#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxj s PHE 499 N 0.00 1.74 0.77 1.61 0.40 -1.26 -5.11 117.98 116.13 1gxj s PHE 499 Ca 0.00 -0.80 -0.14 0.00 -0.60 0.00 0.00 56.93 55.39 1gxj s PHE 499 Cb 0.00 -1.95 0.06 0.00 0.51 0.00 0.00 43.02 41.64 1gxj s PHE 499 CO 0.00 -0.46 1.22 -1.54 0.70 0.00 0.00 175.22 175.14 1gxj s SER 500 N -4.28 3.81 0.24 1.36 1.04 -1.26 -4.76 113.70 109.85 1gxj s SER 500 Ca 0.37 2.41 -0.05 0.00 0.48 0.00 0.00 55.95 59.16 1gxj s SER 500 Cb -0.02 -2.59 0.38 0.00 0.10 0.00 0.00 66.02 63.88 1gxj s SER 500 CO 0.23 -2.53 1.80 -0.09 0.98 0.00 0.00 173.24 173.63 1gxj h ARG 501 N -0.60 0.69 0.44 4.02 2.43 -1.98 -0.31 114.38 119.07 1gxj h ARG 501 Ca -0.47 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.64 1gxj h ARG 501 Cb 1.30 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.69 1gxj h ARG 501 CO 0.48 0.45 -0.27 0.00 -1.51 0.00 0.00 179.97 179.12 1gxj h ALA 502 N 1.45 -0.69 -0.96 2.80 0.00 -1.89 0.42 119.26 120.39 1gxj h ALA 502 Ca 0.38 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.25 1gxj h ALA 502 Cb 0.38 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 1gxj h ALA 502 CO -0.26 -0.90 0.60 0.28 0.00 0.00 0.00 179.25 178.97 1gxj h VAL 503 N -0.69 0.98 -0.67 0.00 2.07 -1.77 -1.94 116.25 114.22 1gxj h VAL 503 Ca -0.05 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 1gxj h VAL 503 Cb 0.56 -0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 1gxj h VAL 503 CO 0.05 0.18 0.21 -0.09 0.02 0.00 0.00 177.57 177.95 1gxj h ARG 504 N 1.01 1.05 -0.15 1.57 2.43 -0.59 -2.40 114.38 117.30 1gxj h ARG 504 Ca 0.45 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1gxj h ARG 504 Cb 0.34 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1gxj h ARG 504 CO -0.23 0.91 0.09 0.00 -1.51 0.00 0.00 179.97 179.23 1gxj h ALA 505 N 1.09 0.19 -0.20 2.80 0.00 -0.20 -0.50 119.26 122.44 1gxj h ALA 505 Ca 0.22 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1gxj h ALA 505 Cb 0.30 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 1gxj h ALA 505 CO -0.01 -0.30 -0.28 0.28 0.00 0.00 0.00 179.25 178.95 1gxj h VAL 506 N 0.16 0.34 0.00 0.00 2.07 -1.21 -1.32 116.25 116.29 1gxj h VAL 506 Ca 0.05 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.49 1gxj h VAL 506 Cb 0.03 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1gxj h VAL 506 CO -0.01 0.00 -0.41 -0.26 0.02 0.00 0.00 177.57 176.91 1gxj h PHE 507 N -0.31 0.00 0.00 1.57 -1.00 -1.28 -1.93 116.94 113.98 1gxj h PHE 507 Ca 0.12 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.90 1gxj h PHE 507 Cb 0.50 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.06 1gxj h PHE 507 CO -0.40 0.41 0.00 -0.85 -1.61 0.00 0.00 178.31 175.86 1gxj n GLU 508 N -3.77 0.02 -0.51 1.51 0.28 -0.21 -2.59 120.64 115.38 1gxj n GLU 508 Ca -0.01 0.03 0.05 0.00 -0.16 0.00 0.00 57.16 57.07 1gxj n GLU 508 Cb 0.48 -1.50 0.19 0.00 1.43 0.00 0.00 31.44 32.05 1gxj n GLU 508 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1gxj n GLU 509 N -1.49 1.63 -0.26 3.44 -0.58 -0.54 -4.84 120.64 118.00 1gxj n GLU 509 Ca 0.07 -3.10 0.05 0.00 -0.42 0.00 0.00 57.16 53.76 1gxj n GLU 509 Cb 0.31 -1.64 0.18 0.00 -0.57 0.00 0.00 31.44 29.73 1gxj n GLU 509 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1gxj h LYS 510 N 0.81 0.44 -0.35 3.49 2.10 -1.11 -1.78 116.57 120.18 1gxj h LYS 510 Ca 0.04 -0.03 0.10 0.00 -2.00 0.00 0.00 60.65 58.76 1gxj h LYS 510 Cb 1.14 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.35 1gxj h LYS 510 CO 0.08 0.29 0.79 1.05 -2.00 0.00 0.00 179.45 179.66 1gxj h GLU 511 N 0.46 0.00 0.00 0.07 9.09 -1.88 1.14 114.58 123.45 1gxj h GLU 511 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.82 1gxj h GLU 511 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 1gxj h GLU 511 CO -0.39 0.00 -0.06 0.00 0.05 0.00 0.00 179.01 178.61 1gxj h ARG 512 N 0.00 0.00 -2.96 1.06 3.08 -1.69 -3.40 114.38 110.47 1gxj h ARG 512 Ca 0.17 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.60 1gxj h ARG 512 Cb 1.74 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.39 1gxj h ARG 512 CO -0.00 0.00 -0.71 -0.06 -1.07 0.00 0.00 179.97 178.13 1gxj s PHE 513 N -3.19 2.57 -0.23 3.04 0.40 0.39 -4.92 117.98 116.05 1gxj s PHE 513 Ca 0.08 -2.85 0.24 0.00 -0.60 0.00 0.00 56.93 53.79 1gxj s PHE 513 Cb 0.07 -2.14 1.19 0.00 0.51 0.00 0.00 43.02 42.66 1gxj s PHE 513 CO 0.66 -0.69 1.73 -1.00 0.70 0.00 0.00 175.22 176.61 1gxj h PRO 514 N 5.98 0.00 -0.27 0.24 0.13 -1.79 0.31 132.00 136.61 1gxj h PRO 514 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1gxj h PRO 514 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1gxj h PRO 514 CO 0.58 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.76 1gxj n GLY 515 N -0.81 0.54 3.73 1.56 0.00 -1.26 -4.89 105.19 104.05 1gxj n GLY 515 Ca -0.00 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 1gxj n GLY 515 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1gxj s LEU 516 N -1.32 4.45 0.00 0.99 2.96 0.10 -0.46 118.68 125.40 1gxj s LEU 516 Ca 0.29 1.63 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 1gxj s LEU 516 Cb 0.16 -3.45 0.00 0.00 0.50 0.00 0.00 46.19 43.40 1gxj s LEU 516 CO 0.22 -0.08 0.00 0.52 -1.32 0.00 0.00 176.35 175.69 1gxj n VAL 517 N 3.07 0.00 0.00 1.68 0.31 -0.38 -4.93 118.33 118.07 1gxj n VAL 517 Ca 0.01 0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1gxj n VAL 517 Cb 0.50 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 1gxj n VAL 517 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1gxj n ASP 518 N -2.12 0.00 -4.77 4.52 -0.08 -1.14 -5.01 116.55 107.95 1gxj n ASP 518 Ca 0.00 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 52.90 1gxj n ASP 518 Cb 0.00 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.40 1gxj n ASP 518 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1gxj s VAL 519 N -2.00 4.13 0.26 5.18 -7.23 -1.26 -1.19 120.40 118.29 1gxj s VAL 519 Ca 0.00 1.88 -0.05 0.00 -1.81 0.00 0.00 61.98 62.00 1gxj s VAL 519 Cb 0.00 -4.10 0.31 0.00 0.56 0.00 0.00 36.38 33.15 1gxj s VAL 519 CO 0.00 0.26 1.62 0.58 -0.31 0.00 0.00 175.10 177.25 1gxj h VAL 520 N 2.78 0.28 -0.42 1.32 2.07 -1.27 -0.21 116.25 120.80 1gxj h VAL 520 Ca -0.46 -0.03 0.09 0.00 0.82 0.00 0.00 66.70 67.11 1gxj h VAL 520 Cb 1.20 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1gxj h VAL 520 CO 0.66 0.02 0.29 0.77 0.02 0.00 0.00 177.57 179.33 1gxj h SER 521 N 0.09 0.18 1.33 0.57 4.64 -1.19 -0.82 113.55 118.35 1gxj h SER 521 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1gxj h SER 521 Cb 0.82 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1gxj h SER 521 CO -0.71 0.11 0.00 0.59 -0.87 0.00 0.00 176.83 175.95 1gxj n ASN 522 N -4.46 0.57 0.01 4.97 3.02 -0.10 -3.43 115.26 115.84 1gxj n ASN 522 Ca 0.06 0.55 0.11 0.00 -0.03 0.00 0.00 54.58 55.28 1gxj n ASN 522 Cb 0.35 -0.71 0.04 0.00 -0.61 0.00 0.00 39.78 38.85 1gxj n ASN 522 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1gxj n LEU 523 N -2.03 0.70 -4.72 3.41 4.77 -0.33 -4.92 117.00 113.88 1gxj n LEU 523 Ca 0.06 -0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.43 1gxj n LEU 523 Cb 0.40 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1gxj n LEU 523 CO 0.29 0.14 0.77 -0.63 -1.33 0.00 0.00 177.39 176.63 1gxj s ILE 524 N -3.07 4.31 -0.18 -0.08 1.09 -1.11 -4.54 121.20 117.62 1gxj s ILE 524 Ca 0.07 1.78 -0.01 0.00 -1.10 0.00 0.00 60.65 61.39 1gxj s ILE 524 Cb 0.16 -4.14 0.05 0.00 -1.06 0.00 0.00 42.46 37.47 1gxj s ILE 524 CO 0.80 0.20 -0.03 -0.70 -0.10 0.00 0.00 174.94 175.11 1gxj s GLU 525 N 0.49 1.24 -0.04 2.79 2.12 -1.00 -5.00 118.70 119.30 1gxj s GLU 525 Ca 0.52 -0.57 -0.17 0.00 0.36 0.00 0.00 54.97 55.11 1gxj s GLU 525 Cb -0.26 -2.11 0.03 0.00 0.26 0.00 0.00 34.13 32.05 1gxj s GLU 525 CO 0.30 -0.51 0.39 0.54 -0.54 0.00 0.00 175.26 175.44 1gxj s VAL 526 N 1.65 0.04 0.31 3.70 0.11 -1.26 -0.53 120.40 124.41 1gxj s VAL 526 Ca -0.01 -0.32 -0.30 0.00 -2.93 0.00 0.00 61.98 58.42 1gxj s VAL 526 Cb -0.16 -0.67 -0.12 0.00 -1.53 0.00 0.00 36.38 33.90 1gxj s VAL 526 CO -0.07 -0.18 1.57 -0.67 -3.33 0.00 0.00 175.10 172.42 1gxj n ASP 527 N 1.48 3.79 -0.35 3.54 4.64 -1.26 -4.83 116.55 123.57 1gxj n ASP 527 Ca -0.20 1.16 0.24 0.00 -1.38 0.00 0.00 54.79 54.61 1gxj n ASP 527 Cb 0.56 -1.59 0.49 0.00 -1.04 0.00 0.00 41.12 39.55 1gxj n ASP 527 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 1gxj h GLU 528 N 4.44 0.37 -0.12 -0.67 4.81 -2.01 0.57 114.58 121.98 1gxj h GLU 528 Ca -0.47 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 58.77 1gxj h GLU 528 Cb 1.23 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 1gxj h GLU 528 CO 0.76 0.25 0.10 0.87 -0.73 0.00 0.00 179.01 180.27 1gxj h LYS 529 N 0.38 0.00 -0.04 1.92 1.57 -2.01 -2.52 116.57 115.86 1gxj h LYS 529 Ca 0.66 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 1gxj h LYS 529 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.93 1gxj h LYS 529 CO -0.41 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.13 1gxj n TYR 530 N -4.18 0.03 -0.37 -1.35 0.53 0.17 -4.64 117.16 107.35 1gxj n TYR 530 Ca -0.00 -0.02 -0.00 0.00 -1.02 0.00 0.00 57.90 56.85 1gxj n TYR 530 Cb 0.22 -0.00 0.14 0.00 -1.03 0.00 0.00 39.34 38.67 1gxj n TYR 530 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 1gxj h SER 531 N 3.24 1.11 -0.27 7.72 4.64 -1.24 -0.94 113.55 127.80 1gxj h SER 531 Ca 0.00 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1gxj h SER 531 Cb 0.70 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1gxj h SER 531 CO 0.00 0.77 0.10 0.25 -0.87 0.00 0.00 176.83 177.07 1gxj h LEU 532 N 1.29 0.39 -0.41 5.97 6.46 -1.82 -0.00 115.31 127.18 1gxj h LEU 532 Ca 0.39 -0.19 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 1gxj h LEU 532 Cb -0.04 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1gxj h LEU 532 CO -0.11 0.47 0.19 0.00 -0.62 0.00 0.00 178.44 178.37 1gxj h ALA 533 N 0.93 0.53 -0.60 1.25 0.00 -1.66 -2.27 119.26 117.45 1gxj h ALA 533 Ca 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1gxj h ALA 533 Cb 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1gxj h ALA 533 CO -0.00 0.10 0.34 0.28 0.00 0.00 0.00 179.25 179.96 1gxj h VAL 534 N 0.52 1.19 -0.89 0.00 2.07 -1.06 -1.63 116.25 116.45 1gxj h VAL 534 Ca 0.14 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1gxj h VAL 534 Cb 0.13 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1gxj h VAL 534 CO -0.02 0.20 0.58 -1.28 0.02 0.00 0.00 177.57 177.07 1gxj h SER 535 N 0.81 0.95 0.07 0.57 0.87 -0.73 0.14 113.55 116.23 1gxj h SER 535 Ca 0.21 -0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.61 1gxj h SER 535 Cb 0.03 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1gxj h SER 535 CO -0.04 0.65 -0.55 1.62 -0.53 0.00 0.00 176.83 177.99 1gxj h VAL 536 N 1.11 1.33 -0.40 2.23 3.04 -1.08 -2.18 116.25 120.29 1gxj h VAL 536 Ca 0.36 -1.81 -0.11 0.00 -1.01 0.00 0.00 66.70 64.13 1gxj h VAL 536 Cb 0.02 1.79 -0.02 0.00 -2.01 0.00 0.00 31.29 31.08 1gxj h VAL 536 CO -0.12 0.56 -0.20 -0.07 -1.01 0.00 0.00 177.57 176.73 1gxj h LEU 537 N 0.40 0.78 -0.60 3.16 3.38 -0.66 -3.07 115.31 118.69 1gxj h LEU 537 Ca 0.01 -0.27 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 1gxj h LEU 537 Cb 1.08 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1gxj h LEU 537 CO 0.10 0.96 -0.37 -0.07 0.09 0.00 0.00 178.44 179.15 1gxj h LEU 538 N 0.68 0.73 0.00 1.67 3.38 -0.88 -3.48 115.31 117.40 1gxj h LEU 538 Ca 0.10 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1gxj h LEU 538 Cb 0.70 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1gxj h LEU 538 CO 0.05 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.22 1gxj n GLY 539 N -0.01 2.97 0.00 0.83 0.00 -0.83 -1.84 105.19 106.31 1gxj n GLY 539 Ca -0.02 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1gxj n GLY 539 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxj n GLY 540 N 0.00 -1.08 0.12 -0.02 0.00 -1.26 -3.22 105.19 99.73 1gxj n GLY 540 Ca 0.00 -0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1gxj n GLY 540 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gxj n THR 541 N -1.27 0.81 0.10 2.61 -2.24 -0.77 -2.95 114.28 110.56 1gxj n THR 541 Ca 0.12 0.18 0.18 0.00 -2.27 0.00 0.00 64.05 62.26 1gxj n THR 541 Cb 0.19 -1.09 0.74 0.00 -2.10 0.00 0.00 70.33 68.07 1gxj n THR 541 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gxj h ALA 542 N 2.31 2.18 -0.63 6.98 0.00 -1.69 -0.11 119.26 128.30 1gxj h ALA 542 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gxj h ALA 542 Cb 0.39 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1gxj h ALA 542 CO 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 179.25 178.76 1gxj n GLN 543 N -4.11 3.28 -2.18 0.00 10.64 -1.15 -0.67 117.38 123.19 1gxj n GLN 543 Ca 0.06 -2.73 -0.35 0.00 -1.83 0.00 0.00 57.00 52.14 1gxj n GLN 543 Cb 0.48 -1.72 0.01 0.00 -0.86 0.00 0.00 30.24 28.15 1gxj n GLN 543 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1gxj s ASN 544 N -1.00 5.56 -0.24 2.61 0.02 -0.06 -4.77 114.94 117.08 1gxj s ASN 544 Ca 0.47 2.26 -0.11 0.00 -1.02 0.00 0.00 52.86 54.46 1gxj s ASN 544 Cb 0.28 -2.59 -0.05 0.00 0.02 0.00 0.00 41.25 38.92 1gxj s ASN 544 CO 0.26 -1.33 0.20 -0.63 0.02 0.00 0.00 177.10 175.62 1gxj s ILE 545 N -1.70 5.33 -0.15 0.60 1.01 0.10 -1.31 121.20 125.07 1gxj s ILE 545 Ca 0.74 0.26 -0.17 0.00 0.00 0.00 0.00 60.65 61.48 1gxj s ILE 545 Cb -0.26 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1gxj s ILE 545 CO 0.29 0.32 0.43 -0.69 0.00 0.00 0.00 174.94 175.29 1gxj s VAL 546 N 1.19 5.20 0.22 2.92 1.01 -0.33 -0.04 120.40 130.58 1gxj s VAL 546 Ca 0.09 0.83 0.06 0.00 0.00 0.00 0.00 61.98 62.96 1gxj s VAL 546 Cb -0.14 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1gxj s VAL 546 CO 0.06 0.30 -0.08 0.68 0.00 0.00 0.00 175.10 176.06 1gxj s VAL 547 N 0.88 1.44 -0.25 2.92 -7.23 -0.87 -1.25 120.40 116.03 1gxj s VAL 547 Ca 0.22 -2.12 0.18 0.00 -1.81 0.00 0.00 61.98 58.46 1gxj s VAL 547 Cb -0.15 -2.21 0.15 0.00 0.56 0.00 0.00 36.38 34.73 1gxj s VAL 547 CO 0.08 -0.46 1.48 0.03 -0.31 0.00 0.00 175.10 175.92 1gxj h ARG 548 N 2.49 0.00 -3.68 4.82 3.08 -1.06 -0.28 114.38 119.74 1gxj h ARG 548 Ca -0.38 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.60 1gxj h ARG 548 Cb 1.22 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.16 1gxj h ARG 548 CO 0.64 0.32 -0.17 0.54 -1.07 0.00 0.00 179.97 180.24 1gxj s ASN 549 N -6.34 -0.08 0.44 7.04 2.20 -1.26 -3.04 114.94 113.89 1gxj s ASN 549 Ca 0.05 -0.82 0.11 0.00 -0.94 0.00 0.00 52.86 51.26 1gxj s ASN 549 Cb 0.07 0.53 0.96 0.00 -2.00 0.00 0.00 41.25 40.81 1gxj s ASN 549 CO 0.72 -1.03 2.03 0.58 -2.94 0.00 0.00 177.10 176.46 1gxj h VAL 550 N 2.35 1.10 -0.18 3.54 2.07 -1.92 -2.71 116.25 120.50 1gxj h VAL 550 Ca -0.29 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 66.85 1gxj h VAL 550 Cb 1.24 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1gxj h VAL 550 CO 0.41 0.13 0.10 0.44 0.02 0.00 0.00 177.57 178.67 1gxj h ASP 551 N 0.22 0.16 -0.67 0.57 3.32 -1.99 0.22 116.42 118.27 1gxj h ASP 551 Ca 0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1gxj h ASP 551 Cb 0.15 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1gxj h ASP 551 CO 0.00 0.12 0.39 0.74 -1.72 0.00 0.00 179.24 178.78 1gxj h THR 552 N 0.22 1.20 -0.38 0.35 2.02 -1.87 0.17 112.91 114.62 1gxj h THR 552 Ca 0.07 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1gxj h THR 552 Cb -0.00 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 1gxj h THR 552 CO -0.04 0.21 0.19 0.00 0.37 0.00 0.00 175.52 176.25 1gxj h ALA 553 N 1.49 0.49 -0.51 6.16 0.00 -0.96 -1.10 119.26 124.83 1gxj h ALA 553 Ca 0.24 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1gxj h ALA 553 Cb -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1gxj h ALA 553 CO -0.04 0.04 -0.13 0.87 0.00 0.00 0.00 179.25 179.99 1gxj h LYS 554 N 0.47 0.98 -0.44 0.00 1.57 0.00 -1.81 116.57 117.35 1gxj h LYS 554 Ca 0.13 -0.38 0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1gxj h LYS 554 Cb 0.11 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1gxj h LYS 554 CO -0.02 1.05 0.28 0.00 -0.57 0.00 0.00 179.45 180.19 1gxj h ALA 555 N 0.90 0.56 -0.38 3.86 0.00 -0.77 0.89 119.26 124.32 1gxj h ALA 555 Ca 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1gxj h ALA 555 Cb 0.69 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1gxj h ALA 555 CO 0.05 -0.02 0.15 0.82 0.00 0.00 0.00 179.25 180.24 1gxj h ILE 556 N 0.56 1.20 -0.10 0.00 2.04 -1.11 0.28 117.51 120.39 1gxj h ILE 556 Ca 0.17 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.44 1gxj h ILE 556 Cb -0.03 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1gxj h ILE 556 CO -0.05 0.22 -0.06 0.58 0.00 0.00 0.00 178.15 178.84 1gxj h VAL 557 N 0.47 0.83 -0.26 1.67 2.07 -0.92 0.31 116.25 120.42 1gxj h VAL 557 Ca 0.13 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.68 1gxj h VAL 557 Cb 0.20 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1gxj h VAL 557 CO -0.01 0.00 0.08 -0.08 0.02 0.00 0.00 177.57 177.58 1gxj h GLU 558 N -0.05 0.19 -0.37 1.57 4.57 -0.65 0.24 114.58 120.07 1gxj h GLU 558 Ca 0.06 -0.01 0.08 0.00 -1.18 0.00 0.00 59.36 58.31 1gxj h GLU 558 Cb 0.14 -0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 28.60 1gxj h GLU 558 CO -0.13 0.13 -0.18 0.35 -1.18 0.00 0.00 179.01 177.99 1gxj h PHE 559 N 0.20 -0.46 0.00 0.92 3.57 0.31 -0.35 116.94 121.12 1gxj h PHE 559 Ca 0.12 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.59 1gxj h PHE 559 Cb 0.09 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1gxj h PHE 559 CO -0.14 -0.26 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.30 1gxj h LEU 560 N -0.12 0.00 -1.27 0.59 3.38 0.11 -2.72 115.31 115.27 1gxj h LEU 560 Ca 0.19 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 1gxj h LEU 560 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1gxj h LEU 560 CO -0.45 0.31 -0.31 0.50 0.09 0.00 0.00 178.44 178.59 1gxj h LYS 561 N 0.00 0.00 0.00 1.13 3.64 0.12 -2.28 116.57 119.18 1gxj h LYS 561 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1gxj h LYS 561 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1gxj h LYS 561 CO 0.04 0.31 -0.37 1.96 -2.27 0.00 0.00 179.45 179.12 1gxj h GLN 562 N 0.00 0.00 0.00 1.90 4.20 -1.07 -3.36 115.11 116.77 1gxj h GLN 562 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1gxj h GLN 562 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1gxj h GLN 562 CO 0.04 0.00 0.00 0.27 -0.67 0.00 0.00 178.83 178.47 1gxj n ASN 563 N -4.59 0.00 -4.25 1.46 2.04 -1.08 -4.87 115.26 103.97 1gxj n ASN 563 Ca -0.05 -0.55 -0.35 0.00 -0.44 0.00 0.00 54.58 53.19 1gxj n ASN 563 Cb 0.19 0.00 -0.07 0.00 -2.53 0.00 0.00 39.78 37.37 1gxj n ASN 563 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1gxj n GLU 564 N -1.00 -0.76 0.03 -3.83 1.02 -0.86 -4.86 120.64 110.39 1gxj n GLU 564 Ca 0.13 0.08 -0.06 0.00 -0.02 0.00 0.00 57.16 57.29 1gxj n GLU 564 Cb 0.06 -3.26 -0.11 0.00 -0.02 0.00 0.00 31.44 28.11 1gxj n GLU 564 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gxj h ALA 565 N 1.03 0.58 0.00 0.62 0.00 -1.90 -3.51 119.26 116.09 1gxj h ALA 565 Ca -0.67 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.14 1gxj h ALA 565 Cb 1.39 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1gxj h ALA 565 CO 0.66 1.31 0.00 0.41 0.00 0.00 0.00 179.25 181.63 1gxj n GLY 566 N 1.43 -0.52 3.55 0.00 0.00 -1.26 -3.64 105.19 104.74 1gxj n GLY 566 Ca -0.08 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 1gxj n GLY 566 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxj s ARG 567 N -2.00 2.00 0.13 1.61 0.52 -1.26 -4.84 118.95 115.11 1gxj s ARG 567 Ca 0.00 -1.11 -0.03 0.00 -0.52 0.00 0.00 55.73 54.07 1gxj s ARG 567 Cb 0.00 -2.22 -0.03 0.00 0.52 0.00 0.00 34.95 33.22 1gxj s ARG 567 CO 0.00 0.49 0.11 0.14 0.02 0.00 0.00 175.30 176.05 1gxj s VAL 568 N -1.26 0.11 -0.16 3.52 -7.23 -1.26 -4.78 120.40 109.34 1gxj s VAL 568 Ca 0.21 -1.73 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1gxj s VAL 568 Cb -0.11 -1.89 -0.01 0.00 0.56 0.00 0.00 36.38 34.94 1gxj s VAL 568 CO 0.13 -0.51 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.43 1gxj s THR 569 N -4.00 3.22 -0.05 5.32 2.01 -1.26 -5.05 115.64 115.83 1gxj s THR 569 Ca 0.19 -0.58 0.04 0.00 0.31 0.00 0.00 61.69 61.65 1gxj s THR 569 Cb 0.06 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.16 1gxj s THR 569 CO -0.01 0.49 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.62 1gxj s ILE 570 N 0.70 2.84 -0.39 1.82 1.01 -1.26 0.00 121.20 125.91 1gxj s ILE 570 Ca -0.05 -0.80 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1gxj s ILE 570 Cb -0.15 -2.10 0.11 0.00 0.01 0.00 0.00 42.46 40.33 1gxj s ILE 570 CO 0.02 0.58 0.17 -0.76 0.00 0.00 0.00 174.94 174.95 1gxj s LEU 571 N -0.57 5.10 -0.35 2.97 1.43 0.94 -4.91 118.68 123.30 1gxj s LEU 571 Ca 0.08 -2.01 -0.28 0.00 -1.03 0.00 0.00 54.13 50.89 1gxj s LEU 571 Cb -0.11 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.33 1gxj s LEU 571 CO 0.01 -0.50 1.04 -2.16 0.23 0.00 0.00 176.35 174.97 1gxj s PRO 572 N 1.11 3.98 0.63 1.29 0.04 -1.26 -2.05 135.00 138.74 1gxj s PRO 572 Ca 0.08 0.90 0.26 0.00 0.04 0.00 0.00 61.00 62.28 1gxj s PRO 572 Cb -0.22 -3.77 1.36 0.00 0.04 0.00 0.00 34.50 31.91 1gxj s PRO 572 CO -0.05 -0.96 1.77 -0.07 0.04 0.00 0.00 177.00 177.74 1gxj h LEU 573 N 10.20 0.00 0.00 -3.56 3.38 -1.13 0.12 115.31 124.32 1gxj h LEU 573 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1gxj h LEU 573 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1gxj h LEU 573 CO 1.03 0.00 -0.38 -2.24 0.09 0.00 0.00 178.44 176.94 1gxj h ASP 574 N 0.00 0.00 0.00 -0.43 -0.00 -1.81 -3.37 116.42 110.81 1gxj h ASP 574 Ca 0.11 -0.05 -0.29 0.00 -0.00 0.00 0.00 57.03 56.81 1gxj h ASP 574 Cb 1.14 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 40.42 1gxj h ASP 574 CO -0.00 0.02 -2.08 0.18 -0.00 0.00 0.00 179.24 177.36 1gxj n LEU 575 N -2.61 0.84 -4.77 0.15 4.77 0.36 -5.02 117.00 110.73 1gxj n LEU 575 Ca 0.03 -0.03 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 1gxj n LEU 575 Cb 0.49 0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.67 1gxj n LEU 575 CO 0.35 0.51 1.02 0.27 -1.33 0.00 0.00 177.39 178.22 1gxj s ILE 576 N -2.38 2.32 -0.24 -0.08 -4.36 -0.93 -5.00 121.20 110.53 1gxj s ILE 576 Ca -0.13 0.28 -0.11 0.00 -0.26 0.00 0.00 60.65 60.43 1gxj s ILE 576 Cb 0.05 -3.17 -0.05 0.00 1.25 0.00 0.00 42.46 40.55 1gxj s ILE 576 CO 0.58 0.04 0.19 -0.62 0.24 0.00 0.00 174.94 175.37 1gxj s ASP 577 N -0.59 6.13 -0.07 4.36 3.68 -1.26 -4.97 116.67 123.95 1gxj s ASP 577 Ca 0.59 0.13 0.13 0.00 2.13 0.00 0.00 52.55 55.53 1gxj s ASP 577 Cb -0.41 -2.12 0.39 0.00 -1.45 0.00 0.00 42.92 39.33 1gxj s ASP 577 CO 0.53 0.03 1.32 0.61 0.13 0.00 0.00 175.17 177.80 1gxj n GLY 578 N 4.36 3.26 3.79 2.66 0.00 -1.26 -3.84 105.19 114.16 1gxj n GLY 578 Ca -0.14 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.91 1gxj n GLY 578 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gxj s SER 579 N -1.36 5.74 -0.07 1.61 1.04 -1.26 -4.22 113.70 115.19 1gxj s SER 579 Ca 0.31 1.98 -0.31 0.00 0.48 0.00 0.00 55.95 58.40 1gxj s SER 579 Cb 0.21 -2.56 0.12 0.00 0.10 0.00 0.00 66.02 63.89 1gxj s SER 579 CO 0.13 -1.20 1.06 0.72 0.98 0.00 0.00 173.24 174.93 1gxj s PHE 580 N -2.15 -0.21 -0.05 5.02 -0.12 -1.26 -4.86 117.98 114.36 1gxj s PHE 580 Ca 0.68 0.10 0.04 0.00 -0.05 0.00 0.00 56.93 57.70 1gxj s PHE 580 Cb -0.19 0.54 -0.00 0.00 -0.63 0.00 0.00 43.02 42.73 1gxj s PHE 580 CO 0.32 -0.41 -0.17 -0.80 -0.05 0.00 0.00 175.22 174.10 1gxj s ASN 581 N -2.44 2.19 0.69 1.98 0.02 -1.26 -5.01 114.94 111.11 1gxj s ASN 581 Ca 0.08 -0.36 -0.11 0.00 -1.02 0.00 0.00 52.86 51.45 1gxj s ASN 581 Cb -0.01 -0.63 0.00 0.00 0.02 0.00 0.00 41.25 40.64 1gxj s ASN 581 CO -0.06 0.15 1.08 -0.13 0.02 0.00 0.00 177.10 178.17 1gxj s ARG 582 N 0.06 2.99 -0.33 -0.60 0.52 -1.26 -4.75 118.95 115.58 1gxj s ARG 582 Ca -0.04 0.55 -0.03 0.00 -0.52 0.00 0.00 55.73 55.69 1gxj s ARG 582 Cb -0.12 -2.03 0.06 0.00 0.52 0.00 0.00 34.95 33.38 1gxj s ARG 582 CO 0.02 -0.96 0.06 0.42 0.02 0.00 0.00 175.30 174.86 1gxj s ILE 583 N -3.30 3.19 0.02 1.52 1.01 -1.26 -5.07 121.20 117.32 1gxj s ILE 583 Ca 0.58 -1.49 -0.36 0.00 0.00 0.00 0.00 60.65 59.38 1gxj s ILE 583 Cb -0.11 -2.91 -0.14 0.00 0.01 0.00 0.00 42.46 39.30 1gxj s ILE 583 CO 0.52 -0.25 1.61 -1.20 0.00 0.00 0.00 174.94 175.63 1gxj n SER 584 N 4.65 2.71 0.00 3.58 7.64 -1.26 -1.92 113.62 129.02 1gxj n SER 584 Ca -0.11 1.07 0.00 0.00 1.01 0.00 0.00 58.87 60.84 1gxj n SER 584 Cb 0.43 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 1gxj n SER 584 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gxj n GLY 585 N 3.52 3.04 0.22 0.23 0.00 -1.26 -4.89 105.19 106.04 1gxj n GLY 585 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 1gxj n GLY 585 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1gxj h LEU 586 N 0.00 0.04 -0.06 0.99 6.46 -1.82 -0.69 115.31 120.23 1gxj h LEU 586 Ca 0.00 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1gxj h LEU 586 Cb 0.00 0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.05 1gxj h LEU 586 CO 0.00 0.04 0.00 -1.84 -0.62 0.00 0.00 178.44 176.02 1gxj n GLU 587 N -5.10 0.01 0.00 1.25 0.00 -1.26 -0.89 120.64 114.64 1gxj n GLU 587 Ca 0.07 0.49 0.12 0.00 0.00 0.00 0.00 57.16 57.84 1gxj n GLU 587 Cb 0.28 -1.52 0.10 0.00 0.00 0.00 0.00 31.44 30.30 1gxj n GLU 587 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1gxj n ASN 588 N -1.53 2.68 -4.80 -1.84 3.02 -0.27 -4.94 115.26 107.59 1gxj n ASN 588 Ca 0.00 -1.85 -0.34 0.00 -0.03 0.00 0.00 54.58 52.36 1gxj n ASN 588 Cb 0.01 0.11 -0.01 0.00 -0.61 0.00 0.00 39.78 39.28 1gxj n ASN 588 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1gxj s GLU 589 N -2.11 3.57 0.23 3.52 0.41 -0.07 -5.00 118.70 119.23 1gxj s GLU 589 Ca 0.26 1.34 -0.30 0.00 -0.41 0.00 0.00 54.97 55.86 1gxj s GLU 589 Cb 0.20 -2.06 -0.09 0.00 -1.78 0.00 0.00 34.13 30.40 1gxj s GLU 589 CO 0.36 -0.62 1.16 0.50 -0.49 0.00 0.00 175.26 176.17 1gxj s ARG 590 N -3.54 4.54 0.00 1.61 3.52 -1.26 -2.72 118.95 121.09 1gxj s ARG 590 Ca 0.67 1.86 0.00 0.00 -0.13 0.00 0.00 55.73 58.13 1gxj s ARG 590 Cb -0.17 -3.22 0.00 0.00 -1.56 0.00 0.00 34.95 30.00 1gxj s ARG 590 CO 0.27 0.02 0.00 0.41 -0.81 0.00 0.00 175.30 175.19 1gxj n GLY 591 N 1.75 1.98 3.70 8.12 0.00 -1.26 -4.93 105.19 114.55 1gxj n GLY 591 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1gxj n GLY 591 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gxj s PHE 592 N -2.33 2.85 -0.23 1.61 5.36 -1.10 0.29 117.98 124.42 1gxj s PHE 592 Ca 0.00 0.65 -0.10 0.00 -0.96 0.00 0.00 56.93 56.52 1gxj s PHE 592 Cb 0.00 -3.82 -0.11 0.00 -0.34 0.00 0.00 43.02 38.75 1gxj s PHE 592 CO 0.00 -3.10 -0.29 0.28 -1.46 0.00 0.00 175.22 170.65 1gxj n VAL 593 N 4.36 1.28 0.00 3.12 0.31 0.08 -4.87 118.33 122.61 1gxj n VAL 593 Ca 0.14 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1gxj n VAL 593 Cb 0.41 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1gxj n VAL 593 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gxj n GLY 594 N 1.66 2.68 3.75 2.92 0.00 -0.98 -5.01 105.19 110.20 1gxj n GLY 594 Ca -0.45 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 1gxj n GLY 594 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxj s TYR 595 N -2.00 3.29 0.28 1.61 1.51 -1.26 -1.26 117.35 119.51 1gxj s TYR 595 Ca 0.00 1.38 0.01 0.00 -1.01 0.00 0.00 57.07 57.45 1gxj s TYR 595 Cb 0.00 -3.54 0.54 0.00 -0.11 0.00 0.00 41.96 38.85 1gxj s TYR 595 CO 0.00 -1.55 1.85 0.00 -1.11 0.00 0.00 175.55 174.74 1gxj h ALA 596 N 4.61 1.51 -0.18 3.71 0.00 -1.66 -0.49 119.26 126.77 1gxj h ALA 596 Ca -0.46 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.52 1gxj h ALA 596 Cb 1.22 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1gxj h ALA 596 CO 0.72 0.25 0.17 -0.24 0.00 0.00 0.00 179.25 180.16 1gxj h VAL 597 N 1.02 0.59 0.00 0.00 3.04 -1.81 -0.50 116.25 118.59 1gxj h VAL 597 Ca 0.49 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 65.98 1gxj h VAL 597 Cb 0.45 0.87 -0.03 0.00 -2.01 0.00 0.00 31.29 30.56 1gxj h VAL 597 CO -0.25 0.00 -1.34 0.44 -1.01 0.00 0.00 177.57 175.41 1gxj h ASP 598 N 0.00 0.00 1.32 3.17 3.32 -1.47 -3.36 116.42 119.40 1gxj h ASP 598 Ca 0.08 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.00 1gxj h ASP 598 Cb 0.42 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1gxj h ASP 598 CO -0.00 0.71 -0.69 -0.07 -1.72 0.00 0.00 179.24 177.47 1gxj h LEU 599 N 0.00 0.00 -9.43 1.55 3.38 -0.72 -3.45 115.31 106.63 1gxj h LEU 599 Ca -0.16 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.18 1gxj h LEU 599 Cb 1.69 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 42.34 1gxj h LEU 599 CO 0.06 0.61 -0.49 -0.69 0.09 0.00 0.00 178.44 178.02 1gxj s VAL 600 N -2.91 5.42 -0.16 1.22 1.01 -0.60 -4.55 120.40 119.84 1gxj s VAL 600 Ca 0.03 0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 1gxj s VAL 600 Cb 0.08 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1gxj s VAL 600 CO 0.77 0.52 -0.01 -0.54 0.00 0.00 0.00 175.10 175.84 1gxj s LYS 601 N -0.29 3.70 0.23 2.72 1.02 0.31 -4.90 119.74 122.53 1gxj s LYS 601 Ca 0.11 -0.47 0.11 0.00 0.02 0.00 0.00 55.97 55.75 1gxj s LYS 601 Cb -0.11 -2.98 -0.05 0.00 -0.52 0.00 0.00 37.83 34.17 1gxj s LYS 601 CO 0.01 0.29 -0.22 -0.06 -0.92 0.00 0.00 175.35 174.45 1gxj s PHE 602 N 0.26 2.24 0.60 3.18 0.40 -1.26 -2.37 117.98 121.04 1gxj s PHE 602 Ca -0.01 -0.36 -0.19 0.00 -0.60 0.00 0.00 56.93 55.77 1gxj s PHE 602 Cb -0.13 -1.05 -0.03 0.00 0.51 0.00 0.00 43.02 42.31 1gxj s PHE 602 CO 0.02 0.57 1.28 -1.25 0.70 0.00 0.00 175.22 176.55 1gxj s PRO 603 N -3.04 2.83 0.29 0.24 0.04 -1.26 -4.82 135.00 129.28 1gxj s PRO 603 Ca 0.24 2.04 0.12 0.00 0.04 0.00 0.00 61.00 63.43 1gxj s PRO 603 Cb -0.06 -1.98 0.95 0.00 0.04 0.00 0.00 34.50 33.45 1gxj s PRO 603 CO 0.12 -1.37 1.33 0.43 0.04 0.00 0.00 177.00 177.55 1gxj n SER 604 N -1.58 0.15 -0.38 6.66 7.64 -1.26 0.01 113.62 124.86 1gxj n SER 604 Ca 0.14 1.42 0.03 0.00 1.01 0.00 0.00 58.87 61.47 1gxj n SER 604 Cb 0.48 -0.62 0.10 0.00 -1.01 0.00 0.00 64.21 63.15 1gxj n SER 604 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1gxj n ASP 605 N -5.03 1.11 -0.86 6.43 3.85 -1.26 -3.73 116.55 117.05 1gxj n ASP 605 Ca 0.28 -1.99 0.05 0.00 -0.71 0.00 0.00 54.79 52.42 1gxj n ASP 605 Cb 0.92 -0.14 0.13 0.00 -1.35 0.00 0.00 41.12 40.69 1gxj n ASP 605 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1gxj n LEU 606 N 0.11 2.01 -0.27 -2.12 4.77 0.10 -4.84 117.00 116.76 1gxj n LEU 606 Ca 0.07 -3.11 -0.03 0.00 -0.03 0.00 0.00 56.01 52.92 1gxj n LEU 606 Cb 0.18 -0.33 0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1gxj n LEU 606 CO 0.05 1.02 1.17 -0.08 -1.33 0.00 0.00 177.39 178.21 1gxj h GLU 607 N 0.89 0.91 -0.43 3.23 4.81 -1.64 -2.18 114.58 120.16 1gxj h GLU 607 Ca -0.08 -0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.22 1gxj h GLU 607 Cb 1.32 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 1gxj h GLU 607 CO 0.03 0.60 0.42 0.28 -0.73 0.00 0.00 179.01 179.62 1gxj h VAL 608 N 0.93 0.44 -0.73 0.32 2.07 -1.92 -1.12 116.25 116.25 1gxj h VAL 608 Ca 0.30 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.80 1gxj h VAL 608 Cb 0.01 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1gxj h VAL 608 CO -0.11 0.00 0.39 0.25 0.02 0.00 0.00 177.57 178.12 1gxj h LEU 609 N 0.00 0.92 -0.09 2.57 5.85 -1.78 -2.14 115.31 120.63 1gxj h LEU 609 Ca 0.21 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1gxj h LEU 609 Cb 1.05 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 1gxj h LEU 609 CO -0.00 0.76 0.04 1.23 -0.34 0.00 0.00 178.44 180.13 1gxj h GLY 610 N 1.01 0.11 1.00 3.75 0.00 -1.34 0.15 103.07 107.75 1gxj h GLY 610 Ca 0.26 -0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.57 1gxj h GLY 610 CO -0.04 0.02 0.56 -1.33 0.00 0.00 0.00 176.54 175.76 1gxj h GLY 611 N 0.09 1.20 1.12 4.60 0.00 -1.59 -0.79 103.07 107.69 1gxj h GLY 611 Ca 0.04 -0.44 -0.15 0.00 0.00 0.00 0.00 47.33 46.77 1gxj h GLY 611 CO -0.03 0.43 -0.34 -2.75 0.00 0.00 0.00 176.54 173.85 1gxj h PHE 612 N 1.15 1.13 0.05 5.60 3.57 -1.15 0.17 116.94 127.46 1gxj h PHE 612 Ca 0.31 -0.32 -0.24 0.00 3.53 0.00 0.00 57.97 61.25 1gxj h PHE 612 Cb -0.12 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.37 1gxj h PHE 612 CO -0.01 1.16 -1.04 -0.07 -2.23 0.00 0.00 178.31 176.11 1gxj h LEU 613 N 0.78 0.41 0.00 0.59 3.38 -0.78 -3.39 115.31 116.29 1gxj h LEU 613 Ca 0.07 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1gxj h LEU 613 Cb 0.94 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1gxj h LEU 613 CO 0.09 1.22 -1.27 0.49 0.09 0.00 0.00 178.44 179.05 1gxj n PHE 614 N -3.63 0.00 -1.14 1.13 3.01 -0.32 -4.85 117.46 111.66 1gxj n PHE 614 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1gxj n PHE 614 Cb 0.90 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 40.23 1gxj n PHE 614 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gxj n GLY 615 N 2.26 3.04 1.87 1.37 0.00 0.59 -0.89 105.19 113.43 1gxj n GLY 615 Ca -0.02 -0.15 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 1gxj n GLY 615 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxj n ASN 616 N 2.61 3.33 -4.74 1.61 6.94 -1.26 -4.58 115.26 119.17 1gxj n ASN 616 Ca 0.00 -3.66 -0.37 0.00 -0.02 0.00 0.00 54.58 50.52 1gxj n ASN 616 Cb 0.00 -0.77 0.06 0.00 -2.36 0.00 0.00 39.78 36.71 1gxj n ASN 616 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 1gxj s SER 617 N -1.72 4.80 0.16 0.53 0.01 -0.07 -4.87 113.70 112.55 1gxj s SER 617 Ca 0.53 2.66 0.09 0.00 1.31 0.00 0.00 55.95 60.54 1gxj s SER 617 Cb 0.45 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 64.02 1gxj s SER 617 CO 0.07 -1.88 -0.20 0.54 0.41 0.00 0.00 173.24 172.19 1gxj s VAL 618 N -1.37 1.89 -0.14 3.43 0.11 -0.87 -1.72 120.40 121.74 1gxj s VAL 618 Ca 0.80 -1.89 0.01 0.00 -2.93 0.00 0.00 61.98 57.96 1gxj s VAL 618 Cb -0.38 -1.85 -0.01 0.00 -1.53 0.00 0.00 36.38 32.61 1gxj s VAL 618 CO 0.42 -0.25 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.09 1gxj s VAL 619 N -1.87 2.68 0.28 2.04 1.01 -0.39 -0.47 120.40 123.68 1gxj s VAL 619 Ca 0.15 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.40 1gxj s VAL 619 Cb -0.07 -2.11 -0.06 0.00 0.00 0.00 0.00 36.38 34.14 1gxj s VAL 619 CO 0.07 0.53 -0.01 0.68 0.00 0.00 0.00 175.10 176.36 1gxj s VAL 620 N 0.59 1.35 0.05 2.92 -7.23 0.13 -0.74 120.40 117.48 1gxj s VAL 620 Ca -0.09 -2.06 -0.21 0.00 -1.81 0.00 0.00 61.98 57.81 1gxj s VAL 620 Cb -0.16 -2.51 -0.13 0.00 0.56 0.00 0.00 36.38 34.14 1gxj s VAL 620 CO 0.03 -0.23 1.41 -0.33 -0.31 0.00 0.00 175.10 175.67 1gxj h GLU 621 N 2.29 0.32 -4.74 4.82 5.08 -0.47 -1.65 114.58 120.23 1gxj h GLU 621 Ca -0.40 -0.14 -0.27 0.00 -1.00 0.00 0.00 59.36 57.55 1gxj h GLU 621 Cb 1.23 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.33 1gxj h GLU 621 CO 0.67 0.64 -0.66 0.95 -1.00 0.00 0.00 179.01 179.61 1gxj s THR 622 N -4.59 0.57 0.35 1.13 -4.23 -1.26 -3.45 115.64 104.17 1gxj s THR 622 Ca -0.14 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 58.43 1gxj s THR 622 Cb 0.05 -2.14 0.26 0.00 1.34 0.00 0.00 72.50 72.01 1gxj s THR 622 CO 0.74 -0.44 2.01 0.25 -0.54 0.00 0.00 174.62 176.63 1gxj h LEU 623 N 2.70 0.69 -0.53 4.79 6.46 -1.98 0.10 115.31 127.54 1gxj h LEU 623 Ca -0.37 -0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 57.36 1gxj h LEU 623 Cb 1.21 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.94 1gxj h LEU 623 CO 0.62 0.52 0.31 -0.78 -0.62 0.00 0.00 178.44 178.49 1gxj h ASP 624 N 0.81 0.64 -0.41 1.25 1.82 -2.00 -0.73 116.42 117.81 1gxj h ASP 624 Ca 0.22 -0.07 -0.03 0.00 -0.39 0.00 0.00 57.03 56.76 1gxj h ASP 624 Cb -0.07 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 39.76 1gxj h ASP 624 CO -0.04 0.52 0.14 0.44 -1.61 0.00 0.00 179.24 178.68 1gxj h ASP 625 N 0.71 0.58 -0.23 2.28 3.45 -1.56 -2.34 116.42 119.32 1gxj h ASP 625 Ca 0.19 -0.20 0.05 0.00 0.43 0.00 0.00 57.03 57.50 1gxj h ASP 625 Cb 0.00 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 38.57 1gxj h ASP 625 CO -0.03 0.62 -0.07 0.00 -1.57 0.00 0.00 179.24 178.19 1gxj h ALA 626 N 0.98 0.14 -0.39 3.45 0.00 -0.54 -1.15 119.26 121.75 1gxj h ALA 626 Ca 0.13 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1gxj h ALA 626 Cb 0.24 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1gxj h ALA 626 CO -0.01 -0.48 0.13 0.82 0.00 0.00 0.00 179.25 179.71 1gxj h ILE 627 N -0.01 1.21 0.00 0.00 2.04 -1.08 -1.77 117.51 117.90 1gxj h ILE 627 Ca 0.11 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1gxj h ILE 627 Cb 0.18 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1gxj h ILE 627 CO -0.25 0.24 -0.00 -0.09 0.00 0.00 0.00 178.15 178.05 1gxj h ARG 628 N 0.48 -0.00 -0.62 2.37 2.43 -1.21 -2.13 114.38 115.70 1gxj h ARG 628 Ca 0.13 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 1gxj h ARG 628 Cb 0.24 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 1gxj h ARG 628 CO -0.01 0.02 0.18 0.52 -1.51 0.00 0.00 179.97 179.17 1gxj h MET 629 N -0.02 0.95 -0.49 0.20 2.86 -1.20 -0.02 114.93 117.21 1gxj h MET 629 Ca -0.00 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1gxj h MET 629 Cb 0.02 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 1gxj h MET 629 CO 0.00 0.83 0.32 -0.22 1.06 0.00 0.00 176.91 178.89 1gxj h LYS 630 N 0.92 0.65 -0.11 1.72 3.64 -1.07 -0.87 116.57 121.45 1gxj h LYS 630 Ca 0.20 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1gxj h LYS 630 Cb 0.28 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1gxj h LYS 630 CO -0.01 0.44 -0.07 0.87 -2.27 0.00 0.00 179.45 178.42 1gxj h LYS 631 N 0.66 0.24 -0.44 1.90 1.57 -1.16 0.44 116.57 119.79 1gxj h LYS 631 Ca 0.18 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1gxj h LYS 631 Cb -0.06 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1gxj h LYS 631 CO -0.04 0.61 0.29 -0.22 -0.57 0.00 0.00 179.45 179.53 1gxj h LYS 632 N -0.13 0.48 -0.08 3.15 3.64 -0.81 -2.80 116.57 120.01 1gxj h LYS 632 Ca 0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1gxj h LYS 632 Cb 0.55 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1gxj h LYS 632 CO 0.02 0.31 0.00 0.66 -2.27 0.00 0.00 179.45 178.17 1gxj n TYR 633 N -4.48 0.10 -3.93 1.91 4.02 -0.35 -4.99 117.16 109.44 1gxj n TYR 633 Ca 0.05 -0.14 -0.27 0.00 -0.01 0.00 0.00 57.90 57.52 1gxj n TYR 633 Cb 0.14 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 1gxj n TYR 633 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1gxj n ARG 634 N 0.42 -4.16 -1.82 -0.72 1.74 0.15 -4.87 116.66 107.39 1gxj n ARG 634 Ca 0.06 0.49 -0.41 0.00 -0.77 0.00 0.00 57.85 57.22 1gxj n ARG 634 Cb 0.26 -5.00 -0.02 0.00 -1.02 0.00 0.00 32.46 26.69 1gxj n ARG 634 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1gxj s LEU 635 N -7.02 4.35 -0.04 0.55 1.43 -0.60 -4.89 118.68 112.47 1gxj s LEU 635 Ca 0.28 2.91 0.09 0.00 -1.03 0.00 0.00 54.13 56.38 1gxj s LEU 635 Cb -0.15 -3.64 0.25 0.00 0.03 0.00 0.00 46.19 42.68 1gxj s LEU 635 CO 0.86 -0.87 1.20 -0.46 0.23 0.00 0.00 176.35 177.31 1gxj n ASN 636 N 1.99 2.75 -4.88 2.29 0.23 -1.26 -4.91 115.26 111.47 1gxj n ASN 636 Ca 0.07 -2.23 -0.21 0.00 -0.53 0.00 0.00 54.58 51.68 1gxj n ASN 636 Cb 0.38 -0.22 -0.03 0.00 -2.08 0.00 0.00 39.78 37.83 1gxj n ASN 636 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1gxj s THR 637 N -1.41 4.00 0.51 5.53 -1.32 -1.26 -4.38 115.64 117.30 1gxj s THR 637 Ca 0.20 -1.29 -0.20 0.00 -1.21 0.00 0.00 61.69 59.19 1gxj s THR 637 Cb 0.13 -3.33 -0.07 0.00 -1.51 0.00 0.00 72.50 67.71 1gxj s THR 637 CO 0.09 -0.23 1.08 -0.13 -2.21 0.00 0.00 174.62 173.22 1gxj s ARG 638 N -3.98 3.61 -0.04 7.08 0.52 -1.26 -4.19 118.95 120.69 1gxj s ARG 638 Ca 0.39 1.48 0.02 0.00 -0.52 0.00 0.00 55.73 57.10 1gxj s ARG 638 Cb -0.07 -2.06 0.01 0.00 0.52 0.00 0.00 34.95 33.35 1gxj s ARG 638 CO 0.27 -0.61 -0.09 0.42 0.02 0.00 0.00 175.30 175.31 1gxj s ILE 639 N -1.88 0.85 0.10 1.52 1.01 -0.41 -2.04 121.20 120.35 1gxj s ILE 639 Ca 0.70 -0.35 0.10 0.00 0.00 0.00 0.00 60.65 61.10 1gxj s ILE 639 Cb -0.20 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 1gxj s ILE 639 CO 0.23 0.28 -0.26 0.00 0.00 0.00 0.00 174.94 175.19 1gxj s ALA 640 N 0.52 2.30 0.25 9.38 0.00 0.38 -0.32 121.76 134.28 1gxj s ALA 640 Ca -0.09 -1.39 0.07 0.00 0.00 0.00 0.00 51.96 50.56 1gxj s ALA 640 Cb -0.12 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 1gxj s ALA 640 CO 0.01 0.53 0.18 0.95 0.00 0.00 0.00 175.76 177.43 1gxj s THR 641 N -0.98 4.35 0.49 0.00 -4.23 -0.71 -0.69 115.64 113.86 1gxj s THR 641 Ca 0.13 -1.45 0.17 0.00 -1.18 0.00 0.00 61.69 59.35 1gxj s THR 641 Cb -0.10 -3.35 0.32 0.00 1.34 0.00 0.00 72.50 70.71 1gxj s THR 641 CO 0.05 -0.35 2.05 -0.07 -0.54 0.00 0.00 174.62 175.75 1gxj h LEU 642 N 1.53 0.15 0.00 4.79 3.38 -1.32 -0.36 115.31 123.48 1gxj h LEU 642 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1gxj h LEU 642 Cb 1.24 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1gxj h LEU 642 CO 0.61 0.10 0.00 0.47 0.09 0.00 0.00 178.44 179.71 1gxj n ASP 643 N -4.47 0.00 0.00 -0.43 10.43 -1.26 -4.40 116.55 116.42 1gxj n ASP 643 Ca 0.05 0.21 0.00 0.00 2.57 0.00 0.00 54.79 57.62 1gxj n ASP 643 Cb 0.31 -0.39 0.00 0.00 1.84 0.00 0.00 41.12 42.88 1gxj n ASP 643 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1gxj n GLY 644 N 0.83 0.95 3.90 0.44 0.00 -0.15 -4.99 105.19 106.17 1gxj n GLY 644 Ca 0.09 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1gxj n GLY 644 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gxj s GLU 645 N -0.25 3.66 -0.03 1.61 8.01 -1.26 -4.83 118.70 125.61 1gxj s GLU 645 Ca 0.00 0.17 0.02 0.00 0.01 0.00 0.00 54.97 55.17 1gxj s GLU 645 Cb 0.00 -2.51 0.01 0.00 -4.31 0.00 0.00 34.13 27.32 1gxj s GLU 645 CO 0.00 0.05 -0.07 -1.17 0.01 0.00 0.00 175.26 174.09 1gxj s LEU 646 N -3.91 1.59 -0.25 1.80 2.96 -0.06 -1.74 118.68 119.07 1gxj s LEU 646 Ca 0.47 -0.15 -0.02 0.00 -0.22 0.00 0.00 54.13 54.20 1gxj s LEU 646 Cb -0.10 -0.48 0.02 0.00 0.50 0.00 0.00 46.19 46.12 1gxj s LEU 646 CO 0.33 0.01 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.70 1gxj s ILE 647 N 0.52 3.06 0.94 6.68 1.01 0.57 -0.56 121.20 133.41 1gxj s ILE 647 Ca -0.07 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 1gxj s ILE 647 Cb -0.11 -2.55 0.16 0.00 0.01 0.00 0.00 42.46 39.97 1gxj s ILE 647 CO 0.01 0.20 1.09 -0.94 0.00 0.00 0.00 174.94 175.29 1gxj s SER 648 N 1.36 3.01 0.49 3.58 1.04 0.43 -1.29 113.70 122.33 1gxj s SER 648 Ca 0.01 1.54 0.19 0.00 0.48 0.00 0.00 55.95 58.16 1gxj s SER 648 Cb -0.17 -2.20 1.23 0.00 0.10 0.00 0.00 66.02 64.99 1gxj s SER 648 CO -0.03 -2.94 2.04 1.23 0.98 0.00 0.00 173.24 174.52 1gxj h GLY 649 N -1.75 0.19 -2.51 7.32 0.00 -1.76 -1.32 103.07 103.23 1gxj h GLY 649 Ca -0.51 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1gxj h GLY 649 CO 0.53 0.04 0.00 0.54 0.00 0.00 0.00 176.54 177.65 1gxj n ARG 650 N -4.45 3.05 -0.26 4.80 1.74 -1.26 -4.47 116.66 115.81 1gxj n ARG 650 Ca 0.06 -2.28 0.00 0.00 -0.77 0.00 0.00 57.85 54.86 1gxj n ARG 650 Cb 0.37 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 1gxj n ARG 650 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gxj n GLY 651 N 1.07 0.76 3.71 -0.13 0.00 -0.50 -5.07 105.19 105.05 1gxj n GLY 651 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1gxj n GLY 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxj s ALA 652 N -2.23 3.32 -0.24 4.61 0.00 -1.26 -4.77 121.76 121.19 1gxj s ALA 652 Ca 0.00 0.75 -0.07 0.00 0.00 0.00 0.00 51.96 52.64 1gxj s ALA 652 Cb 0.00 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1gxj s ALA 652 CO 0.00 -0.36 0.06 0.42 0.00 0.00 0.00 175.76 175.89 1gxj s ILE 653 N 0.97 4.31 -0.16 0.00 1.01 -1.26 -0.43 121.20 125.64 1gxj s ILE 653 Ca 0.56 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 61.02 1gxj s ILE 653 Cb -0.27 -3.00 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 1gxj s ILE 653 CO 0.29 0.36 -0.11 -0.89 0.00 0.00 0.00 174.94 174.59 1gxj s THR 654 N 1.43 3.06 0.32 2.92 2.01 0.27 -4.98 115.64 120.67 1gxj s THR 654 Ca 0.05 -0.63 -0.14 0.00 0.31 0.00 0.00 61.69 61.28 1gxj s THR 654 Cb -0.15 -2.32 0.02 0.00 0.01 0.00 0.00 72.50 70.06 1gxj s THR 654 CO 0.03 0.49 0.63 -0.83 -0.69 0.00 0.00 174.62 174.26 1gxj s GLY 655 N 0.80 0.52 0.00 4.40 0.00 -1.26 -0.88 107.32 110.90 1gxj s GLY 655 Ca -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1gxj s GLY 655 CO 0.01 -0.47 0.00 0.61 0.00 0.00 0.00 173.10 173.25 1gxj n GLY 656 N -0.48 2.54 2.99 0.20 0.00 -1.26 -5.09 105.19 104.08 1gxj n GLY 656 Ca -0.04 -2.13 -0.19 0.00 0.00 0.00 0.00 46.02 43.66 1gxj n GLY 656 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxj s ARG 657 N -2.08 0.83 0.00 1.61 0.52 -1.26 -4.99 118.95 113.58 1gxj s ARG 657 Ca 0.00 -0.27 0.28 0.00 -0.52 0.00 0.00 55.73 55.22 1gxj s ARG 657 Cb 0.00 -0.79 1.02 0.00 0.52 0.00 0.00 34.95 35.71 1gxj s ARG 657 CO 0.00 0.11 1.73 0.39 0.02 0.00 0.00 175.30 177.55