#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxk h ALA 502 N 0.00 1.60 -0.86 2.89 0.00 -1.83 2.09 119.26 123.15 1gxk h ALA 502 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1gxk h ALA 502 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1gxk h ALA 502 CO 0.00 -0.60 0.42 0.28 0.00 0.00 0.00 179.25 179.36 1gxk h VAL 503 N 0.00 1.26 0.35 0.00 2.07 -1.92 -2.53 116.25 115.49 1gxk h VAL 503 Ca 0.00 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1gxk h VAL 503 Cb 1.25 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1gxk h VAL 503 CO 0.00 0.31 -0.33 0.03 0.02 0.00 0.00 177.57 177.60 1gxk h ARG 504 N 1.22 -0.67 -0.76 1.57 3.08 0.30 0.21 114.38 119.32 1gxk h ARG 504 Ca 0.30 0.05 0.16 0.00 0.07 0.00 0.00 59.98 60.56 1gxk h ARG 504 Cb 0.10 0.15 -0.11 0.00 0.08 0.00 0.00 29.97 30.19 1gxk h ARG 504 CO -0.04 -0.45 0.22 0.00 -1.07 0.00 0.00 179.97 178.63 1gxk h ALA 505 N -0.20 1.03 -0.87 0.04 0.00 -1.62 0.38 119.26 118.02 1gxk h ALA 505 Ca -0.02 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1gxk h ALA 505 Cb 0.63 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1gxk h ALA 505 CO -0.05 -0.32 0.43 0.28 0.00 0.00 0.00 179.25 179.60 1gxk h VAL 506 N 0.31 1.26 0.17 0.00 2.07 -0.88 -3.16 116.25 116.02 1gxk h VAL 506 Ca 0.43 -0.71 -0.30 0.00 0.82 0.00 0.00 66.70 66.94 1gxk h VAL 506 Cb 0.74 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1gxk h VAL 506 CO -0.50 0.31 -1.39 -0.26 0.02 0.00 0.00 177.57 175.75 1gxk h PHE 507 N 1.23 0.65 0.00 1.57 -1.00 0.13 -3.15 116.94 116.38 1gxk h PHE 507 Ca 0.30 -0.47 0.00 0.00 2.81 0.00 0.00 57.97 60.61 1gxk h PHE 507 Cb 0.09 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.63 1gxk h PHE 507 CO 0.01 1.40 0.00 -0.85 -1.61 0.00 0.00 178.31 177.27 1gxk n GLU 508 N -3.58 0.61 -0.75 1.51 0.28 0.11 -0.83 120.64 118.00 1gxk n GLU 508 Ca -0.13 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.84 1gxk n GLU 508 Cb 1.06 -1.27 -0.03 0.00 1.43 0.00 0.00 31.44 32.63 1gxk n GLU 508 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1gxk n GLU 509 N 0.35 0.00 -0.01 3.44 1.02 -1.24 -4.96 120.64 119.24 1gxk n GLU 509 Ca 0.00 -0.58 0.23 0.00 -0.02 0.00 0.00 57.16 56.79 1gxk n GLU 509 Cb 0.20 0.15 0.64 0.00 -0.02 0.00 0.00 31.44 32.41 1gxk n GLU 509 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1gxk h LYS 510 N 0.06 0.00 -0.73 3.49 2.10 -0.94 0.35 116.57 120.90 1gxk h LYS 510 Ca -0.23 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.41 1gxk h LYS 510 Cb 1.24 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.54 1gxk h LYS 510 CO -0.11 0.00 0.43 0.93 -2.00 0.00 0.00 179.45 178.70 1gxk h GLU 511 N 0.00 0.99 0.00 0.07 4.39 -1.89 -1.15 114.58 116.99 1gxk h GLU 511 Ca 0.30 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1gxk h GLU 511 Cb 1.75 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 30.19 1gxk h GLU 511 CO -0.00 0.71 0.04 0.00 -1.16 0.00 0.00 179.01 178.60 1gxk h ARG 512 N 0.99 0.00 -4.04 2.33 3.08 -0.68 -3.37 114.38 112.70 1gxk h ARG 512 Ca 0.26 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.70 1gxk h ARG 512 Cb -0.02 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 29.64 1gxk h ARG 512 CO -0.05 0.00 -0.75 -0.06 -1.07 0.00 0.00 179.97 178.04 1gxk s PHE 513 N -3.60 2.40 0.02 3.04 0.40 -0.43 -5.02 117.98 114.79 1gxk s PHE 513 Ca -0.03 -2.06 -0.17 0.00 -0.60 0.00 0.00 56.93 54.07 1gxk s PHE 513 Cb 0.07 -2.00 -0.09 0.00 0.51 0.00 0.00 43.02 41.50 1gxk s PHE 513 CO 0.21 -0.87 1.18 -1.00 0.70 0.00 0.00 175.22 175.45 1gxk h PRO 514 N 7.93 -0.60 0.00 0.24 0.13 -1.76 -3.11 132.00 134.83 1gxk h PRO 514 Ca -0.12 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1gxk h PRO 514 Cb 1.03 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1gxk h PRO 514 CO 0.47 -0.40 0.04 0.41 -0.23 0.00 0.00 178.00 178.29 1gxk n GLY 515 N -1.09 -0.17 3.28 1.56 0.00 -1.26 -4.81 105.19 102.70 1gxk n GLY 515 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1gxk n GLY 515 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1gxk n LEU 516 N -1.12 -2.40 0.00 0.99 7.94 -1.18 -1.38 117.00 119.85 1gxk n LEU 516 Ca 0.00 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 1gxk n LEU 516 Cb 0.04 -0.98 0.00 0.00 0.53 0.00 0.00 43.42 43.01 1gxk n LEU 516 CO 0.00 -4.40 0.00 0.52 -1.11 0.00 0.00 177.39 172.40 1gxk n VAL 517 N -2.09 0.00 0.00 1.96 0.31 -0.79 -4.74 118.33 112.98 1gxk n VAL 517 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1gxk n VAL 517 Cb 0.50 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.34 1gxk n VAL 517 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1gxk n ASP 518 N -1.79 0.00 -4.81 4.52 -0.08 -1.16 -5.01 116.55 108.22 1gxk n ASP 518 Ca 0.00 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.95 1gxk n ASP 518 Cb 0.00 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.41 1gxk n ASP 518 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 1gxk s VAL 519 N -2.00 4.16 0.09 5.18 -7.23 -1.26 -1.57 120.40 117.76 1gxk s VAL 519 Ca 0.00 1.28 -0.29 0.00 -1.81 0.00 0.00 61.98 61.16 1gxk s VAL 519 Cb 0.00 -3.55 -0.13 0.00 0.56 0.00 0.00 36.38 33.27 1gxk s VAL 519 CO 0.00 -0.35 1.46 0.58 -0.31 0.00 0.00 175.10 176.48 1gxk h VAL 520 N 1.56 0.00 -0.85 1.32 2.07 -1.33 -2.78 116.25 116.24 1gxk h VAL 520 Ca -0.49 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.31 1gxk h VAL 520 Cb 1.20 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.81 1gxk h VAL 520 CO 0.60 0.00 0.16 -1.54 0.02 0.00 0.00 177.57 176.81 1gxk n SER 521 N -4.98 0.03 0.19 0.57 3.41 -0.83 -0.67 113.62 111.34 1gxk n SER 521 Ca -0.07 1.43 -0.14 0.00 -0.26 0.00 0.00 58.87 59.83 1gxk n SER 521 Cb 0.35 -0.58 -0.08 0.00 -0.26 0.00 0.00 64.21 63.64 1gxk n SER 521 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1gxk h ASN 522 N 0.00 -0.42 -0.12 4.04 4.21 -1.78 -3.24 115.58 118.27 1gxk h ASN 522 Ca 0.58 -0.12 -0.07 0.00 1.21 0.00 0.00 56.30 57.91 1gxk h ASN 522 Cb 1.33 0.11 -0.04 0.00 -1.12 0.00 0.00 38.32 38.61 1gxk h ASN 522 CO -0.75 -0.10 0.08 0.00 -1.29 0.00 0.00 177.43 175.37 1gxk n LEU 523 N -5.20 3.94 -3.97 1.61 -0.00 0.15 -4.83 117.00 108.69 1gxk n LEU 523 Ca -0.10 -1.95 -0.15 0.00 -0.00 0.00 0.00 56.01 53.81 1gxk n LEU 523 Cb 0.27 -0.67 -0.14 0.00 -0.00 0.00 0.00 43.42 42.88 1gxk n LEU 523 CO 0.32 0.68 -0.40 -0.51 -0.00 0.00 0.00 177.39 177.48 1gxk s ILE 524 N -0.43 0.42 -0.19 1.47 2.07 -1.08 -4.51 121.20 118.96 1gxk s ILE 524 Ca 0.07 -0.37 0.01 0.00 -1.41 0.00 0.00 60.65 58.95 1gxk s ILE 524 Cb 0.06 -0.39 0.03 0.00 0.13 0.00 0.00 42.46 42.29 1gxk s ILE 524 CO 0.01 0.02 -0.17 -1.61 -1.91 0.00 0.00 174.94 171.28 1gxk s GLU 525 N -0.38 2.68 -0.15 3.50 8.01 -0.89 -4.98 118.70 126.49 1gxk s GLU 525 Ca -0.00 -0.88 0.02 0.00 0.01 0.00 0.00 54.97 54.11 1gxk s GLU 525 Cb -0.03 -2.55 0.01 0.00 -4.31 0.00 0.00 34.13 27.25 1gxk s GLU 525 CO -0.00 -0.29 -0.19 0.54 0.01 0.00 0.00 175.26 175.32 1gxk s VAL 526 N 1.29 2.28 -0.44 2.63 0.11 -1.26 -0.99 120.40 124.03 1gxk s VAL 526 Ca 0.02 -0.90 -0.33 0.00 -2.93 0.00 0.00 61.98 57.84 1gxk s VAL 526 Cb -0.14 -1.94 -0.12 0.00 -1.53 0.00 0.00 36.38 32.65 1gxk s VAL 526 CO -0.11 0.53 2.28 -0.67 -3.33 0.00 0.00 175.10 173.81 1gxk n ASP 527 N 4.12 1.97 -0.48 3.54 4.64 -1.24 -4.77 116.55 124.34 1gxk n ASP 527 Ca -0.20 0.24 0.39 0.00 -1.38 0.00 0.00 54.79 53.85 1gxk n ASP 527 Cb 0.51 -1.28 0.64 0.00 -1.04 0.00 0.00 41.12 39.96 1gxk n ASP 527 CO 0.00 0.00 0.00 1.21 -0.82 0.00 0.00 177.20 177.59 1gxk n GLU 528 N 8.37 -0.02 0.00 -0.67 4.07 -1.26 -2.29 120.64 128.83 1gxk n GLU 528 Ca 0.43 1.09 0.00 0.00 -0.06 0.00 0.00 57.16 58.62 1gxk n GLU 528 Cb 0.26 -2.24 0.00 0.00 -0.06 0.00 0.00 31.44 29.40 1gxk n GLU 528 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1gxk n LYS 529 N -4.31 0.00 -1.18 5.31 3.00 -1.26 -1.98 118.16 117.74 1gxk n LYS 529 Ca 0.37 0.74 -0.29 0.00 -0.00 0.00 0.00 58.31 59.14 1gxk n LYS 529 Cb 1.52 -1.31 0.07 0.00 0.00 0.00 0.00 35.03 35.31 1gxk n LYS 529 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1gxk n TYR 530 N -2.12 2.66 0.02 5.64 4.02 -0.97 -4.59 117.16 121.82 1gxk n TYR 530 Ca 0.00 -2.67 -0.12 0.00 -0.01 0.00 0.00 57.90 55.10 1gxk n TYR 530 Cb 0.00 -1.29 -0.06 0.00 -0.02 0.00 0.00 39.34 37.97 1gxk n TYR 530 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1gxk h SER 531 N 1.82 0.05 -0.78 7.72 0.87 -1.34 -2.52 113.55 119.37 1gxk h SER 531 Ca 0.50 -0.02 0.07 0.00 -1.23 0.00 0.00 61.79 61.11 1gxk h SER 531 Cb 0.84 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.73 1gxk h SER 531 CO 1.31 0.05 0.46 0.25 -0.53 0.00 0.00 176.83 178.37 1gxk h LEU 532 N 0.05 0.69 0.30 2.23 6.46 -1.82 0.57 115.31 123.79 1gxk h LEU 532 Ca 0.02 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 1gxk h LEU 532 Cb 0.01 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 1gxk h LEU 532 CO -0.00 0.43 -0.22 0.00 -0.62 0.00 0.00 178.44 178.04 1gxk h ALA 533 N 1.39 -0.50 -0.84 1.25 0.00 -1.74 -2.36 119.26 116.47 1gxk h ALA 533 Ca 0.35 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1gxk h ALA 533 Cb 0.22 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1gxk h ALA 533 CO -0.19 -0.80 0.51 0.28 0.00 0.00 0.00 179.25 179.05 1gxk h VAL 534 N -0.52 1.03 -0.10 0.00 2.07 -1.12 -1.44 116.25 116.18 1gxk h VAL 534 Ca -0.02 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 67.21 1gxk h VAL 534 Cb 0.44 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 1gxk h VAL 534 CO 0.01 0.17 -0.48 -1.28 0.02 0.00 0.00 177.57 176.01 1gxk h SER 535 N 0.94 -1.50 -0.14 0.57 0.87 -0.47 0.40 113.55 114.22 1gxk h SER 535 Ca 0.37 0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 61.05 1gxk h SER 535 Cb 0.18 0.59 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 1gxk h SER 535 CO -0.18 -0.47 -0.10 -0.37 -0.53 0.00 0.00 176.83 175.19 1gxk h VAL 536 N -0.56 1.22 -0.40 2.23 -1.51 -1.18 -0.93 116.25 115.11 1gxk h VAL 536 Ca 0.05 -0.94 -0.06 0.00 -1.23 0.00 0.00 66.70 64.52 1gxk h VAL 536 Cb 0.67 1.11 -0.02 0.00 -2.13 0.00 0.00 31.29 30.92 1gxk h VAL 536 CO -0.40 0.31 -0.01 0.25 -1.23 0.00 0.00 177.57 176.49 1gxk h LEU 537 N 0.44 0.62 0.49 4.19 6.46 -0.38 -3.18 115.31 123.95 1gxk h LEU 537 Ca 0.09 -0.14 -0.02 0.00 -0.12 0.00 0.00 57.88 57.68 1gxk h LEU 537 Cb 0.44 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1gxk h LEU 537 CO 0.02 0.70 -0.23 -0.07 -0.62 0.00 0.00 178.44 178.24 1gxk h LEU 538 N 0.62 -0.55 0.00 2.25 3.38 0.66 -3.49 115.31 118.17 1gxk h LEU 538 Ca 0.12 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1gxk h LEU 538 Cb 0.41 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1gxk h LEU 538 CO 0.02 -0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.02 1gxk n GLY 539 N 0.11 0.12 0.29 0.83 0.00 -0.44 -3.57 105.19 102.53 1gxk n GLY 539 Ca -0.08 -1.00 0.17 0.00 0.00 0.00 0.00 46.02 45.11 1gxk n GLY 539 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1gxk h GLY 540 N 0.00 0.00 1.32 -0.02 0.00 -1.93 -3.08 103.07 99.36 1gxk h GLY 540 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1gxk h GLY 540 CO 0.00 0.00 0.12 -1.30 0.00 0.00 0.00 176.54 175.36 1gxk n THR 541 N -3.36 1.20 0.47 4.70 -2.24 -1.23 -0.59 114.28 113.23 1gxk n THR 541 Ca -0.02 0.42 0.11 0.00 -2.27 0.00 0.00 64.05 62.29 1gxk n THR 541 Cb 0.21 -1.42 0.44 0.00 -2.10 0.00 0.00 70.33 67.46 1gxk n THR 541 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gxk n ALA 542 N -1.28 1.75 -0.91 6.98 0.00 -1.17 -2.48 120.51 123.41 1gxk n ALA 542 Ca 0.00 0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.56 1gxk n ALA 542 Cb 0.12 -1.36 0.17 0.00 0.00 0.00 0.00 19.45 18.38 1gxk n ALA 542 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1gxk n GLN 543 N -2.02 2.04 -2.38 0.00 6.02 0.24 -1.96 117.38 119.33 1gxk n GLN 543 Ca 0.03 -2.55 -0.42 0.00 -0.01 0.00 0.00 57.00 54.05 1gxk n GLN 543 Cb 0.24 -1.56 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 1gxk n GLN 543 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1gxk s ASN 544 N -2.32 7.05 -0.01 1.08 0.02 -1.03 -4.74 114.94 114.99 1gxk s ASN 544 Ca 0.32 2.12 -0.23 0.00 -1.02 0.00 0.00 52.86 54.05 1gxk s ASN 544 Cb 0.27 -2.59 -0.05 0.00 0.02 0.00 0.00 41.25 38.90 1gxk s ASN 544 CO 0.05 -0.46 0.70 -0.63 0.02 0.00 0.00 177.10 176.78 1gxk s ILE 545 N 0.71 4.89 -0.32 0.60 1.01 -0.13 -1.25 121.20 126.71 1gxk s ILE 545 Ca 0.58 1.47 -0.11 0.00 0.00 0.00 0.00 60.65 62.58 1gxk s ILE 545 Cb -0.31 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 1gxk s ILE 545 CO 0.32 0.34 0.19 -0.69 0.00 0.00 0.00 174.94 175.09 1gxk s VAL 546 N 0.22 4.91 0.26 2.92 1.01 -0.61 0.19 120.40 129.31 1gxk s VAL 546 Ca 0.36 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 62.12 1gxk s VAL 546 Cb -0.19 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 1gxk s VAL 546 CO 0.20 0.03 -0.07 0.68 0.00 0.00 0.00 175.10 175.94 1gxk s VAL 547 N 1.66 3.13 0.00 2.92 -7.23 -1.00 -1.88 120.40 118.01 1gxk s VAL 547 Ca 0.05 -2.04 -0.18 0.00 -1.81 0.00 0.00 61.98 58.00 1gxk s VAL 547 Cb -0.17 -2.66 -0.34 0.00 0.56 0.00 0.00 36.38 33.77 1gxk s VAL 547 CO 0.08 -0.36 0.96 0.03 -0.31 0.00 0.00 175.10 175.51 1gxk h ARG 548 N 2.10 0.46 -6.70 4.82 2.47 -1.51 -0.09 114.38 115.92 1gxk h ARG 548 Ca -0.43 -0.79 -0.66 0.00 -1.26 0.00 0.00 59.98 56.84 1gxk h ARG 548 Cb 1.25 0.29 -0.20 0.00 -1.65 0.00 0.00 29.97 29.66 1gxk h ARG 548 CO 0.60 1.38 -0.84 0.54 0.56 0.00 0.00 179.97 182.20 1gxk s ASN 549 N -7.38 3.30 0.23 7.04 2.20 -1.26 -3.03 114.94 116.04 1gxk s ASN 549 Ca -0.11 -0.80 -0.07 0.00 -0.94 0.00 0.00 52.86 50.94 1gxk s ASN 549 Cb 0.03 -0.23 0.19 0.00 -2.00 0.00 0.00 41.25 39.24 1gxk s ASN 549 CO 0.91 0.14 1.84 0.58 -2.94 0.00 0.00 177.10 177.63 1gxk h VAL 550 N 3.57 1.26 -0.91 3.54 2.07 -1.93 -2.33 116.25 121.51 1gxk h VAL 550 Ca -0.48 -0.67 0.15 0.00 0.82 0.00 0.00 66.70 66.52 1gxk h VAL 550 Cb 1.19 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 1gxk h VAL 550 CO 0.43 0.30 0.58 0.44 0.02 0.00 0.00 177.57 179.34 1gxk h ASP 551 N 1.22 0.66 0.17 0.57 5.19 -1.99 0.36 116.42 122.61 1gxk h ASP 551 Ca 0.30 0.05 -0.17 0.00 -0.62 0.00 0.00 57.03 56.58 1gxk h ASP 551 Cb 0.06 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 39.48 1gxk h ASP 551 CO -0.05 0.32 -0.66 0.74 -3.12 0.00 0.00 179.24 176.48 1gxk h THR 552 N 0.69 1.36 0.17 0.35 2.02 -1.86 -1.72 112.91 113.92 1gxk h THR 552 Ca 0.46 -2.00 -0.01 0.00 0.77 0.00 0.00 66.41 65.64 1gxk h THR 552 Cb 0.76 1.98 -0.00 0.00 -1.74 0.00 0.00 68.15 69.15 1gxk h THR 552 CO -0.22 0.61 -0.10 0.00 0.37 0.00 0.00 175.52 176.18 1gxk h ALA 553 N 0.96 -0.25 -0.61 6.16 0.00 -0.08 -0.87 119.26 124.58 1gxk h ALA 553 Ca -0.02 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1gxk h ALA 553 Cb 1.22 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 1gxk h ALA 553 CO 0.12 -0.64 0.40 0.87 0.00 0.00 0.00 179.25 180.00 1gxk h LYS 554 N -0.25 0.77 -0.34 0.00 1.57 -0.74 -1.38 116.57 116.20 1gxk h LYS 554 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1gxk h LYS 554 Cb 0.21 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1gxk h LYS 554 CO 0.02 0.51 0.21 0.00 -0.57 0.00 0.00 179.45 179.63 1gxk h ALA 555 N 1.63 0.43 0.69 3.86 0.00 -0.78 0.42 119.26 125.52 1gxk h ALA 555 Ca 0.23 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1gxk h ALA 555 Cb -0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1gxk h ALA 555 CO -0.06 -0.09 -0.43 0.82 0.00 0.00 0.00 179.25 179.50 1gxk h ILE 556 N 0.45 0.14 -0.67 0.00 2.04 -0.14 0.57 117.51 119.90 1gxk h ILE 556 Ca 0.12 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.12 1gxk h ILE 556 Cb -0.02 0.14 -0.12 0.00 -0.74 0.00 0.00 36.82 36.07 1gxk h ILE 556 CO -0.02 0.00 -0.09 0.58 0.00 0.00 0.00 178.15 178.62 1gxk h VAL 557 N -1.05 0.37 -0.48 1.67 2.07 -1.13 0.79 116.25 118.49 1gxk h VAL 557 Ca -0.09 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 1gxk h VAL 557 Cb 0.85 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1gxk h VAL 557 CO 0.09 0.01 0.03 -0.33 0.02 0.00 0.00 177.57 177.39 1gxk h GLU 558 N 0.05 0.78 0.44 1.57 4.39 -0.59 0.68 114.58 121.90 1gxk h GLU 558 Ca 0.34 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 1gxk h GLU 558 Cb 0.55 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1gxk h GLU 558 CO -0.64 0.77 -0.21 0.35 -1.16 0.00 0.00 179.01 178.12 1gxk h PHE 559 N 0.74 -0.54 -0.44 4.33 3.57 0.54 -2.20 116.94 122.93 1gxk h PHE 559 Ca 0.15 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1gxk h PHE 559 Cb 0.41 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1gxk h PHE 559 CO 0.02 -0.29 0.27 -0.07 -2.23 0.00 0.00 178.31 176.01 1gxk h LEU 560 N -0.67 0.53 -0.92 0.59 3.38 0.46 -2.02 115.31 116.66 1gxk h LEU 560 Ca -0.06 -0.05 0.18 0.00 0.09 0.00 0.00 57.88 58.04 1gxk h LEU 560 Cb 0.49 -0.13 -0.11 0.00 0.09 0.00 0.00 40.66 41.00 1gxk h LEU 560 CO 0.10 0.42 0.50 0.11 0.09 0.00 0.00 178.44 179.66 1gxk h LYS 561 N 0.59 0.62 0.29 1.13 1.57 -0.75 1.56 116.57 121.58 1gxk h LYS 561 Ca 0.16 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1gxk h LYS 561 Cb -0.02 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.16 1gxk h LYS 561 CO -0.03 0.41 -0.14 1.96 -0.57 0.00 0.00 179.45 181.08 1gxk h GLN 562 N 0.63 -0.38 0.00 3.15 4.20 -0.87 -3.23 115.11 118.62 1gxk h GLN 562 Ca 0.53 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.27 1gxk h GLN 562 Cb 0.84 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1gxk h GLN 562 CO -0.40 -0.25 0.00 0.09 -0.67 0.00 0.00 178.83 177.59 1gxk n ASN 563 N -3.68 0.05 -1.37 1.46 4.13 -0.81 -4.82 115.26 110.23 1gxk n ASN 563 Ca -0.05 0.52 -0.13 0.00 1.68 0.00 0.00 54.58 56.60 1gxk n ASN 563 Cb 0.15 -0.53 -0.06 0.00 -1.54 0.00 0.00 39.78 37.81 1gxk n ASN 563 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1gxk n GLU 564 N -1.56 -1.30 0.00 3.52 1.02 0.53 -4.76 120.64 118.09 1gxk n GLU 564 Ca 0.02 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 1gxk n GLU 564 Cb 0.09 -5.01 0.00 0.00 -0.02 0.00 0.00 31.44 26.50 1gxk n GLU 564 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gxk n ALA 565 N 0.50 1.41 0.00 0.62 0.00 -1.20 -4.90 120.51 116.94 1gxk n ALA 565 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1gxk n ALA 565 Cb 0.43 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1gxk n ALA 565 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gxk n GLY 566 N -0.85 -0.01 3.66 0.00 0.00 -1.26 -4.55 105.19 102.18 1gxk n GLY 566 Ca 0.00 -2.28 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 1gxk n GLY 566 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gxk s ARG 567 N -0.17 2.35 0.30 1.61 0.52 -1.26 -4.75 118.95 117.55 1gxk s ARG 567 Ca 0.00 -1.36 -0.11 0.00 -0.52 0.00 0.00 55.73 53.74 1gxk s ARG 567 Cb 0.00 -2.21 0.01 0.00 0.52 0.00 0.00 34.95 33.27 1gxk s ARG 567 CO 0.00 0.38 0.56 0.14 0.02 0.00 0.00 175.30 176.40 1gxk s VAL 568 N -2.25 0.00 -0.08 3.52 -7.23 -1.26 -4.67 120.40 108.43 1gxk s VAL 568 Ca 0.31 -1.34 0.02 0.00 -1.81 0.00 0.00 61.98 59.17 1gxk s VAL 568 Cb -0.07 -2.43 0.01 0.00 0.56 0.00 0.00 36.38 34.45 1gxk s VAL 568 CO 0.20 0.00 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.96 1gxk s THR 569 N -3.41 1.34 -0.01 5.32 2.01 -1.26 -5.09 115.64 114.54 1gxk s THR 569 Ca 0.22 -0.58 0.04 0.00 0.31 0.00 0.00 61.69 61.68 1gxk s THR 569 Cb -0.02 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 1gxk s THR 569 CO 0.12 0.40 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.70 1gxk s ILE 570 N 0.75 3.20 -0.62 1.82 1.01 -1.26 -0.95 121.20 125.14 1gxk s ILE 570 Ca -0.12 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 59.71 1gxk s ILE 570 Cb -0.16 -2.33 0.15 0.00 0.01 0.00 0.00 42.46 40.14 1gxk s ILE 570 CO 0.03 0.46 0.40 -0.76 0.00 0.00 0.00 174.94 175.07 1gxk s LEU 571 N -1.13 4.68 -0.11 2.97 1.43 0.51 -4.90 118.68 122.13 1gxk s LEU 571 Ca 0.14 -3.35 -0.29 0.00 -1.03 0.00 0.00 54.13 49.60 1gxk s LEU 571 Cb -0.11 -1.68 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1gxk s LEU 571 CO 0.04 -0.19 1.68 -2.16 0.23 0.00 0.00 176.35 175.95 1gxk s PRO 572 N -0.76 4.02 0.16 1.29 0.04 -1.26 -2.36 135.00 136.13 1gxk s PRO 572 Ca 0.20 2.05 0.12 0.00 0.04 0.00 0.00 61.00 63.41 1gxk s PRO 572 Cb -0.17 -4.02 0.61 0.00 0.04 0.00 0.00 34.50 30.96 1gxk s PRO 572 CO -0.07 -1.03 1.35 1.28 0.04 0.00 0.00 177.00 178.57 1gxk n LEU 573 N 7.73 0.29 -0.36 -3.56 4.77 -0.05 -1.37 117.00 124.45 1gxk n LEU 573 Ca 0.18 0.63 0.12 0.00 -0.03 0.00 0.00 56.01 56.91 1gxk n LEU 573 Cb 0.43 -0.66 0.17 0.00 -2.33 0.00 0.00 43.42 41.03 1gxk n LEU 573 CO 0.63 -0.71 0.45 -0.90 -1.33 0.00 0.00 177.39 175.53 1gxk n ASP 574 N -1.88 1.52 0.00 -1.43 5.75 -1.17 -4.51 116.55 114.83 1gxk n ASP 574 Ca -0.00 -1.19 0.00 0.00 -0.01 0.00 0.00 54.79 53.58 1gxk n ASP 574 Cb 0.03 0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 1gxk n ASP 574 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1gxk n LEU 575 N -0.39 1.67 -4.64 -2.12 7.94 -0.47 -5.02 117.00 113.96 1gxk n LEU 575 Ca 0.10 0.00 -0.36 0.00 -1.11 0.00 0.00 56.01 54.65 1gxk n LEU 575 Cb 0.41 0.00 0.09 0.00 0.53 0.00 0.00 43.42 44.45 1gxk n LEU 575 CO 0.28 0.28 0.62 2.30 -1.11 0.00 0.00 177.39 179.76 1gxk n ILE 576 N -2.15 3.03 -4.19 1.96 -5.35 -0.78 -5.02 119.36 106.86 1gxk n ILE 576 Ca 0.00 -0.37 -0.34 0.00 -0.27 0.00 0.00 62.75 61.77 1gxk n ILE 576 Cb 0.42 -1.17 -0.14 0.00 -1.74 0.00 0.00 39.64 37.01 1gxk n ILE 576 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1gxk s ASP 577 N -1.66 4.04 -0.14 7.28 3.68 -1.26 -4.99 116.67 123.61 1gxk s ASP 577 Ca 0.75 -0.41 0.16 0.00 2.13 0.00 0.00 52.55 55.17 1gxk s ASP 577 Cb -0.34 -1.66 0.49 0.00 -1.45 0.00 0.00 42.92 39.95 1gxk s ASP 577 CO 0.49 0.04 1.39 0.61 0.13 0.00 0.00 175.17 177.82 1gxk n GLY 578 N 4.40 3.80 3.80 2.66 0.00 -1.26 -3.92 105.19 114.67 1gxk n GLY 578 Ca -0.19 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 1gxk n GLY 578 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gxk s SER 579 N -1.76 5.64 -0.23 1.61 1.04 -1.26 -4.04 113.70 114.70 1gxk s SER 579 Ca 0.38 1.78 -0.34 0.00 0.48 0.00 0.00 55.95 58.25 1gxk s SER 579 Cb 0.30 -2.52 0.15 0.00 0.10 0.00 0.00 66.02 64.05 1gxk s SER 579 CO 0.10 -1.26 1.26 0.72 0.98 0.00 0.00 173.24 175.04 1gxk s PHE 580 N -2.59 -0.10 -0.04 5.02 -0.12 -1.26 -4.79 117.98 114.10 1gxk s PHE 580 Ca 0.62 0.10 0.01 0.00 -0.05 0.00 0.00 56.93 57.61 1gxk s PHE 580 Cb -0.16 0.50 0.02 0.00 -0.63 0.00 0.00 43.02 42.76 1gxk s PHE 580 CO 0.41 -0.14 -0.02 -0.80 -0.05 0.00 0.00 175.22 174.62 1gxk s ASN 581 N -1.79 0.73 0.86 1.98 -0.87 -1.26 -4.96 114.94 109.63 1gxk s ASN 581 Ca 0.09 -0.08 -0.11 0.00 -1.57 0.00 0.00 52.86 51.18 1gxk s ASN 581 Cb -0.01 -0.35 0.11 0.00 -0.02 0.00 0.00 41.25 40.98 1gxk s ASN 581 CO -0.04 -0.08 1.09 -0.13 -2.57 0.00 0.00 177.10 175.37 1gxk s ARG 582 N 0.97 1.54 -0.23 -0.60 0.52 -1.26 -4.66 118.95 115.23 1gxk s ARG 582 Ca -0.10 0.82 -0.00 0.00 -0.52 0.00 0.00 55.73 55.92 1gxk s ARG 582 Cb -0.14 -1.84 0.03 0.00 0.52 0.00 0.00 34.95 33.52 1gxk s ARG 582 CO -0.01 -2.04 -0.11 0.42 0.02 0.00 0.00 175.30 173.58 1gxk s ILE 583 N -2.98 2.55 0.15 1.52 1.01 -1.26 -5.08 121.20 117.12 1gxk s ILE 583 Ca 0.63 -1.07 -0.32 0.00 0.00 0.00 0.00 60.65 59.88 1gxk s ILE 583 Cb -0.17 -2.26 -0.12 0.00 0.01 0.00 0.00 42.46 39.92 1gxk s ILE 583 CO 0.56 0.27 1.76 -1.20 0.00 0.00 0.00 174.94 176.33 1gxk n SER 584 N 4.62 3.85 0.00 3.58 7.64 -1.26 -2.58 113.62 129.47 1gxk n SER 584 Ca -0.17 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.73 1gxk n SER 584 Cb 0.47 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.14 1gxk n SER 584 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gxk n GLY 585 N 4.02 2.14 0.35 0.23 0.00 -1.26 -4.93 105.19 105.74 1gxk n GLY 585 Ca 0.17 -0.30 0.10 0.00 0.00 0.00 0.00 46.02 46.00 1gxk n GLY 585 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1gxk h LEU 586 N 0.00 0.49 -1.94 0.99 3.38 -1.92 -1.76 115.31 114.54 1gxk h LEU 586 Ca 0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1gxk h LEU 586 Cb 0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1gxk h LEU 586 CO 0.00 0.30 0.07 1.05 0.09 0.00 0.00 178.44 179.95 1gxk h GLU 587 N 0.54 0.08 -0.01 1.13 9.09 -1.92 -1.10 114.58 122.39 1gxk h GLU 587 Ca 0.31 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.71 1gxk h GLU 587 Cb 0.48 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.56 1gxk h GLU 587 CO -0.10 0.05 -0.23 0.09 0.05 0.00 0.00 179.01 178.87 1gxk n ASN 588 N -4.52 0.97 -4.72 3.06 3.02 -0.67 -4.89 115.26 107.51 1gxk n ASN 588 Ca -0.01 -0.87 -0.31 0.00 -0.03 0.00 0.00 54.58 53.36 1gxk n ASN 588 Cb 0.13 0.10 0.12 0.00 -0.61 0.00 0.00 39.78 39.53 1gxk n ASN 588 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1gxk s GLU 589 N -2.48 1.72 -0.06 3.52 0.41 -0.42 -4.98 118.70 116.41 1gxk s GLU 589 Ca 0.25 1.39 -0.21 0.00 -0.41 0.00 0.00 54.97 55.99 1gxk s GLU 589 Cb 0.19 -1.82 -0.04 0.00 -1.78 0.00 0.00 34.13 30.68 1gxk s GLU 589 CO 0.51 -2.08 0.62 1.03 -0.49 0.00 0.00 175.26 174.84 1gxk s ARG 590 N -4.69 4.39 0.00 1.61 1.81 -1.26 -3.56 118.95 117.24 1gxk s ARG 590 Ca 0.65 0.74 0.00 0.00 -1.72 0.00 0.00 55.73 55.40 1gxk s ARG 590 Cb -0.21 -3.42 0.00 0.00 -0.45 0.00 0.00 34.95 30.88 1gxk s ARG 590 CO 0.56 0.17 0.00 0.41 -0.68 0.00 0.00 175.30 175.75 1gxk n GLY 591 N 2.97 3.22 3.64 -3.53 0.00 -1.26 -4.90 105.19 105.33 1gxk n GLY 591 Ca -0.04 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.42 1gxk n GLY 591 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1gxk n PHE 592 N -0.90 1.65 -0.07 1.61 7.35 -1.23 -1.55 117.46 124.32 1gxk n PHE 592 Ca 0.00 0.67 -0.10 0.00 -0.76 0.00 0.00 57.45 57.26 1gxk n PHE 592 Cb 0.00 -2.35 -0.03 0.00 0.35 0.00 0.00 39.48 37.45 1gxk n PHE 592 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1gxk n VAL 593 N 3.28 1.42 0.00 -2.13 0.31 -0.45 -4.91 118.33 115.86 1gxk n VAL 593 Ca 0.22 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.66 1gxk n VAL 593 Cb 0.14 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 30.92 1gxk n VAL 593 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1gxk n GLY 594 N 1.78 -0.45 3.84 2.92 0.00 -1.13 -5.01 105.19 107.14 1gxk n GLY 594 Ca -0.17 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 1gxk n GLY 594 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gxk s TYR 595 N -2.00 3.37 0.05 1.61 1.51 -1.26 -1.17 117.35 119.46 1gxk s TYR 595 Ca 0.00 1.31 -0.20 0.00 -1.01 0.00 0.00 57.07 57.17 1gxk s TYR 595 Cb 0.00 -2.62 -0.10 0.00 -0.11 0.00 0.00 41.96 39.13 1gxk s TYR 595 CO 0.00 -0.01 1.32 0.00 -1.11 0.00 0.00 175.55 175.75 1gxk h ALA 596 N 1.98 -0.97 -0.83 3.71 0.00 -1.47 -2.81 119.26 118.88 1gxk h ALA 596 Ca -0.48 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.51 1gxk h ALA 596 Cb 1.18 0.54 -0.16 0.00 0.00 0.00 0.00 17.79 19.36 1gxk h ALA 596 CO 0.64 -0.99 -0.14 1.55 0.00 0.00 0.00 179.25 180.31 1gxk n VAL 597 N -4.14 -0.35 0.28 0.00 3.14 -1.26 0.47 118.33 116.47 1gxk n VAL 597 Ca -0.07 1.87 0.15 0.00 -2.96 0.00 0.00 64.34 63.32 1gxk n VAL 597 Cb 0.26 -2.63 0.81 0.00 -1.06 0.00 0.00 33.84 31.22 1gxk n VAL 597 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1gxk h ASP 598 N 0.00 0.00 -0.53 6.55 3.32 -1.89 -2.61 116.42 121.26 1gxk h ASP 598 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1gxk h ASP 598 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1gxk h ASP 598 CO -0.83 0.08 0.00 0.18 -1.72 0.00 0.00 179.24 176.95 1gxk n LEU 599 N -3.57 5.22 -3.89 1.55 4.77 0.18 -4.92 117.00 116.34 1gxk n LEU 599 Ca -0.02 -2.65 -0.11 0.00 -0.03 0.00 0.00 56.01 53.21 1gxk n LEU 599 Cb 0.20 -0.66 -0.10 0.00 -2.33 0.00 0.00 43.42 40.53 1gxk n LEU 599 CO 0.28 0.61 -0.21 -0.69 -1.33 0.00 0.00 177.39 176.05 1gxk s VAL 600 N -2.52 0.09 0.04 4.08 1.01 -0.98 -3.62 120.40 118.50 1gxk s VAL 600 Ca 0.49 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.83 1gxk s VAL 600 Cb 0.37 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 36.33 1gxk s VAL 600 CO 0.15 -0.40 -0.23 -0.75 0.00 0.00 0.00 175.10 173.87 1gxk s LYS 601 N -1.38 1.59 -0.03 2.72 2.36 -0.16 -4.94 119.74 119.90 1gxk s LYS 601 Ca -0.15 -0.99 0.01 0.00 -2.55 0.00 0.00 55.97 52.29 1gxk s LYS 601 Cb -0.08 -1.71 0.01 0.00 -1.05 0.00 0.00 37.83 35.00 1gxk s LYS 601 CO 0.01 0.44 -0.05 -0.06 1.55 0.00 0.00 175.35 177.24 1gxk s PHE 602 N -0.77 0.66 -0.91 4.03 2.99 -1.26 -2.09 117.98 120.62 1gxk s PHE 602 Ca 0.09 -0.16 -0.21 0.00 0.00 0.00 0.00 56.93 56.66 1gxk s PHE 602 Cb -0.09 -0.54 -0.24 0.00 0.00 0.00 0.00 43.02 42.15 1gxk s PHE 602 CO 0.02 -0.12 2.41 -0.35 -0.00 0.00 0.00 175.22 177.17 1gxk n PRO 603 N 3.64 0.20 0.00 0.24 -0.04 -1.26 -4.66 135.00 133.12 1gxk n PRO 603 Ca -0.21 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 1gxk n PRO 603 Cb 0.53 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1gxk n PRO 603 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1gxk n SER 604 N 10.32 0.00 -0.21 3.54 2.88 -1.26 -1.08 113.62 127.82 1gxk n SER 604 Ca 0.61 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 58.28 1gxk n SER 604 Cb 0.19 0.00 0.44 0.00 -0.75 0.00 0.00 64.21 64.09 1gxk n SER 604 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1gxk h ASP 605 N 0.00 0.52 0.00 -3.46 2.03 -2.07 -2.26 116.42 111.19 1gxk h ASP 605 Ca 0.00 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 1gxk h ASP 605 Cb 0.00 -0.08 0.00 0.00 -0.83 0.00 0.00 39.33 38.42 1gxk h ASP 605 CO 0.00 0.27 0.00 0.18 -1.03 0.00 0.00 179.24 178.66 1gxk n LEU 606 N -4.51 3.13 0.07 0.15 4.77 -0.24 -4.14 117.00 116.23 1gxk n LEU 606 Ca 0.15 -1.50 0.03 0.00 -0.03 0.00 0.00 56.01 54.67 1gxk n LEU 606 Cb 0.48 -0.58 0.42 0.00 -2.33 0.00 0.00 43.42 41.41 1gxk n LEU 606 CO 0.31 0.55 1.03 -0.08 -1.33 0.00 0.00 177.39 177.88 1gxk h GLU 607 N 0.65 0.37 -0.12 3.23 4.81 -1.63 -3.16 114.58 118.74 1gxk h GLU 607 Ca 0.00 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1gxk h GLU 607 Cb 0.85 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 1gxk h GLU 607 CO 0.00 0.35 -0.35 0.28 -0.73 0.00 0.00 179.01 178.55 1gxk h VAL 608 N 0.37 0.00 -0.50 0.32 2.07 -1.87 -2.73 116.25 113.91 1gxk h VAL 608 Ca 0.09 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.78 1gxk h VAL 608 Cb 0.14 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.82 1gxk h VAL 608 CO -0.00 0.00 0.11 0.18 0.02 0.00 0.00 177.57 177.87 1gxk n LEU 609 N -4.41 0.03 0.34 2.57 4.32 -1.19 0.79 117.00 119.45 1gxk n LEU 609 Ca -0.04 0.85 -0.19 0.00 -0.02 0.00 0.00 56.01 56.61 1gxk n LEU 609 Cb 0.24 -0.35 -0.10 0.00 -1.62 0.00 0.00 43.42 41.59 1gxk n LEU 609 CO 0.05 -0.89 0.53 1.23 -1.22 0.00 0.00 177.39 177.09 1gxk h GLY 610 N 0.00 -1.28 0.26 -0.72 0.00 -1.68 1.74 103.07 101.39 1gxk h GLY 610 Ca 0.35 0.57 0.12 0.00 0.00 0.00 0.00 47.33 48.37 1gxk h GLY 610 CO -0.44 -0.40 0.28 -1.33 0.00 0.00 0.00 176.54 174.65 1gxk h GLY 611 N -1.08 1.03 0.37 4.60 0.00 0.27 0.97 103.07 109.24 1gxk h GLY 611 Ca -0.08 -0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 1gxk h GLY 611 CO -0.01 -0.05 -0.18 -2.75 0.00 0.00 0.00 176.54 173.55 1gxk h PHE 612 N 0.45 -0.46 -0.88 5.60 3.57 -0.66 -1.62 116.94 122.94 1gxk h PHE 612 Ca 0.37 -0.01 0.23 0.00 3.53 0.00 0.00 57.97 62.09 1gxk h PHE 612 Cb 0.51 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 1gxk h PHE 612 CO -0.16 -0.29 0.61 -0.07 -2.23 0.00 0.00 178.31 176.17 1gxk h LEU 613 N -0.63 0.20 0.00 0.59 3.38 0.28 -3.39 115.31 115.73 1gxk h LEU 613 Ca -0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1gxk h LEU 613 Cb 0.38 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1gxk h LEU 613 CO 0.08 0.07 0.00 0.49 0.09 0.00 0.00 178.44 179.18 1gxk n PHE 614 N -4.40 0.00 -1.63 1.13 3.01 0.32 -4.96 117.46 110.94 1gxk n PHE 614 Ca 0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.65 1gxk n PHE 614 Cb 0.82 0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.31 1gxk n PHE 614 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gxk n GLY 615 N 3.54 0.50 0.00 1.37 0.00 -0.61 -3.96 105.19 106.04 1gxk n GLY 615 Ca 0.00 -1.41 0.14 0.00 0.00 0.00 0.00 46.02 44.76 1gxk n GLY 615 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gxk n ASN 616 N 1.26 0.00 -4.40 1.61 2.04 -1.26 -4.39 115.26 110.12 1gxk n ASN 616 Ca 0.00 -0.29 -0.46 0.00 -0.44 0.00 0.00 54.58 53.39 1gxk n ASN 616 Cb 0.00 -0.23 -0.02 0.00 -2.53 0.00 0.00 39.78 37.00 1gxk n ASN 616 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 1gxk n SER 617 N -1.23 -1.37 -4.52 0.53 3.41 -1.25 -4.69 113.62 104.49 1gxk n SER 617 Ca 0.15 1.06 -0.25 0.00 -0.26 0.00 0.00 58.87 59.58 1gxk n SER 617 Cb 0.20 -0.97 -0.11 0.00 -0.26 0.00 0.00 64.21 63.08 1gxk n SER 617 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1gxk s VAL 618 N -1.15 1.88 0.01 -3.33 1.01 0.29 -1.33 120.40 117.77 1gxk s VAL 618 Ca 0.63 -2.10 0.07 0.00 0.00 0.00 0.00 61.98 60.58 1gxk s VAL 618 Cb -0.84 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 1gxk s VAL 618 CO 0.58 -0.14 -0.21 -0.69 0.00 0.00 0.00 175.10 174.63 1gxk s VAL 619 N -2.83 1.68 0.25 2.92 1.01 -0.31 -0.38 120.40 122.73 1gxk s VAL 619 Ca 0.33 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1gxk s VAL 619 Cb 0.06 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1gxk s VAL 619 CO 0.16 0.34 0.16 0.68 0.00 0.00 0.00 175.10 176.44 1gxk s VAL 620 N -0.64 0.11 0.02 2.92 -7.23 0.11 -1.34 120.40 114.35 1gxk s VAL 620 Ca 0.08 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.14 1gxk s VAL 620 Cb -0.08 -2.52 -0.06 0.00 0.56 0.00 0.00 36.38 34.28 1gxk s VAL 620 CO 0.00 0.00 1.17 -0.33 -0.31 0.00 0.00 175.10 175.63 1gxk h GLU 621 N 2.44 -0.34 -5.04 4.82 4.39 -1.60 0.48 114.58 119.73 1gxk h GLU 621 Ca -0.34 0.02 -0.50 0.00 0.34 0.00 0.00 59.36 58.88 1gxk h GLU 621 Cb 1.25 0.08 -0.13 0.00 -0.10 0.00 0.00 28.75 29.84 1gxk h GLU 621 CO 0.51 -0.23 -0.54 0.95 -1.16 0.00 0.00 179.01 178.54 1gxk s THR 622 N -3.86 0.65 0.08 1.13 -4.23 -1.26 -3.36 115.64 104.79 1gxk s THR 622 Ca -0.06 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.15 1gxk s THR 622 Cb 0.01 -2.48 -0.17 0.00 1.34 0.00 0.00 72.50 71.20 1gxk s THR 622 CO 0.18 0.00 1.64 0.25 -0.54 0.00 0.00 174.62 176.15 1gxk h LEU 623 N 1.96 -0.67 -0.99 4.79 6.46 -1.97 -2.67 115.31 122.22 1gxk h LEU 623 Ca -0.36 0.03 0.27 0.00 -0.12 0.00 0.00 57.88 57.71 1gxk h LEU 623 Cb 1.26 0.19 -0.18 0.00 -0.73 0.00 0.00 40.66 41.20 1gxk h LEU 623 CO 0.58 -0.44 0.03 0.44 -0.62 0.00 0.00 178.44 178.43 1gxk h ASP 624 N -0.71 -0.47 0.27 1.25 3.32 -1.98 0.62 116.42 118.70 1gxk h ASP 624 Ca -0.06 0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1gxk h ASP 624 Cb 0.57 0.49 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1gxk h ASP 624 CO 0.08 -0.35 -0.18 0.44 -1.72 0.00 0.00 179.24 177.50 1gxk h ASP 625 N 0.01 -0.45 -0.36 6.45 3.45 -1.83 0.29 116.42 123.99 1gxk h ASP 625 Ca 0.60 0.03 0.07 0.00 0.43 0.00 0.00 57.03 58.17 1gxk h ASP 625 Cb 1.23 0.14 -0.07 0.00 -0.56 0.00 0.00 39.33 40.07 1gxk h ASP 625 CO -0.92 -0.28 -0.13 0.00 -1.57 0.00 0.00 179.24 176.34 1gxk h ALA 626 N 0.27 0.18 0.85 3.45 0.00 0.37 0.54 119.26 124.92 1gxk h ALA 626 Ca -0.02 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1gxk h ALA 626 Cb 0.37 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.51 1gxk h ALA 626 CO 0.01 -0.50 -0.41 0.82 0.00 0.00 0.00 179.25 179.17 1gxk h ILE 627 N -0.06 0.06 -1.06 0.00 2.04 -0.63 0.83 117.51 118.70 1gxk h ILE 627 Ca 0.18 -0.13 0.28 0.00 1.00 0.00 0.00 64.86 66.19 1gxk h ILE 627 Cb 0.33 0.07 -0.10 0.00 -0.74 0.00 0.00 36.82 36.37 1gxk h ILE 627 CO -0.40 0.00 0.68 -0.09 0.00 0.00 0.00 178.15 178.34 1gxk h ARG 628 N -1.26 0.37 0.13 2.37 1.12 -0.06 -0.26 114.38 116.79 1gxk h ARG 628 Ca -0.12 -0.02 -0.29 0.00 -1.11 0.00 0.00 59.98 58.44 1gxk h ARG 628 Cb 0.88 -0.08 0.00 0.00 -0.01 0.00 0.00 29.97 30.76 1gxk h ARG 628 CO 0.19 0.24 -1.40 1.98 -3.11 0.00 0.00 179.97 177.87 1gxk h MET 629 N 0.38 0.28 -0.51 0.20 4.05 0.25 -2.93 114.93 116.66 1gxk h MET 629 Ca 0.62 -0.48 -0.06 0.00 -0.28 0.00 0.00 59.70 59.50 1gxk h MET 629 Cb 1.58 0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 32.54 1gxk h MET 629 CO -0.33 1.19 0.07 -0.22 0.23 0.00 0.00 176.91 177.84 1gxk h LYS 630 N 0.08 0.82 -0.81 0.39 3.64 0.70 -2.19 116.57 119.20 1gxk h LYS 630 Ca -0.20 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 58.95 1gxk h LYS 630 Cb 2.01 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 33.68 1gxk h LYS 630 CO 0.19 0.78 0.35 0.87 -2.27 0.00 0.00 179.45 179.36 1gxk h LYS 631 N 0.78 1.19 0.00 1.90 1.57 -1.18 -1.05 116.57 119.78 1gxk h LYS 631 Ca 0.16 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1gxk h LYS 631 Cb 0.37 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1gxk h LYS 631 CO 0.01 0.94 0.00 1.17 -0.57 0.00 0.00 179.45 181.00 1gxk n LYS 632 N -4.30 0.00 0.00 3.15 4.81 -0.86 -3.76 118.16 117.20 1gxk n LYS 632 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1gxk n LYS 632 Cb 0.17 -0.72 0.00 0.00 0.02 0.00 0.00 35.03 34.49 1gxk n LYS 632 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1gxk n TYR 633 N -0.33 0.00 -3.99 5.64 4.02 -0.98 -4.81 117.16 116.71 1gxk n TYR 633 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.59 1gxk n TYR 633 Cb 0.00 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.26 1gxk n TYR 633 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1gxk n ARG 634 N -0.33 -0.74 -1.69 -0.72 1.85 -0.41 -4.72 116.66 109.90 1gxk n ARG 634 Ca 0.00 0.02 -0.44 0.00 -1.00 0.00 0.00 57.85 56.43 1gxk n ARG 634 Cb 0.03 -2.48 -0.04 0.00 -1.05 0.00 0.00 32.46 28.92 1gxk n ARG 634 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1gxk n LEU 635 N -4.04 3.55 -1.23 2.89 4.77 -1.11 -4.82 117.00 117.01 1gxk n LEU 635 Ca -0.20 1.05 0.11 0.00 -0.03 0.00 0.00 56.01 56.94 1gxk n LEU 635 Cb 0.52 -1.48 0.28 0.00 -2.33 0.00 0.00 43.42 40.41 1gxk n LEU 635 CO 0.66 -0.05 0.75 -0.46 -1.33 0.00 0.00 177.39 176.95 1gxk n ASN 636 N 4.35 3.61 -4.98 -1.43 0.23 -1.26 -4.79 115.26 110.98 1gxk n ASN 636 Ca 0.18 -1.99 -0.20 0.00 -0.53 0.00 0.00 54.58 52.04 1gxk n ASN 636 Cb 0.32 -0.39 0.01 0.00 -2.08 0.00 0.00 39.78 37.64 1gxk n ASN 636 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1gxk s THR 637 N -1.22 3.67 0.28 5.53 -1.32 -1.26 -4.32 115.64 117.00 1gxk s THR 637 Ca 0.44 -0.85 -0.10 0.00 -1.21 0.00 0.00 61.69 59.97 1gxk s THR 637 Cb 0.24 -3.29 -0.07 0.00 -1.51 0.00 0.00 72.50 67.86 1gxk s THR 637 CO 0.32 -0.14 0.62 -0.13 -2.21 0.00 0.00 174.62 173.07 1gxk s ARG 638 N -4.37 3.82 -0.04 7.08 0.52 -1.26 -3.87 118.95 120.84 1gxk s ARG 638 Ca 0.49 0.35 -0.02 0.00 -0.52 0.00 0.00 55.73 56.04 1gxk s ARG 638 Cb -0.10 -2.57 0.03 0.00 0.52 0.00 0.00 34.95 32.83 1gxk s ARG 638 CO 0.34 0.23 0.05 0.42 0.02 0.00 0.00 175.30 176.36 1gxk s ILE 639 N -1.95 -0.06 0.10 1.52 1.01 -1.06 -0.55 121.20 120.22 1gxk s ILE 639 Ca 0.49 0.37 0.09 0.00 0.00 0.00 0.00 60.65 61.60 1gxk s ILE 639 Cb -0.11 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.15 1gxk s ILE 639 CO 0.22 0.17 -0.21 0.00 0.00 0.00 0.00 174.94 175.13 1gxk s ALA 640 N 1.97 2.57 0.03 9.38 0.00 0.49 -1.37 121.76 134.83 1gxk s ALA 640 Ca 0.03 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 1gxk s ALA 640 Cb -0.12 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 1gxk s ALA 640 CO -0.03 0.57 0.18 0.95 0.00 0.00 0.00 175.76 177.43 1gxk s THR 641 N -1.06 5.27 0.53 0.00 -4.23 -0.92 0.05 115.64 115.28 1gxk s THR 641 Ca 0.16 -0.34 0.30 0.00 -1.18 0.00 0.00 61.69 60.63 1gxk s THR 641 Cb -0.10 -3.51 0.47 0.00 1.34 0.00 0.00 72.50 70.69 1gxk s THR 641 CO 0.08 0.23 1.90 -0.07 -0.54 0.00 0.00 174.62 176.21 1gxk h LEU 642 N 3.46 0.03 -1.90 4.79 3.38 -0.04 0.74 115.31 125.77 1gxk h LEU 642 Ca -0.47 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1gxk h LEU 642 Cb 1.17 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1gxk h LEU 642 CO 0.71 0.01 -0.12 0.44 0.09 0.00 0.00 178.44 179.57 1gxk h ASP 643 N 0.03 0.00 0.00 -0.43 3.45 -1.81 -3.41 116.42 114.25 1gxk h ASP 643 Ca 0.41 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.87 1gxk h ASP 643 Cb 1.58 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.35 1gxk h ASP 643 CO -0.02 0.12 0.00 0.61 -1.57 0.00 0.00 179.24 178.38 1gxk n GLY 644 N -0.70 1.00 3.77 2.75 0.00 0.26 -5.03 105.19 107.24 1gxk n GLY 644 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1gxk n GLY 644 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gxk s GLU 645 N -0.26 0.59 -0.10 1.61 8.01 -1.25 -4.79 118.70 122.51 1gxk s GLU 645 Ca 0.00 0.10 -0.25 0.00 0.01 0.00 0.00 54.97 54.83 1gxk s GLU 645 Cb 0.00 -1.79 0.06 0.00 -4.31 0.00 0.00 34.13 28.09 1gxk s GLU 645 CO 0.00 -2.53 0.60 -1.17 0.01 0.00 0.00 175.26 172.17 1gxk s LEU 646 N -6.19 -0.31 -0.23 1.80 2.96 -0.23 -2.15 118.68 114.33 1gxk s LEU 646 Ca 0.67 0.76 -0.00 0.00 -0.22 0.00 0.00 54.13 55.34 1gxk s LEU 646 Cb -0.12 2.19 0.06 0.00 0.50 0.00 0.00 46.19 48.83 1gxk s LEU 646 CO 0.54 -0.46 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.45 1gxk s ILE 647 N -0.77 1.28 1.08 6.68 1.01 -0.47 -0.87 121.20 129.15 1gxk s ILE 647 Ca -0.08 -1.08 -0.14 0.00 0.00 0.00 0.00 60.65 59.35 1gxk s ILE 647 Cb -0.02 -1.62 0.17 0.00 0.01 0.00 0.00 42.46 41.00 1gxk s ILE 647 CO 0.06 -0.15 0.65 -1.54 0.00 0.00 0.00 174.94 173.96 1gxk n SER 648 N 4.76 -1.61 0.24 3.58 3.41 0.07 -2.56 113.62 121.51 1gxk n SER 648 Ca -0.11 0.04 0.14 0.00 -0.26 0.00 0.00 58.87 58.68 1gxk n SER 648 Cb 0.45 -1.20 0.80 0.00 -0.26 0.00 0.00 64.21 63.99 1gxk n SER 648 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1gxk h GLY 649 N -2.18 0.00 0.13 5.00 0.00 -1.75 -0.82 103.07 103.45 1gxk h GLY 649 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1gxk h GLY 649 CO 0.42 0.00 -0.25 0.54 0.00 0.00 0.00 176.54 177.25 1gxk n ARG 650 N -4.08 0.91 0.00 4.80 1.74 -1.26 -4.24 116.66 114.53 1gxk n ARG 650 Ca -0.01 -0.55 0.00 0.00 -0.77 0.00 0.00 57.85 56.52 1gxk n ARG 650 Cb 0.20 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1gxk n ARG 650 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gxk n GLY 651 N 1.33 1.22 3.68 -0.13 0.00 -0.31 -5.09 105.19 105.90 1gxk n GLY 651 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1gxk n GLY 651 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxk s ALA 652 N -2.00 3.44 -0.19 4.61 0.00 -1.26 -4.77 121.76 121.60 1gxk s ALA 652 Ca 0.00 0.11 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 1gxk s ALA 652 Cb 0.00 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 1gxk s ALA 652 CO 0.00 -0.50 0.15 0.42 0.00 0.00 0.00 175.76 175.83 1gxk s ILE 653 N 1.77 5.41 -0.00 0.00 1.01 -1.25 -0.75 121.20 127.38 1gxk s ILE 653 Ca 0.40 0.23 0.03 0.00 0.00 0.00 0.00 60.65 61.31 1gxk s ILE 653 Cb -0.17 -3.48 -0.01 0.00 0.01 0.00 0.00 42.46 38.81 1gxk s ILE 653 CO 0.15 0.46 -0.10 -0.89 0.00 0.00 0.00 174.94 174.56 1gxk s THR 654 N 0.21 0.77 -0.07 2.92 2.01 -0.05 -4.98 115.64 116.45 1gxk s THR 654 Ca 0.10 -0.46 -0.31 0.00 0.31 0.00 0.00 61.69 61.33 1gxk s THR 654 Cb -0.11 -0.65 0.11 0.00 0.01 0.00 0.00 72.50 71.85 1gxk s THR 654 CO -0.01 0.18 1.36 -0.83 -0.69 0.00 0.00 174.62 174.64 1gxk s GLY 655 N -0.32 -0.27 0.00 4.40 0.00 -1.26 -1.07 107.32 108.80 1gxk s GLY 655 Ca 0.03 0.32 0.00 0.00 0.00 0.00 0.00 44.72 45.08 1gxk s GLY 655 CO -0.00 4.92 0.00 0.61 0.00 0.00 0.00 173.10 178.63 1gxk n GLY 656 N -0.84 0.61 0.00 0.20 0.00 -1.26 -5.09 105.19 98.80 1gxk n GLY 656 Ca 0.02 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1gxk n GLY 656 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1gxk n ARG 657 N 0.00 0.00 0.00 1.61 3.00 -1.26 -5.06 116.66 114.95 1gxk n ARG 657 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1gxk n ARG 657 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1gxk n ARG 657 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02