#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gzx s HIS 545 N 0.00 3.15 0.04 1.45 3.76 -1.26 -4.92 115.29 117.52 1gzx s HIS 545 Ca 0.00 -1.43 0.03 0.00 -0.15 0.00 0.00 55.06 53.51 1gzx s HIS 545 Cb 0.00 -4.26 -0.04 0.00 1.11 0.00 0.00 32.58 29.39 1gzx s HIS 545 CO 0.00 -1.46 0.01 -0.51 -0.85 0.00 0.00 174.74 171.92 1gzx s LEU 546 N 2.55 3.51 0.65 0.89 1.02 -1.26 -5.11 118.68 120.93 1gzx s LEU 546 Ca 0.32 -0.08 -0.14 0.00 0.02 0.00 0.00 54.13 54.25 1gzx s LEU 546 Cb -0.05 -2.13 -0.01 0.00 0.02 0.00 0.00 46.19 44.03 1gzx s LEU 546 CO -0.09 0.23 1.08 -0.89 0.02 0.00 0.00 176.35 176.69 1gzx s THR 547 N -1.20 3.59 -1.08 5.49 2.01 -1.26 -4.85 115.64 118.33 1gzx s THR 547 Ca 0.23 0.69 0.29 0.00 0.31 0.00 0.00 61.69 63.21 1gzx s THR 547 Cb -0.12 -3.24 0.27 0.00 0.01 0.00 0.00 72.50 69.42 1gzx s THR 547 CO 0.14 -0.50 1.90 -2.65 -0.69 0.00 0.00 174.62 172.83 1gzx n PRO 548 N -2.45 0.08 0.07 4.92 -0.02 -1.26 0.19 135.00 136.54 1gzx n PRO 548 Ca 0.09 -0.01 0.03 0.00 -2.02 0.00 0.00 63.50 61.59 1gzx n PRO 548 Cb 0.53 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.46 1gzx n PRO 548 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1gzx h GLU 549 N 0.02 0.00 0.10 -0.52 4.39 -1.98 -0.21 114.58 116.38 1gzx h GLU 549 Ca 0.00 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.37 1gzx h GLU 549 Cb 0.46 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1gzx h GLU 549 CO 0.00 0.28 -1.81 0.93 -1.16 0.00 0.00 179.01 177.25 1gzx h GLU 550 N 0.00 0.22 -0.16 2.33 5.08 -1.69 -2.61 114.58 117.74 1gzx h GLU 550 Ca -0.10 -0.37 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 1gzx h GLU 550 Cb 1.43 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 1gzx h GLU 550 CO 0.04 1.04 -0.32 0.87 -1.00 0.00 0.00 179.01 179.64 1gzx h LYS 551 N 0.06 0.33 0.02 2.33 1.57 0.21 -2.66 116.57 118.42 1gzx h LYS 551 Ca -0.35 -0.13 -0.21 0.00 -1.87 0.00 0.00 60.65 58.09 1gzx h LYS 551 Cb 2.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 34.32 1gzx h LYS 551 CO 0.11 0.62 -0.94 0.66 -0.57 0.00 0.00 179.45 179.34 1gzx h SER 552 N 0.29 0.23 0.27 0.86 4.64 -1.06 -2.95 113.55 115.83 1gzx h SER 552 Ca 0.04 -0.20 -0.15 0.00 -0.47 0.00 0.00 61.79 61.00 1gzx h SER 552 Cb 0.72 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1gzx h SER 552 CO 0.05 1.04 -0.59 0.00 -0.87 0.00 0.00 176.83 176.47 1gzx h ALA 553 N 0.94 0.81 0.34 5.18 0.00 -1.26 -1.88 119.26 123.38 1gzx h ALA 553 Ca -0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 1gzx h ALA 553 Cb 1.60 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1gzx h ALA 553 CO 0.14 0.72 -0.16 0.28 0.00 0.00 0.00 179.25 180.22 1gzx h VAL 554 N 0.24 0.67 0.06 0.00 2.07 -1.52 -2.98 116.25 114.78 1gzx h VAL 554 Ca -0.00 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 67.08 1gzx h VAL 554 Cb 1.11 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 1gzx h VAL 554 CO 0.10 0.09 -0.24 0.74 0.02 0.00 0.00 177.57 178.27 1gzx h THR 555 N -0.72 0.45 -0.03 2.57 2.02 -1.57 0.42 112.91 116.05 1gzx h THR 555 Ca -0.05 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.16 1gzx h THR 555 Cb 0.49 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1gzx h THR 555 CO 0.08 0.00 -0.15 0.00 0.37 0.00 0.00 175.52 175.82 1gzx h ALA 556 N 0.38 -0.14 -0.12 6.16 0.00 -1.45 -2.54 119.26 121.55 1gzx h ALA 556 Ca 0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gzx h ALA 556 Cb 0.47 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1gzx h ALA 556 CO -0.18 -0.63 0.07 1.25 0.00 0.00 0.00 179.25 179.77 1gzx h LEU 557 N -0.23 0.15 -2.27 0.00 7.12 -1.39 -2.52 115.31 116.18 1gzx h LEU 557 Ca 0.06 -0.05 0.01 0.00 0.13 0.00 0.00 57.88 58.04 1gzx h LEU 557 Cb 0.31 -0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.40 1gzx h LEU 557 CO -0.17 0.15 0.04 -0.25 -0.13 0.00 0.00 178.44 178.08 1gzx h TRP 558 N 0.13 0.00 0.00 1.25 2.91 -0.73 -2.48 115.95 117.03 1gzx h TRP 558 Ca 0.04 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1gzx h TRP 558 Cb 0.03 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 1gzx h TRP 558 CO -0.05 0.00 0.00 0.41 -1.03 0.00 0.00 178.44 177.77 1gzx n GLY 559 N -1.42 -1.24 0.21 2.65 0.00 -0.95 -3.19 105.19 101.25 1gzx n GLY 559 Ca -0.02 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 45.99 1gzx n GLY 559 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gzx n LYS 560 N -1.40 1.35 -2.51 1.61 5.02 -0.94 -5.01 118.16 116.28 1gzx n LYS 560 Ca 0.09 -0.44 -0.43 0.00 -2.02 0.00 0.00 58.31 55.51 1gzx n LYS 560 Cb 0.25 -1.34 -0.02 0.00 -0.02 0.00 0.00 35.03 33.89 1gzx n LYS 560 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1gzx s VAL 561 N -2.39 4.39 -0.79 -0.18 1.01 -1.19 -5.02 120.40 116.22 1gzx s VAL 561 Ca 0.11 1.70 -0.23 0.00 0.00 0.00 0.00 61.98 63.56 1gzx s VAL 561 Cb 0.14 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.50 1gzx s VAL 561 CO 0.60 -0.04 1.16 0.21 0.00 0.00 0.00 175.10 177.03 1gzx s ASN 562 N 1.47 6.31 0.44 3.32 3.84 -1.26 -4.92 114.94 124.14 1gzx s ASN 562 Ca 0.53 -1.13 0.13 0.00 0.21 0.00 0.00 52.86 52.60 1gzx s ASN 562 Cb -0.22 -2.48 0.97 0.00 -0.55 0.00 0.00 41.25 38.97 1gzx s ASN 562 CO 0.19 -1.48 1.99 1.62 -2.79 0.00 0.00 177.10 176.63 1gzx h VAL 563 N 6.11 1.13 0.71 -5.21 3.04 -1.97 0.28 116.25 120.34 1gzx h VAL 563 Ca -0.12 -0.57 -0.03 0.00 -1.01 0.00 0.00 66.70 64.96 1gzx h VAL 563 Cb 1.05 1.24 0.01 0.00 -2.01 0.00 0.00 31.29 31.57 1gzx h VAL 563 CO 1.24 0.17 -0.34 0.44 -1.01 0.00 0.00 177.57 178.07 1gzx h ASP 564 N 0.08 -0.81 0.20 3.17 5.19 -1.93 -0.10 116.42 122.21 1gzx h ASP 564 Ca 0.02 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.42 1gzx h ASP 564 Cb 0.28 0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.00 1gzx h ASP 564 CO 0.02 -0.51 -0.09 -0.33 -3.12 0.00 0.00 179.24 175.20 1gzx h GLU 565 N -1.06 -0.25 -0.47 3.56 5.08 -1.96 -2.88 114.58 116.60 1gzx h GLU 565 Ca -0.10 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 1gzx h GLU 565 Cb 0.75 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 1gzx h GLU 565 CO 0.16 0.01 -0.01 0.28 -1.00 0.00 0.00 179.01 178.46 1gzx h VAL 566 N -0.51 1.24 -0.04 3.13 2.07 -0.95 -2.00 116.25 119.20 1gzx h VAL 566 Ca -0.03 -1.00 -0.16 0.00 0.82 0.00 0.00 66.70 66.33 1gzx h VAL 566 Cb 0.39 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1gzx h VAL 566 CO 0.04 0.35 -0.69 1.23 0.02 0.00 0.00 177.57 178.52 1gzx h GLY 567 N 0.97 0.20 0.77 2.17 0.00 -1.10 -0.54 103.07 105.53 1gzx h GLY 567 Ca 0.14 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 47.09 1gzx h GLY 567 CO 0.02 0.25 -0.32 -1.33 0.00 0.00 0.00 176.54 175.16 1gzx h GLY 568 N 1.69 0.46 0.99 4.60 0.00 -1.26 -2.63 103.07 106.92 1gzx h GLY 568 Ca -0.02 -0.58 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 1gzx h GLY 568 CO 0.10 0.52 0.29 0.83 0.00 0.00 0.00 176.54 178.28 1gzx h GLU 569 N -0.00 0.62 -0.16 4.80 4.39 -1.34 0.29 114.58 123.18 1gzx h GLU 569 Ca -0.01 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1gzx h GLU 569 Cb 0.93 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1gzx h GLU 569 CO 0.07 0.44 -0.00 0.00 -1.16 0.00 0.00 179.01 178.36 1gzx h ALA 570 N 1.14 0.22 0.16 3.43 0.00 -1.13 -1.66 119.26 121.42 1gzx h ALA 570 Ca 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1gzx h ALA 570 Cb -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1gzx h ALA 570 CO -0.03 -0.07 -0.08 1.25 0.00 0.00 0.00 179.25 180.32 1gzx h LEU 571 N 0.03 -0.18 -0.31 0.00 5.85 -1.51 -2.34 115.31 116.86 1gzx h LEU 571 Ca 0.05 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1gzx h LEU 571 Cb 0.38 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 1gzx h LEU 571 CO 0.01 0.10 -0.40 1.23 -0.34 0.00 0.00 178.44 179.04 1gzx h GLY 572 N -0.46 -1.28 2.00 3.75 0.00 -0.41 -1.59 103.07 105.08 1gzx h GLY 572 Ca -0.02 0.76 0.00 0.00 0.00 0.00 0.00 47.33 48.07 1gzx h GLY 572 CO 0.04 -0.30 0.00 3.21 0.00 0.00 0.00 176.54 179.49 1gzx h ARG 573 N -0.28 0.00 -0.07 4.80 3.08 -1.29 -2.61 114.38 118.01 1gzx h ARG 573 Ca 0.05 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1gzx h ARG 573 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1gzx h ARG 573 CO -0.43 0.00 -0.03 1.25 -1.07 0.00 0.00 179.97 179.69 1gzx h LEU 574 N 0.00 0.15 -1.36 3.04 5.85 -0.71 0.70 115.31 122.98 1gzx h LEU 574 Ca 0.00 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.26 1gzx h LEU 574 Cb 0.22 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1gzx h LEU 574 CO 0.00 0.52 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.39 1gzx h LEU 575 N -0.22 0.23 0.06 2.25 4.07 -1.37 -2.29 115.31 118.04 1gzx h LEU 575 Ca 0.02 -0.05 -0.14 0.00 0.08 0.00 0.00 57.88 57.79 1gzx h LEU 575 Cb 0.46 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1gzx h LEU 575 CO 0.01 0.41 -0.67 0.58 -1.08 0.00 0.00 178.44 177.69 1gzx h VAL 576 N 0.23 1.45 -0.09 1.22 2.07 -1.44 -3.25 116.25 116.44 1gzx h VAL 576 Ca 0.04 -2.39 -0.22 0.00 0.82 0.00 0.00 66.70 64.95 1gzx h VAL 576 Cb 0.41 3.05 0.01 0.00 -1.52 0.00 0.00 31.29 33.24 1gzx h VAL 576 CO 0.03 0.61 -0.84 0.58 0.02 0.00 0.00 177.57 177.97 1gzx h VAL 577 N -0.70 1.31 -2.16 2.57 2.07 -0.85 -3.37 116.25 115.12 1gzx h VAL 577 Ca -0.15 -2.12 -0.59 0.00 0.82 0.00 0.00 66.70 64.67 1gzx h VAL 577 Cb 1.36 2.13 -0.42 0.00 -1.52 0.00 0.00 31.29 32.85 1gzx h VAL 577 CO 0.02 0.66 -0.68 -1.22 0.02 0.00 0.00 177.57 176.37 1gzx n TYR 578 N -3.88 3.01 0.12 1.57 4.01 -0.87 -4.97 117.16 116.16 1gzx n TYR 578 Ca -0.07 -4.05 0.20 0.00 -0.16 0.00 0.00 57.90 53.81 1gzx n TYR 578 Cb 0.78 -0.52 0.73 0.00 -0.31 0.00 0.00 39.34 40.02 1gzx n TYR 578 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1gzx h PRO 579 N 4.06 0.00 0.00 -0.72 0.13 -1.72 0.33 132.00 134.08 1gzx h PRO 579 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1gzx h PRO 579 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1gzx h PRO 579 CO 0.77 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.87 1gzx n TRP 580 N -3.54 0.00 1.16 1.56 2.14 -1.26 -2.19 117.44 115.31 1gzx n TRP 580 Ca 0.06 0.00 0.14 0.00 2.07 0.00 0.00 57.50 59.78 1gzx n TRP 580 Cb 0.63 -0.04 0.67 0.00 -0.81 0.00 0.00 31.31 31.76 1gzx n TRP 580 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 1gzx n THR 581 N -1.04 0.02 0.30 -1.67 -2.24 0.10 -3.08 114.28 106.68 1gzx n THR 581 Ca 0.18 0.01 0.16 0.00 -2.27 0.00 0.00 64.05 62.13 1gzx n THR 581 Cb 0.10 -0.51 0.63 0.00 -2.10 0.00 0.00 70.33 68.45 1gzx n THR 581 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1gzx h GLN 582 N 0.00 0.00 0.00 -0.78 4.20 -1.63 -3.12 115.11 113.78 1gzx h GLN 582 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1gzx h GLN 582 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1gzx h GLN 582 CO 0.00 0.00 0.02 0.07 -0.67 0.00 0.00 178.83 178.25 1gzx h ARG 583 N 0.00 0.00 0.00 1.46 0.11 -1.78 -2.32 114.38 111.86 1gzx h ARG 583 Ca 0.00 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.95 1gzx h ARG 583 Cb 0.51 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.57 1gzx h ARG 583 CO 0.00 0.00 -1.08 0.74 0.10 0.00 0.00 179.97 179.73 1gzx h PHE 584 N 0.00 0.00 -0.17 4.08 -1.00 -1.84 -3.36 116.94 114.66 1gzx h PHE 584 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1gzx h PHE 584 Cb 0.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.61 1gzx h PHE 584 CO 0.00 0.51 0.00 1.19 -1.61 0.00 0.00 178.31 178.40 1gzx n PHE 585 N -2.98 0.48 -0.33 -0.55 3.01 -0.90 -4.73 117.46 111.46 1gzx n PHE 585 Ca -0.05 -0.81 0.14 0.00 1.01 0.00 0.00 57.45 57.74 1gzx n PHE 585 Cb 0.78 -0.19 0.28 0.00 -0.01 0.00 0.00 39.48 40.34 1gzx n PHE 585 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1gzx h GLU 586 N 1.10 0.03 0.00 -1.08 5.08 -1.66 0.18 114.58 118.23 1gzx h GLU 586 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1gzx h GLU 586 Cb 1.10 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1gzx h GLU 586 CO 0.10 0.02 0.00 -1.13 -1.00 0.00 0.00 179.01 177.00 1gzx n SER 587 N -5.46 0.00 0.17 1.42 3.41 -1.26 -3.12 113.62 108.78 1gzx n SER 587 Ca 0.23 0.03 0.07 0.00 -0.26 0.00 0.00 58.87 58.94 1gzx n SER 587 Cb 0.74 -0.20 0.09 0.00 -0.26 0.00 0.00 64.21 64.58 1gzx n SER 587 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1gzx h PHE 588 N 0.00 0.00 0.00 7.33 0.05 -1.02 -3.49 116.94 119.81 1gzx h PHE 588 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1gzx h PHE 588 Cb 0.06 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.01 1gzx h PHE 588 CO 0.00 0.24 0.00 0.41 -0.18 0.00 0.00 178.31 178.78 1gzx n GLY 589 N 1.17 0.83 3.53 -1.45 0.00 -1.18 -4.84 105.19 103.24 1gzx n GLY 589 Ca 0.03 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 1gzx n GLY 589 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gzx s ASP 590 N -4.00 6.36 -0.10 1.61 3.68 -1.26 -4.76 116.67 118.20 1gzx s ASP 590 Ca 0.00 -0.22 0.15 0.00 2.13 0.00 0.00 52.55 54.61 1gzx s ASP 590 Cb 0.00 -2.34 0.23 0.00 -1.45 0.00 0.00 42.92 39.36 1gzx s ASP 590 CO 0.00 -0.81 1.12 0.18 0.13 0.00 0.00 175.17 175.79 1gzx n LEU 591 N 6.40 1.90 0.00 -1.34 4.77 -1.26 -4.27 117.00 123.20 1gzx n LEU 591 Ca -0.00 -2.68 0.06 0.00 -0.03 0.00 0.00 56.01 53.36 1gzx n LEU 591 Cb 0.48 -0.34 0.34 0.00 -2.33 0.00 0.00 43.42 41.56 1gzx n LEU 591 CO 0.55 0.62 0.58 -1.54 -1.33 0.00 0.00 177.39 176.27 1gzx n SER 592 N -1.16 0.00 -3.53 -1.43 3.41 -1.26 -4.67 113.62 104.98 1gzx n SER 592 Ca 0.13 -0.26 -0.09 0.00 -0.26 0.00 0.00 58.87 58.39 1gzx n SER 592 Cb 0.65 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.51 1gzx n SER 592 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1gzx s THR 593 N -2.13 0.00 0.20 6.66 -4.23 -1.26 -4.95 115.64 109.93 1gzx s THR 593 Ca 0.16 -0.15 -0.14 0.00 -1.18 0.00 0.00 61.69 60.38 1gzx s THR 593 Cb 0.08 -1.20 0.20 0.00 1.34 0.00 0.00 72.50 72.92 1gzx s THR 593 CO 0.14 0.00 1.64 -0.65 -0.54 0.00 0.00 174.62 175.21 1gzx h PRO 594 N 2.00 0.01 -0.36 3.99 0.11 -1.97 0.85 132.00 136.62 1gzx h PRO 594 Ca -0.26 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 1gzx h PRO 594 Cb 1.26 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1gzx h PRO 594 CO 0.32 0.01 0.07 -0.44 -0.21 0.00 0.00 178.00 177.75 1gzx h ASP 595 N 0.01 0.57 -0.14 -2.05 5.19 -1.97 2.69 116.42 120.73 1gzx h ASP 595 Ca 0.28 -0.25 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1gzx h ASP 595 Cb 0.42 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 1gzx h ASP 595 CO -0.58 0.67 0.09 0.00 -3.12 0.00 0.00 179.24 176.30 1gzx h ALA 596 N 0.92 0.17 0.76 3.45 0.00 -1.43 -2.05 119.26 121.07 1gzx h ALA 596 Ca 0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1gzx h ALA 596 Cb 0.33 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1gzx h ALA 596 CO 0.00 -0.33 -0.36 0.28 0.00 0.00 0.00 179.25 178.84 1gzx h VAL 597 N 0.17 0.15 -0.87 0.00 2.07 0.11 -2.76 116.25 115.12 1gzx h VAL 597 Ca 0.05 -0.17 0.22 0.00 0.82 0.00 0.00 66.70 67.62 1gzx h VAL 597 Cb -0.00 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 29.89 1gzx h VAL 597 CO -0.01 0.01 0.59 0.24 0.02 0.00 0.00 177.57 178.43 1gzx h MET 598 N -1.16 0.25 0.02 1.57 2.07 0.47 -2.75 114.93 115.40 1gzx h MET 598 Ca -0.10 -0.01 -0.22 0.00 -2.07 0.00 0.00 59.70 57.30 1gzx h MET 598 Cb 0.80 -0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 30.46 1gzx h MET 598 CO 0.17 0.16 -0.95 0.78 1.07 0.00 0.00 176.91 178.14 1gzx h GLY 599 N 0.25 0.26 -6.02 8.32 0.00 -1.33 -3.46 103.07 101.09 1gzx h GLY 599 Ca 0.44 -0.50 -0.66 0.00 0.00 0.00 0.00 47.33 46.61 1gzx h GLY 599 CO -0.11 0.44 1.05 -2.01 0.00 0.00 0.00 176.54 175.90 1gzx n ASN 600 N -3.64 3.03 0.00 0.19 2.85 -1.04 -4.81 115.26 111.84 1gzx n ASN 600 Ca -0.05 0.99 0.13 0.00 -0.11 0.00 0.00 54.58 55.54 1gzx n ASN 600 Cb 0.85 -1.28 0.61 0.00 1.24 0.00 0.00 39.78 41.20 1gzx n ASN 600 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1gzx n PRO 601 N 6.28 0.23 0.07 1.20 -0.04 -1.26 -1.02 135.00 140.47 1gzx n PRO 601 Ca 0.25 0.05 -0.21 0.00 -0.04 0.00 0.00 63.50 63.54 1gzx n PRO 601 Cb 0.23 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.05 1gzx n PRO 601 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1gzx h LYS 602 N 0.00 0.43 -0.23 0.54 1.79 -1.88 -0.50 116.57 116.72 1gzx h LYS 602 Ca 0.00 -0.66 0.03 0.00 -2.18 0.00 0.00 60.65 57.84 1gzx h LYS 602 Cb 0.32 0.23 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 1gzx h LYS 602 CO 0.00 1.30 0.04 0.28 -1.08 0.00 0.00 179.45 179.99 1gzx h VAL 603 N -0.10 0.89 -0.09 0.50 2.07 -1.72 0.26 116.25 118.07 1gzx h VAL 603 Ca -0.17 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1gzx h VAL 603 Cb 1.77 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1gzx h VAL 603 CO 0.19 0.02 0.05 0.50 0.02 0.00 0.00 177.57 178.35 1gzx h LYS 604 N 0.13 0.12 -0.15 1.57 3.64 -1.12 0.93 116.57 121.69 1gzx h LYS 604 Ca 0.10 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 1gzx h LYS 604 Cb 0.10 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1gzx h LYS 604 CO -0.14 0.17 -0.20 0.00 -2.27 0.00 0.00 179.45 177.01 1gzx h ALA 605 N 0.95 1.39 0.02 5.00 0.00 -0.85 -2.81 119.26 122.96 1gzx h ALA 605 Ca 0.03 -0.26 -0.21 0.00 0.00 0.00 0.00 54.91 54.47 1gzx h ALA 605 Cb 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1gzx h ALA 605 CO -0.00 0.42 -0.99 1.25 0.00 0.00 0.00 179.25 179.93 1gzx h HIS 606 N 0.23 0.15 -0.52 0.00 -0.00 -0.00 -2.99 115.15 112.02 1gzx h HIS 606 Ca 0.04 -0.10 -0.08 0.00 -0.00 0.00 0.00 60.37 60.23 1gzx h HIS 606 Cb 0.49 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.87 1gzx h HIS 606 CO 0.01 1.01 0.01 0.78 -0.00 0.00 0.00 177.93 179.74 1gzx h GLY 607 N 2.42 0.98 2.00 5.26 0.00 0.11 -2.36 103.07 111.49 1gzx h GLY 607 Ca -0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 47.33 46.53 1gzx h GLY 607 CO 0.14 0.66 -0.21 1.70 0.00 0.00 0.00 176.54 178.83 1gzx h LYS 608 N 0.78 0.00 -0.19 4.80 3.64 -1.55 -1.20 116.57 122.85 1gzx h LYS 608 Ca 0.15 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 1gzx h LYS 608 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1gzx h LYS 608 CO 0.03 0.21 -0.08 -0.22 -2.27 0.00 0.00 179.45 177.12 1gzx h LYS 609 N 0.00 0.39 0.06 1.90 3.64 -1.36 -1.46 116.57 119.74 1gzx h LYS 609 Ca -0.00 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1gzx h LYS 609 Cb 0.42 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1gzx h LYS 609 CO 0.03 0.68 -0.03 0.28 -2.27 0.00 0.00 179.45 178.14 1gzx h VAL 610 N 0.09 1.10 -0.30 2.00 2.07 -1.18 -3.00 116.25 117.04 1gzx h VAL 610 Ca 0.04 -0.54 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1gzx h VAL 610 Cb 0.55 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1gzx h VAL 610 CO 0.03 0.14 0.14 0.25 0.02 0.00 0.00 177.57 178.14 1gzx h LEU 611 N -0.32 0.37 -0.92 2.57 7.12 -1.23 -1.47 115.31 121.42 1gzx h LEU 611 Ca -0.01 -0.03 -0.07 0.00 0.13 0.00 0.00 57.88 57.91 1gzx h LEU 611 Cb 0.28 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.31 1gzx h LEU 611 CO 0.01 0.32 -0.34 1.23 -0.13 0.00 0.00 178.44 179.54 1gzx h GLY 612 N 0.53 0.00 1.57 3.75 0.00 -1.17 -1.65 103.07 106.09 1gzx h GLY 612 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.25 1gzx h GLY 612 CO -0.01 0.00 -0.76 0.00 0.00 0.00 0.00 176.54 175.77 1gzx h ALA 613 N 1.66 0.55 0.01 3.60 0.00 -1.16 -2.79 119.26 121.13 1gzx h ALA 613 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1gzx h ALA 613 Cb 0.89 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1gzx h ALA 613 CO 0.04 0.77 -0.01 0.35 0.00 0.00 0.00 179.25 180.40 1gzx h PHE 614 N 0.28 -0.03 -0.27 0.00 3.57 -1.13 -2.48 116.94 116.88 1gzx h PHE 614 Ca -0.04 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.52 1gzx h PHE 614 Cb 1.34 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 40.02 1gzx h PHE 614 CO 0.05 -0.02 -0.36 0.77 -2.23 0.00 0.00 178.31 176.51 1gzx h SER 615 N -0.02 -1.18 -0.70 0.41 0.02 -1.29 -1.90 113.55 108.89 1gzx h SER 615 Ca 0.00 0.18 0.14 0.00 -0.84 0.00 0.00 61.79 61.28 1gzx h SER 615 Cb 0.03 0.51 -0.13 0.00 0.14 0.00 0.00 62.40 62.95 1gzx h SER 615 CO -0.01 -0.36 -0.14 -0.78 -1.14 0.00 0.00 176.83 174.40 1gzx h ASP 616 N -0.36 -0.58 1.04 3.07 3.58 -1.38 0.98 116.42 122.78 1gzx h ASP 616 Ca 0.12 0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.77 1gzx h ASP 616 Cb 0.57 0.41 -0.00 0.00 1.72 0.00 0.00 39.33 42.03 1gzx h ASP 616 CO -0.47 -0.22 -0.02 1.23 -2.88 0.00 0.00 179.24 176.89 1gzx h GLY 617 N 0.02 0.00 2.00 -0.78 0.00 -0.89 -2.63 103.07 100.79 1gzx h GLY 617 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1gzx h GLY 617 CO -0.70 0.00 0.00 1.04 0.00 0.00 0.00 176.54 176.88 1gzx n LEU 618 N -3.12 0.77 0.03 3.11 4.32 0.29 -2.38 117.00 120.02 1gzx n LEU 618 Ca 0.01 0.61 0.10 0.00 -0.02 0.00 0.00 56.01 56.70 1gzx n LEU 618 Cb 0.32 -0.40 -0.11 0.00 -1.62 0.00 0.00 43.42 41.61 1gzx n LEU 618 CO 0.28 -0.31 -0.48 0.00 -1.22 0.00 0.00 177.39 175.66 1gzx n ALA 619 N -1.78 2.59 -1.95 -1.18 0.00 -0.88 -4.42 120.51 112.88 1gzx n ALA 619 Ca 0.04 -0.46 -0.24 0.00 0.00 0.00 0.00 53.44 52.78 1gzx n ALA 619 Cb 0.36 -0.86 0.03 0.00 0.00 0.00 0.00 19.45 18.98 1gzx n ALA 619 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1gzx n HIS 620 N -2.47 2.73 0.26 0.00 8.25 -1.04 -4.95 115.22 118.01 1gzx n HIS 620 Ca -0.04 -2.27 0.14 0.00 -0.26 0.00 0.00 57.72 55.29 1gzx n HIS 620 Cb 0.61 -0.43 0.76 0.00 1.12 0.00 0.00 29.99 32.04 1gzx n HIS 620 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1gzx h LEU 621 N 2.14 0.00 -0.53 2.41 3.38 -1.68 -1.01 115.31 120.01 1gzx h LEU 621 Ca 0.38 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.19 1gzx h LEU 621 Cb 1.47 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.20 1gzx h LEU 621 CO 0.81 0.00 -0.72 -2.24 0.09 0.00 0.00 178.44 176.39 1gzx h ASP 622 N 0.00 0.16 -0.83 -0.43 3.04 -1.91 -3.33 116.42 113.11 1gzx h ASP 622 Ca 0.00 -0.11 -0.34 0.00 -3.24 0.00 0.00 57.03 53.35 1gzx h ASP 622 Cb 0.33 -0.05 -0.26 0.00 -1.04 0.00 0.00 39.33 38.32 1gzx h ASP 622 CO 0.00 0.82 -0.76 -3.20 -2.04 0.00 0.00 179.24 174.06 1gzx n ASN 623 N -3.75 -0.96 -0.31 4.15 4.05 -0.39 -4.94 115.26 113.11 1gzx n ASN 623 Ca -0.02 -3.36 -0.01 0.00 0.45 0.00 0.00 54.58 51.63 1gzx n ASN 623 Cb 0.70 0.82 0.16 0.00 1.23 0.00 0.00 39.78 42.69 1gzx n ASN 623 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1gzx h LEU 624 N 2.97 1.04 -0.84 1.20 3.38 -1.74 -0.24 115.31 121.08 1gzx h LEU 624 Ca -0.03 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1gzx h LEU 624 Cb 1.06 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1gzx h LEU 624 CO 0.28 0.76 0.25 0.11 0.09 0.00 0.00 178.44 179.94 1gzx h LYS 625 N 1.22 1.12 -0.33 1.13 1.57 -1.90 -0.39 116.57 118.98 1gzx h LYS 625 Ca 0.33 -0.22 -0.17 0.00 -1.87 0.00 0.00 60.65 58.72 1gzx h LYS 625 Cb -0.12 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.01 1gzx h LYS 625 CO -0.07 0.93 -0.47 0.78 -0.57 0.00 0.00 179.45 180.05 1gzx h GLY 626 N 1.11 0.98 1.95 3.86 0.00 -1.87 -1.92 103.07 107.19 1gzx h GLY 626 Ca 0.24 -1.07 -0.03 0.00 0.00 0.00 0.00 47.33 46.47 1gzx h GLY 626 CO -0.01 0.96 -0.10 -0.84 0.00 0.00 0.00 176.54 176.55 1gzx h THR 627 N 0.71 1.10 -0.34 4.70 2.02 -0.04 -3.25 112.91 117.82 1gzx h THR 627 Ca 0.04 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1gzx h THR 627 Cb 1.07 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 1gzx h THR 627 CO 0.11 0.13 0.00 0.49 0.37 0.00 0.00 175.52 176.62 1gzx n PHE 628 N -4.39 0.57 -0.23 3.16 3.01 -0.25 -4.72 117.46 114.60 1gzx n PHE 628 Ca -0.02 -0.57 0.01 0.00 1.01 0.00 0.00 57.45 57.88 1gzx n PHE 628 Cb 0.19 -0.08 0.13 0.00 -0.01 0.00 0.00 39.48 39.71 1gzx n PHE 628 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gzx h ALA 629 N 2.02 0.92 -0.11 4.37 0.00 -1.38 -0.90 119.26 124.18 1gzx h ALA 629 Ca 0.00 0.06 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 1gzx h ALA 629 Cb 0.87 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.66 1gzx h ALA 629 CO 0.04 -0.09 -0.77 0.00 0.00 0.00 0.00 179.25 178.43 1gzx h THR 630 N 0.54 1.30 -0.05 0.00 1.03 -1.85 0.08 112.91 113.96 1gzx h THR 630 Ca 0.34 -2.00 -0.02 0.00 -0.01 0.00 0.00 66.41 64.72 1gzx h THR 630 Cb 0.38 2.11 -0.01 0.00 -1.07 0.00 0.00 68.15 69.56 1gzx h THR 630 CO -0.28 0.62 -0.08 -0.07 -0.01 0.00 0.00 175.52 175.71 1gzx h LEU 631 N 0.42 0.06 -0.05 0.00 3.38 -1.80 -0.22 115.31 117.10 1gzx h LEU 631 Ca -0.06 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1gzx h LEU 631 Cb 1.41 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1gzx h LEU 631 CO 0.16 0.15 -0.18 -1.28 0.09 0.00 0.00 178.44 177.38 1gzx h SER 632 N 0.06 0.24 -0.23 -0.43 0.87 -0.97 -2.86 113.55 110.25 1gzx h SER 632 Ca 0.01 -0.63 -0.11 0.00 -1.23 0.00 0.00 61.79 59.84 1gzx h SER 632 Cb 0.18 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1gzx h SER 632 CO 0.01 0.83 -0.22 -0.33 -0.53 0.00 0.00 176.83 176.59 1gzx h GLU 633 N -0.34 0.69 -0.45 2.24 5.08 -0.56 -1.97 114.58 119.28 1gzx h GLU 633 Ca -0.01 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 1gzx h GLU 633 Cb 0.82 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1gzx h GLU 633 CO 0.04 0.85 0.07 1.25 -1.00 0.00 0.00 179.01 180.22 1gzx h LEU 634 N 0.60 0.72 -0.93 1.33 5.85 -1.06 0.09 115.31 121.91 1gzx h LEU 634 Ca 0.09 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.46 1gzx h LEU 634 Cb 0.70 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1gzx h LEU 634 CO 0.05 0.80 -0.15 0.45 -0.34 0.00 0.00 178.44 179.25 1gzx h HIS 635 N 0.61 0.67 0.00 1.25 3.86 -1.44 0.30 115.15 120.40 1gzx h HIS 635 Ca 0.14 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1gzx h HIS 635 Cb 0.39 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.69 1gzx h HIS 635 CO 0.03 0.73 0.00 0.00 0.86 0.00 0.00 177.93 179.55 1gzx h ASP 637 N 0.00 0.09 0.00 0.00 3.45 -1.08 -2.58 116.42 116.30 1gzx h ASP 637 Ca 0.00 -0.02 -0.05 0.00 0.43 0.00 0.00 57.03 57.39 1gzx h ASP 637 Cb 0.00 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 1gzx h ASP 637 CO 0.00 0.36 -1.00 1.17 -1.57 0.00 0.00 179.24 178.20 1gzx n LYS 638 N -4.18 0.51 0.00 3.56 3.00 -0.47 -4.72 118.16 115.85 1gzx n LYS 638 Ca -0.02 0.32 0.12 0.00 -0.00 0.00 0.00 58.31 58.74 1gzx n LYS 638 Cb 0.34 -1.52 0.29 0.00 0.00 0.00 0.00 35.03 34.14 1gzx n LYS 638 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1gzx n LEU 639 N -4.49 0.82 -4.01 3.14 4.77 -0.03 -5.01 117.00 112.19 1gzx n LEU 639 Ca -0.16 -0.17 -0.31 0.00 -0.03 0.00 0.00 56.01 55.34 1gzx n LEU 639 Cb 0.48 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1gzx n LEU 639 CO 0.16 0.17 -0.25 1.41 -1.33 0.00 0.00 177.39 177.55 1gzx n HIS 640 N -1.05 -1.56 -3.57 -1.77 8.25 -0.57 -4.97 115.22 109.98 1gzx n HIS 640 Ca 0.09 0.56 -0.37 0.00 -0.26 0.00 0.00 57.72 57.74 1gzx n HIS 640 Cb 0.34 -3.33 -0.08 0.00 1.12 0.00 0.00 29.99 28.04 1gzx n HIS 640 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1gzx s VAL 641 N -3.91 5.31 0.03 1.59 1.01 -0.75 -5.02 120.40 118.67 1gzx s VAL 641 Ca 0.16 0.40 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 1gzx s VAL 641 Cb -0.07 -3.58 -0.07 0.00 0.00 0.00 0.00 36.38 32.65 1gzx s VAL 641 CO 0.92 0.34 1.58 -0.62 0.00 0.00 0.00 175.10 177.32 1gzx s ASP 642 N 0.83 6.69 0.03 3.32 3.68 -1.26 -4.73 116.67 125.23 1gzx s ASP 642 Ca 0.12 2.33 0.06 0.00 2.13 0.00 0.00 52.55 57.19 1gzx s ASP 642 Cb -0.13 -2.56 0.26 0.00 -1.45 0.00 0.00 42.92 39.04 1gzx s ASP 642 CO 0.04 -0.84 1.18 -2.65 0.13 0.00 0.00 175.17 173.03 1gzx n PRO 643 N 5.81 0.01 0.17 4.34 -0.02 -1.26 -1.42 135.00 142.64 1gzx n PRO 643 Ca 0.15 0.44 0.02 0.00 -2.02 0.00 0.00 63.50 62.09 1gzx n PRO 643 Cb 0.42 -1.54 0.31 0.00 -0.02 0.00 0.00 33.50 32.67 1gzx n PRO 643 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1gzx h GLU 644 N 0.00 0.00 0.00 -0.52 4.57 -1.97 -0.23 114.58 116.43 1gzx h GLU 644 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1gzx h GLU 644 Cb 0.08 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1gzx h GLU 644 CO 0.00 0.43 -0.07 -0.91 -1.18 0.00 0.00 179.01 177.28 1gzx h ASN 645 N 0.00 0.00 -0.65 1.04 -0.26 -1.62 -2.47 115.58 111.61 1gzx h ASN 645 Ca -0.00 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.70 1gzx h ASN 645 Cb 0.78 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.01 1gzx h ASN 645 CO 0.06 0.07 0.27 -0.26 -1.06 0.00 0.00 177.43 176.50 1gzx h PHE 646 N 0.00 0.99 -0.37 1.19 0.04 -1.20 -1.70 116.94 115.88 1gzx h PHE 646 Ca -0.00 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.68 1gzx h PHE 646 Cb 0.17 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.01 1gzx h PHE 646 CO 0.00 0.77 0.18 -0.09 -0.60 0.00 0.00 178.31 178.57 1gzx h ARG 647 N 0.92 0.53 -0.11 1.51 2.43 -1.43 -1.44 114.38 116.79 1gzx h ARG 647 Ca 0.22 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1gzx h ARG 647 Cb 0.20 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1gzx h ARG 647 CO -0.02 0.48 -0.03 -0.07 -1.51 0.00 0.00 179.97 178.82 1gzx h LEU 648 N 0.46 -0.10 -0.74 3.80 3.38 -1.23 -2.24 115.31 118.63 1gzx h LEU 648 Ca 0.13 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1gzx h LEU 648 Cb 0.12 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1gzx h LEU 648 CO -0.02 -0.04 0.46 0.25 0.09 0.00 0.00 178.44 179.19 1gzx h LEU 649 N 0.00 0.75 -0.65 1.67 5.85 -1.13 -1.70 115.31 120.10 1gzx h LEU 649 Ca 0.05 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1gzx h LEU 649 Cb 0.08 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1gzx h LEU 649 CO -0.11 0.51 0.43 1.23 -0.34 0.00 0.00 178.44 180.16 1gzx h GLY 650 N 0.89 0.92 0.96 3.75 0.00 -1.03 -0.40 103.07 108.17 1gzx h GLY 650 Ca 0.30 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1gzx h GLY 650 CO -0.12 0.34 0.21 3.43 0.00 0.00 0.00 176.54 180.40 1gzx h ASN 651 N 0.88 0.56 -0.95 0.19 2.35 -0.84 -1.47 115.58 116.29 1gzx h ASN 651 Ca 0.24 -0.12 0.09 0.00 -0.55 0.00 0.00 56.30 55.96 1gzx h ASN 651 Cb -0.09 -0.14 -0.07 0.00 0.05 0.00 0.00 38.32 38.06 1gzx h ASN 651 CO -0.05 0.52 0.61 0.58 -1.65 0.00 0.00 177.43 177.45 1gzx h VAL 652 N 0.55 0.99 -0.49 2.81 2.07 -0.89 -2.13 116.25 119.15 1gzx h VAL 652 Ca 0.15 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1gzx h VAL 652 Cb 0.11 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.76 1gzx h VAL 652 CO -0.02 0.18 0.30 0.25 0.02 0.00 0.00 177.57 178.31 1gzx h LEU 653 N 1.00 0.59 -0.70 2.57 5.85 -0.48 -1.17 115.31 122.98 1gzx h LEU 653 Ca 0.44 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 59.08 1gzx h LEU 653 Cb 0.36 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1gzx h LEU 653 CO -0.20 0.47 0.32 0.58 -0.34 0.00 0.00 178.44 179.27 1gzx h VAL 654 N 0.66 1.24 -0.43 1.05 2.07 -0.67 0.11 116.25 120.28 1gzx h VAL 654 Ca 0.18 -0.69 -0.09 0.00 0.82 0.00 0.00 66.70 66.92 1gzx h VAL 654 Cb -0.02 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 1gzx h VAL 654 CO -0.03 0.28 -0.08 0.00 0.02 0.00 0.00 177.57 177.76 1gzx h VAL 656 N 0.68 1.20 -0.53 0.00 2.07 -0.72 -0.76 116.25 118.20 1gzx h VAL 656 Ca 0.12 -0.85 0.06 0.00 0.82 0.00 0.00 66.70 66.85 1gzx h VAL 656 Cb 0.54 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1gzx h VAL 656 CO 0.03 0.21 0.35 -0.07 0.02 0.00 0.00 177.57 178.12 1gzx h LEU 657 N -0.44 0.43 -0.07 2.57 3.38 -0.77 -1.69 115.31 118.73 1gzx h LEU 657 Ca -0.01 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1gzx h LEU 657 Cb 0.40 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1gzx h LEU 657 CO 0.01 0.29 -0.05 0.00 0.09 0.00 0.00 178.44 178.77 1gzx h ALA 658 N 1.71 0.09 -0.61 1.53 0.00 -1.23 -0.09 119.26 120.67 1gzx h ALA 658 Ca 0.23 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.00 1gzx h ALA 658 Cb 0.26 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.93 1gzx h ALA 658 CO -0.06 -0.12 -0.03 1.25 0.00 0.00 0.00 179.25 180.29 1gzx h HIS 659 N -0.27 -0.10 0.34 0.00 6.17 -0.57 0.14 115.15 120.86 1gzx h HIS 659 Ca 0.01 0.05 -0.02 0.00 0.71 0.00 0.00 60.37 61.12 1gzx h HIS 659 Cb 0.54 0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.61 1gzx h HIS 659 CO 0.08 -0.18 -0.17 0.45 0.71 0.00 0.00 177.93 178.82 1gzx h HIS 660 N 0.09 -0.43 -0.01 5.26 -0.00 -1.36 -3.37 115.15 115.33 1gzx h HIS 660 Ca 0.31 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.67 1gzx h HIS 660 Cb 0.50 0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.05 1gzx h HIS 660 CO -0.39 -0.13 -0.07 1.19 -0.00 0.00 0.00 177.93 178.53 1gzx n PHE 661 N -5.09 0.00 0.00 2.45 3.01 -0.05 -4.99 117.46 112.79 1gzx n PHE 661 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1gzx n PHE 661 Cb 0.25 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 1gzx n PHE 661 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gzx n GLY 662 N 1.20 2.20 0.29 1.37 0.00 0.47 0.37 105.19 111.09 1gzx n GLY 662 Ca 0.18 -0.03 0.26 0.00 0.00 0.00 0.00 46.02 46.42 1gzx n GLY 662 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1gzx n LYS 663 N 13.32 -0.03 0.23 1.61 4.81 -1.26 -0.38 118.16 136.45 1gzx n LYS 663 Ca 0.00 0.86 0.14 0.00 -0.87 0.00 0.00 58.31 58.45 1gzx n LYS 663 Cb 0.00 -1.66 0.44 0.00 0.02 0.00 0.00 35.03 33.83 1gzx n LYS 663 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1gzx h GLU 664 N 0.00 0.00 -4.56 1.64 5.08 -0.48 -3.36 114.58 112.90 1gzx h GLU 664 Ca 0.59 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 58.21 1gzx h GLU 664 Cb 1.81 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.89 1gzx h GLU 664 CO -0.36 0.00 1.52 0.34 -1.00 0.00 0.00 179.01 179.51 1gzx n PHE 665 N -2.96 4.59 -1.63 4.33 7.35 0.48 -4.93 117.46 124.70 1gzx n PHE 665 Ca 0.03 -3.24 -0.30 0.00 -0.76 0.00 0.00 57.45 53.17 1gzx n PHE 665 Cb 0.40 -2.16 0.07 0.00 0.35 0.00 0.00 39.48 38.13 1gzx n PHE 665 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1gzx s THR 666 N 1.45 3.52 0.24 -2.13 -4.23 -1.26 -4.72 115.64 108.51 1gzx s THR 666 Ca 0.43 0.49 -0.04 0.00 -1.18 0.00 0.00 61.69 61.39 1gzx s THR 666 Cb -0.00 -3.29 0.21 0.00 1.34 0.00 0.00 72.50 70.76 1gzx s THR 666 CO 0.01 -0.64 1.82 -0.65 -0.54 0.00 0.00 174.62 174.61 1gzx h PRO 667 N -0.87 0.80 -0.67 3.99 0.11 -1.95 1.18 132.00 134.59 1gzx h PRO 667 Ca -0.46 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1gzx h PRO 667 Cb 1.24 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1gzx h PRO 667 CO 0.59 0.53 0.40 -1.35 -0.21 0.00 0.00 178.00 177.96 1gzx h PRO 668 N 0.82 0.91 -0.11 1.05 0.11 -1.98 1.38 132.00 134.18 1gzx h PRO 668 Ca 0.40 -0.09 -0.22 0.00 0.11 0.00 0.00 66.00 66.20 1gzx h PRO 668 Cb 0.34 -0.19 0.01 0.00 0.11 0.00 0.00 31.00 31.26 1gzx h PRO 668 CO -0.24 0.65 -0.80 0.28 -0.21 0.00 0.00 178.00 177.69 1gzx h VAL 669 N 0.91 1.32 -0.43 3.15 2.07 -1.61 -2.70 116.25 118.96 1gzx h VAL 669 Ca 0.24 -2.08 -0.01 0.00 0.82 0.00 0.00 66.70 65.68 1gzx h VAL 669 Cb -0.02 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1gzx h VAL 669 CO -0.04 0.64 0.24 -0.61 0.02 0.00 0.00 177.57 177.82 1gzx h GLN 670 N 0.43 0.59 -0.70 1.57 4.15 0.20 -1.36 115.11 119.99 1gzx h GLN 670 Ca -0.05 -0.07 0.08 0.00 0.77 0.00 0.00 58.65 59.38 1gzx h GLN 670 Cb 1.41 -0.12 -0.07 0.00 0.21 0.00 0.00 27.48 28.92 1gzx h GLN 670 CO 0.15 0.47 0.36 0.00 -1.93 0.00 0.00 178.83 177.88 1gzx h ALA 671 N 1.10 0.96 -0.65 3.38 0.00 0.20 0.25 119.26 124.50 1gzx h ALA 671 Ca 0.15 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1gzx h ALA 671 Cb 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1gzx h ALA 671 CO -0.03 -0.01 0.25 0.00 0.00 0.00 0.00 179.25 179.46 1gzx h ALA 672 N 1.41 0.84 -0.07 0.00 0.00 -1.25 -2.43 119.26 117.76 1gzx h ALA 672 Ca 0.34 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1gzx h ALA 672 Cb 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1gzx h ALA 672 CO -0.24 0.46 -0.39 1.88 0.00 0.00 0.00 179.25 180.96 1gzx h TYR 673 N 0.91 0.16 -0.79 0.00 0.05 -0.58 -2.73 116.97 114.00 1gzx h TYR 673 Ca 0.21 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.96 1gzx h TYR 673 Cb 0.22 -0.04 -0.04 0.00 1.01 0.00 0.00 36.73 37.88 1gzx h TYR 673 CO 0.01 0.52 0.51 1.96 -1.05 0.00 0.00 178.16 180.11 1gzx h GLN 674 N 0.12 1.06 -0.80 4.88 1.08 -0.05 -2.25 115.11 119.15 1gzx h GLN 674 Ca 0.01 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 1gzx h GLN 674 Cb 0.75 -0.23 -0.04 0.00 -0.05 0.00 0.00 27.48 27.91 1gzx h GLN 674 CO 0.06 0.72 0.41 0.87 -0.95 0.00 0.00 178.83 179.93 1gzx h LYS 675 N 1.08 1.14 0.46 1.46 1.57 -1.19 -1.07 116.57 120.02 1gzx h LYS 675 Ca 0.29 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1gzx h LYS 675 Cb -0.09 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.00 1gzx h LYS 675 CO -0.06 0.87 -0.27 0.28 -0.57 0.00 0.00 179.45 179.70 1gzx h VAL 676 N 1.13 0.44 -0.75 0.50 2.07 -1.24 0.57 116.25 118.97 1gzx h VAL 676 Ca 0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1gzx h VAL 676 Cb 0.09 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1gzx h VAL 676 CO -0.04 0.00 0.47 0.58 0.02 0.00 0.00 177.57 178.60 1gzx h VAL 677 N -0.69 1.20 -0.26 2.57 2.07 -1.41 -0.23 116.25 119.51 1gzx h VAL 677 Ca -0.05 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1gzx h VAL 677 Cb 0.56 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1gzx h VAL 677 CO 0.06 0.20 0.17 0.00 0.02 0.00 0.00 177.57 178.02 1gzx h ALA 678 N 1.25 0.33 -0.30 1.67 0.00 -1.03 -1.61 119.26 119.57 1gzx h ALA 678 Ca 0.27 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.19 1gzx h ALA 678 Cb -0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1gzx h ALA 678 CO -0.05 -0.18 0.08 0.78 0.00 0.00 0.00 179.25 179.88 1gzx h GLY 679 N 0.34 0.36 1.01 0.00 0.00 -0.25 -1.90 103.07 102.63 1gzx h GLY 679 Ca 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1gzx h GLY 679 CO -0.02 0.01 0.41 -2.08 0.00 0.00 0.00 176.54 174.86 1gzx h VAL 680 N 0.20 1.22 -0.77 4.60 2.07 -1.05 0.26 116.25 122.78 1gzx h VAL 680 Ca 0.14 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 1gzx h VAL 680 Cb 0.13 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 1gzx h VAL 680 CO -0.16 0.25 0.36 0.00 0.02 0.00 0.00 177.57 178.04 1gzx h ALA 681 N 1.21 0.99 -0.21 1.67 0.00 -0.94 0.65 119.26 122.63 1gzx h ALA 681 Ca 0.26 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1gzx h ALA 681 Cb 0.02 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1gzx h ALA 681 CO -0.04 0.57 -0.35 -0.91 0.00 0.00 0.00 179.25 178.51 1gzx h ASN 682 N 1.09 0.68 -0.41 0.00 2.35 -1.22 -0.38 115.58 117.69 1gzx h ASN 682 Ca 0.26 -0.53 -0.05 0.00 -0.55 0.00 0.00 56.30 55.43 1gzx h ASN 682 Cb 0.13 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1gzx h ASN 682 CO -0.03 1.08 0.08 0.00 -1.65 0.00 0.00 177.43 176.90 1gzx h ALA 683 N 0.62 1.24 0.00 -0.83 0.00 0.12 -1.12 119.26 119.29 1gzx h ALA 683 Ca 0.02 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1gzx h ALA 683 Cb 0.94 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1gzx h ALA 683 CO 0.08 0.52 -0.33 -0.07 0.00 0.00 0.00 179.25 179.45 1gzx h LEU 684 N 0.71 0.00 -0.06 0.00 3.38 -0.74 -2.92 115.31 115.69 1gzx h LEU 684 Ca 0.15 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1gzx h LEU 684 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1gzx h LEU 684 CO 0.00 0.33 -0.23 0.00 0.09 0.00 0.00 178.44 178.64 1gzx h ALA 685 N 1.67 0.86 -0.65 1.53 0.00 -0.36 -3.40 119.26 118.90 1gzx h ALA 685 Ca -0.00 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.83 1gzx h ALA 685 Cb 0.77 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.41 1gzx h ALA 685 CO 0.04 0.28 -0.14 1.25 0.00 0.00 0.00 179.25 180.69 1gzx h HIS 686 N 0.00 -0.30 -0.55 0.00 6.17 -1.02 -2.59 115.15 116.86 1gzx h HIS 686 Ca -0.00 0.06 -0.21 0.00 0.71 0.00 0.00 60.37 60.92 1gzx h HIS 686 Cb 1.15 0.23 -0.13 0.00 2.52 0.00 0.00 27.41 31.19 1gzx h HIS 686 CO 0.00 -0.27 0.27 1.63 0.71 0.00 0.00 177.93 180.27 1gzx n LYS 687 N -5.42 2.51 -2.59 5.26 4.76 -1.26 -4.90 118.16 116.52 1gzx n LYS 687 Ca 0.08 -2.04 -0.41 0.00 -2.87 0.00 0.00 58.31 53.08 1gzx n LYS 687 Cb 0.35 -1.87 -0.04 0.00 -1.84 0.00 0.00 35.03 31.62 1gzx n LYS 687 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1gzx s TYR 688 N -2.18 3.69 0.00 2.13 2.02 -0.98 -4.74 117.35 117.29 1gzx s TYR 688 Ca 0.37 1.69 0.00 0.00 -0.37 0.00 0.00 57.07 58.76 1gzx s TYR 688 Cb 0.30 -3.19 0.00 0.00 -0.40 0.00 0.00 41.96 38.68 1gzx s TYR 688 CO 0.09 -0.28 0.00 -2.39 -1.57 0.00 0.00 175.55 171.39