -4.79 119.66 116.98 3hv9 s GLN 486 Ca 0.00 0.19 -0.30 0.00 -1.82 0.00 0.00 55.36 53.43 3hv9 s GLN 486 Cb 0.00 -2.84 -0.06 0.00 -1.09 0.00 0.00 33.01 29.02 3hv9 s GLN 486 CO 0.00 0.45 1.10 -2.00 -1.32 0.00 0.00 175.29 173.51 3hv9 s GLU 487 N -2.40 4.56 -0.07 9.60 2.12 -1.26 -0.35 118.70 130.90 3hv9 s GLU 487 Ca 0.40 1.67 -0.18 0.00 0.36 0.00 0.00 54.97 57.23 3hv9 s GLU 487 Cb -0.13 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 3hv9 s GLU 487 CO 0.21 -0.01 0.47 0.54 -0.54 0.00 0.00 175.26 175.94 3hv9 s VAL 488 N 0.25 5.10 -0.10 3.70 0.11 -0.34 -4.90 120.40 124.22 3hv9 s VAL 488 Ca 0.52 0.96 -0.38 0.00 -2.93 0.00 0.00 61.98 60.15 3hv9 s VAL 488 Cb -0.28 -3.80 -0.16 0.00 -1.53 0.00 0.00 36.38 30.61 3hv9 s VAL 488 CO 0.32 0.41 1.56 -2.65 -3.33 0.00 0.00 175.10 171.41 3hv9 n PRO 489 N 3.03 1.19 -0.33 1.54 -0.02 -1.26 -4.60 135.00 134.55 3hv9 n PRO 489 Ca -0.09 0.43 0.09 0.00 -2.02 0.00 0.00 63.50 61.92 3hv9 n PRO 489 Cb 0.52 -2.10 0.26 0.00 -0.02 0.00 0.00 33.50 32.16 3hv9 n PRO 489 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3hv9 h PRO 490 N 5.99 0.74 -0.82 0.52 0.11 -1.95 0.14 132.00 136.73 3hv9 h PRO 490 Ca -0.47 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.63 3hv9 h PRO 490 Cb 1.32 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3hv9 h PRO 490 CO 0.87 0.49 0.54 0.00 -0.21 0.00 0.00 178.00 179.69 3hv9 h ALA 491 N 1.58 1.49 0.12 -0.75 0.00 -1.99 0.52 119.26 120.24 3hv9 h ALA 491 Ca 0.51 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 55.09 3hv9 h ALA 491 Cb 0.70 -0.29 0.03 0.00 0.00 0.00 0.00 17.79 18.23 3hv9 h ALA 491 CO -0.35 0.43 -1.20 0.93 0.00 0.00 0.00 179.25 179.06 3hv9 h GLU 492 N 1.02 0.60 0.00 0.00 5.08 -1.14 -2.26 114.58 117.89 3hv9 h GLU 492 Ca 0.33 -0.81 -0.19 0.00 -1.00 0.00 0.00 59.36 57.69 3hv9 h GLU 492 Cb 0.03 0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3hv9 h GLU 492 CO -0.09 1.37 -0.86 0.27 -1.00 0.00 0.00 179.01 178.70 3hv9 h PHE 493 N 0.22 0.14 -0.27 4.33 -5.15 -0.91 -1.32 116.94 113.98 3hv9 h PHE 493 Ca -0.18 -0.08 0.02 0.00 -0.20 0.00 0.00 57.97 57.53 3hv9 h PHE 493 Cb 1.88 -0.01 -0.02 0.00 0.22 0.00 0.00 35.95 38.01 3hv9 h PHE 493 CO 0.12 0.90 0.12 -0.07 -2.00 0.00 0.00 178.31 177.38 3hv9 h LEU 494 N 0.05 0.16 -0.23 2.10 4.07 -0.03 0.22 115.31 121.65 3hv9 h LEU 494 Ca -0.03 0.02 0.01 0.00 0.08 0.00 0.00 57.88 57.97 3hv9 h LEU 494 Cb 1.49 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 43.20 3hv9 h LEU 494 CO 0.12 0.13 0.11 -0.74 -1.08 0.00 0.00 178.44 176.98 3hv9 h HIS 495 N 0.25 0.20 -0.04 1.13 2.76 -1.26 -2.17 115.15 116.03 3hv9 h HIS 495 Ca 0.11 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.22 3hv9 h HIS 495 Cb 0.06 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 3hv9 h HIS 495 CO -0.11 0.12 -0.30 0.00 -1.30 0.00 0.00 177.93 176.33 3hv9 h ALA 496 N 1.12 1.43 -0.10 5.26 0.00 -1.07 -2.77 119.26 123.12 3hv9 h ALA 496 Ca 0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 3hv9 h ALA 496 Cb 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hv9 h ALA 496 CO -0.06 0.42 0.03 0.00 0.00 0.00 0.00 179.25 179.63 3hv9 h ALA 497 N 1.63 0.13 -0.39 0.00 0.00 -0.34 -1.63 119.26 118.67 3hv9 h ALA 497 Ca 0.01 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.84 3hv9 h ALA 497 Cb 0.57 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 3hv9 h ALA 497 CO 0.04 -0.24 0.12 0.87 0.00 0.00 0.00 179.25 180.04 3hv9 h LYS 498 N -0.04 0.26 -0.79 0.00 1.57 -1.26 0.03 116.57 116.34 3hv9 h LYS 498 Ca 0.03 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3hv9 h LYS 498 Cb 0.24 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 3hv9 h LYS 498 CO -0.00 0.17 0.47 1.49 -0.57 0.00 0.00 179.45 181.01 3hv9 h GLU 499 N 0.27 1.06 -0.28 3.15 4.81 -1.36 -1.87 114.58 120.37 3hv9 h GLU 499 Ca 0.18 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3hv9 h GLU 499 Cb 0.18 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3hv9 h GLU 499 CO -0.20 0.75 0.00 0.00 -0.73 0.00 0.00 179.01 178.82 3hv9 n ALA 500 N -2.42 2.48 -3.52 2.92 0.00 -0.62 -4.94 120.51 114.40 3hv9 n ALA 500 Ca 0.08 -0.65 -0.20 0.00 0.00 0.00 0.00 53.44 52.67 3hv9 n ALA 500 Cb 0.07 -1.02 0.08 0.00 0.00 0.00 0.00 19.45 18.58 3hv9 n ALA 500 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hv9 n GLY 501 N 1.18 -0.44 0.48 0.00 0.00 -0.70 -4.94 105.19 100.77 3hv9 n GLY 501 Ca 0.16 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.41 3hv9 n GLY 501 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hv9 n LEU 502 N -4.53 1.99 0.07 0.99 4.32 -0.07 -4.75 117.00 115.01 3hv9 n LEU 502 Ca -0.15 -0.98 -0.13 0.00 -0.02 0.00 0.00 56.01 54.73 3hv9 n LEU 502 Cb 0.62 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.34 3hv9 n LEU 502 CO 0.63 0.37 0.77 0.00 -1.22 0.00 0.00 177.39 177.94 3hv9 h ALA 503 N 2.45 -0.13 -1.00 -1.18 0.00 -1.91 -1.46 119.26 116.03 3hv9 h ALA 503 Ca 0.00 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.90 3hv9 h ALA 503 Cb 0.52 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 3hv9 h ALA 503 CO 0.00 -0.51 0.64 0.93 0.00 0.00 0.00 179.25 180.31 3hv9 h GLU 504 N -0.26 1.09 -0.34 0.00 3.07 -1.91 -1.60 114.58 114.64 3hv9 h GLU 504 Ca -0.01 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.68 3hv9 h GLU 504 Cb 0.21 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 3hv9 h GLU 504 CO 0.02 0.72 -0.22 -0.22 -1.40 0.00 0.00 179.01 177.92 3hv9 h LYS 505 N 1.12 0.65 -0.13 2.33 3.64 -1.81 -1.75 116.57 120.62 3hv9 h LYS 505 Ca 0.45 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 3hv9 h LYS 505 Cb 0.25 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3hv9 h LYS 505 CO -0.20 0.82 -0.01 0.82 -2.27 0.00 0.00 179.45 178.62 3hv9 h ILE 506 N 0.58 1.26 -0.92 2.00 2.04 -0.44 -1.71 117.51 120.31 3hv9 h ILE 506 Ca 0.08 -0.86 0.16 0.00 1.00 0.00 0.00 64.86 65.24 3hv9 h ILE 506 Cb 0.69 1.57 -0.10 0.00 -0.74 0.00 0.00 36.82 38.24 3hv9 h ILE 506 CO 0.05 0.25 0.52 0.44 0.00 0.00 0.00 178.15 179.41 3hv9 h ASP 507 N -0.04 0.67 -0.58 1.72 3.32 -1.20 -1.42 116.42 118.88 3hv9 h ASP 507 Ca 0.04 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 3hv9 h ASP 507 Cb 0.39 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 3hv9 h ASP 507 CO 0.01 0.27 0.25 0.03 -1.72 0.00 0.00 179.24 178.08 3hv9 h ARG 508 N 0.72 0.86 -0.30 3.56 -0.00 -0.87 0.27 114.38 118.61 3hv9 h ARG 508 Ca 0.51 -0.15 0.04 0.00 -0.50 0.00 0.00 59.98 59.88 3hv9 h ARG 508 Cb 0.73 -0.14 -0.04 0.00 0.00 0.00 0.00 29.97 30.52 3hv9 h ARG 508 CO -0.36 0.72 0.07 2.35 0.00 0.00 0.00 179.97 182.76 3hv9 h TRP 509 N 0.80 0.13 -0.09 3.04 7.01 -0.42 0.29 115.95 126.70 3hv9 h TRP 509 Ca 0.20 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 3hv9 h TRP 509 Cb 0.17 -0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.21 3hv9 h TRP 509 CO 0.01 0.04 0.02 0.28 -2.79 0.00 0.00 178.44 176.00 3hv9 h VAL 510 N 0.19 1.20 -0.21 2.65 2.07 -0.82 -1.11 116.25 120.22 3hv9 h VAL 510 Ca 0.14 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.06 3hv9 h VAL 510 Cb 0.13 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3hv9 h VAL 510 CO -0.17 0.18 0.01 0.40 0.02 0.00 0.00 177.57 178.01 3hv9 h ILE 511 N -0.07 0.86 -0.39 4.57 2.04 -0.20 0.23 117.51 124.54 3hv9 h ILE 511 Ca 0.03 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 65.91 3hv9 h ILE 511 Cb 0.26 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 3hv9 h ILE 511 CO 0.00 0.01 0.14 -0.07 0.00 0.00 0.00 178.15 178.24 3hv9 h LEU 512 N 0.07 0.16 -0.67 1.44 3.38 -0.27 0.99 115.31 120.42 3hv9 h LEU 512 Ca 0.10 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 3hv9 h LEU 512 Cb 0.12 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3hv9 h LEU 512 CO -0.16 0.13 -0.57 0.78 0.09 0.00 0.00 178.44 178.71 3hv9 h ASN 513 N 0.31 0.33 -0.40 -0.43 4.21 -0.82 -1.38 115.58 117.39 3hv9 h ASN 513 Ca 0.18 -0.18 -0.02 0.00 1.21 0.00 0.00 56.30 57.49 3hv9 h ASN 513 Cb 0.15 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.24 3hv9 h ASN 513 CO -0.18 0.83 0.19 0.28 -1.29 0.00 0.00 177.43 177.26 3hv9 h SER 514 N 0.22 0.53 -0.49 5.81 0.02 -0.04 -0.67 113.55 118.93 3hv9 h SER 514 Ca -0.00 -0.13 0.03 0.00 -0.84 0.00 0.00 61.79 60.85 3hv9 h SER 514 Cb 1.07 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.44 3hv9 h SER 514 CO 0.09 0.51 0.28 0.40 -1.14 0.00 0.00 176.83 176.97 3hv9 h ILE 515 N 0.51 1.02 0.69 3.27 2.04 -0.63 -0.99 117.51 123.42 3hv9 h ILE 515 Ca 0.14 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 3hv9 h ILE 515 Cb 0.12 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3hv9 h ILE 515 CO -0.02 0.10 -0.41 0.50 0.00 0.00 0.00 178.15 178.33 3hv9 h LYS 516 N 0.56 -0.99 -0.75 2.37 3.64 -0.84 -1.24 116.57 119.32 3hv9 h LYS 516 Ca 0.20 0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.75 3hv9 h LYS 516 Cb 0.05 0.23 -0.07 0.00 -0.41 0.00 0.00 32.23 32.02 3hv9 h LYS 516 CO -0.11 -0.66 0.39 -0.07 -2.27 0.00 0.00 179.45 176.73 3hv9 h LEU 517 N -1.03 0.51 -1.54 5.20 3.38 -1.06 -1.64 115.31 119.13 3hv9 h LEU 517 Ca -0.09 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3hv9 h LEU 517 Cb 0.83 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 3hv9 h LEU 517 CO 0.10 0.28 -0.23 0.25 0.09 0.00 0.00 178.44 178.93 3hv9 h LEU 518 N 0.64 0.00 -0.14 1.67 5.85 -0.94 -1.04 115.31 121.35 3hv9 h LEU 518 Ca 0.37 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 59.03 3hv9 h LEU 518 Cb 0.40 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 3hv9 h LEU 518 CO -0.28 0.23 -0.17 0.00 -0.34 0.00 0.00 178.44 177.89 3hv9 h ALA 519 N 1.77 0.21 -0.59 1.25 0.00 -0.26 -1.81 119.26 119.83 3hv9 h ALA 519 Ca -0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3hv9 h ALA 519 Cb 0.42 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3hv9 h ALA 519 CO 0.03 0.12 0.36 0.93 0.00 0.00 0.00 179.25 180.69 3hv9 h GLU 520 N -0.01 0.81 0.53 0.00 5.08 -1.16 -1.76 114.58 118.06 3hv9 h GLU 520 Ca 0.02 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3hv9 h GLU 520 Cb 0.71 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.80 3hv9 h GLU 520 CO 0.04 0.58 -0.26 0.45 -1.00 0.00 0.00 179.01 178.82 3hv9 h HIS 521 N 0.80 -0.66 -0.58 4.33 3.86 -1.24 -2.83 115.15 118.83 3hv9 h HIS 521 Ca 0.21 -0.02 0.15 0.00 -1.16 0.00 0.00 60.37 59.56 3hv9 h HIS 521 Cb -0.02 0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 3hv9 h HIS 521 CO -0.02 -0.34 0.41 0.00 0.86 0.00 0.00 177.93 178.84 3hv9 h ARG 522 N -0.94 0.11 0.00 2.45 2.47 -1.33 0.83 114.38 117.97 3hv9 h ARG 522 Ca -0.07 -0.01 -0.10 0.00 -1.26 0.00 0.00 59.98 58.54 3hv9 h ARG 522 Cb 0.62 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.90 3hv9 h ARG 522 CO 0.12 0.07 -0.47 0.00 0.56 0.00 0.00 179.97 180.25 3hv9 h ALA 523 N 1.71 0.98 -0.40 0.04 0.00 -1.24 -2.45 119.26 117.92 3hv9 h ALA 523 Ca 0.28 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 3hv9 h ALA 523 Cb 0.95 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3hv9 h ALA 523 CO -0.03 0.59 0.09 1.63 0.00 0.00 0.00 179.25 181.52 3hv9 n LYS 524 N -3.63 2.95 -0.94 0.00 5.02 0.25 -4.90 118.16 116.91 3hv9 n LYS 524 Ca -0.01 -1.85 0.00 0.00 -2.02 0.00 0.00 58.31 54.44 3hv9 n LYS 524 Cb 0.55 -1.90 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3hv9 n LYS 524 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hv9 n GLY 525 N 0.18 0.54 3.69 0.72 0.00 -0.92 -4.99 105.19 104.41 3hv9 n GLY 525 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3hv9 n GLY 525 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hv9 s HIS 526 N -2.42 3.30 0.00 1.61 3.76 -0.98 -4.93 115.29 115.63 3hv9 s HIS 526 Ca 0.00 1.29 -0.05 0.00 -0.15 0.00 0.00 55.06 56.15 3hv9 s HIS 526 Cb 0.00 -3.39 -0.22 0.00 1.11 0.00 0.00 32.58 30.08 3hv9 s HIS 526 CO 0.00 -1.15 3.20 1.04 -0.85 0.00 0.00 174.74 176.98 3hv9 n GLN 527 N 4.80 1.73 -3.14 1.40 6.02 -1.26 -3.72 117.38 123.22 3hv9 n GLN 527 Ca 0.10 -0.82 -0.36 0.00 -0.01 0.00 0.00 57.00 55.92 3hv9 n GLN 527 Cb 0.47 -1.86 -0.06 0.00 1.02 0.00 0.00 30.24 29.81 3hv9 n GLN 527 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3hv9 s THR 528 N 1.06 4.62 -0.01 5.09 -1.32 -1.26 -0.77 115.64 123.05 3hv9 s THR 528 Ca 0.55 1.18 0.01 0.00 -1.21 0.00 0.00 61.69 62.22 3hv9 s THR 528 Cb 0.26 -3.81 0.00 0.00 -1.51 0.00 0.00 72.50 67.44 3hv9 s THR 528 CO 0.00 0.16 -0.05 -0.75 -2.21 0.00 0.00 174.62 171.77 3hv9 s LYS 529 N -2.11 0.47 -0.09 7.08 2.20 -0.58 -4.87 119.74 121.84 3hv9 s LYS 529 Ca 0.44 -0.15 0.04 0.00 -0.36 0.00 0.00 55.97 55.93 3hv9 s LYS 529 Cb -0.16 -0.48 -0.01 0.00 -1.51 0.00 0.00 37.83 35.68 3hv9 s LYS 529 CO 0.20 0.07 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.53 3hv9 s LEU 530 N 0.12 2.24 -0.24 5.43 1.43 -0.86 -1.26 118.68 125.55 3hv9 s LEU 530 Ca -0.01 -0.48 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 3hv9 s LEU 530 Cb -0.05 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.70 3hv9 s LEU 530 CO -0.00 0.19 0.57 -0.36 0.23 0.00 0.00 176.35 176.97 3hv9 s PHE 531 N 0.17 3.31 -0.07 0.29 0.08 0.38 -0.94 117.98 121.20 3hv9 s PHE 531 Ca -0.12 0.76 0.05 0.00 0.12 0.00 0.00 56.93 57.74 3hv9 s PHE 531 Cb -0.16 -2.76 -0.00 0.00 -0.57 0.00 0.00 43.02 39.53 3hv9 s PHE 531 CO 0.07 -0.24 -0.23 0.08 -0.10 0.00 0.00 175.22 174.80 3hv9 s VAL 532 N 2.18 1.90 0.36 -0.44 1.01 0.98 -1.12 120.40 125.27 3hv9 s VAL 532 Ca 0.24 -0.96 -0.25 0.00 0.00 0.00 0.00 61.98 61.01 3hv9 s VAL 532 Cb -0.16 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 3hv9 s VAL 532 CO 0.09 0.53 1.01 -1.00 0.00 0.00 0.00 175.10 175.73 3hv9 s HIS 533 N 0.09 3.46 -0.10 5.22 0.09 -1.26 -0.01 115.29 122.78 3hv9 s HIS 533 Ca -0.10 1.70 0.03 0.00 -0.00 0.00 0.00 55.06 56.70 3hv9 s HIS 533 Cb -0.15 -3.04 -0.01 0.00 -0.00 0.00 0.00 32.58 29.38 3hv9 s HIS 533 CO 0.05 -0.26 -0.21 -0.51 -0.00 0.00 0.00 174.74 173.81 3hv9 s LEU 534 N -2.35 2.26 0.96 0.89 1.43 -0.82 -4.84 118.68 116.21 3hv9 s LEU 534 Ca 0.54 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 3hv9 s LEU 534 Cb -0.21 -1.46 0.16 0.00 0.03 0.00 0.00 46.19 44.71 3hv9 s LEU 534 CO 0.26 0.17 1.11 -0.94 0.23 0.00 0.00 176.35 177.18 3hv9 s SER 535 N 0.28 3.03 0.26 2.29 1.04 -1.26 -4.66 113.70 114.68 3hv9 s SER 535 Ca -0.15 1.14 0.00 0.00 0.48 0.00 0.00 55.95 57.42 3hv9 s SER 535 Cb -0.17 -1.78 0.33 0.00 0.10 0.00 0.00 66.02 64.51 3hv9 s SER 535 CO 0.08 -2.87 1.69 0.77 0.98 0.00 0.00 173.24 173.89 3hv9 h SER 536 N -1.71 0.59 -0.36 7.02 4.64 -1.98 -1.18 113.55 120.57 3hv9 h SER 536 Ca -0.53 -0.20 0.08 0.00 -0.47 0.00 0.00 61.79 60.67 3hv9 h SER 536 Cb 1.32 -0.16 -0.07 0.00 -0.31 0.00 0.00 62.40 63.18 3hv9 h SER 536 CO 0.59 0.82 -0.12 0.00 -0.87 0.00 0.00 176.83 177.25 3hv9 h ALA 537 N 1.23 0.19 -0.30 5.18 0.00 -1.96 -0.56 119.26 123.04 3hv9 h ALA 537 Ca 0.08 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3hv9 h ALA 537 Cb 0.68 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 3hv9 h ALA 537 CO 0.05 -0.49 -0.08 0.77 0.00 0.00 0.00 179.25 179.50 3hv9 h SER 538 N -0.04 0.46 -0.67 0.00 0.02 -1.78 -1.05 113.55 110.50 3hv9 h SER 538 Ca 0.18 -0.10 0.07 0.00 -0.84 0.00 0.00 61.79 61.09 3hv9 h SER 538 Cb 0.31 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 3hv9 h SER 538 CO -0.40 0.59 0.44 0.25 -1.14 0.00 0.00 176.83 176.57 3hv9 h LEU 539 N 0.46 0.59 -2.40 5.07 6.46 -0.16 -1.52 115.31 123.81 3hv9 h LEU 539 Ca 0.09 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 3hv9 h LEU 539 Cb 0.42 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3hv9 h LEU 539 CO 0.02 0.38 0.00 0.00 -0.62 0.00 0.00 178.44 178.22 3hv9 n GLN 540 N -4.48 2.64 -3.47 1.25 6.02 -0.32 -4.66 117.38 114.35 3hv9 n GLN 540 Ca 0.10 -2.30 -0.43 0.00 -0.01 0.00 0.00 57.00 54.36 3hv9 n GLN 540 Cb 0.24 -1.55 -0.09 0.00 1.02 0.00 0.00 30.24 29.86 3hv9 n GLN 540 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3hv9 s ASP 541 N -0.97 6.01 0.55 1.08 3.68 -0.57 -4.94 116.67 121.51 3hv9 s ASP 541 Ca 0.42 -1.19 0.28 0.00 2.13 0.00 0.00 52.55 54.19 3hv9 s ASP 541 Cb 0.23 -2.13 1.60 0.00 -1.45 0.00 0.00 42.92 41.18 3hv9 s ASP 541 CO 0.27 -0.54 2.16 -0.65 0.13 0.00 0.00 175.17 176.54 3hv9 h PRO 542 N 8.63 0.00 0.00 4.34 0.11 -1.90 -2.09 132.00 141.08 3hv9 h PRO 542 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3hv9 h PRO 542 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3hv9 h PRO 542 CO 0.79 0.06 0.00 0.41 -0.21 0.00 0.00 178.00 179.06 3hv9 n GLY 543 N -1.03 -1.17 0.25 -0.55 0.00 -1.26 -4.28 105.19 97.15 3hv9 n GLY 543 Ca -0.02 -0.14 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 3hv9 n GLY 543 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hv9 h LEU 544 N 0.00 -0.47 -0.48 0.99 5.85 -1.71 -2.78 115.31 116.70 3hv9 h LEU 544 Ca 0.00 -0.11 0.10 0.00 0.84 0.00 0.00 57.88 58.70 3hv9 h LEU 544 Cb 0.24 0.12 -0.10 0.00 0.37 0.00 0.00 40.66 41.29 3hv9 h LEU 544 CO 0.00 -0.06 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.81 3hv9 h LEU 545 N -0.96 -0.55 -0.07 2.25 4.07 -1.80 0.34 115.31 118.59 3hv9 h LEU 545 Ca -0.06 0.16 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 3hv9 h LEU 545 Cb 0.55 0.34 -0.00 0.00 1.08 0.00 0.00 40.66 42.63 3hv9 h LEU 545 CO 0.09 -0.19 0.04 -0.65 -1.08 0.00 0.00 178.44 176.65 3hv9 h PRO 546 N -0.04 0.10 -0.85 1.13 0.11 -1.78 -0.15 132.00 130.51 3hv9 h PRO 546 Ca 0.23 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 3hv9 h PRO 546 Cb 0.40 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.45 3hv9 h PRO 546 CO -0.52 0.16 0.48 2.35 -0.21 0.00 0.00 178.00 180.25 3hv9 h TRP 547 N 0.01 1.16 -0.42 0.65 7.01 -1.19 -2.61 115.95 120.56 3hv9 h TRP 547 Ca 0.02 -0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.96 3hv9 h TRP 547 Cb 0.09 -0.37 -0.02 0.00 -2.10 0.00 0.00 29.16 26.76 3hv9 h TRP 547 CO -0.04 0.79 0.11 1.25 -2.79 0.00 0.00 178.44 177.76 3hv9 h LEU 548 N 1.19 0.63 -0.80 0.65 6.46 0.04 -1.24 115.31 122.24 3hv9 h LEU 548 Ca 0.30 -0.23 0.16 0.00 -0.12 0.00 0.00 57.88 57.99 3hv9 h LEU 548 Cb 0.01 -0.17 -0.10 0.00 -0.73 0.00 0.00 40.66 39.67 3hv9 h LEU 548 CO -0.05 0.69 0.35 1.23 -0.62 0.00 0.00 178.44 180.04 3hv9 h GLY 549 N 0.54 1.26 1.85 3.75 0.00 -0.65 -0.43 103.07 109.39 3hv9 h GLY 549 Ca 0.13 -0.17 -0.19 0.00 0.00 0.00 0.00 47.33 47.10 3hv9 h GLY 549 CO 0.00 -0.11 -0.96 -0.24 0.00 0.00 0.00 176.54 175.23 3hv9 h VAL 550 N 0.48 1.35 -0.67 4.60 3.04 -1.30 -2.55 116.25 121.20 3hv9 h VAL 550 Ca 0.45 -2.98 -0.07 0.00 -1.01 0.00 0.00 66.70 63.09 3hv9 h VAL 550 Cb 0.70 2.66 -0.03 0.00 -2.01 0.00 0.00 31.29 32.61 3hv9 h VAL 550 CO -0.42 0.77 0.14 0.00 -1.01 0.00 0.00 177.57 177.05 3hv9 h ALA 551 N 1.15 0.97 0.05 3.17 0.00 -0.33 0.04 119.26 124.31 3hv9 h ALA 551 Ca -0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3hv9 h ALA 551 Cb 1.69 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3hv9 h ALA 551 CO 0.10 0.65 -0.02 -0.07 0.00 0.00 0.00 179.25 179.91 3hv9 h LEU 552 N 1.02 -0.06 -0.40 0.00 3.38 -1.13 -3.10 115.31 115.03 3hv9 h LEU 552 Ca 0.21 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.84 3hv9 h LEU 552 Cb 0.40 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3hv9 h LEU 552 CO 0.01 0.32 0.25 0.50 0.09 0.00 0.00 178.44 179.61 3hv9 h LYS 553 N -0.44 0.50 -0.63 1.13 3.64 -1.39 -1.21 116.57 118.17 3hv9 h LYS 553 Ca -0.01 -0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.52 3hv9 h LYS 553 Cb 0.40 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 3hv9 h LYS 553 CO 0.01 0.33 0.48 0.00 -2.27 0.00 0.00 179.45 178.00 3hv9 h ALA 554 N 1.15 2.54 -0.04 5.00 0.00 -1.00 0.30 119.26 127.21 3hv9 h ALA 554 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hv9 h ALA 554 Cb -0.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hv9 h ALA 554 CO -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 179.25 178.40 3hv9 n ALA 555 N -2.60 2.46 -3.92 0.00 0.00 -0.92 -4.97 120.51 110.56 3hv9 n ALA 555 Ca 0.12 -0.68 -0.28 0.00 0.00 0.00 0.00 53.44 52.60 3hv9 n ALA 555 Cb 0.73 -0.71 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 3hv9 n ALA 555 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hv9 n ARG 556 N 1.19 -2.54 -2.66 0.00 3.00 0.10 -4.86 116.66 110.89 3hv9 n ARG 556 Ca 0.12 0.38 -0.42 0.00 -0.01 0.00 0.00 57.85 57.92 3hv9 n ARG 556 Cb 0.53 -4.27 -0.03 0.00 0.00 0.00 0.00 32.46 28.69 3hv9 n ARG 556 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 3hv9 s LEU 557 N -6.91 4.29 0.84 0.55 2.96 -0.91 -5.01 118.68 114.48 3hv9 s LEU 557 Ca 0.14 1.61 -0.15 0.00 -0.22 0.00 0.00 54.13 55.50 3hv9 s LEU 557 Cb -0.05 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.03 3hv9 s LEU 557 CO 0.89 -0.41 0.20 -2.65 -1.32 0.00 0.00 176.35 173.07 3hv9 n PRO 558 N 4.66 0.02 -1.95 0.98 -0.02 -1.26 -4.93 135.00 132.50 3hv9 n PRO 558 Ca 0.08 0.04 -0.38 0.00 -2.02 0.00 0.00 63.50 61.22 3hv9 n PRO 558 Cb 0.49 -1.63 0.02 0.00 -0.02 0.00 0.00 33.50 32.36 3hv9 n PRO 558 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3hv9 s PRO 559 N -2.81 3.45 -1.19 0.52 0.02 -1.26 -3.96 135.00 129.77 3hv9 s PRO 559 Ca 0.57 2.10 -0.20 0.00 0.02 0.00 0.00 61.00 63.50 3hv9 s PRO 559 Cb -0.28 -2.38 -0.00 0.00 0.02 0.00 0.00 34.50 31.86 3hv9 s PRO 559 CO 0.66 -0.90 0.73 0.39 -0.33 0.00 0.00 177.00 177.55 3hv9 n GLU 560 N -0.69 -1.40 0.00 5.54 1.02 0.69 -4.87 120.64 120.93 3hv9 n GLU 560 Ca 0.08 0.40 0.01 0.00 -0.02 0.00 0.00 57.16 57.64 3hv9 n GLU 560 Cb 0.46 -3.98 -0.02 0.00 -0.02 0.00 0.00 31.44 27.88 3hv9 n GLU 560 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3hv9 n SER 561 N -2.65 0.24 -4.14 1.62 3.41 -1.25 -4.97 113.62 105.86 3hv9 n SER 561 Ca -0.13 -0.62 -0.27 0.00 -0.26 0.00 0.00 58.87 57.59 3hv9 n SER 561 Cb 0.60 0.92 -0.16 0.00 -0.26 0.00 0.00 64.21 65.31 3hv9 n SER 561 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hv9 s LEU 562 N -2.00 1.91 -0.15 1.04 2.96 -1.26 -2.02 118.68 119.17 3hv9 s LEU 562 Ca 0.01 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 3hv9 s LEU 562 Cb 0.02 -1.05 0.02 0.00 0.50 0.00 0.00 46.19 45.68 3hv9 s LEU 562 CO 0.12 0.15 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.47 3hv9 s VAL 563 N 0.15 1.55 -0.07 1.68 1.01 -0.11 -1.12 120.40 123.49 3hv9 s VAL 563 Ca -0.07 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.13 3hv9 s VAL 563 Cb -0.13 -1.46 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3hv9 s VAL 563 CO 0.03 0.46 0.41 -0.36 0.00 0.00 0.00 175.10 175.64 3hv9 s PHE 564 N 1.48 3.61 -0.19 5.22 0.08 -0.48 -0.02 117.98 127.68 3hv9 s PHE 564 Ca 0.05 0.88 -0.00 0.00 0.12 0.00 0.00 56.93 57.98 3hv9 s PHE 564 Cb -0.13 -2.39 0.01 0.00 -0.57 0.00 0.00 43.02 39.94 3hv9 s PHE 564 CO -0.10 0.41 -0.16 -1.14 -0.10 0.00 0.00 175.22 174.13 3hv9 s GLN 565 N -0.21 3.11 -0.09 0.44 0.74 0.99 0.09 119.66 124.73 3hv9 s GLN 565 Ca 0.23 -0.77 0.04 0.00 0.05 0.00 0.00 55.36 54.91 3hv9 s GLN 565 Cb -0.15 -2.69 -0.00 0.00 1.10 0.00 0.00 33.01 31.27 3hv9 s GLN 565 CO 0.11 -0.19 -0.24 0.42 -0.55 0.00 0.00 175.29 174.84 3hv9 s ILE 566 N 1.29 2.12 0.40 -2.34 1.01 0.53 -1.94 121.20 122.27 3hv9 s ILE 566 Ca 0.04 -1.01 -0.25 0.00 0.00 0.00 0.00 60.65 59.43 3hv9 s ILE 566 Cb -0.14 -1.80 -0.08 0.00 0.01 0.00 0.00 42.46 40.45 3hv9 s ILE 566 CO -0.09 0.56 1.21 -0.94 0.00 0.00 0.00 174.94 175.68 3hv9 s SER 567 N 0.25 6.44 0.17 3.58 1.04 -1.26 -1.27 113.70 122.65 3hv9 s SER 567 Ca -0.16 2.44 -0.19 0.00 0.48 0.00 0.00 55.95 58.52 3hv9 s SER 567 Cb -0.17 -2.62 0.11 0.00 0.10 0.00 0.00 66.02 63.43 3hv9 s SER 567 CO 0.08 -0.74 1.63 -0.08 0.98 0.00 0.00 173.24 175.11 3hv9 h GLU 568 N 2.63 -0.12 -0.55 4.02 4.81 -1.26 -0.44 114.58 123.68 3hv9 h GLU 568 Ca -0.49 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 58.86 3hv9 h GLU 568 Cb 1.24 0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.55 3hv9 h GLU 568 CO 0.62 -0.08 -0.03 0.00 -0.73 0.00 0.00 179.01 178.79 3hv9 h ALA 569 N 1.17 0.49 0.03 2.92 0.00 -1.87 0.80 119.26 122.79 3hv9 h ALA 569 Ca 0.20 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 3hv9 h ALA 569 Cb 0.44 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3hv9 h ALA 569 CO -0.50 -0.40 -0.01 -0.44 0.00 0.00 0.00 179.25 177.90 3hv9 h ASP 570 N 0.08 -0.03 -0.05 0.00 3.45 -1.59 -0.60 116.42 117.68 3hv9 h ASP 570 Ca 0.28 -0.29 0.02 0.00 0.43 0.00 0.00 57.03 57.46 3hv9 h ASP 570 Cb 0.44 0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 39.21 3hv9 h ASP 570 CO -0.49 0.28 0.04 0.00 -1.57 0.00 0.00 179.24 177.50 3hv9 h ALA 571 N 0.62 1.98 -0.00 3.45 0.00 -0.82 -1.62 119.26 122.88 3hv9 h ALA 571 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hv9 h ALA 571 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3hv9 h ALA 571 CO 0.01 -0.07 -0.03 1.15 0.00 0.00 0.00 179.25 180.31 3hv9 h THR 572 N 0.00 1.57 0.00 0.00 2.02 -0.54 -2.56 112.91 113.40 3hv9 h THR 572 Ca 0.03 -1.71 -0.02 0.00 0.77 0.00 0.00 66.41 65.48 3hv9 h THR 572 Cb 0.11 2.72 -0.00 0.00 -1.74 0.00 0.00 68.15 69.23 3hv9 h THR 572 CO -0.00 0.45 -0.08 0.28 0.37 0.00 0.00 175.52 176.53 3hv9 h SER 573 N -0.69 0.00 -1.80 4.18 0.02 -0.70 -3.21 113.55 111.35 3hv9 h SER 573 Ca -0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 3hv9 h SER 573 Cb 0.75 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.88 3hv9 h SER 573 CO 0.01 0.08 -0.95 -1.22 -1.14 0.00 0.00 176.83 173.61 3hv9 n TYR 574 N -4.16 2.12 0.17 3.45 4.01 -0.65 -4.91 117.16 117.19 3hv9 n TYR 574 Ca -0.03 -3.54 0.05 0.00 -0.16 0.00 0.00 57.90 54.22 3hv9 n TYR 574 Cb 0.17 -0.37 0.51 0.00 -0.31 0.00 0.00 39.34 39.33 3hv9 n TYR 574 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3hv9 h LEU 575 N 2.92 0.14 0.46 7.72 6.46 -1.46 -0.88 115.31 130.67 3hv9 h LEU 575 Ca 0.11 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.83 3hv9 h LEU 575 Cb 0.86 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.76 3hv9 h LEU 575 CO 0.66 0.20 -0.22 0.11 -0.62 0.00 0.00 178.44 178.56 3hv9 h LYS 576 N 0.15 -0.60 -0.84 1.25 1.57 -1.91 -0.30 116.57 115.90 3hv9 h LYS 576 Ca 0.04 0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.95 3hv9 h LYS 576 Cb 0.15 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.52 3hv9 h LYS 576 CO 0.00 -0.29 0.49 1.96 -0.57 0.00 0.00 179.45 181.04 3hv9 h GLN 577 N -0.90 0.80 -0.61 3.15 7.50 -1.80 -2.15 115.11 121.11 3hv9 h GLN 577 Ca -0.06 -0.05 -0.02 0.00 0.50 0.00 0.00 58.65 59.02 3hv9 h GLN 577 Cb 0.58 -0.18 -0.03 0.00 0.05 0.00 0.00 27.48 27.90 3hv9 h GLN 577 CO 0.10 0.53 0.32 0.00 -1.50 0.00 0.00 178.83 178.28 3hv9 h ALA 578 N 1.46 0.78 -0.10 3.87 0.00 -1.02 0.20 119.26 124.45 3hv9 h ALA 578 Ca 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 3hv9 h ALA 578 Cb 0.36 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3hv9 h ALA 578 CO -0.24 0.32 0.06 -0.22 0.00 0.00 0.00 179.25 179.16 3hv9 h LYS 579 N 0.83 0.14 0.05 0.00 3.64 -0.60 -1.06 116.57 119.56 3hv9 h LYS 579 Ca 0.21 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3hv9 h LYS 579 Cb 0.08 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3hv9 h LYS 579 CO -0.03 0.15 -0.04 1.96 -2.27 0.00 0.00 179.45 179.22 3hv9 h GLN 580 N 0.08 -0.10 -0.21 1.90 4.20 -1.14 -1.24 115.11 118.61 3hv9 h GLN 580 Ca 0.04 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3hv9 h GLN 580 Cb 0.05 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 3hv9 h GLN 580 CO -0.01 -0.06 0.00 1.25 -0.67 0.00 0.00 178.83 179.34 3hv9 h LEU 581 N -0.10 -0.07 -1.34 1.46 7.12 -0.52 -0.29 115.31 121.57 3hv9 h LEU 581 Ca 0.00 0.04 -0.06 0.00 0.13 0.00 0.00 57.88 57.99 3hv9 h LEU 581 Cb 0.09 0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.29 3hv9 h LEU 581 CO -0.01 -0.01 -0.30 0.71 -0.13 0.00 0.00 178.44 178.71 3hv9 h THR 582 N 0.07 0.94 -0.22 1.05 1.35 -1.03 -0.09 112.91 114.98 3hv9 h THR 582 Ca 0.10 -1.13 -0.04 0.00 -0.55 0.00 0.00 66.41 64.79 3hv9 h THR 582 Cb 0.12 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 3hv9 h THR 582 CO -0.16 0.29 -0.01 1.56 -0.25 0.00 0.00 175.52 176.95 3hv9 h GLN 583 N 0.00 0.40 -0.50 4.72 4.20 -0.41 -2.29 115.11 121.22 3hv9 h GLN 583 Ca -0.00 -0.13 0.02 0.00 0.06 0.00 0.00 58.65 58.59 3hv9 h GLN 583 Cb 0.64 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 3hv9 h GLN 583 CO 0.04 0.60 0.31 0.78 -0.67 0.00 0.00 178.83 179.88 3hv9 h GLY 584 N 0.15 0.71 1.02 3.46 0.00 -0.23 -2.25 103.07 105.94 3hv9 h GLY 584 Ca 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 3hv9 h GLY 584 CO 0.01 0.21 0.45 1.41 0.00 0.00 0.00 176.54 178.62 3hv9 h LEU 585 N 0.62 1.06 0.05 3.11 3.38 -1.02 -1.45 115.31 121.06 3hv9 h LEU 585 Ca 0.20 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hv9 h LEU 585 Cb -0.00 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 3hv9 h LEU 585 CO -0.08 0.87 -0.37 0.00 0.09 0.00 0.00 178.44 178.95 3hv9 h ALA 586 N 1.24 -0.60 -0.17 1.53 0.00 -1.18 0.29 119.26 120.38 3hv9 h ALA 586 Ca 0.30 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.21 3hv9 h ALA 586 Cb 0.05 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3hv9 h ALA 586 CO -0.05 -0.91 0.19 1.79 0.00 0.00 0.00 179.25 180.27 3hv9 h THR 587 N -0.56 0.47 -0.39 0.00 1.35 -0.74 0.18 112.91 113.23 3hv9 h THR 587 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.90 3hv9 h THR 587 Cb 0.62 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 3hv9 h THR 587 CO -0.26 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.19 3hv9 n LEU 588 N -3.80 2.65 -2.71 3.87 4.77 -0.26 -4.89 117.00 116.63 3hv9 n LEU 588 Ca 0.01 -1.33 -0.22 0.00 -0.03 0.00 0.00 56.01 54.44 3hv9 n LEU 588 Cb 0.30 -0.38 0.01 0.00 -2.33 0.00 0.00 43.42 41.03 3hv9 n LEU 588 CO 0.27 0.52 -0.14 1.41 -1.33 0.00 0.00 177.39 178.13 3hv9 n HIS 589 N 0.60 -1.49 -4.16 -1.77 8.25 0.64 -4.86 115.22 112.43 3hv9 n HIS 589 Ca 0.14 0.26 -0.31 0.00 -0.26 0.00 0.00 57.72 57.56 3hv9 n HIS 589 Cb 0.48 -4.26 -0.08 0.00 1.12 0.00 0.00 29.99 27.25 3hv9 n HIS 589 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hv9 s GLN 591 N -2.18 2.46 0.12 0.00 -0.21 -0.28 -3.64 119.66 115.93 3hv9 s GLN 591 Ca 0.25 -1.44 -0.09 0.00 0.02 0.00 0.00 55.36 54.10 3hv9 s GLN 591 Cb -0.12 -2.66 -0.00 0.00 1.00 0.00 0.00 33.01 31.23 3hv9 s GLN 591 CO 0.17 -0.69 0.23 0.00 -2.12 0.00 0.00 175.29 172.88 3hv9 s ALA 592 N -2.59 -0.12 0.01 6.09 0.00 -1.26 -1.38 121.76 122.51 3hv9 s ALA 592 Ca 0.60 -0.74 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 3hv9 s ALA 592 Cb -0.07 0.66 0.01 0.00 0.00 0.00 0.00 23.12 23.72 3hv9 s ALA 592 CO 0.37 -0.57 0.24 0.00 0.00 0.00 0.00 175.76 175.80 3hv9 s ALA 593 N -3.91 -0.56 -0.17 0.00 0.00 0.11 -2.32 121.76 114.91 3hv9 s ALA 593 Ca 0.11 0.03 -0.04 0.00 0.00 0.00 0.00 51.96 52.05 3hv9 s ALA 593 Cb 0.04 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.30 3hv9 s ALA 593 CO -0.06 -0.29 -0.02 0.42 0.00 0.00 0.00 175.76 175.81 3hv9 s ILE 594 N -1.80 4.03 0.35 0.00 -1.09 -0.91 -0.35 121.20 121.44 3hv9 s ILE 594 Ca -0.11 -0.30 0.08 0.00 -2.23 0.00 0.00 60.65 58.09 3hv9 s ILE 594 Cb -0.04 -2.79 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 3hv9 s ILE 594 CO 0.01 0.48 0.29 -0.94 -1.23 0.00 0.00 174.94 173.54 3hv9 s SER 595 N 0.47 5.14 -1.47 3.58 1.04 -0.40 0.12 113.70 122.18 3hv9 s SER 595 Ca -0.02 -0.60 -0.11 0.00 0.48 0.00 0.00 55.95 55.70 3hv9 s SER 595 Cb -0.14 -0.85 0.07 0.00 0.10 0.00 0.00 66.02 65.20 3hv9 s SER 595 CO 0.02 -0.41 0.82 0.00 0.98 0.00 0.00 173.24 174.65 3hv9 n GLN 596 N -1.38 -5.03 -2.29 4.02 6.02 -0.38 -0.90 117.38 117.44 3hv9 n GLN 596 Ca -0.01 0.63 -0.40 0.00 -0.01 0.00 0.00 57.00 57.21 3hv9 n GLN 596 Cb 0.60 -5.48 -0.03 0.00 1.02 0.00 0.00 30.24 26.35 3hv9 n GLN 596 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 3hv9 s PHE 597 N -3.19 3.27 0.00 1.08 5.36 -0.77 -4.21 117.98 119.52 3hv9 s PHE 597 Ca 0.54 1.55 0.00 0.00 -0.96 0.00 0.00 56.93 58.07 3hv9 s PHE 597 Cb -0.27 -3.48 0.00 0.00 -0.34 0.00 0.00 43.02 38.93 3hv9 s PHE 597 CO 0.67 -1.24 0.00 0.41 -1.46 0.00 0.00 175.22 173.60 3hv9 n GLY 598 N 0.94 1.11 0.01 13.12 0.00 -1.26 -1.72 105.19 117.38 3hv9 n GLY 598 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3hv9 n GLY 598 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hv9 s SER 600 N -3.79 1.94 0.05 0.00 1.04 -1.26 -4.99 113.70 106.69 3hv9 s SER 600 Ca -0.02 0.51 -0.30 0.00 0.48 0.00 0.00 55.95 56.62 3hv9 s SER 600 Cb 0.14 -0.69 -0.18 0.00 0.10 0.00 0.00 66.02 65.39 3hv9 s SER 600 CO 0.83 -3.48 1.51 -0.07 0.98 0.00 0.00 173.24 173.02 3hv9 h LEU 601 N -2.15 -0.62 -6.37 2.42 3.38 -2.04 -3.36 115.31 106.58 3hv9 h LEU 601 Ca -0.45 -0.02 -0.59 0.00 0.09 0.00 0.00 57.88 56.91 3hv9 h LEU 601 Cb 1.27 0.16 -0.41 0.00 0.09 0.00 0.00 40.66 41.78 3hv9 h LEU 601 CO 0.37 -0.37 -0.79 0.59 0.09 0.00 0.00 178.44 178.33 3hv9 n ASN 602 N -5.37 1.93 -0.32 -0.43 3.02 -1.26 -4.98 115.26 107.86 3hv9 n ASN 602 Ca -0.12 -3.01 0.13 0.00 -0.03 0.00 0.00 54.58 51.55 3hv9 n ASN 602 Cb 0.32 -0.66 0.28 0.00 -0.61 0.00 0.00 39.78 39.10 3hv9 n ASN 602 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3hv9 h PRO 603 N 4.64 0.06 0.00 3.52 0.11 -1.92 0.13 132.00 138.54 3hv9 h PRO 603 Ca 0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 3hv9 h PRO 603 Cb 0.78 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3hv9 h PRO 603 CO 0.63 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 179.65 3hv9 n PHE 604 N -5.41 0.36 0.11 0.65 3.72 -1.26 -3.23 117.46 112.39 3hv9 n PHE 604 Ca 0.22 0.14 -0.12 0.00 -0.05 0.00 0.00 57.45 57.63 3hv9 n PHE 604 Cb 0.72 -0.72 -0.08 0.00 -0.94 0.00 0.00 39.48 38.46 3hv9 n PHE 604 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 3hv9 h ASN 605 N 0.00 -0.27 -0.36 4.37 -0.26 -1.40 -3.07 115.58 114.59 3hv9 h ASN 605 Ca 0.00 -0.25 0.10 0.00 -0.56 0.00 0.00 56.30 55.59 3hv9 h ASN 605 Cb 0.33 0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.65 3hv9 h ASN 605 CO 0.00 0.16 0.41 0.00 -1.06 0.00 0.00 177.43 176.95 3hv9 h ALA 606 N -0.19 2.04 0.00 -0.83 0.00 -1.70 0.22 119.26 118.81 3hv9 h ALA 606 Ca -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3hv9 h ALA 606 Cb 0.50 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hv9 h ALA 606 CO 0.05 -0.60 -0.08 -0.07 0.00 0.00 0.00 179.25 178.56 3hv9 h LEU 607 N 0.00 0.00 -0.93 0.00 4.07 -1.67 -2.98 115.31 113.80 3hv9 h LEU 607 Ca 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.11 3hv9 h LEU 607 Cb 1.00 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.70 3hv9 h LEU 607 CO -0.00 0.08 0.44 0.11 -1.08 0.00 0.00 178.44 177.98 3hv9 h LYS 608 N 0.00 1.20 0.00 1.13 1.57 -0.64 -3.16 116.57 116.66 3hv9 h LYS 608 Ca -0.00 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 3hv9 h LYS 608 Cb 0.40 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3hv9 h LYS 608 CO 0.01 0.90 -1.16 0.45 -0.57 0.00 0.00 179.45 179.08 3hv9 h HIS 609 N 1.20 0.00 -3.46 -1.35 3.86 -1.69 -3.48 115.15 110.24 3hv9 h HIS 609 Ca 0.30 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 59.00 3hv9 h HIS 609 Cb 0.07 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.54 3hv9 h HIS 609 CO 0.01 0.27 0.01 -0.51 0.86 0.00 0.00 177.93 178.57 3hv9 s LEU 610 N -5.58 3.89 -0.65 2.43 1.43 -1.20 -4.69 118.68 114.30 3hv9 s LEU 610 Ca -0.01 0.92 -0.04 0.00 -1.03 0.00 0.00 54.13 53.96 3hv9 s LEU 610 Cb 0.09 -3.79 0.17 0.00 0.03 0.00 0.00 46.19 42.69 3hv9 s LEU 610 CO 0.80 -0.35 0.49 -0.89 0.23 0.00 0.00 176.35 176.63 3hv9 s THR 611 N -2.32 3.96 -0.04 5.49 2.01 -1.26 -4.97 115.64 118.51 3hv9 s THR 611 Ca 0.47 -2.91 0.02 0.00 0.31 0.00 0.00 61.69 59.58 3hv9 s THR 611 Cb -0.10 -3.56 0.01 0.00 0.01 0.00 0.00 72.50 68.86 3hv9 s THR 611 CO 0.33 -0.90 -0.07 0.68 -0.69 0.00 0.00 174.62 173.97 3hv9 s VAL 612 N -0.05 0.66 -0.04 3.82 -7.23 -1.26 -4.52 120.40 111.78 3hv9 s VAL 612 Ca 0.17 -0.24 0.13 0.00 -1.81 0.00 0.00 61.98 60.23 3hv9 s VAL 612 Cb -0.19 -0.64 -0.19 0.00 0.56 0.00 0.00 36.38 35.92 3hv9 s VAL 612 CO -0.04 0.24 0.84 1.56 -0.31 0.00 0.00 175.10 177.39 3hv9 h GLN 613 N 6.86 0.00 -6.22 4.82 7.50 -1.85 -3.48 115.11 122.75 3hv9 h GLN 613 Ca -0.36 0.00 -0.69 0.00 0.50 0.00 0.00 58.65 58.11 3hv9 h GLN 613 Cb 1.16 0.00 -0.25 0.00 0.05 0.00 0.00 27.48 28.45 3hv9 h GLN 613 CO 0.48 0.53 -0.79 -0.06 -1.50 0.00 0.00 178.83 177.50 3hv9 s PHE 614 N -2.71 2.67 -0.16 2.96 0.08 -1.07 -1.12 117.98 118.63 3hv9 s PHE 614 Ca -0.03 -0.27 0.00 0.00 0.12 0.00 0.00 56.93 56.76 3hv9 s PHE 614 Cb 0.08 -1.64 0.03 0.00 -0.57 0.00 0.00 43.02 40.92 3hv9 s PHE 614 CO 0.82 0.10 -0.14 0.42 -0.10 0.00 0.00 175.22 176.31 3hv9 s ILE 615 N -0.56 1.62 -0.39 0.64 -1.09 -0.02 -2.15 121.20 119.25 3hv9 s ILE 615 Ca 0.08 -0.71 -0.13 0.00 -2.23 0.00 0.00 60.65 57.66 3hv9 s ILE 615 Cb -0.11 -1.54 0.03 0.00 -1.58 0.00 0.00 42.46 39.25 3hv9 s ILE 615 CO 0.01 0.42 0.25 -0.75 -1.23 0.00 0.00 174.94 173.65 3hv9 s LYS 616 N 1.46 2.87 0.43 2.79 2.20 0.12 -0.54 119.74 129.07 3hv9 s LYS 616 Ca 0.04 -1.09 -0.21 0.00 -0.36 0.00 0.00 55.97 54.35 3hv9 s LYS 616 Cb -0.13 -3.85 -0.10 0.00 -1.51 0.00 0.00 37.83 32.23 3hv9 s LYS 616 CO -0.11 -0.75 0.97 0.96 -0.36 0.00 0.00 175.35 176.06 3hv9 s ILE 617 N 1.60 4.27 0.41 5.43 -0.00 -0.22 -1.25 121.20 131.43 3hv9 s ILE 617 Ca 0.03 1.44 -0.27 0.00 -0.00 0.00 0.00 60.65 61.85 3hv9 s ILE 617 Cb -0.19 -3.59 -0.10 0.00 -0.00 0.00 0.00 42.46 38.57 3hv9 s ILE 617 CO 0.08 -0.28 1.46 -0.62 -0.00 0.00 0.00 174.94 175.57 3hv9 s ASP 618 N -2.11 6.15 0.35 4.36 2.15 -0.70 -4.44 116.67 122.43 3hv9 s ASP 618 Ca 0.62 2.99 0.25 0.00 0.43 0.00 0.00 52.55 56.84 3hv9 s ASP 618 Cb -0.11 -2.66 1.27 0.00 -0.30 0.00 0.00 42.92 41.12 3hv9 s ASP 618 CO 0.15 -1.00 1.75 1.23 -0.17 0.00 0.00 175.17 177.13 3hv9 h GLY 619 N 2.72 0.00 2.00 2.66 0.00 -1.92 -2.07 103.07 106.46 3hv9 h GLY 619 Ca -0.51 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 3hv9 h GLY 619 CO 0.63 0.00 -0.06 1.48 0.00 0.00 0.00 176.54 178.59 3hv9 h SER 620 N 0.00 0.00 0.85 0.19 4.64 -1.97 -1.06 113.55 116.20 3hv9 h SER 620 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hv9 h SER 620 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3hv9 h SER 620 CO 0.00 0.06 0.00 0.49 -0.87 0.00 0.00 176.83 176.51 3hv9 n PHE 621 N -3.38 0.17 -0.23 4.77 3.72 -0.78 -2.60 117.46 119.14 3hv9 n PHE 621 Ca -0.02 0.06 0.10 0.00 -0.05 0.00 0.00 57.45 57.54 3hv9 n PHE 621 Cb 0.21 -0.59 0.26 0.00 -0.94 0.00 0.00 39.48 38.42 3hv9 n PHE 621 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3hv9 n VAL 622 N -1.65 0.92 -3.62 -4.37 0.31 -0.41 -4.83 118.33 104.68 3hv9 n VAL 622 Ca 0.05 -0.96 -0.35 0.00 -0.01 0.00 0.00 64.34 63.07 3hv9 n VAL 622 Cb 0.28 0.57 -0.05 0.00 -0.91 0.00 0.00 33.84 33.73 3hv9 n VAL 622 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3hv9 s GLN 623 N -1.05 3.72 -1.35 5.55 -0.21 -1.07 -4.48 119.66 120.76 3hv9 s GLN 623 Ca 0.41 0.12 -0.07 0.00 0.02 0.00 0.00 55.36 55.84 3hv9 s GLN 623 Cb 0.21 -3.03 0.02 0.00 1.00 0.00 0.00 33.01 31.22 3hv9 s GLN 623 CO 0.28 0.59 1.05 -0.25 -2.12 0.00 0.00 175.29 174.84 3hv9 n ASP 624 N 1.00 -4.54 0.24 5.90 10.43 -1.26 -4.88 116.55 123.43 3hv9 n ASP 624 Ca -0.09 -0.64 0.10 0.00 2.57 0.00 0.00 54.79 56.73 3hv9 n ASP 624 Cb 0.52 -4.72 0.59 0.00 1.84 0.00 0.00 41.12 39.35 3hv9 n ASP 624 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 3hv9 h LEU 625 N -2.32 0.00 -1.33 0.64 3.38 -1.91 -2.49 115.31 111.29 3hv9 h LEU 625 Ca -0.58 0.00 0.30 0.00 0.09 0.00 0.00 57.88 57.69 3hv9 h LEU 625 Cb 1.36 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.01 3hv9 h LEU 625 CO 0.57 0.19 0.69 -0.55 0.09 0.00 0.00 178.44 179.43 3hv9 h ASN 626 N 0.00 0.43 -2.84 -0.43 -1.07 -1.97 -3.40 115.58 106.30 3hv9 h ASN 626 Ca -0.00 0.10 -0.53 0.00 0.07 0.00 0.00 56.30 55.94 3hv9 h ASN 626 Cb 0.51 0.04 0.02 0.00 -2.07 0.00 0.00 38.32 36.83 3hv9 h ASN 626 CO 0.03 0.03 0.87 -1.10 0.07 0.00 0.00 177.43 177.32 3hv9 s GLN 627 N -5.48 4.25 0.33 4.14 -1.52 -0.94 -4.92 119.66 115.52 3hv9 s GLN 627 Ca -0.09 2.22 0.05 0.00 -1.95 0.00 0.00 55.36 55.59 3hv9 s GLN 627 Cb 0.26 -3.39 0.59 0.00 -0.22 0.00 0.00 33.01 30.26 3hv9 s GLN 627 CO 0.80 -0.60 1.85 -0.39 -0.25 0.00 0.00 175.29 176.70 3hv9 h VAL 628 N 4.48 1.21 -0.69 1.09 -1.51 -1.89 -2.63 116.25 116.31 3hv9 h VAL 628 Ca -0.42 -0.88 -0.07 0.00 -1.23 0.00 0.00 66.70 64.10 3hv9 h VAL 628 Cb 1.20 1.07 -0.03 0.00 -2.13 0.00 0.00 31.29 31.40 3hv9 h VAL 628 CO 0.91 0.29 0.15 -0.08 -1.23 0.00 0.00 177.57 177.61 3hv9 h GLU 629 N 0.44 1.12 -0.48 5.19 4.81 -1.92 -1.27 114.58 122.48 3hv9 h GLU 629 Ca 0.09 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 3hv9 h GLU 629 Cb 0.41 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3hv9 h GLU 629 CO 0.02 1.00 0.12 -0.91 -0.73 0.00 0.00 179.01 178.51 3hv9 h ASN 630 N 1.05 0.67 -0.44 1.04 -0.26 -1.78 -0.61 115.58 115.26 3hv9 h ASN 630 Ca 0.21 -0.11 0.03 0.00 -0.56 0.00 0.00 56.30 55.88 3hv9 h ASN 630 Cb 0.40 -0.17 -0.04 0.00 -1.06 0.00 0.00 38.32 37.45 3hv9 h ASN 630 CO 0.01 0.66 0.22 -0.61 -1.06 0.00 0.00 177.43 176.65 3hv9 h GLN 631 N 0.70 0.43 -0.14 0.81 4.15 -1.02 -0.88 115.11 119.16 3hv9 h GLN 631 Ca 0.16 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 3hv9 h GLN 631 Cb 0.26 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 3hv9 h GLN 631 CO -0.00 0.28 -0.05 0.93 -1.93 0.00 0.00 178.83 178.07 3hv9 h GLU 632 N 0.44 0.28 -0.42 1.69 4.39 -0.61 -1.34 114.58 119.01 3hv9 h GLU 632 Ca 0.19 -0.11 0.08 0.00 0.34 0.00 0.00 59.36 59.85 3hv9 h GLU 632 Cb 0.09 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.66 3hv9 h GLU 632 CO -0.13 0.58 0.02 0.82 -1.16 0.00 0.00 179.01 179.14 3hv9 h ILE 633 N -0.04 0.70 0.26 3.13 2.04 -1.01 0.20 117.51 122.79 3hv9 h ILE 633 Ca 0.03 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3hv9 h ILE 633 Cb 0.49 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.13 3hv9 h ILE 633 CO 0.02 0.02 -0.13 0.25 0.00 0.00 0.00 178.15 178.31 3hv9 h LEU 634 N 0.13 -0.30 -0.83 1.44 6.46 -1.10 -0.69 115.31 120.43 3hv9 h LEU 634 Ca 0.21 -0.03 0.08 0.00 -0.12 0.00 0.00 57.88 58.03 3hv9 h LEU 634 Cb 0.29 0.08 -0.07 0.00 -0.73 0.00 0.00 40.66 40.23 3hv9 h LEU 634 CO -0.33 -0.17 0.49 0.11 -0.62 0.00 0.00 178.44 177.91 3hv9 h LYS 635 N -0.40 0.82 -0.47 1.25 1.57 -0.80 0.03 116.57 118.58 3hv9 h LYS 635 Ca -0.04 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 3hv9 h LYS 635 Cb 0.31 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3hv9 h LYS 635 CO 0.06 0.54 -0.04 0.78 -0.57 0.00 0.00 179.45 180.22 3hv9 h GLY 636 N 0.84 0.92 0.99 3.86 0.00 -0.44 -0.19 103.07 109.05 3hv9 h GLY 636 Ca 0.39 -0.71 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 3hv9 h GLY 636 CO -0.22 0.65 -0.39 -2.00 0.00 0.00 0.00 176.54 174.58 3hv9 h LEU 637 N 0.70 -0.93 -1.24 3.11 6.46 -0.36 0.52 115.31 123.57 3hv9 h LEU 637 Ca 0.13 0.04 0.18 0.00 -0.12 0.00 0.00 57.88 58.11 3hv9 h LEU 637 Cb 0.57 0.25 -0.08 0.00 -0.73 0.00 0.00 40.66 40.66 3hv9 h LEU 637 CO 0.03 -0.65 0.61 0.40 -0.62 0.00 0.00 178.44 178.21 3hv9 h ILE 638 N -1.07 0.73 -0.21 4.05 2.04 -0.97 -0.80 117.51 121.28 3hv9 h ILE 638 Ca -0.11 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 3hv9 h ILE 638 Cb 0.82 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3hv9 h ILE 638 CO 0.17 0.12 -0.06 0.00 0.00 0.00 0.00 178.15 178.37 3hv9 h ALA 639 N 1.61 0.29 -0.67 1.87 0.00 -0.54 -1.52 119.26 120.31 3hv9 h ALA 639 Ca 0.51 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.17 3hv9 h ALA 639 Cb 0.95 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 3hv9 h ALA 639 CO -0.27 0.09 0.45 0.93 0.00 0.00 0.00 179.25 180.44 3hv9 h GLU 640 N 0.14 0.88 -0.37 0.00 5.08 0.02 -0.93 114.58 119.40 3hv9 h GLU 640 Ca 0.05 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 3hv9 h GLU 640 Cb 0.51 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3hv9 h GLU 640 CO 0.02 0.58 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.28 3hv9 h LEU 641 N 0.91 0.88 -1.32 1.33 3.38 -0.89 -1.45 115.31 118.15 3hv9 h LEU 641 Ca 0.25 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3hv9 h LEU 641 Cb -0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 3hv9 h LEU 641 CO -0.05 1.13 -0.23 0.45 0.09 0.00 0.00 178.44 179.83 3hv9 h HIS 642 N 0.64 0.00 -0.37 1.13 3.86 -0.97 0.22 115.15 119.65 3hv9 h HIS 642 Ca 0.07 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.22 3hv9 h HIS 642 Cb 0.84 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.30 3hv9 h HIS 642 CO 0.06 0.23 -0.01 1.49 0.86 0.00 0.00 177.93 180.56 3hv9 h GLU 643 N 0.00 0.66 -0.90 2.45 4.57 -0.71 -2.49 114.58 118.16 3hv9 h GLU 643 Ca -0.00 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 57.95 3hv9 h GLU 643 Cb 0.65 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.18 3hv9 h GLU 643 CO 0.03 0.77 0.01 1.04 -1.18 0.00 0.00 179.01 179.68 3hv9 n GLN 644 N -4.47 1.97 -3.85 1.92 1.13 -0.59 -4.85 117.38 108.64 3hv9 n GLN 644 Ca -0.01 -0.81 -0.28 0.00 -1.94 0.00 0.00 57.00 53.96 3hv9 n GLN 644 Cb 0.29 -1.67 0.03 0.00 0.11 0.00 0.00 30.24 28.99 3hv9 n GLN 644 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3hv9 n GLN 645 N 0.16 -5.48 -4.07 -1.09 6.02 -0.94 -4.97 117.38 107.01 3hv9 n GLN 645 Ca 0.08 0.61 -0.32 0.00 -0.01 0.00 0.00 57.00 57.36 3hv9 n GLN 645 Cb 0.52 -5.43 -0.07 0.00 1.02 0.00 0.00 30.24 26.28 3hv9 n GLN 645 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3hv9 s LYS 646 N -6.46 3.01 -0.19 -1.09 -0.14 0.69 -4.99 119.74 110.58 3hv9 s LYS 646 Ca 0.50 -0.57 -0.21 0.00 -1.36 0.00 0.00 55.97 54.33 3hv9 s LYS 646 Cb -0.25 -2.82 -0.03 0.00 -1.68 0.00 0.00 37.83 33.06 3hv9 s LYS 646 CO 0.82 0.61 0.62 -0.51 -0.76 0.00 0.00 175.35 176.14 3hv9 s LEU 647 N -2.06 4.15 -0.05 3.17 1.43 -0.28 -4.14 118.68 120.90 3hv9 s LEU 647 Ca 0.26 0.83 -0.21 0.00 -1.03 0.00 0.00 54.13 53.99 3hv9 s LEU 647 Cb -0.12 -2.88 -0.05 0.00 0.03 0.00 0.00 46.19 43.17 3hv9 s LEU 647 CO 0.18 -0.26 0.59 -0.94 0.23 0.00 0.00 176.35 176.15 3hv9 s SER 648 N 1.18 6.90 -0.19 2.29 1.04 -1.26 -0.84 113.70 122.83 3hv9 s SER 648 Ca 0.29 1.08 0.00 0.00 0.48 0.00 0.00 55.95 57.80 3hv9 s SER 648 Cb -0.16 -2.36 0.02 0.00 0.10 0.00 0.00 66.02 63.62 3hv9 s SER 648 CO 0.10 0.02 -0.16 -0.63 0.98 0.00 0.00 173.24 173.55 3hv9 s ILE 649 N 0.28 2.32 -0.25 -1.02 1.01 0.30 -0.50 121.20 123.33 3hv9 s ILE 649 Ca 0.31 -0.90 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 3hv9 s ILE 649 Cb -0.17 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.29 3hv9 s ILE 649 CO 0.16 0.48 -0.01 -0.69 0.00 0.00 0.00 174.94 174.87 3hv9 s VAL 650 N 1.31 3.33 0.70 2.92 1.01 0.06 -1.06 120.40 128.68 3hv9 s VAL 650 Ca 0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 3hv9 s VAL 650 Cb -0.14 -2.65 0.15 0.00 0.00 0.00 0.00 36.38 33.74 3hv9 s VAL 650 CO -0.11 0.22 0.95 -0.81 0.00 0.00 0.00 175.10 175.36 3hv9 n PRO 651 N 4.76 -0.33 -3.27 2.72 -0.04 -1.26 -1.64 135.00 135.94 3hv9 n PRO 651 Ca -0.16 -2.22 -0.22 0.00 -0.04 0.00 0.00 63.50 60.85 3hv9 n PRO 651 Cb 0.48 -0.75 0.06 0.00 -0.04 0.00 0.00 33.50 33.25 3hv9 n PRO 651 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hv9 n PHE 652 N -2.93 -2.32 -2.46 0.54 3.72 -0.84 -4.80 117.46 108.37 3hv9 n PHE 652 Ca 0.14 0.74 -0.42 0.00 -0.05 0.00 0.00 57.45 57.86 3hv9 n PHE 652 Cb 0.51 -4.58 -0.02 0.00 -0.94 0.00 0.00 39.48 34.45 3hv9 n PHE 652 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3hv9 s VAL 653 N -3.23 3.92 -0.77 -4.37 1.01 -0.70 -4.83 120.40 111.44 3hv9 s VAL 653 Ca 0.43 0.84 0.07 0.00 0.00 0.00 0.00 61.98 63.32 3hv9 s VAL 653 Cb -0.19 -4.50 0.04 0.00 0.00 0.00 0.00 36.38 31.73 3hv9 s VAL 653 CO 0.53 -1.13 0.66 -0.62 0.00 0.00 0.00 175.10 174.54 3hv9 n GLU 654 N 8.41 0.49 -3.63 2.72 -0.58 -1.26 -2.63 120.64 124.15 3hv9 n GLU 654 Ca 0.12 -0.80 -0.10 0.00 -0.42 0.00 0.00 57.16 55.96 3hv9 n GLU 654 Cb 0.49 -1.09 -0.04 0.00 -0.57 0.00 0.00 31.44 30.23 3hv9 n GLU 654 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hv9 s SER 655 N -0.66 -0.28 0.22 1.62 1.04 -1.26 -4.71 113.70 109.67 3hv9 s SER 655 Ca 0.07 -0.31 -0.08 0.00 0.48 0.00 0.00 55.95 56.11 3hv9 s SER 655 Cb 0.05 0.50 0.19 0.00 0.10 0.00 0.00 66.02 66.87 3hv9 s SER 655 CO 0.10 -0.90 1.88 0.00 0.98 0.00 0.00 173.24 175.30 3hv9 h ALA 656 N 2.30 1.08 -0.55 5.32 0.00 -1.99 -1.50 119.26 123.92 3hv9 h ALA 656 Ca -0.33 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.60 3hv9 h ALA 656 Cb 1.26 -0.34 -0.09 0.00 0.00 0.00 0.00 17.79 18.62 3hv9 h ALA 656 CO 0.44 0.53 0.02 1.03 0.00 0.00 0.00 179.25 181.28 3hv9 h SER 657 N 1.17 -0.20 0.65 0.00 0.87 -2.00 -1.15 113.55 112.89 3hv9 h SER 657 Ca 0.31 0.13 -0.21 0.00 -1.23 0.00 0.00 61.79 60.79 3hv9 h SER 657 Cb -0.07 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 3hv9 h SER 657 CO -0.06 -0.07 -0.94 0.58 -0.53 0.00 0.00 176.83 175.81 3hv9 h VAL 658 N 0.14 1.53 -0.32 2.23 2.07 -1.84 -2.09 116.25 117.96 3hv9 h VAL 658 Ca 0.28 -2.79 0.01 0.00 0.82 0.00 0.00 66.70 65.02 3hv9 h VAL 658 Cb 0.43 2.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 3hv9 h VAL 658 CO -0.45 0.81 0.19 0.25 0.02 0.00 0.00 177.57 178.39 3hv9 h LEU 659 N 0.09 0.31 -0.18 2.57 6.46 -0.75 -0.43 115.31 123.38 3hv9 h LEU 659 Ca -0.05 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 3hv9 h LEU 659 Cb 1.60 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 41.46 3hv9 h LEU 659 CO 0.14 0.23 0.08 0.00 -0.62 0.00 0.00 178.44 178.27 3hv9 h ALA 660 N 1.13 0.24 -0.88 1.25 0.00 -1.11 -0.42 119.26 119.48 3hv9 h ALA 660 Ca 0.12 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3hv9 h ALA 660 Cb -0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 3hv9 h ALA 660 CO -0.05 -0.18 0.56 1.15 0.00 0.00 0.00 179.25 180.73 3hv9 h THR 661 N 0.15 1.11 -0.41 0.00 2.02 -1.17 0.16 112.91 114.77 3hv9 h THR 661 Ca 0.06 -0.37 -0.14 0.00 0.77 0.00 0.00 66.41 66.73 3hv9 h THR 661 Cb 0.16 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 3hv9 h THR 661 CO -0.01 0.19 -0.30 -0.07 0.37 0.00 0.00 175.52 175.71 3hv9 h LEU 662 N 1.07 0.98 0.26 2.58 3.38 -0.77 -0.96 115.31 121.84 3hv9 h LEU 662 Ca 0.36 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3hv9 h LEU 662 Cb 0.06 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 3hv9 h LEU 662 CO -0.14 1.21 -0.15 -0.25 0.09 0.00 0.00 178.44 179.20 3hv9 h TRP 663 N 0.76 -0.39 -0.62 1.13 7.01 -0.42 -2.12 115.95 121.31 3hv9 h TRP 663 Ca 0.08 -0.01 0.13 0.00 2.11 0.00 0.00 58.89 61.20 3hv9 h TRP 663 Cb 0.89 0.14 -0.11 0.00 -2.10 0.00 0.00 29.16 27.97 3hv9 h TRP 663 CO 0.06 -0.24 -0.11 1.96 -2.79 0.00 0.00 178.44 177.33 3hv9 h GLN 664 N -0.39 0.03 0.00 2.65 4.20 -0.59 -0.62 115.11 120.40 3hv9 h GLN 664 Ca -0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3hv9 h GLN 664 Cb 0.32 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.09 3hv9 h GLN 664 CO 0.03 0.02 0.00 0.00 -0.67 0.00 0.00 178.83 178.21 3hv9 n ALA 665 N -2.96 1.58 -1.55 3.87 0.00 -0.38 -4.87 120.51 116.20 3hv9 n ALA 665 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3hv9 n ALA 665 Cb 0.33 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3hv9 n ALA 665 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hv9 n GLY 666 N -0.19 0.91 3.75 0.00 0.00 -0.24 -4.79 105.19 104.64 3hv9 n GLY 666 Ca 0.03 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 3hv9 n GLY 666 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hv9 s ALA 667 N -2.31 3.47 0.06 4.61 0.00 -0.85 -4.94 121.76 121.80 3hv9 s ALA 667 Ca 0.00 1.09 0.08 0.00 0.00 0.00 0.00 51.96 53.12 3hv9 s ALA 667 Cb 0.00 -3.43 -0.22 0.00 0.00 0.00 0.00 23.12 19.47 3hv9 s ALA 667 CO 0.00 -0.45 1.07 0.00 0.00 0.00 0.00 175.76 176.37 3hv9 h THR 668 N 3.32 1.42 -4.00 0.00 1.03 -1.86 -3.44 112.91 109.39 3hv9 h THR 668 Ca -0.47 -3.16 -0.20 0.00 -0.01 0.00 0.00 66.41 62.57 3hv9 h THR 668 Cb 1.22 2.72 -0.20 0.00 -1.07 0.00 0.00 68.15 70.82 3hv9 h THR 668 CO 0.70 0.82 -0.71 -0.31 -0.01 0.00 0.00 175.52 176.01 3hv9 s TYR 669 N -2.67 0.43 0.10 0.00 2.02 0.35 -1.59 117.35 115.99 3hv9 s TYR 669 Ca -0.01 -0.60 0.02 0.00 -0.37 0.00 0.00 57.07 56.11 3hv9 s TYR 669 Cb 0.09 -0.29 -0.04 0.00 -0.40 0.00 0.00 41.96 41.32 3hv9 s TYR 669 CO 0.83 -0.18 -0.07 0.96 -1.57 0.00 0.00 175.55 175.51 3hv9 s ILE 670 N -1.82 0.75 -0.01 2.71 -4.36 -0.39 -0.76 121.20 117.32 3hv9 s ILE 670 Ca -0.10 -1.89 -0.16 0.00 -0.26 0.00 0.00 60.65 58.24 3hv9 s ILE 670 Cb -0.07 -1.63 0.03 0.00 1.25 0.00 0.00 42.46 42.03 3hv9 s ILE 670 CO -0.02 -0.82 0.33 -1.58 0.24 0.00 0.00 174.94 173.09 3hv9 s GLN 671 N -3.66 0.70 0.00 0.37 0.74 -0.65 -0.70 119.66 116.45 3hv9 s GLN 671 Ca 0.11 -0.19 0.00 0.00 0.05 0.00 0.00 55.36 55.33 3hv9 s GLN 671 Cb 0.04 0.31 0.00 0.00 1.10 0.00 0.00 33.01 34.46 3hv9 s GLN 671 CO -0.04 -0.20 0.00 0.41 -0.55 0.00 0.00 175.29 174.92 3hv9 n GLY 672 N 1.20 2.51 0.37 2.59 0.00 -1.26 -1.71 105.19 108.88 3hv9 n GLY 672 Ca -0.21 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.23 3hv9 n GLY 672 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3hv9 h TYR 673 N 0.00 0.96 -1.00 1.61 5.03 -1.66 -0.05 116.97 121.86 3hv9 h TYR 673 Ca 0.00 0.03 0.17 0.00 2.58 0.00 0.00 58.73 61.51 3hv9 h TYR 673 Cb 0.00 -0.30 -0.10 0.00 1.55 0.00 0.00 36.73 37.88 3hv9 h TYR 673 CO 0.00 0.32 0.62 -0.92 -1.32 0.00 0.00 178.16 176.86 3hv9 h TYR 674 N 0.78 1.06 0.18 -3.82 5.03 -1.79 -2.43 116.97 115.98 3hv9 h TYR 674 Ca 0.50 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.83 3hv9 h TYR 674 Cb 0.73 -0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.68 3hv9 h TYR 674 CO -0.00 0.30 -0.09 -0.07 -1.32 0.00 0.00 178.16 176.98 3hv9 h LEU 675 N 0.81 -0.20 -7.00 2.82 -0.00 -1.28 -3.49 115.31 106.97 3hv9 h LEU 675 Ca 0.55 -0.10 0.10 0.00 -0.00 0.00 0.00 57.88 58.42 3hv9 h LEU 675 Cb 0.79 0.05 -0.25 0.00 -0.00 0.00 0.00 40.66 41.26 3hv9 h LEU 675 CO -0.33 0.31 0.58 -1.58 -0.00 0.00 0.00 178.44 177.41 3hv9 s GLN 676 N -2.52 0.50 0.51 1.13 0.74 -0.34 -5.05 119.66 114.63 3hv9 s GLN 676 Ca -0.06 0.24 -0.03 0.00 0.05 0.00 0.00 55.36 55.56 3hv9 s GLN 676 Cb 0.00 0.24 0.11 0.00 1.10 0.00 0.00 33.01 34.46 3hv9 s GLN 676 CO 0.20 -0.13 0.70 0.41 -0.55 0.00 0.00 175.29 175.92 3hv9 n GLY 677 N 1.13 0.14 3.76 2.59 0.00 -1.24 -3.85 105.19 107.72 3hv9 n GLY 677 Ca -0.10 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 3hv9 n GLY 677 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hv9 s PRO 678 N -4.33 3.67 0.02 1.61 0.02 -1.26 -4.64 135.00 130.09 3hv9 s PRO 678 Ca 0.44 2.23 -0.07 0.00 0.02 0.00 0.00 61.00 63.62 3hv9 s PRO 678 Cb -0.02 -2.58 -0.00 0.00 0.02 0.00 0.00 34.50 31.91 3hv9 s PRO 678 CO 0.30 -0.76 0.13 0.45 -0.33 0.00 0.00 177.00 176.78 3hv9 s SER 679 N -0.76 0.08 0.13 2.53 0.15 -0.58 -4.87 113.70 110.37 3hv9 s SER 679 Ca 0.62 -0.34 0.23 0.00 0.70 0.00 0.00 55.95 57.16 3hv9 s SER 679 Cb -0.40 0.22 0.91 0.00 -1.71 0.00 0.00 66.02 65.05 3hv9 s SER 679 CO 0.50 -0.44 1.72 0.00 1.20 0.00 0.00 173.24 176.22 3hv9 n GLN 680 N 1.13 0.12 -4.44 5.44 6.02 -1.26 0.03 117.38 124.42 3hv9 n GLN 680 Ca -0.21 0.23 -0.34 0.00 -0.01 0.00 0.00 57.00 56.67 3hv9 n GLN 680 Cb 0.57 -1.68 -0.10 0.00 1.02 0.00 0.00 30.24 30.05 3hv9 n GLN 680 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hv9 s ALA 681 N -3.11 3.17 -1.21 -1.58 0.00 -1.26 -4.85 121.76 112.91 3hv9 s ALA 681 Ca 0.09 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.06 3hv9 s ALA 681 Cb 0.12 -1.34 0.20 0.00 0.00 0.00 0.00 23.12 22.10 3hv9 s ALA 681 CO 0.45 0.60 1.55 -1.33 0.00 0.00 0.00 175.76 177.03 3hv9 n MET 682 N 1.93 3.59 -0.17 0.00 2.81 -1.26 -4.74 117.12 119.29 3hv9 n MET 682 Ca -0.17 -3.89 0.07 0.00 -1.81 0.00 0.00 57.70 51.90 3hv9 n MET 682 Cb 0.53 -2.89 0.15 0.00 -0.71 0.00 0.00 33.22 30.30 3hv9 n MET 682 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3hv9 n ASP 683 N 4.23 2.74 -4.76 7.83 8.00 -1.26 -5.05 116.55 128.28 3hv9 n ASP 683 Ca 0.35 -2.76 -0.40 0.00 0.71 0.00 0.00 54.79 52.69 3hv9 n ASP 683 Cb 0.39 -0.36 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 3hv9 n ASP 683 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3hv9 s TYR 684 N -2.32 3.40 -1.02 1.24 6.14 -1.26 -4.95 117.35 118.58 3hv9 s TYR 684 Ca 0.28 1.61 -0.17 0.00 0.64 0.00 0.00 57.07 59.43 3hv9 s TYR 684 Cb 0.23 -3.40 0.15 0.00 0.42 0.00 0.00 41.96 39.36 3hv9 s TYR 684 CO 0.05 -0.95 1.22 0.34 0.64 0.00 0.00 175.55 176.86 3hv9 s ASP 685 N -0.80 6.78 0.27 4.32 2.15 -1.26 -5.00 116.67 123.13 3hv9 s ASP 685 Ca 0.47 -2.37 -0.29 0.00 0.43 0.00 0.00 52.55 50.78 3hv9 s ASP 685 Cb -0.34 -2.40 -0.09 0.00 -0.30 0.00 0.00 42.92 39.79 3hv9 s ASP 685 CO 0.44 -0.95 1.22 -0.36 -0.17 0.00 0.00 175.17 175.35 3hv9 s PHE 686 N 2.28 3.32 -0.24 -5.34 0.08 -1.26 -5.02 117.98 111.80 3hv9 s PHE 686 Ca 0.36 1.48 -0.03 0.00 0.12 0.00 0.00 56.93 58.85 3hv9 s PHE 686 Cb -0.04 -3.50 0.08 0.00 -0.57 0.00 0.00 43.02 38.99 3hv9 s PHE 686 CO -0.06 -1.32 0.09 0.45 -0.10 0.00 0.00 175.22 174.27 3hv9 s SER 687 N -0.38 3.23 0.00 1.36 0.15 -1.26 -4.98 113.70 111.83 3hv9 s SER 687 Ca 0.49 -1.10 0.05 0.00 0.70 0.00 0.00 55.95 56.09 3hv9 s SER 687 Cb -0.35 -0.50 0.08 0.00 -1.71 0.00 0.00 66.02 63.54 3hv9 s SER 687 CO 0.44 -0.38 0.87 -0.24 1.20 0.00 0.00 173.24 175.12 3hv9 n SER 688 N 5.12 -0.09 0.00 5.45 2.88 -1.26 -4.98 113.62 120.74 3hv9 n SER 688 Ca -0.06 -1.67 0.00 0.00 -1.33 0.00 0.00 58.87 55.80 3hv9 n SER 688 Cb 0.45 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 3hv9 n SER 688 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42