#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpy n SER 530 N 0.00 -0.99 -4.22 1.61 2.88 -1.26 -4.82 113.62 106.82 2cpy n SER 530 Ca 0.00 -1.02 -0.41 0.00 -1.33 0.00 0.00 58.87 56.11 2cpy n SER 530 Cb 0.00 -1.29 -0.04 0.00 -0.75 0.00 0.00 64.21 62.13 2cpy n SER 530 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2cpy s SER 531 N -3.10 6.47 0.00 -3.46 0.01 -1.26 -4.90 113.70 107.46 2cpy s SER 531 Ca 0.53 -3.39 0.00 0.00 1.31 0.00 0.00 55.95 54.40 2cpy s SER 531 Cb -0.31 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 63.87 2cpy s SER 531 CO 0.83 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 174.78 2cpy n GLY 532 N 2.89 1.09 3.61 3.44 0.00 -1.26 -5.18 105.19 109.78 2cpy n GLY 532 Ca 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.17 2cpy n GLY 532 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cpy s SER 533 N 0.96 -0.22 0.24 1.61 1.04 -1.26 -5.19 113.70 110.88 2cpy s SER 533 Ca 0.00 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.30 2cpy s SER 533 Cb 0.00 0.34 -0.05 0.00 0.10 0.00 0.00 66.02 66.41 2cpy s SER 533 CO 0.00 -0.58 0.09 -0.44 0.98 0.00 0.00 173.24 173.29 2cpy s SER 534 N -2.65 1.03 0.00 7.02 0.01 -1.26 -5.18 113.70 112.67 2cpy s SER 534 Ca 0.09 -1.37 0.00 0.00 1.31 0.00 0.00 55.95 55.99 2cpy s SER 534 Cb -0.00 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.42 2cpy s SER 534 CO -0.04 -0.73 0.00 0.61 0.41 0.00 0.00 173.24 173.49 2cpy n GLY 535 N -0.41 4.67 1.11 3.44 0.00 -1.26 -5.11 105.19 107.63 2cpy n GLY 535 Ca -0.00 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2cpy n GLY 535 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2cpy n GLU 536 N 0.00 0.00 0.00 1.61 4.07 -1.26 -5.16 120.64 119.90 2cpy n GLU 536 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2cpy n GLU 536 Cb 0.00 -0.46 0.00 0.00 -0.06 0.00 0.00 31.44 30.92 2cpy n GLU 536 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cpy n GLY 537 N 3.09 2.31 3.71 8.31 0.00 -1.26 -5.10 105.19 116.24 2cpy n GLY 537 Ca 0.00 -1.39 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 2cpy n GLY 537 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cpy s ASP 538 N 0.00 5.14 0.00 1.61 1.01 -1.26 -5.01 116.67 118.16 2cpy s ASP 538 Ca 0.00 -0.15 0.28 0.00 0.71 0.00 0.00 52.55 53.39 2cpy s ASP 538 Cb 0.00 -1.26 1.06 0.00 1.01 0.00 0.00 42.92 43.74 2cpy s ASP 538 CO 0.00 0.17 1.78 1.33 0.21 0.00 0.00 175.17 178.66 2cpy n VAL 539 N 0.49 0.00 -0.05 -1.27 0.24 -1.26 -3.79 118.33 112.69 2cpy n VAL 539 Ca -0.10 -0.03 -0.22 0.00 -2.04 0.00 0.00 64.34 61.96 2cpy n VAL 539 Cb 0.52 -0.15 -0.13 0.00 -1.47 0.00 0.00 33.84 32.61 2cpy n VAL 539 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2cpy h ASN 540 N 0.24 0.21 -3.40 -1.34 -0.73 -2.07 -3.44 115.58 105.05 2cpy h ASN 540 Ca 0.00 -0.73 -0.61 0.00 1.87 0.00 0.00 56.30 56.84 2cpy h ASN 540 Cb 0.43 -0.07 -0.40 0.00 0.27 0.00 0.00 38.32 38.56 2cpy h ASN 540 CO 0.00 1.64 -0.75 -0.94 -0.37 0.00 0.00 177.43 177.01 2cpy s SER 541 N -6.95 3.64 0.26 1.15 1.04 -1.25 -5.08 113.70 106.51 2cpy s SER 541 Ca -0.25 -2.49 -0.01 0.00 0.48 0.00 0.00 55.95 53.68 2cpy s SER 541 Cb 0.06 -0.97 -0.04 0.00 0.10 0.00 0.00 66.02 65.17 2cpy s SER 541 CO 0.68 -0.29 0.46 0.00 0.98 0.00 0.00 173.24 175.08 2cpy s ALA 542 N 0.54 3.76 -1.00 5.32 0.00 -1.25 -4.45 121.76 124.68 2cpy s ALA 542 Ca 0.17 -0.81 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 2cpy s ALA 542 Cb -0.24 -2.07 0.22 0.00 0.00 0.00 0.00 23.12 21.03 2cpy s ALA 542 CO -0.02 0.27 1.04 0.15 0.00 0.00 0.00 175.76 177.20 2cpy s LYS 543 N -3.65 3.89 -0.23 0.00 1.02 -1.26 -3.40 119.74 116.10 2cpy s LYS 543 Ca 0.40 -2.64 0.11 0.00 0.02 0.00 0.00 55.97 53.85 2cpy s LYS 543 Cb -0.10 -4.64 0.44 0.00 -0.52 0.00 0.00 37.83 33.01 2cpy s LYS 543 CO 0.31 -1.42 1.30 1.33 -0.92 0.00 0.00 175.35 175.95 2cpy n VAL 544 N 3.85 2.31 -3.86 3.17 0.24 -1.25 -4.67 118.33 118.11 2cpy n VAL 544 Ca 0.22 -3.06 -0.12 0.00 -2.04 0.00 0.00 64.34 59.34 2cpy n VAL 544 Cb 0.44 -0.27 -0.14 0.00 -1.47 0.00 0.00 33.84 32.40 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 0.10 1.57 -0.21 0.00 0.00 0.29 -1.49 121.76 122.03 2cpy s ALA 546 Ca -0.01 -0.64 -0.06 0.00 0.00 0.00 0.00 51.96 51.26 2cpy s ALA 546 Cb -0.01 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2cpy s ALA 546 CO -0.00 0.21 0.03 -1.58 0.00 0.00 0.00 175.76 174.41 2cpy s HIS 547 N 0.41 3.09 -0.21 0.00 5.04 -0.62 -0.20 115.29 122.79 2cpy s HIS 547 Ca -0.13 -0.36 -0.10 0.00 -1.54 0.00 0.00 55.06 52.94 2cpy s HIS 547 Cb -0.15 -2.13 -0.05 0.00 0.04 0.00 0.00 32.58 30.29 2cpy s HIS 547 CO 0.05 -0.21 0.12 0.42 -2.34 0.00 0.00 174.74 172.78 2cpy s ILE 548 N 1.07 5.24 0.32 0.89 1.01 0.13 -1.71 121.20 128.15 2cpy s ILE 548 Ca 0.03 0.13 0.03 0.00 0.00 0.00 0.00 60.65 60.84 2cpy s ILE 548 Cb -0.14 -3.40 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 2cpy s ILE 548 CO 0.02 0.41 0.11 0.42 0.00 0.00 0.00 174.94 175.91 2cpy s THR 549 N 0.59 0.64 -0.97 2.92 -4.23 -0.74 -2.05 115.64 111.79 2cpy s THR 549 Ca 0.07 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.52 2cpy s THR 549 Cb -0.12 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.15 2cpy s THR 549 CO 0.00 0.00 0.85 -3.20 -0.54 0.00 0.00 174.62 171.73 2cpy n ASN 550 N -0.83 -4.95 -4.49 3.99 5.15 -1.24 -1.67 115.26 111.22 2cpy n ASN 550 Ca -0.01 -0.39 -0.28 0.00 -0.60 0.00 0.00 54.58 53.29 2cpy n ASN 550 Cb 0.66 -3.78 -0.11 0.00 -0.53 0.00 0.00 39.78 36.02 2cpy n ASN 550 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2cpy s ILE 551 N -3.23 2.81 -0.11 -1.44 -4.36 -1.23 -4.12 121.20 109.51 2cpy s ILE 551 Ca 0.39 -1.70 -0.30 0.00 -0.26 0.00 0.00 60.65 58.79 2cpy s ILE 551 Cb -0.17 -2.33 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 2cpy s ILE 551 CO 0.53 -0.02 1.28 -2.16 0.24 0.00 0.00 174.94 174.81 2cpy s PRO 552 N -2.49 4.27 0.00 0.37 0.04 -1.26 -4.26 135.00 131.67 2cpy s PRO 552 Ca 0.21 1.73 0.13 0.00 0.04 0.00 0.00 61.00 63.10 2cpy s PRO 552 Cb -0.09 -3.70 0.71 0.00 0.04 0.00 0.00 34.50 31.46 2cpy s PRO 552 CO 0.11 -0.63 1.25 1.97 0.04 0.00 0.00 177.00 179.75 2cpy n PHE 553 N 6.12 0.00 0.21 0.56 -1.74 -1.26 -2.51 117.46 118.85 2cpy n PHE 553 Ca 0.13 0.00 0.06 0.00 -0.56 0.00 0.00 57.45 57.09 2cpy n PHE 553 Cb 0.45 -0.13 0.46 0.00 1.52 0.00 0.00 39.48 41.79 2cpy n PHE 553 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 2cpy h SER 554 N 0.00 0.00 -3.02 5.98 4.64 -1.90 -3.44 113.55 115.81 2cpy h SER 554 Ca 0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 2cpy h SER 554 Cb 0.05 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.22 2cpy h SER 554 CO 0.00 0.29 0.15 0.27 -0.87 0.00 0.00 176.83 176.67 2cpy s ILE 555 N -4.04 2.29 0.41 0.95 -4.36 -1.04 -5.12 121.20 110.29 2cpy s ILE 555 Ca -0.02 -0.43 0.04 0.00 -0.26 0.00 0.00 60.65 59.98 2cpy s ILE 555 Cb 0.13 -2.86 -0.03 0.00 1.25 0.00 0.00 42.46 40.95 2cpy s ILE 555 CO 0.67 0.00 0.11 0.42 0.24 0.00 0.00 174.94 176.38 2cpy s THR 556 N -3.17 0.72 0.23 8.37 -4.23 -1.26 -5.01 115.64 111.28 2cpy s THR 556 Ca 0.63 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.03 2cpy s THR 556 Cb -0.08 -2.39 0.28 0.00 1.34 0.00 0.00 72.50 71.64 2cpy s THR 556 CO 0.44 0.00 1.62 0.50 -0.54 0.00 0.00 174.62 176.64 2cpy h LYS 557 N 1.80 0.02 -0.68 3.99 3.64 -2.00 0.60 116.57 123.95 2cpy h LYS 557 Ca -0.37 -0.00 0.14 0.00 -1.27 0.00 0.00 60.65 59.15 2cpy h LYS 557 Cb 1.27 -0.01 -0.13 0.00 -0.41 0.00 0.00 32.23 32.96 2cpy h LYS 557 CO 0.60 0.02 -0.12 1.98 -2.27 0.00 0.00 179.45 179.65 2cpy h MET 558 N 0.03 0.03 0.04 1.90 4.05 -2.00 -0.02 114.93 118.95 2cpy h MET 558 Ca 0.36 -0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.79 2cpy h MET 558 Cb 0.57 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.35 2cpy h MET 558 CO -0.71 0.02 -0.13 -0.44 0.23 0.00 0.00 176.91 175.88 2cpy h ASP 559 N 0.03 -0.37 0.08 1.39 5.19 -1.29 -3.00 116.42 118.46 2cpy h ASP 559 Ca 0.34 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.82 2cpy h ASP 559 Cb 0.54 0.15 -0.05 0.00 0.18 0.00 0.00 39.33 40.15 2cpy h ASP 559 CO -0.67 -0.19 -0.37 0.58 -3.12 0.00 0.00 179.24 175.47 2cpy h VAL 560 N -0.24 0.22 -0.86 -1.35 2.07 -0.71 -1.45 116.25 113.93 2cpy h VAL 560 Ca 0.03 0.00 0.36 0.00 0.82 0.00 0.00 66.70 67.91 2cpy h VAL 560 Cb 0.28 0.22 -0.15 0.00 -1.52 0.00 0.00 31.29 30.12 2cpy h VAL 560 CO -0.10 0.00 0.46 0.18 0.02 0.00 0.00 177.57 178.13 2cpy n LEU 561 N -5.44 0.30 0.07 2.57 4.77 -0.17 0.41 117.00 119.51 2cpy n LEU 561 Ca -0.06 1.43 -0.11 0.00 -0.03 0.00 0.00 56.01 57.23 2cpy n LEU 561 Cb 0.36 -0.70 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 2cpy n LEU 561 CO 0.20 -1.60 0.43 -0.61 -1.33 0.00 0.00 177.39 174.48 2cpy h GLN 562 N 0.00 -0.23 -1.36 3.23 4.15 -1.22 -3.14 115.11 116.54 2cpy h GLN 562 Ca 0.73 0.02 0.39 0.00 0.77 0.00 0.00 58.65 60.56 2cpy h GLN 562 Cb 1.93 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 29.62 2cpy h GLN 562 CO -0.66 0.18 1.13 0.35 -1.93 0.00 0.00 178.83 177.90 2cpy h PHE 563 N -0.83 0.00 -0.54 3.99 3.57 0.42 1.69 116.94 125.24 2cpy h PHE 563 Ca -0.02 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.21 2cpy h PHE 563 Cb 0.52 0.00 -0.16 0.00 2.79 0.00 0.00 35.95 39.10 2cpy h PHE 563 CO 0.07 0.00 0.33 1.28 -2.23 0.00 0.00 178.31 177.77 2cpy n LEU 564 N -3.77 4.98 -4.66 0.59 4.77 -0.81 -4.95 117.00 113.15 2cpy n LEU 564 Ca 0.30 -2.61 -0.46 0.00 -0.03 0.00 0.00 56.01 53.21 2cpy n LEU 564 Cb 1.55 -0.68 -0.04 0.00 -2.33 0.00 0.00 43.42 41.92 2cpy n LEU 564 CO 0.36 0.77 1.56 1.21 -1.33 0.00 0.00 177.39 179.97 2cpy n GLU 565 N -0.35 2.44 0.00 3.23 4.07 0.57 -2.44 120.64 128.16 2cpy n GLU 565 Ca 0.32 0.89 0.00 0.00 -0.06 0.00 0.00 57.16 58.31 2cpy n GLU 565 Cb 1.13 -2.82 0.00 0.00 -0.06 0.00 0.00 31.44 29.69 2cpy n GLU 565 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2cpy n GLY 566 N 4.58 3.57 3.68 8.31 0.00 -1.26 -5.08 105.19 118.98 2cpy n GLY 566 Ca 0.22 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 4.64 -1.19 -0.61 1.01 -1.02 -4.96 121.20 119.07 2cpy s ILE 567 Ca 0.00 1.94 -0.20 0.00 0.00 0.00 0.00 60.65 62.38 2cpy s ILE 567 Cb 0.00 -4.25 0.03 0.00 0.01 0.00 0.00 42.46 38.26 2cpy s ILE 567 CO 0.00 -0.04 1.72 -2.16 0.00 0.00 0.00 174.94 174.46 2cpy s PRO 568 N 2.38 3.56 0.02 2.79 0.04 -1.26 -4.93 135.00 137.59 2cpy s PRO 568 Ca 0.49 -1.56 0.02 0.00 0.04 0.00 0.00 61.00 60.00 2cpy s PRO 568 Cb -0.19 -5.42 -0.01 0.00 0.04 0.00 0.00 34.50 28.92 2cpy s PRO 568 CO 0.16 -2.61 -0.08 0.54 0.04 0.00 0.00 177.00 175.05 2cpy s VAL 569 N 5.90 0.60 0.72 -0.36 0.11 -1.26 -5.05 120.40 121.05 2cpy s VAL 569 Ca 0.56 -0.61 -0.11 0.00 -2.93 0.00 0.00 61.98 58.89 2cpy s VAL 569 Cb 0.02 -0.56 0.02 0.00 -1.53 0.00 0.00 36.38 34.33 2cpy s VAL 569 CO 0.04 -0.03 1.07 -0.62 -3.33 0.00 0.00 175.10 172.23 2cpy s ASP 570 N -0.71 5.23 0.18 3.54 -1.08 -1.26 -4.97 116.67 117.61 2cpy s ASP 570 Ca -0.01 1.49 -0.09 0.00 -0.52 0.00 0.00 52.55 53.42 2cpy s ASP 570 Cb -0.05 -2.34 0.07 0.00 -1.46 0.00 0.00 42.92 39.14 2cpy s ASP 570 CO 0.00 -1.52 1.63 1.05 0.52 0.00 0.00 175.17 176.85 2cpy h GLU 571 N -0.77 1.05 -0.10 4.34 -0.00 -2.01 -2.50 114.58 114.59 2cpy h GLU 571 Ca -0.45 -0.35 0.03 0.00 -0.00 0.00 0.00 59.36 58.59 2cpy h GLU 571 Cb 1.23 -0.09 -0.00 0.00 -0.00 0.00 0.00 28.75 29.89 2cpy h GLU 571 CO 0.58 1.05 0.26 -2.95 -0.00 0.00 0.00 179.01 177.95 2cpy h ASN 572 N 0.95 0.00 -0.19 3.06 -1.07 -2.01 0.38 115.58 116.70 2cpy h ASN 572 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.53 2cpy h ASN 572 Cb 0.61 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.86 2cpy h ASN 572 CO 0.04 0.00 0.00 0.00 0.07 0.00 0.00 177.43 177.54 2cpy n ALA 573 N -2.09 2.68 -3.96 4.14 0.00 -0.94 -4.60 120.51 115.74 2cpy n ALA 573 Ca -0.00 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.67 2cpy n ALA 573 Cb 0.34 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.64 2cpy n ALA 573 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2cpy s VAL 574 N -1.61 2.55 -0.42 0.00 1.01 0.13 -2.02 120.40 120.04 2cpy s VAL 574 Ca 0.15 -2.88 -0.26 0.00 0.00 0.00 0.00 61.98 58.99 2cpy s VAL 574 Cb 0.10 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.69 2cpy s VAL 574 CO 0.07 -0.72 0.92 -1.00 0.00 0.00 0.00 175.10 174.37 2cpy s HIS 575 N 0.23 2.99 -0.24 5.22 3.76 0.45 -4.94 115.29 122.76 2cpy s HIS 575 Ca 0.14 0.54 -0.10 0.00 -0.15 0.00 0.00 55.06 55.50 2cpy s HIS 575 Cb -0.23 -3.83 -0.05 0.00 1.11 0.00 0.00 32.58 29.58 2cpy s HIS 575 CO -0.03 -0.98 0.14 0.08 -0.85 0.00 0.00 174.74 173.09 2cpy s VAL 576 N 3.63 5.13 0.67 -0.90 1.01 -1.26 -0.00 120.40 128.68 2cpy s VAL 576 Ca 0.37 0.10 -0.15 0.00 0.00 0.00 0.00 61.98 62.30 2cpy s VAL 576 Cb -0.11 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.89 2cpy s VAL 576 CO 0.23 0.35 1.14 -0.76 0.00 0.00 0.00 175.10 176.06 2cpy s LEU 577 N 1.09 3.40 0.05 3.92 1.43 -0.81 -5.02 118.68 122.74 2cpy s LEU 577 Ca 0.07 2.12 -0.07 0.00 -1.03 0.00 0.00 54.13 55.21 2cpy s LEU 577 Cb -0.14 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.51 2cpy s LEU 577 CO 0.04 -1.78 0.15 0.68 0.23 0.00 0.00 176.35 175.67 2cpy s VAL 578 N -2.19 0.13 0.39 -1.59 -7.23 -1.26 -4.24 120.40 104.41 2cpy s VAL 578 Ca 0.70 -1.11 0.01 0.00 -1.81 0.00 0.00 61.98 59.77 2cpy s VAL 578 Cb -0.23 -1.08 0.01 0.00 0.56 0.00 0.00 36.38 35.64 2cpy s VAL 578 CO 0.41 -0.61 0.08 -0.90 -0.31 0.00 0.00 175.10 173.78 2cpy n ASP 579 N 0.45 2.85 -0.29 4.85 5.75 -1.26 -4.77 116.55 124.13 2cpy n ASP 579 Ca -0.17 -2.59 0.12 0.00 -0.01 0.00 0.00 54.79 52.13 2cpy n ASP 579 Cb 0.60 0.18 0.27 0.00 -1.03 0.00 0.00 41.12 41.15 2cpy n ASP 579 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 2cpy h ASN 580 N 0.79 0.08 -0.69 -1.12 2.35 -2.02 0.72 115.58 115.69 2cpy h ASN 580 Ca -0.30 0.18 -0.37 0.00 -0.55 0.00 0.00 56.30 55.26 2cpy h ASN 580 Cb 0.95 0.22 -0.21 0.00 0.05 0.00 0.00 38.32 39.33 2cpy h ASN 580 CO 0.49 -0.10 0.47 0.59 -1.65 0.00 0.00 177.43 177.23 2cpy n ASN 581 N -5.17 3.88 -3.82 5.81 4.13 -1.26 -4.89 115.26 113.94 2cpy n ASN 581 Ca 0.20 -3.14 -0.26 0.00 1.68 0.00 0.00 54.58 53.06 2cpy n ASN 581 Cb 0.64 -0.77 -0.07 0.00 -1.54 0.00 0.00 39.78 38.04 2cpy n ASN 581 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cpy n GLY 582 N -0.59 -0.16 0.13 7.41 0.00 0.25 -4.79 105.19 107.45 2cpy n GLY 582 Ca 0.42 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 46.33 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 -3.49 0.66 -0.02 1.61 6.02 -1.26 -4.80 117.38 116.11 2cpy n GLN 583 Ca -0.14 0.26 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2cpy n GLN 583 Cb 0.46 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 30.12 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 1.89 1.01 2.00 1.08 0.00 -1.26 -4.83 105.19 105.08 2cpy n GLY 584 Ca -0.42 -1.27 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 2cpy n GLY 584 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cpy n LEU 585 N -0.04 5.78 -4.09 0.99 4.77 -1.26 -4.64 117.00 118.52 2cpy n LEU 585 Ca 0.00 -3.26 -0.41 0.00 -0.03 0.00 0.00 56.01 52.31 2cpy n LEU 585 Cb 0.00 -1.25 -0.00 0.00 -2.33 0.00 0.00 43.42 39.84 2cpy n LEU 585 CO 0.00 1.48 -0.21 0.61 -1.33 0.00 0.00 177.39 177.94 2cpy n GLY 586 N 1.51 -0.64 3.63 -0.72 0.00 -1.26 -4.92 105.19 102.78 2cpy n GLY 586 Ca 0.33 0.28 -0.09 0.00 0.00 0.00 0.00 46.02 46.54 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 -7.27 0.73 -0.02 1.61 -0.21 -1.26 -3.56 119.66 109.68 2cpy s GLN 587 Ca 0.37 1.16 -0.08 0.00 0.02 0.00 0.00 55.36 56.84 2cpy s GLN 587 Cb -0.21 0.20 0.01 0.00 1.00 0.00 0.00 33.01 34.01 2cpy s GLN 587 CO 0.90 -0.14 0.17 0.00 -2.12 0.00 0.00 175.29 174.10 2cpy s ALA 588 N 1.34 -0.41 0.00 6.09 0.00 -0.87 -1.93 121.76 125.98 2cpy s ALA 588 Ca -0.08 0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.01 2cpy s ALA 588 Cb -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2cpy s ALA 588 CO -0.15 -0.18 -0.06 -0.51 0.00 0.00 0.00 175.76 174.87 2cpy s LEU 589 N -0.96 3.23 -0.11 0.00 1.43 1.00 -0.70 118.68 122.57 2cpy s LEU 589 Ca -0.10 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 2cpy s LEU 589 Cb -0.06 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.33 2cpy s LEU 589 CO 0.01 0.28 -0.16 -0.69 0.23 0.00 0.00 176.35 176.03 2cpy s VAL 590 N -1.01 1.56 -0.11 -1.59 1.01 0.73 -0.41 120.40 120.57 2cpy s VAL 590 Ca 0.17 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 2cpy s VAL 590 Cb -0.11 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2cpy s VAL 590 CO 0.08 0.45 0.03 -1.58 0.00 0.00 0.00 175.10 174.08 2cpy s GLN 591 N 0.88 3.29 0.31 2.72 0.74 -0.86 -0.54 119.66 126.20 2cpy s GLN 591 Ca -0.09 -0.36 0.10 0.00 0.05 0.00 0.00 55.36 55.06 2cpy s GLN 591 Cb -0.15 -2.94 -0.06 0.00 1.10 0.00 0.00 33.01 30.96 2cpy s GLN 591 CO -0.00 0.60 -0.13 -0.06 -0.55 0.00 0.00 175.29 175.15 2cpy s PHE 592 N -0.57 2.29 -0.08 1.67 0.08 0.10 -4.84 117.98 116.65 2cpy s PHE 592 Ca 0.10 -0.47 -0.25 0.00 0.12 0.00 0.00 56.93 56.43 2cpy s PHE 592 Cb -0.12 -1.20 -0.26 0.00 -0.57 0.00 0.00 43.02 40.87 2cpy s PHE 592 CO 0.02 0.59 0.92 0.87 -0.10 0.00 0.00 175.22 177.52 2cpy h LYS 593 N 2.15 0.15 -4.27 0.44 1.57 -1.97 -3.46 116.57 111.18 2cpy h LYS 593 Ca -0.41 -0.20 -0.14 0.00 -1.87 0.00 0.00 60.65 58.03 2cpy h LYS 593 Cb 1.25 0.07 -0.16 0.00 0.08 0.00 0.00 32.23 33.47 2cpy h LYS 593 CO 0.66 1.01 -0.68 -0.80 -0.57 0.00 0.00 179.45 179.07 2cpy s ASN 594 N -6.42 0.56 0.64 0.86 0.01 -1.26 -5.01 114.94 104.31 2cpy s ASN 594 Ca -0.16 -0.95 0.27 0.00 -0.71 0.00 0.00 52.86 51.30 2cpy s ASN 594 Cb -0.00 0.18 1.44 0.00 0.41 0.00 0.00 41.25 43.27 2cpy s ASN 594 CO 0.74 -0.55 1.83 -0.33 -1.51 0.00 0.00 177.10 177.28 2cpy h GLU 595 N 3.27 0.00 -0.83 -0.60 4.39 -1.92 0.19 114.58 119.07 2cpy h GLU 595 Ca -0.34 0.00 0.20 0.00 0.34 0.00 0.00 59.36 59.56 2cpy h GLU 595 Cb 1.15 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.75 2cpy h GLU 595 CO 0.63 0.00 0.56 -0.44 -1.16 0.00 0.00 179.01 178.61 2cpy h ASP 596 N 0.00 0.27 0.21 1.42 3.32 -1.95 0.22 116.42 119.91 2cpy h ASP 596 Ca 0.09 0.03 -0.34 0.00 0.02 0.00 0.00 57.03 56.82 2cpy h ASP 596 Cb 1.00 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.47 2cpy h ASP 596 CO -0.00 0.12 -2.10 0.47 -1.72 0.00 0.00 179.24 176.01 2cpy n ASP 597 N -4.44 0.53 0.22 6.45 8.00 0.05 -4.40 116.55 122.96 2cpy n ASP 597 Ca 0.17 0.17 -0.14 0.00 0.71 0.00 0.00 54.79 55.71 2cpy n ASP 597 Cb 0.71 0.42 -0.08 0.00 -0.02 0.00 0.00 41.12 42.16 2cpy n ASP 597 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cpy h ALA 598 N 0.92 -0.58 -0.41 2.24 0.00 -1.15 -2.79 119.26 117.50 2cpy h ALA 598 Ca -0.44 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.40 2cpy h ALA 598 Cb 2.13 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 20.13 2cpy h ALA 598 CO 0.05 -0.67 0.87 0.00 0.00 0.00 0.00 179.25 179.50 2cpy h ARG 599 N -0.89 0.00 0.00 0.00 3.08 -0.84 0.30 114.38 116.03 2cpy h ARG 599 Ca -0.06 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2cpy h ARG 599 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 2cpy h ARG 599 CO 0.10 0.00 -0.09 0.87 -1.07 0.00 0.00 179.97 179.78 2cpy h LYS 600 N 0.00 0.00 -0.99 0.04 1.57 -1.70 -3.23 116.57 112.26 2cpy h LYS 600 Ca 0.20 0.00 0.17 0.00 -1.87 0.00 0.00 60.65 59.15 2cpy h LYS 600 Cb 1.92 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 34.14 2cpy h LYS 600 CO -0.00 0.72 0.61 0.66 -0.57 0.00 0.00 179.45 180.87 2cpy h SER 601 N -1.00 0.77 0.48 0.86 4.64 -0.25 0.41 113.55 119.46 2cpy h SER 601 Ca -0.02 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 2cpy h SER 601 Cb 0.75 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2cpy h SER 601 CO -0.01 0.32 -0.15 1.05 -0.87 0.00 0.00 176.83 177.17 2cpy h GLU 602 N 0.78 0.00 0.00 4.77 4.11 -1.50 -1.75 114.58 120.98 2cpy h GLU 602 Ca 0.54 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.97 2cpy h GLU 602 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2cpy h GLU 602 CO -0.32 0.15 0.00 -2.13 0.07 0.00 0.00 179.01 176.78 2cpy n ARG 603 N -3.61 0.10 -0.56 1.06 0.63 0.14 -1.96 116.66 112.47 2cpy n ARG 603 Ca -0.01 0.33 0.09 0.00 -0.92 0.00 0.00 57.85 57.33 2cpy n ARG 603 Cb 0.28 -1.69 0.33 0.00 0.45 0.00 0.00 32.46 31.84 2cpy n ARG 603 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2cpy n LEU 604 N -1.88 4.39 -4.77 6.15 4.77 -0.66 -4.98 117.00 120.02 2cpy n LEU 604 Ca 0.03 -2.21 -0.40 0.00 -0.03 0.00 0.00 56.01 53.40 2cpy n LEU 604 Cb 0.21 -0.55 0.01 0.00 -2.33 0.00 0.00 43.42 40.76 2cpy n LEU 604 CO 0.17 0.77 1.05 -2.28 -1.33 0.00 0.00 177.39 175.77 2cpy s HIS 605 N -1.77 2.60 -1.19 -1.77 2.46 -0.83 -2.62 115.29 112.18 2cpy s HIS 605 Ca 0.47 1.29 -0.05 0.00 0.47 0.00 0.00 55.06 57.25 2cpy s HIS 605 Cb 0.30 -3.87 0.01 0.00 -0.13 0.00 0.00 32.58 28.89 2cpy s HIS 605 CO 0.23 -2.69 0.60 0.54 -2.47 0.00 0.00 174.74 170.96 2cpy n ARG 606 N 0.05 -4.52 -2.40 2.88 1.74 -0.99 -4.95 116.66 108.47 2cpy n ARG 606 Ca 0.04 0.70 -0.25 0.00 -0.77 0.00 0.00 57.85 57.57 2cpy n ARG 606 Cb 0.42 -5.18 0.05 0.00 -1.02 0.00 0.00 32.46 26.73 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 -5.60 2.51 -0.28 5.56 -0.14 -1.08 -4.80 119.74 115.90 2cpy s LYS 607 Ca 0.30 -0.34 -0.03 0.00 -1.36 0.00 0.00 55.97 54.54 2cpy s LYS 607 Cb -0.13 -2.29 0.03 0.00 -1.68 0.00 0.00 37.83 33.75 2cpy s LYS 607 CO 0.37 -0.92 -0.00 0.15 -0.76 0.00 0.00 175.35 174.19 2cpy s LYS 608 N -5.03 2.74 -0.27 1.68 1.02 -1.26 -0.25 119.74 118.37 2cpy s LYS 608 Ca 0.57 -1.06 -0.03 0.00 0.02 0.00 0.00 55.97 55.47 2cpy s LYS 608 Cb -0.11 -3.16 0.03 0.00 -0.52 0.00 0.00 37.83 34.07 2cpy s LYS 608 CO 0.43 -0.50 -0.02 -1.17 -0.92 0.00 0.00 175.35 173.17 2cpy s LEU 609 N 1.34 3.48 -1.46 3.17 0.20 -0.29 -4.63 118.68 120.50 2cpy s LEU 609 Ca -0.01 -0.92 -0.10 0.00 0.69 0.00 0.00 54.13 53.78 2cpy s LEU 609 Cb -0.18 -1.72 0.05 0.00 -0.43 0.00 0.00 46.19 43.91 2cpy s LEU 609 CO -0.01 -0.17 0.95 0.59 -0.29 0.00 0.00 176.35 177.41 2cpy n ASN 610 N 4.70 -5.47 -0.69 3.68 4.13 -1.26 -1.06 115.26 119.29 2cpy n ASN 610 Ca -0.15 -0.58 -0.07 0.00 1.68 0.00 0.00 54.58 55.45 2cpy n ASN 610 Cb 0.46 -4.36 -0.02 0.00 -1.54 0.00 0.00 39.78 34.32 2cpy n ASN 610 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cpy n GLY 611 N -1.72 0.47 2.73 7.41 0.00 -1.26 -5.01 105.19 107.80 2cpy n GLY 611 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.55 0.60 0.09 1.61 1.81 -0.22 -5.11 118.95 114.18 2cpy s ARG 612 Ca 0.00 -0.31 -0.31 0.00 -1.72 0.00 0.00 55.73 53.39 2cpy s ARG 612 Cb 0.00 -1.91 -0.09 0.00 -0.45 0.00 0.00 34.95 32.50 2cpy s ARG 612 CO 0.00 -0.59 1.77 -1.21 -0.68 0.00 0.00 175.30 174.59 2cpy s GLU 613 N 1.90 4.16 0.20 3.54 0.41 -1.26 -1.14 118.70 126.51 2cpy s GLU 613 Ca 0.00 2.49 0.08 0.00 -0.41 0.00 0.00 54.97 57.13 2cpy s GLU 613 Cb -0.16 -3.65 -0.04 0.00 -1.78 0.00 0.00 34.13 28.50 2cpy s GLU 613 CO -0.08 -0.81 0.01 0.00 -0.49 0.00 0.00 175.26 173.89 2cpy s ALA 614 N 2.86 3.21 -0.16 5.21 0.00 0.65 -4.69 121.76 128.84 2cpy s ALA 614 Ca 0.79 -1.44 0.01 0.00 0.00 0.00 0.00 51.96 51.32 2cpy s ALA 614 Cb -0.43 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 21.76 2cpy s ALA 614 CO 0.35 0.42 -0.18 -0.06 0.00 0.00 0.00 175.76 176.29 2cpy s PHE 615 N -1.88 2.54 -0.33 0.00 0.08 -0.67 -2.36 117.98 115.35 2cpy s PHE 615 Ca 0.29 -1.45 -0.10 0.00 0.12 0.00 0.00 56.93 55.79 2cpy s PHE 615 Cb -0.09 -1.78 0.01 0.00 -0.57 0.00 0.00 43.02 40.59 2cpy s PHE 615 CO 0.19 -0.73 0.16 0.08 -0.10 0.00 0.00 175.22 174.82 2cpy s VAL 616 N 1.29 4.48 -0.18 -0.44 1.01 -1.26 -1.80 120.40 123.50 2cpy s VAL 616 Ca 0.03 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 2cpy s VAL 616 Cb -0.13 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2cpy s VAL 616 CO -0.11 -0.06 0.02 -1.00 0.00 0.00 0.00 175.10 173.96 2cpy s HIS 617 N 1.57 3.13 -0.10 5.22 3.76 -0.69 -4.77 115.29 123.40 2cpy s HIS 617 Ca 0.03 -0.18 -0.25 0.00 -0.15 0.00 0.00 55.06 54.51 2cpy s HIS 617 Cb -0.18 -2.06 -0.03 0.00 1.11 0.00 0.00 32.58 31.43 2cpy s HIS 617 CO 0.06 -0.02 0.78 0.08 -0.85 0.00 0.00 174.74 174.78 2cpy s VAL 618 N 0.60 4.97 0.06 -0.90 1.01 -1.26 -1.60 120.40 123.28 2cpy s VAL 618 Ca 0.01 1.57 -0.04 0.00 0.00 0.00 0.00 61.98 63.52 2cpy s VAL 618 Cb -0.14 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 2cpy s VAL 618 CO 0.02 0.16 0.05 0.68 0.00 0.00 0.00 175.10 176.01 2cpy s VAL 619 N 1.32 0.18 0.57 2.92 -7.23 -0.55 -5.02 120.40 112.59 2cpy s VAL 619 Ca 0.39 -1.52 -0.19 0.00 -1.81 0.00 0.00 61.98 58.85 2cpy s VAL 619 Cb -0.18 -1.36 -0.05 0.00 0.56 0.00 0.00 36.38 35.36 2cpy s VAL 619 CO 0.17 -0.84 1.14 0.42 -0.31 0.00 0.00 175.10 175.68 2cpy s THR 620 N -3.68 3.08 0.25 5.32 -4.23 -1.26 -2.91 115.64 112.21 2cpy s THR 620 Ca 0.04 0.65 -0.08 0.00 -1.18 0.00 0.00 61.69 61.12 2cpy s THR 620 Cb 0.06 -3.24 0.30 0.00 1.34 0.00 0.00 72.50 70.96 2cpy s THR 620 CO -0.09 -0.17 1.62 0.25 -0.54 0.00 0.00 174.62 175.68 2cpy h LEU 621 N 0.97 -0.49 -0.75 4.79 5.85 -1.90 0.16 115.31 123.94 2cpy h LEU 621 Ca -0.50 0.21 0.17 0.00 0.84 0.00 0.00 57.88 58.61 2cpy h LEU 621 Cb 1.27 0.40 -0.13 0.00 0.37 0.00 0.00 40.66 42.57 2cpy h LEU 621 CO 0.56 -0.22 0.05 -0.08 -0.34 0.00 0.00 178.44 178.41 2cpy h GLU 622 N 0.06 0.13 -0.30 1.25 4.57 -1.91 0.59 114.58 118.97 2cpy h GLU 622 Ca 0.41 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.61 2cpy h GLU 622 Cb 0.70 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.24 2cpy h GLU 622 CO -0.73 0.09 0.13 0.22 -1.18 0.00 0.00 179.01 177.54 2cpy h ASP 623 N 0.14 0.18 -0.54 1.04 1.82 -1.04 -2.28 116.42 115.74 2cpy h ASP 623 Ca 0.42 0.02 0.07 0.00 -0.39 0.00 0.00 57.03 57.15 2cpy h ASP 623 Cb 0.73 -0.01 -0.06 0.00 0.68 0.00 0.00 39.33 40.68 2cpy h ASP 623 CO -0.63 0.14 0.21 -0.03 -1.61 0.00 0.00 179.24 177.32 2cpy h MET 624 N 0.28 0.39 -0.66 0.28 4.05 -0.62 -1.37 114.93 117.28 2cpy h MET 624 Ca 0.13 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.59 2cpy h MET 624 Cb 0.07 -0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 30.72 2cpy h MET 624 CO -0.11 0.26 0.36 -0.09 0.23 0.00 0.00 176.91 177.56 2cpy h ARG 625 N 0.40 0.64 0.75 0.39 2.43 -0.83 -2.01 114.38 116.16 2cpy h ARG 625 Ca 0.26 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2cpy h ARG 625 Cb 0.27 -0.15 0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2cpy h ARG 625 CO -0.25 0.43 -0.36 0.93 -1.51 0.00 0.00 179.97 179.21 2cpy h GLU 626 N 0.66 -0.98 -0.46 0.20 5.08 -0.79 -3.13 114.58 115.17 2cpy h GLU 626 Ca 0.30 0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.78 2cpy h GLU 626 Cb 0.20 0.22 -0.09 0.00 0.50 0.00 0.00 28.75 29.58 2cpy h GLU 626 CO -0.19 -0.64 -0.54 0.82 -1.00 0.00 0.00 179.01 177.47 2cpy h ILE 627 N -1.08 0.02 -0.86 3.13 2.04 -1.09 0.21 117.51 119.87 2cpy h ILE 627 Ca -0.10 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.93 2cpy h ILE 627 Cb 0.79 0.02 -0.16 0.00 -0.74 0.00 0.00 36.82 36.72 2cpy h ILE 627 CO 0.17 0.00 -0.21 1.21 0.00 0.00 0.00 178.15 179.32 2cpy n GLU 628 N -5.38 -0.08 -0.02 2.37 0.00 -0.77 0.00 120.64 116.76 2cpy n GLU 628 Ca -0.02 1.34 -0.13 0.00 0.00 0.00 0.00 57.16 58.35 2cpy n GLU 628 Cb 0.34 -2.01 -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 0.04 -3.25 5.31 1.57 -1.03 -3.40 116.57 115.82 2cpy h LYS 629 Ca 0.42 -0.03 -0.63 0.00 -1.87 0.00 0.00 60.65 58.54 2cpy h LYS 629 Cb 0.64 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.55 2cpy h LYS 629 CO -0.89 0.59 -0.66 0.54 -0.57 0.00 0.00 179.45 178.46 2cpy s ASN 630 N -5.83 4.11 0.45 0.86 4.22 0.10 -5.11 114.94 113.75 2cpy s ASN 630 Ca -0.16 -2.92 -0.21 0.00 -2.14 0.00 0.00 52.86 47.43 2cpy s ASN 630 Cb 0.01 -1.45 -0.09 0.00 1.28 0.00 0.00 41.25 41.01 2cpy s ASN 630 CO 0.69 -0.24 1.01 -2.16 -2.04 0.00 0.00 177.10 174.36 2cpy s PRO 631 N -0.12 4.00 1.01 3.55 0.04 0.01 -4.23 135.00 139.25 2cpy s PRO 631 Ca 0.17 1.30 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 2cpy s PRO 631 Cb -0.25 -2.19 0.21 0.00 0.04 0.00 0.00 34.50 32.31 2cpy s PRO 631 CO -0.00 -0.25 1.25 -1.25 0.04 0.00 0.00 177.00 176.78 2cpy s PRO 632 N -3.10 0.30 -0.11 0.56 0.04 -1.26 -5.05 135.00 126.39 2cpy s PRO 632 Ca 0.64 -0.24 -0.03 0.00 0.04 0.00 0.00 61.00 61.41 2cpy s PRO 632 Cb -0.15 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 2cpy s PRO 632 CO 0.19 -2.67 -0.13 0.00 0.04 0.00 0.00 177.00 174.43 2cpy n ALA 633 N -3.98 2.11 -2.43 8.56 0.00 -1.26 -5.03 120.51 118.47 2cpy n ALA 633 Ca 0.14 -0.45 -0.31 0.00 0.00 0.00 0.00 53.44 52.82 2cpy n ALA 633 Cb 0.60 0.32 -0.13 0.00 0.00 0.00 0.00 19.45 20.23 2cpy n ALA 633 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2cpy s GLN 634 N -2.21 2.16 -0.66 0.00 2.00 -1.26 -5.09 119.66 114.60 2cpy s GLN 634 Ca -0.15 -0.92 -0.08 0.00 -2.00 0.00 0.00 55.36 52.21 2cpy s GLN 634 Cb 0.05 -2.19 0.17 0.00 0.80 0.00 0.00 33.01 31.84 2cpy s GLN 634 CO 0.21 0.56 0.53 0.20 -0.50 0.00 0.00 175.29 176.30 2cpy s GLY 635 N -1.12 2.46 -0.79 2.59 0.00 -1.26 -5.02 107.32 104.18 2cpy s GLY 635 Ca 0.13 -3.13 -0.26 0.00 0.00 0.00 0.00 44.72 41.46 2cpy s GLY 635 CO 0.03 1.16 1.66 1.25 0.00 0.00 0.00 173.10 177.19 2cpy s LYS 636 N 0.31 2.93 0.40 2.90 2.36 -1.26 -4.98 119.74 122.40 2cpy s LYS 636 Ca 0.15 -0.13 -0.07 0.00 -2.55 0.00 0.00 55.97 53.37 2cpy s LYS 636 Cb -0.18 -4.67 -0.05 0.00 -1.05 0.00 0.00 37.83 31.88 2cpy s LYS 636 CO -0.05 -2.64 0.71 -1.12 1.55 0.00 0.00 175.35 173.81 2cpy s SER 637 N 6.40 6.41 0.17 1.43 0.01 -1.26 -5.10 113.70 121.76 2cpy s SER 637 Ca 0.56 0.93 -0.16 0.00 1.31 0.00 0.00 55.95 58.59 2cpy s SER 637 Cb -0.08 -2.24 0.02 0.00 0.21 0.00 0.00 66.02 63.94 2cpy s SER 637 CO 0.09 -0.40 0.45 -0.83 0.41 0.00 0.00 173.24 172.96 2cpy s GLY 638 N -3.50 -0.07 -0.96 3.44 0.00 -1.26 -5.10 107.32 99.87 2cpy s GLY 638 Ca 0.48 -0.26 -0.24 0.00 0.00 0.00 0.00 44.72 44.70 2cpy s GLY 638 CO 0.35 -0.35 1.61 2.56 0.00 0.00 0.00 173.10 177.27 2cpy s PRO 639 N -3.87 3.23 0.25 2.90 0.04 -1.26 -4.95 135.00 131.33 2cpy s PRO 639 Ca 0.08 -0.79 0.07 0.00 0.04 0.00 0.00 61.00 60.41 2cpy s PRO 639 Cb 0.00 -5.20 -0.05 0.00 0.04 0.00 0.00 34.50 29.29 2cpy s PRO 639 CO -0.05 -2.59 -0.10 -1.54 0.04 0.00 0.00 177.00 172.76 2cpy s SER 640 N 5.96 2.68 -0.18 6.66 1.04 -1.26 -5.14 113.70 123.47 2cpy s SER 640 Ca 0.54 -1.12 -0.12 0.00 0.48 0.00 0.00 55.95 55.73 2cpy s SER 640 Cb -0.03 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.89 2cpy s SER 640 CO -0.06 -0.27 0.22 -0.55 0.98 0.00 0.00 173.24 173.57 2cpy s SER 641 N -3.39 6.34 0.00 7.02 0.15 -1.26 -5.20 113.70 117.36 2cpy s SER 641 Ca 0.27 0.39 0.00 0.00 0.70 0.00 0.00 55.95 57.31 2cpy s SER 641 Cb 0.02 -2.14 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 2cpy s SER 641 CO 0.10 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.29