#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 6.17 0.05 1.61 0.15 -1.26 -4.95 113.70 115.47 2cpy s SER 530 Ca 0.00 -1.38 -0.27 0.00 0.70 0.00 0.00 55.95 55.00 2cpy s SER 530 Cb 0.00 -2.21 -0.17 0.00 -1.71 0.00 0.00 66.02 61.93 2cpy s SER 530 CO 0.00 -0.74 1.50 0.28 1.20 0.00 0.00 173.24 175.48 2cpy h SER 531 N 8.83 -0.38 0.00 5.45 0.02 -2.06 -3.46 113.55 121.94 2cpy h SER 531 Ca -0.29 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2cpy h SER 531 Cb 1.11 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2cpy h SER 531 CO 0.93 -0.16 0.00 0.61 -1.14 0.00 0.00 176.83 177.08 2cpy n GLY 532 N -0.89 0.87 3.59 -3.77 0.00 -1.26 -5.18 105.19 98.55 2cpy n GLY 532 Ca -0.10 0.58 -0.12 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 -0.51 -0.12 1.61 1.04 -1.26 -5.18 113.70 109.28 2cpy s SER 533 Ca 0.00 0.75 -0.22 0.00 0.48 0.00 0.00 55.95 56.97 2cpy s SER 533 Cb 0.00 0.68 0.05 0.00 0.10 0.00 0.00 66.02 66.86 2cpy s SER 533 CO 0.00 -0.33 0.53 -0.94 0.98 0.00 0.00 173.24 173.48 2cpy s SER 534 N -0.53 -0.51 0.00 7.02 1.04 -1.26 -5.14 113.70 114.32 2cpy s SER 534 Ca -0.02 0.78 0.00 0.00 0.48 0.00 0.00 55.95 57.19 2cpy s SER 534 Cb -0.02 0.78 0.00 0.00 0.10 0.00 0.00 66.02 66.88 2cpy s SER 534 CO 0.01 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2cpy n GLY 535 N 1.93 -0.40 3.20 7.32 0.00 -1.26 -5.09 105.19 110.88 2cpy n GLY 535 Ca -0.17 0.80 -0.40 0.00 0.00 0.00 0.00 46.02 46.25 2cpy n GLY 535 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cpy s GLU 536 N 0.00 3.60 0.00 1.61 8.01 -1.26 -4.90 118.70 125.76 2cpy s GLU 536 Ca 0.00 -3.22 0.00 0.00 0.01 0.00 0.00 54.97 51.76 2cpy s GLU 536 Cb 0.00 -4.18 0.00 0.00 -4.31 0.00 0.00 34.13 25.64 2cpy s GLU 536 CO 0.00 -1.25 0.00 0.41 0.01 0.00 0.00 175.26 174.43 2cpy n GLY 537 N 2.54 4.64 0.00 -1.39 0.00 -1.26 -5.09 105.19 104.63 2cpy n GLY 537 Ca 0.22 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2cpy n GLY 537 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cpy n ASP 538 N 0.00 3.59 -2.03 1.61 2.03 -1.26 -4.74 116.55 115.76 2cpy n ASP 538 Ca 0.00 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.09 2cpy n ASP 538 Cb 0.00 0.18 0.11 0.00 -0.72 0.00 0.00 41.12 40.69 2cpy n ASP 538 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2cpy n VAL 539 N -2.04 2.94 0.00 5.18 0.24 -1.26 -4.13 118.33 119.26 2cpy n VAL 539 Ca 0.00 -1.85 0.00 0.00 -2.04 0.00 0.00 64.34 60.45 2cpy n VAL 539 Cb 0.40 -0.85 0.00 0.00 -1.47 0.00 0.00 33.84 31.92 2cpy n VAL 539 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2cpy n ASN 540 N -0.61 2.12 -2.50 -1.34 4.13 -1.26 -4.81 115.26 110.99 2cpy n ASN 540 Ca 0.47 0.00 -0.36 0.00 1.68 0.00 0.00 54.58 56.38 2cpy n ASN 540 Cb 1.09 0.00 0.06 0.00 -1.54 0.00 0.00 39.78 39.39 2cpy n ASN 540 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2cpy n SER 541 N -2.20 7.58 -4.75 6.41 3.41 -1.26 -4.88 113.62 117.93 2cpy n SER 541 Ca 0.00 -3.76 -0.40 0.00 -0.26 0.00 0.00 58.87 54.45 2cpy n SER 541 Cb 0.30 -1.02 -0.05 0.00 -0.26 0.00 0.00 64.21 63.19 2cpy n SER 541 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cpy s ALA 542 N -3.77 3.37 -1.13 7.33 0.00 -1.26 -4.96 121.76 121.33 2cpy s ALA 542 Ca 0.59 0.30 -0.21 0.00 0.00 0.00 0.00 51.96 52.64 2cpy s ALA 542 Cb 0.47 -3.01 -0.06 0.00 0.00 0.00 0.00 23.12 20.52 2cpy s ALA 542 CO -0.14 0.07 1.92 1.63 0.00 0.00 0.00 175.76 179.23 2cpy n LYS 543 N 2.75 2.00 -0.86 0.00 5.02 -1.26 -4.44 118.16 121.37 2cpy n LYS 543 Ca -0.02 -2.50 -0.05 0.00 -2.02 0.00 0.00 58.31 53.72 2cpy n LYS 543 Cb 0.50 -3.45 0.24 0.00 -0.02 0.00 0.00 35.03 32.29 2cpy n LYS 543 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2cpy n VAL 544 N 6.87 2.71 -3.95 -0.18 0.24 -1.25 -4.59 118.33 118.18 2cpy n VAL 544 Ca 0.47 -2.13 -0.09 0.00 -2.04 0.00 0.00 64.34 60.55 2cpy n VAL 544 Cb 0.44 -0.34 -0.11 0.00 -1.47 0.00 0.00 33.84 32.37 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 -1.62 -0.51 0.02 0.00 0.00 -0.05 -0.80 121.76 118.79 2cpy s ALA 546 Ca -0.14 0.67 0.01 0.00 0.00 0.00 0.00 51.96 52.50 2cpy s ALA 546 Cb -0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2cpy s ALA 546 CO -0.01 -0.12 0.07 -1.58 0.00 0.00 0.00 175.76 174.12 2cpy s HIS 547 N 0.41 3.24 -0.16 0.00 5.04 -0.15 -0.77 115.29 122.90 2cpy s HIS 547 Ca -0.02 0.16 0.00 0.00 -1.54 0.00 0.00 55.06 53.66 2cpy s HIS 547 Cb -0.04 -1.70 0.03 0.00 0.04 0.00 0.00 32.58 30.91 2cpy s HIS 547 CO -0.02 0.53 -0.09 0.42 -2.34 0.00 0.00 174.74 173.24 2cpy s ILE 548 N -1.23 1.32 0.49 0.89 1.01 0.17 -1.35 121.20 122.50 2cpy s ILE 548 Ca 0.24 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.28 2cpy s ILE 548 Cb -0.12 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 2cpy s ILE 548 CO 0.15 0.29 0.05 0.42 0.00 0.00 0.00 174.94 175.85 2cpy s THR 549 N 1.56 0.90 -1.08 2.92 -4.23 -0.90 -1.47 115.64 113.34 2cpy s THR 549 Ca 0.03 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.50 2cpy s THR 549 Cb -0.14 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2cpy s THR 549 CO -0.09 0.00 0.92 0.59 -0.54 0.00 0.00 174.62 175.50 2cpy n ASN 550 N -1.33 -3.57 -4.42 3.99 4.13 -1.22 -2.13 115.26 110.70 2cpy n ASN 550 Ca -0.16 -0.50 -0.25 0.00 1.68 0.00 0.00 54.58 55.35 2cpy n ASN 550 Cb 0.66 -4.42 -0.11 0.00 -1.54 0.00 0.00 39.78 34.37 2cpy n ASN 550 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2cpy s ILE 551 N -3.29 2.29 -0.11 2.41 -4.36 -1.20 -3.96 121.20 112.97 2cpy s ILE 551 Ca 0.21 -2.11 -0.30 0.00 -0.26 0.00 0.00 60.65 58.19 2cpy s ILE 551 Cb -0.09 -2.12 -0.02 0.00 1.25 0.00 0.00 42.46 41.47 2cpy s ILE 551 CO 0.62 -0.22 1.25 -2.16 0.24 0.00 0.00 174.94 174.67 2cpy s PRO 552 N -2.91 4.28 0.00 0.37 0.04 -1.26 -4.41 135.00 131.11 2cpy s PRO 552 Ca 0.22 1.69 0.08 0.00 0.04 0.00 0.00 61.00 63.03 2cpy s PRO 552 Cb -0.07 -3.68 0.42 0.00 0.04 0.00 0.00 34.50 31.22 2cpy s PRO 552 CO 0.11 -0.60 1.12 1.97 0.04 0.00 0.00 177.00 179.64 2cpy n PHE 553 N 6.01 0.00 -0.12 0.56 1.16 -1.26 -2.34 117.46 121.47 2cpy n PHE 553 Ca 0.13 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.60 2cpy n PHE 553 Cb 0.45 -0.27 0.02 0.00 -1.61 0.00 0.00 39.48 38.08 2cpy n PHE 553 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 2cpy h SER 554 N 0.00 0.93 -4.39 5.98 0.02 -1.93 -3.45 113.55 110.70 2cpy h SER 554 Ca 0.00 -0.37 -0.50 0.00 -0.84 0.00 0.00 61.79 60.08 2cpy h SER 554 Cb 0.07 -0.26 0.09 0.00 0.14 0.00 0.00 62.40 62.44 2cpy h SER 554 CO 0.00 1.14 0.39 0.27 -1.14 0.00 0.00 176.83 177.49 2cpy s ILE 555 N -4.53 3.66 0.40 3.27 -4.36 -0.99 -5.09 121.20 113.55 2cpy s ILE 555 Ca -0.10 0.54 0.03 0.00 -0.26 0.00 0.00 60.65 60.85 2cpy s ILE 555 Cb 0.12 -3.44 -0.01 0.00 1.25 0.00 0.00 42.46 40.38 2cpy s ILE 555 CO 0.86 -0.71 0.10 0.35 0.24 0.00 0.00 174.94 175.78 2cpy n THR 556 N -3.08 0.00 -0.24 8.37 -2.24 -1.26 -5.00 114.28 110.82 2cpy n THR 556 Ca 0.07 -2.16 -0.06 0.00 -2.27 0.00 0.00 64.05 59.62 2cpy n THR 556 Cb 0.56 0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 2cpy n THR 556 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2cpy n LYS 557 N -0.92 -0.25 -0.24 -0.78 3.00 -1.26 -1.06 118.16 116.64 2cpy n LYS 557 Ca -0.09 1.21 -0.06 0.00 -0.00 0.00 0.00 58.31 59.36 2cpy n LYS 557 Cb 0.56 -1.79 -0.06 0.00 0.00 0.00 0.00 35.03 33.75 2cpy n LYS 557 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 2cpy n MET 558 N -4.33 -0.26 -0.08 1.64 1.56 -1.26 -0.10 117.12 114.30 2cpy n MET 558 Ca 0.01 1.06 -0.10 0.00 -0.27 0.00 0.00 57.70 58.40 2cpy n MET 558 Cb 0.15 -1.56 -0.04 0.00 2.15 0.00 0.00 33.22 33.92 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 -1.30 -0.82 6.12 3.32 -1.49 -0.51 116.42 121.74 2cpy h ASP 559 Ca 0.09 0.19 0.20 0.00 0.02 0.00 0.00 57.03 57.54 2cpy h ASP 559 Cb 0.24 0.56 -0.12 0.00 0.22 0.00 0.00 39.33 40.23 2cpy h ASP 559 CO -0.55 -0.37 0.24 0.58 -1.72 0.00 0.00 179.24 177.42 2cpy h VAL 560 N -0.36 0.44 -0.58 -1.35 2.07 0.26 0.44 116.25 117.17 2cpy h VAL 560 Ca 0.12 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.59 2cpy h VAL 560 Cb 0.58 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2cpy h VAL 560 CO -0.50 0.05 0.38 -0.07 0.02 0.00 0.00 177.57 177.45 2cpy h LEU 561 N 0.28 0.53 -0.36 2.57 3.38 0.63 -1.92 115.31 120.43 2cpy h LEU 561 Ca 0.49 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.40 2cpy h LEU 561 Cb 0.92 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2cpy h LEU 561 CO -0.56 0.36 -0.03 -0.61 0.09 0.00 0.00 178.44 177.69 2cpy h GLN 562 N 0.61 0.65 -0.83 1.13 4.15 0.44 -2.65 115.11 118.61 2cpy h GLN 562 Ca 0.24 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 2cpy h GLN 562 Cb 0.18 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 2cpy h GLN 562 CO -0.07 0.78 0.44 0.35 -1.93 0.00 0.00 178.83 178.40 2cpy h PHE 563 N 0.45 1.14 -0.41 3.99 3.57 -0.82 -1.59 116.94 123.27 2cpy h PHE 563 Ca 0.10 -0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.44 2cpy h PHE 563 Cb 0.50 -0.36 -0.08 0.00 2.79 0.00 0.00 35.95 38.80 2cpy h PHE 563 CO 0.04 0.79 0.17 1.28 -2.23 0.00 0.00 178.31 178.36 2cpy n LEU 564 N -4.34 4.21 -4.68 0.59 4.77 -0.81 -4.93 117.00 111.81 2cpy n LEU 564 Ca 0.09 -2.18 -0.42 0.00 -0.03 0.00 0.00 56.01 53.47 2cpy n LEU 564 Cb 0.10 -0.64 -0.03 0.00 -2.33 0.00 0.00 43.42 40.53 2cpy n LEU 564 CO 0.39 0.61 1.25 -0.70 -1.33 0.00 0.00 177.39 177.61 2cpy s GLU 565 N -1.84 4.23 0.00 3.23 2.12 -0.60 -2.88 118.70 122.96 2cpy s GLU 565 Ca 0.29 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.78 2cpy s GLU 565 Cb 0.24 -3.64 0.00 0.00 0.26 0.00 0.00 34.13 30.98 2cpy s GLU 565 CO 0.07 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.51 2cpy n GLY 566 N 3.87 0.57 3.53 -1.50 0.00 -1.26 -5.07 105.19 105.33 2cpy n GLY 566 Ca 0.15 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.95 4.81 -0.67 -0.61 1.01 -1.14 -4.98 121.20 118.67 2cpy s ILE 567 Ca 0.00 0.25 -0.35 0.00 0.00 0.00 0.00 60.65 60.55 2cpy s ILE 567 Cb 0.00 -4.21 -0.17 0.00 0.01 0.00 0.00 42.46 38.09 2cpy s ILE 567 CO 0.00 -0.57 2.41 -2.65 0.00 0.00 0.00 174.94 174.12 2cpy n PRO 568 N 6.31 0.34 -3.57 2.79 -0.02 -1.26 -4.87 135.00 134.71 2cpy n PRO 568 Ca -0.01 0.06 -0.14 0.00 -2.02 0.00 0.00 63.50 61.39 2cpy n PRO 568 Cb 0.48 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 31.97 2cpy n PRO 568 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2cpy s VAL 569 N 8.20 0.00 0.41 -1.45 0.11 -1.26 -4.85 120.40 121.56 2cpy s VAL 569 Ca 1.22 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 60.29 2cpy s VAL 569 Cb -1.12 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 32.73 2cpy s VAL 569 CO 0.51 0.00 0.61 -0.62 -3.33 0.00 0.00 175.10 172.27 2cpy s ASP 570 N -0.70 5.90 0.09 3.54 2.15 -1.26 -5.02 116.67 121.36 2cpy s ASP 570 Ca -0.04 0.17 -0.30 0.00 0.43 0.00 0.00 52.55 52.81 2cpy s ASP 570 Cb -0.02 -1.48 -0.14 0.00 -0.30 0.00 0.00 42.92 40.98 2cpy s ASP 570 CO 0.03 -0.60 1.64 -0.33 -0.17 0.00 0.00 175.17 175.74 2cpy h GLU 571 N 0.56 -0.63 -0.87 4.34 5.08 -2.01 -2.55 114.58 118.50 2cpy h GLU 571 Ca -0.46 0.04 0.22 0.00 -1.00 0.00 0.00 59.36 58.16 2cpy h GLU 571 Cb 1.25 0.14 -0.13 0.00 0.50 0.00 0.00 28.75 30.52 2cpy h GLU 571 CO 0.56 -0.42 0.33 -2.95 -1.00 0.00 0.00 179.01 175.54 2cpy h ASN 572 N -0.65 0.22 -1.29 1.42 -1.07 -2.01 0.24 115.58 112.44 2cpy h ASN 572 Ca -0.03 0.16 0.40 0.00 0.07 0.00 0.00 56.30 56.90 2cpy h ASN 572 Cb 0.57 0.17 -0.11 0.00 -2.07 0.00 0.00 38.32 36.87 2cpy h ASN 572 CO -0.01 -0.04 0.84 0.00 0.07 0.00 0.00 177.43 178.29 2cpy h ALA 573 N 1.71 2.70 -2.71 4.14 0.00 -1.75 -3.38 119.26 119.99 2cpy h ALA 573 Ca 0.54 0.09 -0.59 0.00 0.00 0.00 0.00 54.91 54.95 2cpy h ALA 573 Cb 1.03 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2cpy h ALA 573 CO -0.55 -1.27 -0.10 0.08 0.00 0.00 0.00 179.25 177.40 2cpy s VAL 574 N -5.30 4.89 -0.20 0.00 1.01 0.82 -1.49 120.40 120.13 2cpy s VAL 574 Ca -0.08 1.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.96 2cpy s VAL 574 Cb 0.28 -3.82 0.05 0.00 0.00 0.00 0.00 36.38 32.89 2cpy s VAL 574 CO 0.82 0.54 -0.04 -1.00 0.00 0.00 0.00 175.10 175.42 2cpy s HIS 575 N -0.94 1.94 0.19 5.22 3.76 -0.35 -4.98 115.29 120.14 2cpy s HIS 575 Ca 0.27 -1.37 -0.30 0.00 -0.15 0.00 0.00 55.06 53.51 2cpy s HIS 575 Cb -0.18 -1.40 -0.08 0.00 1.11 0.00 0.00 32.58 32.03 2cpy s HIS 575 CO 0.16 -0.69 0.97 0.08 -0.85 0.00 0.00 174.74 174.41 2cpy s VAL 576 N 1.55 4.17 0.66 -0.90 1.01 -1.26 -1.40 120.40 124.22 2cpy s VAL 576 Ca -0.03 2.00 -0.07 0.00 0.00 0.00 0.00 61.98 63.89 2cpy s VAL 576 Cb -0.17 -4.27 0.04 0.00 0.00 0.00 0.00 36.38 31.97 2cpy s VAL 576 CO -0.07 0.40 0.97 -0.76 0.00 0.00 0.00 175.10 175.65 2cpy s LEU 577 N -0.70 2.99 0.08 3.92 1.43 -0.85 -4.99 118.68 120.57 2cpy s LEU 577 Ca 0.44 0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 2cpy s LEU 577 Cb -0.26 -3.35 0.01 0.00 0.03 0.00 0.00 46.19 42.63 2cpy s LEU 577 CO 0.32 -1.36 0.25 0.68 0.23 0.00 0.00 176.35 176.48 2cpy s VAL 578 N -3.15 0.11 0.34 -1.59 -7.23 -1.26 -4.61 120.40 103.01 2cpy s VAL 578 Ca 0.57 -0.93 0.01 0.00 -1.81 0.00 0.00 61.98 59.82 2cpy s VAL 578 Cb -0.11 -1.19 0.01 0.00 0.56 0.00 0.00 36.38 35.66 2cpy s VAL 578 CO 0.45 -0.52 0.07 -0.90 -0.31 0.00 0.00 175.10 173.90 2cpy n ASP 579 N 0.10 2.70 -0.31 4.85 5.75 -1.26 -4.83 116.55 123.56 2cpy n ASP 579 Ca -0.16 -2.38 0.09 0.00 -0.01 0.00 0.00 54.79 52.32 2cpy n ASP 579 Cb 0.62 0.16 0.21 0.00 -1.03 0.00 0.00 41.12 41.07 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 0.69 -0.49 1.13 -1.12 2.35 -2.02 0.98 115.58 117.11 2cpy h ASN 580 Ca -0.26 0.24 -0.10 0.00 -0.55 0.00 0.00 56.30 55.63 2cpy h ASN 580 Cb 0.83 0.44 -0.01 0.00 0.05 0.00 0.00 38.32 39.62 2cpy h ASN 580 CO 0.43 -0.27 -0.49 -1.13 -1.65 0.00 0.00 177.43 174.32 2cpy h ASN 581 N 0.05 0.00 0.00 5.81 -1.24 -2.01 -3.47 115.58 114.71 2cpy h ASN 581 Ca 0.50 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.51 2cpy h ASN 581 Cb 0.92 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.97 2cpy h ASN 581 CO -0.82 0.49 0.00 0.61 -1.29 0.00 0.00 177.43 176.42 2cpy n GLY 582 N 0.76 2.98 0.35 1.57 0.00 0.34 -4.91 105.19 106.28 2cpy n GLY 582 Ca 0.01 -0.13 0.10 0.00 0.00 0.00 0.00 46.02 46.00 2cpy n GLY 582 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2cpy h GLN 583 N 0.00 0.00 0.00 1.61 1.08 -1.92 -3.36 115.11 112.52 2cpy h GLN 583 Ca 0.00 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2cpy h GLN 583 Cb 0.00 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2cpy h GLN 583 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 2cpy n GLY 584 N -1.57 3.19 0.22 3.46 0.00 -1.26 -4.89 105.19 104.34 2cpy n GLY 584 Ca 0.19 -1.43 0.13 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 0.00 0.99 3.38 -1.88 -3.43 115.31 114.37 2cpy h LEU 585 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cpy h LEU 585 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2cpy h LEU 585 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2cpy n GLY 586 N 0.95 0.62 3.34 0.83 0.00 -1.26 -4.72 105.19 104.95 2cpy n GLY 586 Ca 0.04 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.93 0.83 -0.16 1.61 -0.21 -1.26 -3.25 119.66 116.29 2cpy s GLN 587 Ca 0.00 -0.07 -0.23 0.00 0.02 0.00 0.00 55.36 55.07 2cpy s GLN 587 Cb 0.00 0.38 0.06 0.00 1.00 0.00 0.00 33.01 34.45 2cpy s GLN 587 CO 0.00 -0.25 0.60 0.00 -2.12 0.00 0.00 175.29 173.52 2cpy s ALA 588 N -1.45 -1.50 0.27 6.09 0.00 -0.54 -2.00 121.76 122.63 2cpy s ALA 588 Ca -0.12 1.46 0.07 0.00 0.00 0.00 0.00 51.96 53.38 2cpy s ALA 588 Cb -0.03 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2cpy s ALA 588 CO 0.05 -0.31 0.21 -0.51 0.00 0.00 0.00 175.76 175.20 2cpy s LEU 589 N -0.27 3.74 -0.06 0.00 1.43 -0.49 -0.66 118.68 122.37 2cpy s LEU 589 Ca -0.04 -0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 52.71 2cpy s LEU 589 Cb -0.03 -2.29 0.04 0.00 0.03 0.00 0.00 46.19 43.94 2cpy s LEU 589 CO 0.04 -0.11 0.11 -0.69 0.23 0.00 0.00 176.35 175.93 2cpy s VAL 590 N -2.18 -0.13 -0.33 -1.59 1.01 0.05 -1.21 120.40 116.02 2cpy s VAL 590 Ca 0.35 0.28 -0.06 0.00 0.00 0.00 0.00 61.98 62.55 2cpy s VAL 590 Cb -0.07 -0.21 0.04 0.00 0.00 0.00 0.00 36.38 36.14 2cpy s VAL 590 CO 0.25 0.12 0.09 -1.58 0.00 0.00 0.00 175.10 173.98 2cpy s GLN 591 N 1.67 2.60 0.42 2.72 0.74 -0.55 -0.87 119.66 126.38 2cpy s GLN 591 Ca -0.03 -1.19 0.01 0.00 0.05 0.00 0.00 55.36 54.21 2cpy s GLN 591 Cb -0.12 -3.41 -0.01 0.00 1.10 0.00 0.00 33.01 30.57 2cpy s GLN 591 CO -0.05 -0.65 0.62 -0.06 -0.55 0.00 0.00 175.29 174.60 2cpy s PHE 592 N 1.38 3.22 -0.14 1.67 0.08 0.19 -4.75 117.98 119.64 2cpy s PHE 592 Ca -0.02 0.16 -0.26 0.00 0.12 0.00 0.00 56.93 56.93 2cpy s PHE 592 Cb -0.19 -2.22 -0.23 0.00 -0.57 0.00 0.00 43.02 39.80 2cpy s PHE 592 CO 0.02 -0.26 0.69 0.87 -0.10 0.00 0.00 175.22 176.44 2cpy h LYS 593 N 0.51 0.00 -5.30 0.44 1.79 -1.89 -3.44 116.57 108.68 2cpy h LYS 593 Ca -0.46 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 57.62 2cpy h LYS 593 Cb 1.25 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 31.74 2cpy h LYS 593 CO 0.57 0.91 -0.73 -0.80 -1.08 0.00 0.00 179.45 178.31 2cpy s ASN 594 N -6.18 2.03 0.55 0.86 0.01 -1.26 -4.95 114.94 106.00 2cpy s ASN 594 Ca -0.18 -0.94 0.25 0.00 -0.71 0.00 0.00 52.86 51.29 2cpy s ASN 594 Cb -0.03 -0.06 1.46 0.00 0.41 0.00 0.00 41.25 43.04 2cpy s ASN 594 CO 0.63 -0.23 2.05 -0.33 -1.51 0.00 0.00 177.10 177.71 2cpy h GLU 595 N 3.02 0.00 -0.43 -0.60 5.08 -1.93 -1.00 114.58 118.72 2cpy h GLU 595 Ca -0.38 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.11 2cpy h GLU 595 Cb 1.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 2cpy h GLU 595 CO 0.58 0.00 0.66 -0.44 -1.00 0.00 0.00 179.01 178.81 2cpy h ASP 596 N 0.00 0.00 0.02 1.42 3.32 -1.95 0.22 116.42 119.45 2cpy h ASP 596 Ca 0.16 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.83 2cpy h ASP 596 Cb 0.69 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.19 2cpy h ASP 596 CO -0.00 0.00 -2.16 0.47 -1.72 0.00 0.00 179.24 175.83 2cpy n ASP 597 N -3.31 1.97 0.15 6.45 8.00 -0.38 -4.36 116.55 125.06 2cpy n ASP 597 Ca 0.08 0.22 -0.14 0.00 0.71 0.00 0.00 54.79 55.67 2cpy n ASP 597 Cb 0.82 -0.76 -0.07 0.00 -0.02 0.00 0.00 41.12 41.09 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 -0.49 -0.35 -0.46 2.24 0.00 -1.12 -1.40 119.26 117.68 2cpy h ALA 598 Ca -0.55 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 54.43 2cpy h ALA 598 Cb 1.68 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 2cpy h ALA 598 CO -0.22 -0.71 0.76 0.00 0.00 0.00 0.00 179.25 179.08 2cpy h ARG 599 N -0.37 0.00 0.05 0.00 3.08 -0.87 1.03 114.38 117.30 2cpy h ARG 599 Ca -0.01 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.73 2cpy h ARG 599 Cb 0.33 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 2cpy h ARG 599 CO -0.01 0.00 -1.72 0.87 -1.07 0.00 0.00 179.97 178.04 2cpy h LYS 600 N 0.00 0.10 -0.23 0.04 1.57 -1.48 -3.34 116.57 113.23 2cpy h LYS 600 Ca 0.22 -0.17 -0.12 0.00 -1.87 0.00 0.00 60.65 58.71 2cpy h LYS 600 Cb 1.74 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.10 2cpy h LYS 600 CO -0.00 0.78 -0.37 0.66 -0.57 0.00 0.00 179.45 179.94 2cpy h SER 601 N 0.03 0.54 0.63 0.86 4.64 0.17 -2.68 113.55 117.73 2cpy h SER 601 Ca -0.30 -0.23 -0.03 0.00 -0.47 0.00 0.00 61.79 60.76 2cpy h SER 601 Cb 2.01 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.94 2cpy h SER 601 CO 0.09 0.87 -0.12 1.05 -0.87 0.00 0.00 176.83 177.85 2cpy h GLU 602 N 0.43 0.00 0.00 4.77 4.11 -1.33 -2.19 114.58 120.38 2cpy h GLU 602 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2cpy h GLU 602 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2cpy h GLU 602 CO 0.07 0.12 0.00 -0.09 0.07 0.00 0.00 179.01 179.18 2cpy h ARG 603 N 0.00 0.00 -0.57 1.06 2.43 -1.59 -1.71 114.38 114.00 2cpy h ARG 603 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2cpy h ARG 603 Cb 0.47 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2cpy h ARG 603 CO 0.02 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.76 2cpy n LEU 604 N -2.93 2.90 -4.74 3.80 4.77 -0.82 -4.95 117.00 115.03 2cpy n LEU 604 Ca -0.00 -1.46 -0.37 0.00 -0.03 0.00 0.00 56.01 54.14 2cpy n LEU 604 Cb 0.23 -0.43 0.05 0.00 -2.33 0.00 0.00 43.42 40.94 2cpy n LEU 604 CO 0.24 0.52 0.91 -2.28 -1.33 0.00 0.00 177.39 175.45 2cpy s HIS 605 N -1.68 2.19 -1.49 -1.77 2.46 -0.65 -2.83 115.29 111.51 2cpy s HIS 605 Ca 0.30 1.46 -0.10 0.00 0.47 0.00 0.00 55.06 57.19 2cpy s HIS 605 Cb 0.19 -3.69 0.07 0.00 -0.13 0.00 0.00 32.58 29.02 2cpy s HIS 605 CO 0.15 -2.79 0.83 0.54 -2.47 0.00 0.00 174.74 171.00 2cpy n ARG 606 N -1.61 -4.82 -3.61 2.88 1.74 -0.89 -4.95 116.66 105.40 2cpy n ARG 606 Ca 0.14 0.55 -0.29 0.00 -0.77 0.00 0.00 57.85 57.48 2cpy n ARG 606 Cb 0.48 -5.26 -0.04 0.00 -1.02 0.00 0.00 32.46 26.62 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 -6.52 3.59 -0.62 5.56 -0.14 -1.13 -4.80 119.74 115.68 2cpy s LYS 607 Ca 0.46 -0.16 -0.21 0.00 -1.36 0.00 0.00 55.97 54.70 2cpy s LYS 607 Cb -0.23 -2.80 0.09 0.00 -1.68 0.00 0.00 37.83 33.21 2cpy s LYS 607 CO 0.85 0.38 0.82 0.15 -0.76 0.00 0.00 175.35 176.79 2cpy s LYS 608 N -3.11 3.07 -0.38 1.68 1.02 -1.26 -0.29 119.74 120.47 2cpy s LYS 608 Ca 0.41 -1.10 -0.12 0.00 0.02 0.00 0.00 55.97 55.18 2cpy s LYS 608 Cb -0.11 -4.25 0.02 0.00 -0.52 0.00 0.00 37.83 32.97 2cpy s LYS 608 CO 0.27 -1.66 0.24 -1.17 -0.92 0.00 0.00 175.35 172.11 2cpy s LEU 609 N 3.29 4.80 -1.72 3.17 0.20 -0.50 -4.42 118.68 123.50 2cpy s LEU 609 Ca 0.16 -0.88 -0.00 0.00 0.69 0.00 0.00 54.13 54.10 2cpy s LEU 609 Cb -0.21 -2.08 0.00 0.00 -0.43 0.00 0.00 46.19 43.47 2cpy s LEU 609 CO 0.08 -0.38 0.01 0.59 -0.29 0.00 0.00 176.35 176.36 2cpy n ASN 610 N 5.06 -5.75 0.00 3.68 4.13 -1.26 -1.19 115.26 119.93 2cpy n ASN 610 Ca -0.12 -0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.14 2cpy n ASN 610 Cb 0.47 -4.79 0.00 0.00 -1.54 0.00 0.00 39.78 33.92 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 -1.01 0.44 2.87 7.41 0.00 -1.26 -5.04 105.19 108.59 2cpy n GLY 611 Ca -0.24 -0.97 -0.27 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.43 1.28 -0.31 1.61 0.52 -0.34 -5.09 118.95 114.20 2cpy s ARG 612 Ca 0.00 -0.32 -0.28 0.00 -0.52 0.00 0.00 55.73 54.61 2cpy s ARG 612 Cb 0.00 -1.71 -0.05 0.00 0.52 0.00 0.00 34.95 33.72 2cpy s ARG 612 CO 0.00 -0.37 2.18 -1.21 0.02 0.00 0.00 175.30 175.92 2cpy s GLU 613 N 1.73 2.92 0.29 3.54 2.02 -1.26 -1.41 118.70 126.52 2cpy s GLU 613 Ca 0.03 1.73 -0.07 0.00 0.02 0.00 0.00 54.97 56.68 2cpy s GLU 613 Cb -0.14 -4.39 -0.06 0.00 0.10 0.00 0.00 34.13 29.64 2cpy s GLU 613 CO -0.08 -2.35 0.59 0.00 0.02 0.00 0.00 175.26 173.44 2cpy s ALA 614 N 8.96 3.57 -0.17 5.21 0.00 0.60 -4.76 121.76 135.18 2cpy s ALA 614 Ca 0.95 -0.44 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 2cpy s ALA 614 Cb -0.27 -2.39 0.04 0.00 0.00 0.00 0.00 23.12 20.50 2cpy s ALA 614 CO 0.32 0.26 -0.08 -0.06 0.00 0.00 0.00 175.76 176.21 2cpy s PHE 615 N -2.07 1.93 -0.14 0.00 0.08 -0.91 -2.10 117.98 114.77 2cpy s PHE 615 Ca 0.46 -1.20 -0.07 0.00 0.12 0.00 0.00 56.93 56.23 2cpy s PHE 615 Cb -0.11 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.88 2cpy s PHE 615 CO 0.28 -0.65 0.11 0.08 -0.10 0.00 0.00 175.22 174.94 2cpy s VAL 616 N 1.56 5.23 -0.13 -0.44 1.01 -1.26 -2.12 120.40 124.26 2cpy s VAL 616 Ca 0.01 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.09 2cpy s VAL 616 Cb -0.15 -3.30 0.03 0.00 0.00 0.00 0.00 36.38 32.96 2cpy s VAL 616 CO -0.08 0.56 -0.04 -1.00 0.00 0.00 0.00 175.10 174.54 2cpy s HIS 617 N -0.56 1.28 -0.08 5.22 3.76 -0.46 -4.88 115.29 119.57 2cpy s HIS 617 Ca 0.12 -0.70 -0.30 0.00 -0.15 0.00 0.00 55.06 54.03 2cpy s HIS 617 Cb -0.12 -1.12 -0.02 0.00 1.11 0.00 0.00 32.58 32.43 2cpy s HIS 617 CO 0.02 -0.51 1.08 0.08 -0.85 0.00 0.00 174.74 174.56 2cpy s VAL 618 N 1.77 4.58 0.23 -0.90 1.01 -1.26 -0.97 120.40 124.86 2cpy s VAL 618 Ca 0.03 1.87 0.04 0.00 0.00 0.00 0.00 61.98 63.92 2cpy s VAL 618 Cb -0.14 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.02 2cpy s VAL 618 CO -0.07 0.01 0.15 1.33 0.00 0.00 0.00 175.10 176.51 2cpy n VAL 619 N 4.56 0.00 -2.53 2.92 0.24 0.02 -4.98 118.33 118.56 2cpy n VAL 619 Ca 0.09 -1.55 -0.23 0.00 -2.04 0.00 0.00 64.34 60.61 2cpy n VAL 619 Cb 0.48 0.69 0.09 0.00 -1.47 0.00 0.00 33.84 33.63 2cpy n VAL 619 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2cpy s THR 620 N -2.74 2.29 0.18 3.34 -4.23 -1.26 -2.58 115.64 110.63 2cpy s THR 620 Ca 0.21 -0.55 -0.09 0.00 -1.18 0.00 0.00 61.69 60.08 2cpy s THR 620 Cb 0.01 -2.74 0.04 0.00 1.34 0.00 0.00 72.50 71.15 2cpy s THR 620 CO 0.15 0.00 1.61 0.25 -0.54 0.00 0.00 174.62 176.08 2cpy h LEU 621 N -0.42 1.00 -0.63 4.79 5.85 -1.90 -2.63 115.31 121.36 2cpy h LEU 621 Ca -0.39 -0.33 0.02 0.00 0.84 0.00 0.00 57.88 58.01 2cpy h LEU 621 Cb 1.28 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 2cpy h LEU 621 CO 0.46 1.12 0.40 -0.08 -0.34 0.00 0.00 178.44 180.00 2cpy h GLU 622 N 0.88 0.78 -0.61 1.25 4.81 -1.95 -1.09 114.58 118.66 2cpy h GLU 622 Ca 0.14 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 2cpy h GLU 622 Cb 0.68 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 2cpy h GLU 622 CO 0.05 0.52 0.16 -0.44 -0.73 0.00 0.00 179.01 178.57 2cpy h ASP 623 N 0.81 0.89 -0.09 1.04 3.32 -1.93 -2.07 116.42 118.38 2cpy h ASP 623 Ca 0.25 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 2cpy h ASP 623 Cb -0.03 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.29 2cpy h ASP 623 CO -0.08 0.85 0.02 -0.03 -1.72 0.00 0.00 179.24 178.28 2cpy h MET 624 N 0.91 0.15 -0.06 3.56 4.05 -1.03 -1.43 114.93 121.08 2cpy h MET 624 Ca 0.20 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 2cpy h MET 624 Cb 0.30 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.08 2cpy h MET 624 CO -0.00 0.34 0.00 -0.09 0.23 0.00 0.00 176.91 177.39 2cpy h ARG 625 N -0.07 0.08 0.26 0.39 9.65 -1.08 -0.18 114.38 123.42 2cpy h ARG 625 Ca 0.03 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 2cpy h ARG 625 Cb 0.26 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.82 2cpy h ARG 625 CO 0.00 0.09 -0.12 0.93 2.80 0.00 0.00 179.97 183.66 2cpy h GLU 626 N 0.08 -0.33 -0.41 0.20 4.39 -1.09 -3.17 114.58 114.25 2cpy h GLU 626 Ca 0.02 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.78 2cpy h GLU 626 Cb 0.05 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2cpy h GLU 626 CO 0.00 -0.00 0.20 0.82 -1.16 0.00 0.00 179.01 178.86 2cpy h ILE 627 N -0.95 0.96 -0.72 3.13 2.04 -1.10 -1.69 117.51 119.18 2cpy h ILE 627 Ca -0.04 -0.14 0.14 0.00 1.00 0.00 0.00 64.86 65.83 2cpy h ILE 627 Cb 0.48 0.53 -0.14 0.00 -0.74 0.00 0.00 36.82 36.96 2cpy h ILE 627 CO 0.06 0.07 -0.23 -0.08 0.00 0.00 0.00 178.15 177.97 2cpy h GLU 628 N 0.40 -0.04 0.11 2.37 4.81 -1.13 -0.32 114.58 120.78 2cpy h GLU 628 Ca 0.17 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2cpy h GLU 628 Cb 0.09 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2cpy h GLU 628 CO -0.13 -0.03 -0.05 0.87 -0.73 0.00 0.00 179.01 178.94 2cpy h LYS 629 N -0.04 -0.14 -3.65 1.92 1.57 -1.44 -3.39 116.57 111.40 2cpy h LYS 629 Ca 0.33 0.01 -0.63 0.00 -1.87 0.00 0.00 60.65 58.48 2cpy h LYS 629 Cb 0.55 0.03 -0.40 0.00 0.08 0.00 0.00 32.23 32.49 2cpy h LYS 629 CO -0.76 0.16 -0.69 0.54 -0.57 0.00 0.00 179.45 178.13 2cpy s ASN 630 N -5.34 4.26 0.60 0.86 4.22 -0.51 -5.11 114.94 113.93 2cpy s ASN 630 Ca -0.15 -2.59 -0.15 0.00 -2.14 0.00 0.00 52.86 47.84 2cpy s ASN 630 Cb 0.03 -1.44 -0.04 0.00 1.28 0.00 0.00 41.25 41.09 2cpy s ASN 630 CO 0.63 -0.29 1.04 -2.16 -2.04 0.00 0.00 177.10 174.28 2cpy s PRO 631 N 0.32 3.38 0.82 3.55 0.04 -0.25 -4.36 135.00 138.51 2cpy s PRO 631 Ca 0.15 1.07 -0.12 0.00 0.04 0.00 0.00 61.00 62.14 2cpy s PRO 631 Cb -0.23 -2.05 0.09 0.00 0.04 0.00 0.00 34.50 32.35 2cpy s PRO 631 CO -0.04 -0.75 1.14 -1.25 0.04 0.00 0.00 177.00 176.14 2cpy s PRO 632 N -4.34 1.85 -0.25 0.56 0.04 -1.26 -5.04 135.00 126.55 2cpy s PRO 632 Ca 0.61 0.32 -0.14 0.00 0.04 0.00 0.00 61.00 61.83 2cpy s PRO 632 Cb -0.14 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.37 2cpy s PRO 632 CO 0.41 -1.71 -0.34 0.00 0.04 0.00 0.00 177.00 175.39 2cpy n ALA 633 N -3.44 1.23 -0.10 8.56 0.00 -1.26 -4.79 120.51 120.72 2cpy n ALA 633 Ca 0.07 -1.02 -0.23 0.00 0.00 0.00 0.00 53.44 52.26 2cpy n ALA 633 Cb 0.59 0.14 -0.12 0.00 0.00 0.00 0.00 19.45 20.06 2cpy n ALA 633 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2cpy n GLN 634 N -4.23 0.64 0.00 0.00 6.02 -1.26 -5.10 117.38 113.45 2cpy n GLN 634 Ca -0.47 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 2cpy n GLN 634 Cb 0.82 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 30.47 2cpy n GLN 634 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cpy n GLY 635 N 1.76 2.28 3.77 1.08 0.00 -1.26 -5.07 105.19 107.76 2cpy n GLY 635 Ca -0.42 -1.06 -0.38 0.00 0.00 0.00 0.00 46.02 44.15 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 -3.45 4.42 0.03 1.61 2.47 -1.26 -4.97 119.74 118.60 2cpy s LYS 636 Ca 0.00 1.63 -0.23 0.00 -1.56 0.00 0.00 55.97 55.82 2cpy s LYS 636 Cb 0.00 -2.87 -0.16 0.00 -1.46 0.00 0.00 37.83 33.34 2cpy s LYS 636 CO 0.00 0.06 1.42 0.66 0.16 0.00 0.00 175.35 177.65 2cpy h SER 637 N 3.19 0.16 -0.96 1.43 4.64 -2.06 -3.50 113.55 116.44 2cpy h SER 637 Ca -0.47 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 60.49 2cpy h SER 637 Cb 1.21 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2cpy h SER 637 CO 0.65 0.48 0.00 0.61 -0.87 0.00 0.00 176.83 177.70 2cpy n GLY 638 N -0.14 0.77 3.55 -0.77 0.00 -1.26 -5.04 105.19 102.31 2cpy n GLY 638 Ca -0.07 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 2cpy n GLY 638 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cpy s PRO 639 N -2.00 3.04 0.20 1.61 0.04 -1.26 -4.96 135.00 131.67 2cpy s PRO 639 Ca 0.00 -0.03 -0.27 0.00 0.04 0.00 0.00 61.00 60.74 2cpy s PRO 639 Cb 0.00 -4.27 -0.16 0.00 0.04 0.00 0.00 34.50 30.10 2cpy s PRO 639 CO 0.00 -2.32 0.48 -1.13 0.04 0.00 0.00 177.00 174.07 2cpy n SER 640 N 10.33 -1.28 -4.92 6.66 3.41 -1.26 -4.93 113.62 121.63 2cpy n SER 640 Ca 0.09 1.07 -0.30 0.00 -0.26 0.00 0.00 58.87 59.47 2cpy n SER 640 Cb 0.50 -0.91 -0.04 0.00 -0.26 0.00 0.00 64.21 63.50 2cpy n SER 640 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2cpy s SER 641 N -0.96 6.41 0.00 4.04 1.04 -1.26 -5.29 113.70 117.67 2cpy s SER 641 Ca 0.61 0.39 0.00 0.00 0.48 0.00 0.00 55.95 57.43 2cpy s SER 641 Cb -0.88 -2.01 0.00 0.00 0.10 0.00 0.00 66.02 63.23 2cpy s SER 641 CO 0.54 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.46