#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpy s SER 530 N 0.00 6.60 0.07 1.61 0.01 -1.26 -4.94 113.70 115.79 2cpy s SER 530 Ca 0.00 0.49 -0.20 0.00 1.31 0.00 0.00 55.95 57.56 2cpy s SER 530 Cb 0.00 -2.40 -0.10 0.00 0.21 0.00 0.00 66.02 63.73 2cpy s SER 530 CO 0.00 -0.68 1.51 0.28 0.41 0.00 0.00 173.24 174.77 2cpy h SER 531 N 8.32 0.35 -6.38 2.44 0.02 -2.14 -3.45 113.55 112.70 2cpy h SER 531 Ca -0.25 -0.30 -0.48 0.00 -0.84 0.00 0.00 61.79 59.92 2cpy h SER 531 Cb 1.10 -0.09 -0.30 0.00 0.14 0.00 0.00 62.40 63.24 2cpy h SER 531 CO 0.90 0.57 -0.69 0.61 -1.14 0.00 0.00 176.83 177.07 2cpy n GLY 532 N -0.33 -0.36 3.56 -3.77 0.00 -1.26 -4.81 105.19 98.23 2cpy n GLY 532 Ca -0.04 0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2cpy n GLY 532 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cpy s SER 533 N -2.80 6.45 -0.21 1.61 0.15 -1.26 -4.99 113.70 112.66 2cpy s SER 533 Ca 0.64 0.03 -0.02 0.00 0.70 0.00 0.00 55.95 57.29 2cpy s SER 533 Cb -0.37 -2.49 0.06 0.00 -1.71 0.00 0.00 66.02 61.50 2cpy s SER 533 CO 0.79 -1.27 0.02 -0.44 1.20 0.00 0.00 173.24 173.54 2cpy s SER 534 N 2.69 3.11 0.00 5.45 0.01 -1.26 -4.99 113.70 118.70 2cpy s SER 534 Ca 0.39 -0.91 0.00 0.00 1.31 0.00 0.00 55.95 56.74 2cpy s SER 534 Cb -0.09 -0.70 0.00 0.00 0.21 0.00 0.00 66.02 65.44 2cpy s SER 534 CO 0.25 -0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2cpy n GLY 535 N 4.98 -0.20 3.12 3.44 0.00 -1.26 -5.08 105.19 110.19 2cpy n GLY 535 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 2cpy n GLY 535 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2cpy s GLU 536 N -0.97 2.45 0.00 1.61 -1.05 -1.26 -5.02 118.70 114.46 2cpy s GLU 536 Ca 0.00 -1.22 0.00 0.00 -0.15 0.00 0.00 54.97 53.60 2cpy s GLU 536 Cb 0.00 -2.95 0.00 0.00 -0.44 0.00 0.00 34.13 30.74 2cpy s GLU 536 CO 0.00 -0.52 0.00 0.41 0.95 0.00 0.00 175.26 176.10 2cpy n GLY 537 N 4.53 1.77 4.09 -3.83 0.00 -1.26 -4.99 105.19 105.50 2cpy n GLY 537 Ca -0.15 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 2cpy n GLY 537 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2cpy n ASP 538 N 0.00 -1.82 -0.02 1.61 8.00 -1.26 -4.65 116.55 118.41 2cpy n ASP 538 Ca 0.00 -1.21 -0.14 0.00 0.71 0.00 0.00 54.79 54.15 2cpy n ASP 538 Cb 0.00 -2.09 -0.09 0.00 -0.02 0.00 0.00 41.12 38.92 2cpy n ASP 538 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2cpy h VAL 539 N -2.12 0.00 0.00 2.53 2.07 -1.99 0.19 116.25 116.94 2cpy h VAL 539 Ca -0.68 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2cpy h VAL 539 Cb 1.39 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2cpy h VAL 539 CO 0.60 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.73 2cpy n ASN 540 N -5.27 0.00 -3.58 0.57 6.94 -1.26 -3.84 115.26 108.81 2cpy n ASN 540 Ca -0.06 0.68 -0.29 0.00 -0.02 0.00 0.00 54.58 54.90 2cpy n ASN 540 Cb 0.36 -0.32 -0.12 0.00 -2.36 0.00 0.00 39.78 37.34 2cpy n ASN 540 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2cpy s SER 541 N -2.89 3.06 0.09 0.53 0.01 -1.12 -5.08 113.70 108.30 2cpy s SER 541 Ca 0.00 -2.70 -0.29 0.00 1.31 0.00 0.00 55.95 54.27 2cpy s SER 541 Cb 0.00 -0.77 -0.05 0.00 0.21 0.00 0.00 66.02 65.41 2cpy s SER 541 CO 0.00 -0.24 0.92 0.00 0.41 0.00 0.00 173.24 174.33 2cpy s ALA 542 N 0.34 3.26 -0.97 1.44 0.00 0.04 -4.89 121.76 120.97 2cpy s ALA 542 Ca 0.22 0.51 -0.24 0.00 0.00 0.00 0.00 51.96 52.45 2cpy s ALA 542 Cb -0.16 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.67 2cpy s ALA 542 CO -0.06 -0.03 1.97 0.15 0.00 0.00 0.00 175.76 177.80 2cpy s LYS 543 N 0.08 2.47 -0.32 0.00 1.02 -1.26 -3.92 119.74 117.80 2cpy s LYS 543 Ca 0.46 -0.48 0.07 0.00 0.02 0.00 0.00 55.97 56.04 2cpy s LYS 543 Cb -0.22 -5.09 0.45 0.00 -0.52 0.00 0.00 37.83 32.44 2cpy s LYS 543 CO 0.28 -3.63 1.17 1.33 -0.92 0.00 0.00 175.35 173.58 2cpy n VAL 544 N 7.93 2.43 -3.68 3.17 0.24 -1.23 -4.64 118.33 122.55 2cpy n VAL 544 Ca 0.42 -4.31 -0.14 0.00 -2.04 0.00 0.00 64.34 58.26 2cpy n VAL 544 Cb 0.47 -1.06 -0.09 0.00 -1.47 0.00 0.00 33.84 31.69 2cpy n VAL 544 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cpy s ALA 546 N -0.05 1.06 -0.26 0.00 0.00 0.31 -0.78 121.76 122.03 2cpy s ALA 546 Ca -0.03 -0.32 -0.11 0.00 0.00 0.00 0.00 51.96 51.50 2cpy s ALA 546 Cb -0.03 -0.66 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 2cpy s ALA 546 CO 0.02 -0.16 0.17 -1.58 0.00 0.00 0.00 175.76 174.22 2cpy s HIS 547 N 1.22 3.28 -0.22 0.00 5.04 -0.54 -0.55 115.29 123.51 2cpy s HIS 547 Ca -0.05 0.18 -0.11 0.00 -1.54 0.00 0.00 55.06 53.54 2cpy s HIS 547 Cb -0.14 -2.32 -0.05 0.00 0.04 0.00 0.00 32.58 30.12 2cpy s HIS 547 CO -0.02 -0.03 0.17 0.42 -2.34 0.00 0.00 174.74 172.95 2cpy s ILE 548 N 1.34 5.36 0.21 0.89 1.01 0.89 -1.50 121.20 129.41 2cpy s ILE 548 Ca 0.07 0.23 0.05 0.00 0.00 0.00 0.00 60.65 61.01 2cpy s ILE 548 Cb -0.15 -3.51 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 2cpy s ILE 548 CO 0.07 0.37 -0.08 0.42 0.00 0.00 0.00 174.94 175.72 2cpy s THR 549 N 0.85 1.36 -0.66 2.92 -4.23 -0.33 -1.59 115.64 113.97 2cpy s THR 549 Ca 0.09 -2.10 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 2cpy s THR 549 Cb -0.13 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.57 2cpy s THR 549 CO 0.03 -0.51 0.55 -3.20 -0.54 0.00 0.00 174.62 170.95 2cpy n ASN 550 N -0.37 -2.39 -4.29 3.99 2.85 -1.21 -1.42 115.26 112.42 2cpy n ASN 550 Ca -0.07 -0.33 -0.27 0.00 -0.11 0.00 0.00 54.58 53.80 2cpy n ASN 550 Cb 0.62 -2.97 -0.14 0.00 1.24 0.00 0.00 39.78 38.52 2cpy n ASN 550 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2cpy s ILE 551 N -3.19 1.83 -0.09 -1.44 -4.36 -1.17 -3.97 121.20 108.81 2cpy s ILE 551 Ca 0.05 -1.30 -0.39 0.00 -0.26 0.00 0.00 60.65 58.75 2cpy s ILE 551 Cb -0.02 -1.59 -0.17 0.00 1.25 0.00 0.00 42.46 41.93 2cpy s ILE 551 CO 0.39 0.23 1.44 -2.65 0.24 0.00 0.00 174.94 174.60 2cpy n PRO 552 N 1.74 0.87 -0.53 0.37 -0.02 -1.26 -4.52 135.00 131.65 2cpy n PRO 552 Ca -0.17 0.32 -0.09 0.00 -2.02 0.00 0.00 63.50 61.54 2cpy n PRO 552 Cb 0.53 -1.94 0.04 0.00 -0.02 0.00 0.00 33.50 32.11 2cpy n PRO 552 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2cpy n PHE 553 N 3.36 0.95 0.00 6.00 1.16 -1.26 -3.48 117.46 124.18 2cpy n PHE 553 Ca 0.22 -1.20 0.00 0.00 -1.87 0.00 0.00 57.45 54.60 2cpy n PHE 553 Cb 0.13 -0.60 0.00 0.00 -1.61 0.00 0.00 39.48 37.40 2cpy n PHE 553 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 2cpy n SER 554 N 0.32 4.93 -4.83 5.98 3.41 -1.26 -4.79 113.62 117.39 2cpy n SER 554 Ca 0.18 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.50 2cpy n SER 554 Cb 0.73 0.86 0.08 0.00 -0.26 0.00 0.00 64.21 65.61 2cpy n SER 554 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2cpy s ILE 555 N -1.98 3.03 0.44 -1.33 -4.36 -1.23 -5.09 121.20 110.68 2cpy s ILE 555 Ca 0.00 0.33 0.06 0.00 -0.26 0.00 0.00 60.65 60.79 2cpy s ILE 555 Cb 0.00 -3.16 -0.05 0.00 1.25 0.00 0.00 42.46 40.50 2cpy s ILE 555 CO 0.00 -0.44 0.13 0.42 0.24 0.00 0.00 174.94 175.29 2cpy s THR 556 N -3.25 2.00 0.17 8.37 -4.23 -1.26 -5.01 115.64 112.43 2cpy s THR 556 Ca 0.60 -1.81 -0.28 0.00 -1.18 0.00 0.00 61.69 59.03 2cpy s THR 556 Cb -0.13 -2.81 -0.00 0.00 1.34 0.00 0.00 72.50 70.89 2cpy s THR 556 CO 0.53 0.00 1.55 0.50 -0.54 0.00 0.00 174.62 176.66 2cpy h LYS 557 N 1.46 -0.12 -0.99 3.99 3.64 -2.01 -0.93 116.57 121.60 2cpy h LYS 557 Ca -0.43 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.05 2cpy h LYS 557 Cb 1.26 0.03 -0.12 0.00 -0.41 0.00 0.00 32.23 32.99 2cpy h LYS 557 CO 0.73 -0.08 -0.58 -0.12 -2.27 0.00 0.00 179.45 177.13 2cpy n MET 558 N -5.34 -0.43 -0.38 1.90 1.56 -1.26 -0.83 117.12 112.33 2cpy n MET 558 Ca 0.02 1.50 -0.09 0.00 -0.27 0.00 0.00 57.70 58.87 2cpy n MET 558 Cb 0.32 -2.21 -0.07 0.00 2.15 0.00 0.00 33.22 33.41 2cpy n MET 558 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 2cpy h ASP 559 N 0.00 -1.97 -0.80 6.12 3.32 -1.57 0.21 116.42 121.73 2cpy h ASP 559 Ca 0.16 0.32 0.16 0.00 0.02 0.00 0.00 57.03 57.69 2cpy h ASP 559 Cb 0.41 0.89 -0.15 0.00 0.22 0.00 0.00 39.33 40.71 2cpy h ASP 559 CO -0.94 -0.26 -0.22 0.58 -1.72 0.00 0.00 179.24 176.69 2cpy h VAL 560 N -0.04 0.18 -0.83 -1.35 2.07 -0.82 0.41 116.25 115.88 2cpy h VAL 560 Ca 0.19 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.86 2cpy h VAL 560 Cb 0.47 0.18 -0.09 0.00 -1.52 0.00 0.00 31.29 30.33 2cpy h VAL 560 CO -0.92 0.00 0.41 -0.07 0.02 0.00 0.00 177.57 177.02 2cpy h LEU 561 N -0.01 0.49 -0.35 2.57 3.38 -0.26 -1.18 115.31 119.95 2cpy h LEU 561 Ca 0.37 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.42 2cpy h LEU 561 Cb 0.59 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2cpy h LEU 561 CO -0.83 0.21 0.14 -0.61 0.09 0.00 0.00 178.44 177.44 2cpy h GLN 562 N 0.60 0.53 -0.53 1.13 5.75 0.27 -2.45 115.11 120.40 2cpy h GLN 562 Ca 0.45 -0.10 0.14 0.00 -0.15 0.00 0.00 58.65 58.99 2cpy h GLN 562 Cb 0.63 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.07 2cpy h GLN 562 CO -0.36 0.52 0.38 0.35 -2.65 0.00 0.00 178.83 177.06 2cpy h PHE 563 N 0.42 0.10 -0.26 3.99 3.04 -0.17 0.35 116.94 124.41 2cpy h PHE 563 Ca 0.12 0.00 -0.14 0.00 3.98 0.00 0.00 57.97 61.93 2cpy h PHE 563 Cb 0.19 -0.03 -0.08 0.00 2.56 0.00 0.00 35.95 38.59 2cpy h PHE 563 CO -0.00 0.04 0.18 1.28 -2.02 0.00 0.00 178.31 177.78 2cpy n LEU 564 N -4.41 4.15 -4.69 0.59 4.77 -0.89 -4.93 117.00 111.60 2cpy n LEU 564 Ca 0.10 -2.12 -0.51 0.00 -0.03 0.00 0.00 56.01 53.45 2cpy n LEU 564 Cb 0.55 -0.63 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 2cpy n LEU 564 CO 0.36 0.69 1.42 1.21 -1.33 0.00 0.00 177.39 179.74 2cpy n GLU 565 N 0.14 1.90 0.00 3.23 0.00 0.11 -1.94 120.64 124.09 2cpy n GLU 565 Ca 0.16 0.70 0.00 0.00 0.00 0.00 0.00 57.16 58.01 2cpy n GLU 565 Cb 0.78 -2.49 0.00 0.00 0.00 0.00 0.00 31.44 29.73 2cpy n GLU 565 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2cpy n GLY 566 N 4.25 3.22 3.57 8.31 0.00 -1.26 -5.06 105.19 118.22 2cpy n GLY 566 Ca 0.23 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 2cpy n GLY 566 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cpy s ILE 567 N -0.03 4.58 -1.12 -0.61 1.01 -0.82 -4.98 121.20 119.23 2cpy s ILE 567 Ca 0.00 0.77 -0.22 0.00 0.00 0.00 0.00 60.65 61.20 2cpy s ILE 567 Cb 0.00 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.12 2cpy s ILE 567 CO 0.00 -0.69 1.76 -2.16 0.00 0.00 0.00 174.94 173.85 2cpy s PRO 568 N 3.49 3.22 0.06 2.79 0.04 -1.26 -4.94 135.00 138.40 2cpy s PRO 568 Ca 0.35 -1.21 0.09 0.00 0.04 0.00 0.00 61.00 60.26 2cpy s PRO 568 Cb -0.11 -5.32 -0.03 0.00 0.04 0.00 0.00 34.50 29.07 2cpy s PRO 568 CO 0.23 -2.90 -0.26 0.54 0.04 0.00 0.00 177.00 174.65 2cpy s VAL 569 N 7.30 2.10 1.21 -0.36 0.11 -1.26 -5.06 120.40 124.44 2cpy s VAL 569 Ca 0.59 -1.45 -0.18 0.00 -2.93 0.00 0.00 61.98 58.01 2cpy s VAL 569 Cb -0.00 -1.81 0.25 0.00 -1.53 0.00 0.00 36.38 33.28 2cpy s VAL 569 CO 0.03 0.28 0.54 -0.67 -3.33 0.00 0.00 175.10 171.95 2cpy n ASP 570 N 1.59 -3.08 -0.02 3.54 2.03 -1.26 -4.97 116.55 114.38 2cpy n ASP 570 Ca -0.17 -0.46 -0.22 0.00 0.52 0.00 0.00 54.79 54.46 2cpy n ASP 570 Cb 0.52 -0.96 -0.13 0.00 -0.72 0.00 0.00 41.12 39.83 2cpy n ASP 570 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2cpy h GLU 571 N -2.89 0.19 -0.44 -0.67 4.57 -1.99 -3.37 114.58 109.98 2cpy h GLU 571 Ca -0.42 -0.33 -0.07 0.00 -1.18 0.00 0.00 59.36 57.36 2cpy h GLU 571 Cb 1.16 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.85 2cpy h GLU 571 CO 0.28 1.16 -0.00 -0.97 -1.18 0.00 0.00 179.01 178.30 2cpy h ASN 572 N -0.34 0.69 -1.55 1.04 -1.24 -2.00 -2.78 115.58 109.41 2cpy h ASN 572 Ca -0.35 -0.16 0.47 0.00 0.71 0.00 0.00 56.30 56.97 2cpy h ASN 572 Cb 1.74 -0.18 -0.10 0.00 0.73 0.00 0.00 38.32 40.52 2cpy h ASN 572 CO 0.01 0.76 1.07 0.00 -1.29 0.00 0.00 177.43 177.98 2cpy h ALA 573 N 1.32 3.23 -2.74 1.57 0.00 -1.85 -3.37 119.26 117.42 2cpy h ALA 573 Ca 0.14 0.02 -0.57 0.00 0.00 0.00 0.00 54.91 54.49 2cpy h ALA 573 Cb 0.42 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2cpy h ALA 573 CO 0.02 -1.79 -0.05 0.08 0.00 0.00 0.00 179.25 177.51 2cpy s VAL 574 N -5.08 4.89 -0.06 0.00 1.01 -1.05 -1.42 120.40 118.69 2cpy s VAL 574 Ca -0.06 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.13 2cpy s VAL 574 Cb 0.27 -3.89 0.00 0.00 0.00 0.00 0.00 36.38 32.76 2cpy s VAL 574 CO 0.85 0.47 -0.17 -1.00 0.00 0.00 0.00 175.10 175.24 2cpy s HIS 575 N -0.50 1.82 -0.18 5.22 3.76 -0.29 -4.98 115.29 120.13 2cpy s HIS 575 Ca 0.29 -0.60 -0.07 0.00 -0.15 0.00 0.00 55.06 54.53 2cpy s HIS 575 Cb -0.18 -1.24 -0.04 0.00 1.11 0.00 0.00 32.58 32.23 2cpy s HIS 575 CO 0.17 -0.24 0.04 0.08 -0.85 0.00 0.00 174.74 173.94 2cpy s VAL 576 N 0.24 4.59 0.24 -0.90 1.01 -1.26 -0.28 120.40 124.03 2cpy s VAL 576 Ca -0.09 -0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2cpy s VAL 576 Cb -0.14 -3.06 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 2cpy s VAL 576 CO 0.04 0.47 1.07 -0.76 0.00 0.00 0.00 175.10 175.91 2cpy s LEU 577 N 0.39 4.55 0.08 3.92 1.43 -0.89 -5.02 118.68 123.13 2cpy s LEU 577 Ca 0.02 2.15 -0.06 0.00 -1.03 0.00 0.00 54.13 55.20 2cpy s LEU 577 Cb -0.13 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 2cpy s LEU 577 CO 0.01 -0.11 0.12 0.68 0.23 0.00 0.00 176.35 177.27 2cpy s VAL 578 N -0.85 0.17 0.47 -1.59 -7.23 -1.26 -4.17 120.40 105.93 2cpy s VAL 578 Ca 0.45 -1.40 0.04 0.00 -1.81 0.00 0.00 61.98 59.27 2cpy s VAL 578 Cb -0.30 -1.41 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2cpy s VAL 578 CO 0.37 -0.77 0.07 -0.62 -0.31 0.00 0.00 175.10 173.85 2cpy s ASP 579 N -2.88 4.14 0.31 4.85 2.15 -1.26 -4.93 116.67 119.04 2cpy s ASP 579 Ca 0.06 -1.44 0.05 0.00 0.43 0.00 0.00 52.55 51.65 2cpy s ASP 579 Cb 0.06 0.06 0.82 0.00 -0.30 0.00 0.00 42.92 43.56 2cpy s ASP 579 CO -0.11 -0.70 1.62 -1.13 -0.17 0.00 0.00 175.17 174.69 2cpy h ASN 580 N 1.45 -0.06 0.67 -0.34 -0.73 -2.05 1.53 115.58 116.05 2cpy h ASN 580 Ca -0.43 0.23 -0.08 0.00 1.87 0.00 0.00 56.30 57.89 2cpy h ASN 580 Cb 1.28 0.32 -0.01 0.00 0.27 0.00 0.00 38.32 40.18 2cpy h ASN 580 CO 0.74 -0.24 -0.36 -1.13 -0.37 0.00 0.00 177.43 176.07 2cpy h ASN 581 N 0.14 0.00 -3.76 1.15 -0.73 -2.05 -3.47 115.58 106.85 2cpy h ASN 581 Ca 0.61 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 58.58 2cpy h ASN 581 Cb 1.31 0.00 0.08 0.00 0.27 0.00 0.00 38.32 39.99 2cpy h ASN 581 CO -0.74 0.36 -0.39 0.61 -0.37 0.00 0.00 177.43 176.91 2cpy n GLY 582 N -0.02 0.09 0.11 1.57 0.00 0.52 -4.96 105.19 102.51 2cpy n GLY 582 Ca -0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2cpy n GLY 582 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2cpy n GLN 583 N -2.86 0.68 0.00 1.61 6.02 -1.26 -4.90 117.38 116.66 2cpy n GLN 583 Ca -0.05 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2cpy n GLN 583 Cb 0.55 -1.56 0.00 0.00 1.02 0.00 0.00 30.24 30.25 2cpy n GLN 583 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cpy n GLY 584 N 1.95 1.44 0.14 1.08 0.00 -1.26 -4.85 105.19 103.69 2cpy n GLY 584 Ca -0.36 -1.11 -0.07 0.00 0.00 0.00 0.00 46.02 44.48 2cpy n GLY 584 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2cpy h LEU 585 N 0.00 0.22 0.00 0.99 4.07 -1.93 -3.45 115.31 115.21 2cpy h LEU 585 Ca 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.80 2cpy h LEU 585 Cb 0.00 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.67 2cpy h LEU 585 CO 0.00 0.91 0.00 0.61 -1.08 0.00 0.00 178.44 178.88 2cpy n GLY 586 N 0.65 1.47 2.94 0.83 0.00 -1.26 -4.82 105.19 105.00 2cpy n GLY 586 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 2cpy n GLY 586 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cpy s GLN 587 N -0.15 0.14 -0.01 1.61 -0.21 -1.26 -3.03 119.66 116.75 2cpy s GLN 587 Ca 0.00 -0.12 -0.09 0.00 0.02 0.00 0.00 55.36 55.17 2cpy s GLN 587 Cb 0.00 0.06 0.01 0.00 1.00 0.00 0.00 33.01 34.07 2cpy s GLN 587 CO 0.00 -0.02 0.18 0.00 -2.12 0.00 0.00 175.29 173.33 2cpy s ALA 588 N -0.40 -0.45 0.22 6.09 0.00 -0.62 -2.09 121.76 124.51 2cpy s ALA 588 Ca -0.05 0.03 0.08 0.00 0.00 0.00 0.00 51.96 52.02 2cpy s ALA 588 Cb -0.03 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 2cpy s ALA 588 CO -0.00 -0.21 0.07 -0.51 0.00 0.00 0.00 175.76 175.11 2cpy s LEU 589 N -1.25 3.49 -0.07 0.00 1.43 0.61 -0.07 118.68 122.82 2cpy s LEU 589 Ca -0.13 -0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 52.56 2cpy s LEU 589 Cb -0.07 -2.07 0.03 0.00 0.03 0.00 0.00 46.19 44.12 2cpy s LEU 589 CO 0.02 0.03 0.01 -0.69 0.23 0.00 0.00 176.35 175.95 2cpy s VAL 590 N -2.02 0.30 -0.19 -1.59 1.01 0.28 -1.14 120.40 117.05 2cpy s VAL 590 Ca 0.31 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.35 2cpy s VAL 590 Cb -0.08 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 2cpy s VAL 590 CO 0.21 0.23 0.07 -1.58 0.00 0.00 0.00 175.10 174.04 2cpy s GLN 591 N 2.00 3.97 0.13 2.72 0.74 -0.51 -0.53 119.66 128.17 2cpy s GLN 591 Ca 0.05 -0.34 0.08 0.00 0.05 0.00 0.00 55.36 55.20 2cpy s GLN 591 Cb -0.12 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2cpy s GLN 591 CO -0.05 0.22 -0.13 -0.06 -0.55 0.00 0.00 175.29 174.72 2cpy s PHE 592 N 0.53 2.64 0.08 1.67 0.08 0.54 -4.71 117.98 118.80 2cpy s PHE 592 Ca 0.04 -0.21 -0.21 0.00 0.12 0.00 0.00 56.93 56.67 2cpy s PHE 592 Cb -0.13 -1.37 -0.10 0.00 -0.57 0.00 0.00 43.02 40.85 2cpy s PHE 592 CO 0.01 0.43 1.60 0.87 -0.10 0.00 0.00 175.22 178.03 2cpy h LYS 593 N 3.50 0.25 0.00 0.44 6.56 -1.98 -3.45 116.57 121.90 2cpy h LYS 593 Ca -0.49 -0.05 -0.35 0.00 -1.06 0.00 0.00 60.65 58.70 2cpy h LYS 593 Cb 1.18 -0.04 -0.08 0.00 -0.57 0.00 0.00 32.23 32.72 2cpy h LYS 593 CO 0.50 0.36 -0.31 0.09 -2.06 0.00 0.00 179.45 178.03 2cpy n ASN 594 N -4.84 0.58 0.05 0.86 3.02 -1.26 -5.02 115.26 108.65 2cpy n ASN 594 Ca -0.05 -2.44 -0.13 0.00 -0.03 0.00 0.00 54.58 51.93 2cpy n ASN 594 Cb 0.14 0.83 -0.02 0.00 -0.61 0.00 0.00 39.78 40.11 2cpy n ASN 594 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2cpy h GLU 595 N 0.00 0.47 -1.40 3.52 3.07 -1.90 -3.16 114.58 115.18 2cpy h GLU 595 Ca -0.19 -0.44 0.46 0.00 -0.50 0.00 0.00 59.36 58.69 2cpy h GLU 595 Cb 0.80 0.11 -0.13 0.00 -0.84 0.00 0.00 28.75 28.69 2cpy h GLU 595 CO 0.30 1.09 0.91 0.38 -1.40 0.00 0.00 179.01 180.28 2cpy h ASP 596 N 0.29 0.20 0.07 1.42 2.03 -1.97 0.40 116.42 118.87 2cpy h ASP 596 Ca -0.06 0.14 -0.26 0.00 -0.73 0.00 0.00 57.03 56.12 2cpy h ASP 596 Cb 1.46 0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 40.08 2cpy h ASP 596 CO 0.15 -0.20 -1.36 0.44 -1.03 0.00 0.00 179.24 177.24 2cpy h ASP 597 N 0.04 0.24 0.34 4.15 3.32 -1.97 -3.37 116.42 119.17 2cpy h ASP 597 Ca 0.86 -0.77 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2cpy h ASP 597 Cb 2.78 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 42.23 2cpy h ASP 597 CO -0.41 1.57 -0.38 0.00 -1.72 0.00 0.00 179.24 178.31 2cpy h ALA 598 N -0.16 -0.80 -0.89 3.45 0.00 -0.47 -0.72 119.26 119.67 2cpy h ALA 598 Ca -0.32 -0.12 0.26 0.00 0.00 0.00 0.00 54.91 54.73 2cpy h ALA 598 Cb 1.61 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 19.92 2cpy h ALA 598 CO -0.02 -0.99 0.96 0.00 0.00 0.00 0.00 179.25 179.20 2cpy h ARG 599 N -0.75 0.00 0.11 0.00 2.47 -0.62 1.04 114.38 116.64 2cpy h ARG 599 Ca -0.02 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.37 2cpy h ARG 599 Cb 0.69 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.99 2cpy h ARG 599 CO -0.09 0.00 -1.72 0.87 0.56 0.00 0.00 179.97 179.59 2cpy h LYS 600 N 0.00 0.24 -0.55 0.04 1.57 -1.34 -3.34 116.57 113.19 2cpy h LYS 600 Ca 0.42 -0.40 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 2cpy h LYS 600 Cb 2.35 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 34.77 2cpy h LYS 600 CO -0.00 1.07 0.37 0.66 -0.57 0.00 0.00 179.45 180.98 2cpy h SER 601 N 0.06 0.36 0.75 0.86 4.64 0.23 0.38 113.55 120.83 2cpy h SER 601 Ca -0.32 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.91 2cpy h SER 601 Cb 2.03 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 64.04 2cpy h SER 601 CO 0.13 0.22 -0.48 1.05 -0.87 0.00 0.00 176.83 176.88 2cpy h GLU 602 N 0.40 0.00 -0.50 4.77 4.11 -1.56 -3.02 114.58 118.77 2cpy h GLU 602 Ca 0.25 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.81 2cpy h GLU 602 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2cpy h GLU 602 CO -0.06 0.48 0.36 -0.09 0.07 0.00 0.00 179.01 179.76 2cpy h ARG 603 N 0.00 0.05 -0.44 1.06 9.65 -1.03 0.39 114.38 124.06 2cpy h ARG 603 Ca -0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2cpy h ARG 603 Cb 0.99 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.55 2cpy h ARG 603 CO 0.06 0.03 0.00 1.28 2.80 0.00 0.00 179.97 184.15 2cpy n LEU 604 N -4.40 0.85 -4.73 3.80 4.77 -1.14 -4.90 117.00 111.24 2cpy n LEU 604 Ca 0.09 -0.43 -0.39 0.00 -0.03 0.00 0.00 56.01 55.26 2cpy n LEU 604 Cb 0.54 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 2cpy n LEU 604 CO 0.36 0.18 0.93 1.57 -1.33 0.00 0.00 177.39 179.10 2cpy n HIS 605 N -0.14 2.15 -3.83 -1.77 -0.00 0.14 -2.71 115.22 109.05 2cpy n HIS 605 Ca 0.03 0.44 -0.25 0.00 0.46 0.00 0.00 57.72 58.39 2cpy n HIS 605 Cb 0.18 -2.34 0.02 0.00 -0.12 0.00 0.00 29.99 27.72 2cpy n HIS 605 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2cpy n ARG 606 N -0.90 -4.73 -3.53 1.57 1.74 -1.02 -4.97 116.66 104.83 2cpy n ARG 606 Ca 0.10 0.56 -0.26 0.00 -0.77 0.00 0.00 57.85 57.48 2cpy n ARG 606 Cb 0.44 -5.15 -0.02 0.00 -1.02 0.00 0.00 32.46 26.71 2cpy n ARG 606 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2cpy s LYS 607 N -6.32 3.53 -0.59 5.56 -0.14 -1.10 -4.82 119.74 115.87 2cpy s LYS 607 Ca 0.24 -0.28 -0.18 0.00 -1.36 0.00 0.00 55.97 54.39 2cpy s LYS 607 Cb -0.12 -2.74 0.12 0.00 -1.68 0.00 0.00 37.83 33.40 2cpy s LYS 607 CO 0.84 0.28 0.64 0.15 -0.76 0.00 0.00 175.35 176.50 2cpy s LYS 608 N -3.71 3.05 -0.49 1.68 1.02 -1.26 -0.50 119.74 119.52 2cpy s LYS 608 Ca 0.40 -1.49 -0.17 0.00 0.02 0.00 0.00 55.97 54.72 2cpy s LYS 608 Cb -0.10 -4.29 0.07 0.00 -0.52 0.00 0.00 37.83 32.98 2cpy s LYS 608 CO 0.31 -1.47 0.52 -1.17 -0.92 0.00 0.00 175.35 172.62 2cpy s LEU 609 N 2.25 5.32 -1.55 3.17 0.20 0.49 -4.29 118.68 124.28 2cpy s LEU 609 Ca 0.09 -1.15 0.00 0.00 0.69 0.00 0.00 54.13 53.76 2cpy s LEU 609 Cb -0.25 -2.31 0.00 0.00 -0.43 0.00 0.00 46.19 43.20 2cpy s LEU 609 CO 0.04 -0.78 0.00 0.59 -0.29 0.00 0.00 176.35 175.91 2cpy n ASN 610 N 5.69 -5.09 0.00 3.68 3.02 -1.26 -1.53 115.26 119.77 2cpy n ASN 610 Ca -0.10 0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 2cpy n ASN 610 Cb 0.44 -4.17 0.00 0.00 -0.61 0.00 0.00 39.78 35.44 2cpy n ASN 610 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cpy n GLY 611 N -0.99 0.72 3.22 7.41 0.00 -1.26 -5.05 105.19 109.25 2cpy n GLY 611 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 2cpy n GLY 611 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cpy s ARG 612 N -0.43 3.15 -0.29 1.61 1.81 -0.58 -5.07 118.95 119.15 2cpy s ARG 612 Ca 0.00 -0.77 -0.29 0.00 -1.72 0.00 0.00 55.73 52.95 2cpy s ARG 612 Cb 0.00 -2.63 -0.02 0.00 -0.45 0.00 0.00 34.95 31.85 2cpy s ARG 612 CO 0.00 -0.07 1.66 -1.21 -0.68 0.00 0.00 175.30 175.00 2cpy s GLU 613 N 1.01 3.59 0.19 3.54 0.41 -1.26 -0.38 118.70 125.79 2cpy s GLU 613 Ca -0.02 1.48 0.04 0.00 -0.41 0.00 0.00 54.97 56.06 2cpy s GLU 613 Cb -0.15 -4.10 -0.03 0.00 -1.78 0.00 0.00 34.13 28.07 2cpy s GLU 613 CO -0.04 -1.55 0.26 0.00 -0.49 0.00 0.00 175.26 173.45 2cpy s ALA 614 N 5.88 3.84 -0.02 5.21 0.00 0.34 -4.79 121.76 132.21 2cpy s ALA 614 Ca 0.73 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 51.60 2cpy s ALA 614 Cb -0.22 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.25 2cpy s ALA 614 CO 0.31 0.43 -0.21 -0.06 0.00 0.00 0.00 175.76 176.23 2cpy s PHE 615 N -1.85 1.92 -0.05 0.00 0.40 -0.51 -2.43 117.98 115.47 2cpy s PHE 615 Ca 0.33 -0.37 0.04 0.00 -0.60 0.00 0.00 56.93 56.34 2cpy s PHE 615 Cb -0.10 -1.24 -0.02 0.00 0.51 0.00 0.00 43.02 42.17 2cpy s PHE 615 CO 0.27 -0.04 -0.18 0.08 0.70 0.00 0.00 175.22 176.06 2cpy s VAL 616 N -0.48 2.77 -0.16 -0.44 1.01 -1.26 -1.19 120.40 120.65 2cpy s VAL 616 Ca 0.08 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.23 2cpy s VAL 616 Cb -0.08 -2.06 0.04 0.00 0.00 0.00 0.00 36.38 34.27 2cpy s VAL 616 CO -0.01 0.58 -0.08 -1.00 0.00 0.00 0.00 175.10 174.60 2cpy s HIS 617 N -0.59 1.90 -0.32 5.22 3.76 -0.56 -4.93 115.29 119.76 2cpy s HIS 617 Ca 0.09 -1.17 -0.29 0.00 -0.15 0.00 0.00 55.06 53.54 2cpy s HIS 617 Cb -0.11 -1.42 0.01 0.00 1.11 0.00 0.00 32.58 32.17 2cpy s HIS 617 CO 0.01 -0.64 1.20 0.08 -0.85 0.00 0.00 174.74 174.54 2cpy s VAL 618 N 1.57 4.28 0.25 -0.90 1.01 -1.26 -1.46 120.40 123.89 2cpy s VAL 618 Ca 0.02 1.45 0.04 0.00 0.00 0.00 0.00 61.98 63.49 2cpy s VAL 618 Cb -0.15 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 2cpy s VAL 618 CO -0.08 -0.52 -0.01 0.68 0.00 0.00 0.00 175.10 175.16 2cpy s VAL 619 N 4.11 1.19 0.78 2.92 -7.23 0.04 -5.01 120.40 117.20 2cpy s VAL 619 Ca 0.51 -2.05 -0.11 0.00 -1.81 0.00 0.00 61.98 58.52 2cpy s VAL 619 Cb -0.14 -2.40 0.06 0.00 0.56 0.00 0.00 36.38 34.46 2cpy s VAL 619 CO 0.21 -0.29 1.09 0.42 -0.31 0.00 0.00 175.10 176.22 2cpy s THR 620 N -3.31 3.17 0.10 5.32 -4.23 -1.26 -2.41 115.64 113.01 2cpy s THR 620 Ca 0.29 0.38 -0.29 0.00 -1.18 0.00 0.00 61.69 60.89 2cpy s THR 620 Cb 0.05 -3.14 -0.11 0.00 1.34 0.00 0.00 72.50 70.65 2cpy s THR 620 CO 0.10 -0.50 1.47 0.25 -0.54 0.00 0.00 174.62 175.40 2cpy h LEU 621 N -1.04 -1.48 -0.64 4.79 7.12 -1.88 -1.58 115.31 120.61 2cpy h LEU 621 Ca -0.47 0.17 0.13 0.00 0.13 0.00 0.00 57.88 57.85 2cpy h LEU 621 Cb 1.26 0.58 -0.10 0.00 -0.53 0.00 0.00 40.66 41.87 2cpy h LEU 621 CO 0.59 -0.42 0.10 -0.33 -0.13 0.00 0.00 178.44 178.26 2cpy h GLU 622 N -0.50 0.21 -0.14 1.25 3.07 -1.94 0.41 114.58 116.95 2cpy h GLU 622 Ca 0.03 -0.01 0.04 0.00 -0.50 0.00 0.00 59.36 58.91 2cpy h GLU 622 Cb 0.58 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.44 2cpy h GLU 622 CO -0.37 0.14 0.49 -0.44 -1.40 0.00 0.00 179.01 177.43 2cpy h ASP 623 N 0.22 0.00 0.39 1.42 3.32 -1.66 0.49 116.42 120.60 2cpy h ASP 623 Ca 0.34 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 57.08 2cpy h ASP 623 Cb 0.54 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 2cpy h ASP 623 CO -0.46 0.00 -1.73 -0.03 -1.72 0.00 0.00 179.24 175.30 2cpy h MET 624 N 0.00 0.15 -0.07 3.56 4.05 0.20 -3.32 114.93 119.50 2cpy h MET 624 Ca 0.07 -0.25 -0.08 0.00 -0.28 0.00 0.00 59.70 59.16 2cpy h MET 624 Cb 1.05 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 2cpy h MET 624 CO -0.00 0.90 -0.25 -0.09 0.23 0.00 0.00 176.91 177.69 2cpy h ARG 625 N 0.04 0.30 -0.91 0.39 2.43 0.22 -2.45 114.38 114.40 2cpy h ARG 625 Ca -0.31 -0.22 0.15 0.00 -0.81 0.00 0.00 59.98 58.79 2cpy h ARG 625 Cb 2.01 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 31.53 2cpy h ARG 625 CO 0.11 0.85 0.59 1.05 -1.51 0.00 0.00 179.97 181.05 2cpy h GLU 626 N -0.19 0.67 0.33 0.20 4.11 -1.17 -2.66 114.58 115.87 2cpy h GLU 626 Ca -0.01 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.36 2cpy h GLU 626 Cb 0.88 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2cpy h GLU 626 CO 0.05 0.44 -0.16 0.82 0.07 0.00 0.00 179.01 180.24 2cpy h ILE 627 N 0.69 0.30 -0.79 -1.06 2.04 -1.65 -2.39 117.51 114.65 2cpy h ILE 627 Ca 0.47 -0.76 0.25 0.00 1.00 0.00 0.00 64.86 65.82 2cpy h ILE 627 Cb 0.77 0.49 -0.15 0.00 -0.74 0.00 0.00 36.82 37.19 2cpy h ILE 627 CO -0.23 0.07 0.12 1.21 0.00 0.00 0.00 178.15 179.33 2cpy n GLU 628 N -5.07 -0.06 -0.03 2.37 0.00 -0.92 0.11 120.64 117.03 2cpy n GLU 628 Ca -0.07 1.16 -0.14 0.00 0.00 0.00 0.00 57.16 58.11 2cpy n GLU 628 Cb 0.23 -1.91 -0.10 0.00 0.00 0.00 0.00 31.44 29.67 2cpy n GLU 628 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2cpy h LYS 629 N 0.00 0.23 -2.86 5.31 1.57 -1.55 -3.38 116.57 115.89 2cpy h LYS 629 Ca 0.53 -0.18 -0.64 0.00 -1.87 0.00 0.00 60.65 58.49 2cpy h LYS 629 Cb 1.20 0.04 -0.40 0.00 0.08 0.00 0.00 32.23 33.14 2cpy h LYS 629 CO -0.71 0.83 -0.44 -1.71 -0.57 0.00 0.00 179.45 176.85 2cpy n ASN 630 N -4.54 3.59 -4.35 0.86 2.85 0.30 -5.09 115.26 108.88 2cpy n ASN 630 Ca -0.08 -3.28 -0.38 0.00 -0.11 0.00 0.00 54.58 50.73 2cpy n ASN 630 Cb 0.44 -0.81 0.04 0.00 1.24 0.00 0.00 39.78 40.69 2cpy n ASN 630 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2cpy n PRO 631 N 1.67 0.23 -2.67 1.20 -0.02 0.12 -4.56 135.00 130.97 2cpy n PRO 631 Ca 0.23 0.10 -0.37 0.00 -2.02 0.00 0.00 63.50 61.44 2cpy n PRO 631 Cb 0.37 -1.44 -0.05 0.00 -0.02 0.00 0.00 33.50 32.35 2cpy n PRO 631 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2cpy s PRO 632 N -1.91 4.46 0.84 0.52 0.04 -1.26 -5.04 135.00 132.65 2cpy s PRO 632 Ca 0.61 1.44 -0.10 0.00 0.04 0.00 0.00 61.00 62.99 2cpy s PRO 632 Cb -0.41 -2.77 0.10 0.00 0.04 0.00 0.00 34.50 31.45 2cpy s PRO 632 CO 0.62 0.14 1.11 0.00 0.04 0.00 0.00 177.00 178.91 2cpy s ALA 633 N -1.57 1.88 -0.06 8.56 0.00 -1.26 -4.90 121.76 124.41 2cpy s ALA 633 Ca 0.52 0.37 -0.29 0.00 0.00 0.00 0.00 51.96 52.55 2cpy s ALA 633 Cb -0.21 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 2cpy s ALA 633 CO 0.27 -2.21 1.91 -1.14 0.00 0.00 0.00 175.76 174.59 2cpy s GLN 634 N -4.80 3.93 0.00 0.00 0.74 -1.26 -3.92 119.66 114.35 2cpy s GLN 634 Ca 0.63 2.31 0.00 0.00 0.05 0.00 0.00 55.36 58.36 2cpy s GLN 634 Cb -0.19 -4.15 0.00 0.00 1.10 0.00 0.00 33.01 29.77 2cpy s GLN 634 CO 0.57 -1.18 0.00 0.41 -0.55 0.00 0.00 175.29 174.54 2cpy n GLY 635 N 4.69 -0.20 3.89 2.59 0.00 -1.26 -5.09 105.19 109.82 2cpy n GLY 635 Ca 0.21 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2cpy n GLY 635 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cpy s LYS 636 N -1.34 3.38 -0.02 1.61 2.20 -1.25 -5.11 119.74 119.21 2cpy s LYS 636 Ca 0.00 -0.38 -0.11 0.00 -0.36 0.00 0.00 55.97 55.12 2cpy s LYS 636 Cb 0.00 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.29 2cpy s LYS 636 CO 0.00 0.65 0.24 0.45 -0.36 0.00 0.00 175.35 176.33 2cpy s SER 637 N -2.07 -0.12 0.29 1.43 0.15 -1.26 -5.17 113.70 106.94 2cpy s SER 637 Ca 0.29 0.03 0.05 0.00 0.70 0.00 0.00 55.95 57.03 2cpy s SER 637 Cb -0.13 0.30 -0.02 0.00 -1.71 0.00 0.00 66.02 64.47 2cpy s SER 637 CO 0.21 -0.37 0.20 0.61 1.20 0.00 0.00 173.24 175.08 2cpy n GLY 638 N 1.57 3.20 3.48 9.45 0.00 -1.26 -5.13 105.19 116.51 2cpy n GLY 638 Ca -0.21 -1.91 -0.45 0.00 0.00 0.00 0.00 46.02 43.45 2cpy n GLY 638 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2cpy n PRO 639 N -0.58 0.67 -4.02 1.61 -0.02 -1.26 -4.97 135.00 126.44 2cpy n PRO 639 Ca 0.03 0.24 -0.34 0.00 -2.02 0.00 0.00 63.50 61.41 2cpy n PRO 639 Cb 0.49 -1.46 -0.15 0.00 -0.02 0.00 0.00 33.50 32.36 2cpy n PRO 639 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2cpy s SER 640 N -0.82 3.95 -0.05 2.55 1.04 -1.26 -5.09 113.70 114.03 2cpy s SER 640 Ca 0.62 -0.46 -0.02 0.00 0.48 0.00 0.00 55.95 56.57 2cpy s SER 640 Cb -0.74 -1.66 0.03 0.00 0.10 0.00 0.00 66.02 63.76 2cpy s SER 640 CO 0.58 -0.00 0.08 -0.55 0.98 0.00 0.00 173.24 174.33 2cpy s SER 641 N 1.36 0.81 0.00 7.02 0.15 -1.26 -5.37 113.70 116.41 2cpy s SER 641 Ca 0.05 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2cpy s SER 641 Cb -0.14 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.15 2cpy s SER 641 CO -0.05 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.77