#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n7j s ASP 515 N 0.00 7.17 -0.19 3.54 -1.08 -1.26 -4.96 116.67 119.89 1n7j s ASP 515 Ca 0.00 1.39 0.14 0.00 -0.52 0.00 0.00 52.55 53.56 1n7j s ASP 515 Cb 0.00 -2.45 -0.21 0.00 -1.46 0.00 0.00 42.92 38.80 1n7j s ASP 515 CO 0.00 0.05 0.02 -1.54 0.52 0.00 0.00 175.17 174.22 1n7j n SER 516 N 2.69 0.81 -0.23 -0.34 3.41 -1.26 -4.64 113.62 114.08 1n7j n SER 516 Ca -0.04 -0.02 0.03 0.00 -0.26 0.00 0.00 58.87 58.59 1n7j n SER 516 Cb 0.50 0.74 0.15 0.00 -0.26 0.00 0.00 64.21 65.34 1n7j n SER 516 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n7j h ALA 517 N 0.75 0.86 0.07 7.33 0.00 -1.99 -2.91 119.26 123.37 1n7j h ALA 517 Ca -0.49 0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1n7j h ALA 517 Cb 2.06 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 19.98 1n7j h ALA 517 CO 0.01 -0.30 -0.46 -1.35 0.00 0.00 0.00 179.25 177.15 1n7j h PRO 518 N 0.30 -0.63 -0.26 0.00 0.11 -2.00 0.21 132.00 129.73 1n7j h PRO 518 Ca 0.37 0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.54 1n7j h PRO 518 Cb 0.58 0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1n7j h PRO 518 CO -0.44 -0.42 0.14 0.78 -0.21 0.00 0.00 178.00 177.84 1n7j h GLY 519 N -0.66 0.35 0.19 -0.55 0.00 -1.85 -1.41 103.07 99.14 1n7j h GLY 519 Ca 0.02 -0.10 0.09 0.00 0.00 0.00 0.00 47.33 47.34 1n7j h GLY 519 CO -0.29 0.09 -0.01 1.46 0.00 0.00 0.00 176.54 177.80 1n7j h GLN 520 N 0.30 0.11 -0.79 4.80 4.20 -1.29 0.54 115.11 122.98 1n7j h GLN 520 Ca 0.10 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.87 1n7j h GLN 520 Cb 0.01 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.71 1n7j h GLN 520 CO -0.06 0.07 0.48 0.00 -0.67 0.00 0.00 178.83 178.65 1n7j h ALA 521 N 1.44 1.08 -0.17 3.87 0.00 -0.18 0.15 119.26 125.45 1n7j h ALA 521 Ca 0.25 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1n7j h ALA 521 Cb 0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1n7j h ALA 521 CO -0.41 0.20 0.03 0.00 0.00 0.00 0.00 179.25 179.06 1n7j h ALA 522 N 1.38 0.16 0.40 0.00 0.00 0.12 0.22 119.26 121.55 1n7j h ALA 522 Ca 0.35 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1n7j h ALA 522 Cb 0.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1n7j h ALA 522 CO -0.17 -0.41 -0.20 0.28 0.00 0.00 0.00 179.25 178.74 1n7j h VAL 523 N 0.09 0.59 -0.78 0.00 2.07 -0.27 0.09 116.25 118.04 1n7j h VAL 523 Ca 0.07 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.70 1n7j h VAL 523 Cb 0.07 0.59 -0.08 0.00 -1.52 0.00 0.00 31.29 30.36 1n7j h VAL 523 CO -0.10 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.89 1n7j h ALA 524 N 0.05 1.12 0.70 1.67 0.00 -0.54 -1.13 119.26 121.13 1n7j h ALA 524 Ca -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1n7j h ALA 524 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1n7j h ALA 524 CO 0.09 -0.02 -0.36 1.03 0.00 0.00 0.00 179.25 179.99 1n7j h SER 525 N 0.65 -0.86 -0.73 0.00 0.87 -0.21 -3.03 113.55 110.23 1n7j h SER 525 Ca 0.40 0.04 0.16 0.00 -1.23 0.00 0.00 61.79 61.15 1n7j h SER 525 Cb 0.45 0.23 -0.11 0.00 -0.44 0.00 0.00 62.40 62.53 1n7j h SER 525 CO -0.29 -0.59 0.14 0.00 -0.53 0.00 0.00 176.83 175.55 1n7j h ALA 526 N -0.68 0.91 0.00 6.23 0.00 -0.30 -0.81 119.26 124.61 1n7j h ALA 526 Ca -0.09 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1n7j h ALA 526 Cb 0.76 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1n7j h ALA 526 CO 0.14 -0.37 0.00 1.88 0.00 0.00 0.00 179.25 180.91 1n7j h TYR 527 N 0.23 0.00 0.00 0.00 -1.99 -1.12 -2.67 116.97 111.41 1n7j h TYR 527 Ca 0.41 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.14 1n7j h TYR 527 Cb 0.72 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.45 1n7j h TYR 527 CO -0.29 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 178.91 1n7j n GLN 528 N -2.36 0.19 -0.12 4.88 1.13 -0.31 -1.27 117.38 119.52 1n7j n GLN 528 Ca 0.01 0.15 0.04 0.00 -1.94 0.00 0.00 57.00 55.26 1n7j n GLN 528 Cb 0.17 -1.50 0.10 0.00 0.11 0.00 0.00 30.24 29.12 1n7j n GLN 528 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1n7j n ARG 529 N -1.24 2.84 -2.14 -1.09 5.12 -1.01 -5.02 116.66 114.12 1n7j n ARG 529 Ca 0.06 -1.92 -0.42 0.00 -1.93 0.00 0.00 57.85 53.64 1n7j n ARG 529 Cb 0.08 -1.22 -0.03 0.00 -1.16 0.00 0.00 32.46 30.14 1n7j n ARG 529 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1n7j s PHE 530 N -1.23 2.97 -0.48 -1.55 5.36 -0.40 -3.60 117.98 119.06 1n7j s PHE 530 Ca 0.16 0.80 -0.04 0.00 -0.96 0.00 0.00 56.93 56.88 1n7j s PHE 530 Cb 0.10 -3.73 0.13 0.00 -0.34 0.00 0.00 43.02 39.18 1n7j s PHE 530 CO 0.08 -2.67 0.30 -1.21 -1.46 0.00 0.00 175.22 170.27 1n7j s GLU 531 N 1.80 2.27 0.22 10.12 2.02 -0.28 -5.01 118.70 129.84 1n7j s GLU 531 Ca 0.66 -1.98 -0.19 0.00 0.02 0.00 0.00 54.97 53.48 1n7j s GLU 531 Cb -0.36 -3.71 0.20 0.00 0.10 0.00 0.00 34.13 30.36 1n7j s GLU 531 CO 0.29 -1.13 1.56 -1.35 0.02 0.00 0.00 175.26 174.65 1n7j h PRO 532 N 7.90 -0.04 -0.53 0.39 0.11 -1.90 -0.87 132.00 137.06 1n7j h PRO 532 Ca -0.12 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.03 1n7j h PRO 532 Cb 1.03 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 1n7j h PRO 532 CO 0.74 -0.03 0.30 0.00 -0.21 0.00 0.00 178.00 178.80 1n7j h ARG 533 N -0.04 0.56 -0.61 1.05 2.47 -1.96 0.15 114.38 116.00 1n7j h ARG 533 Ca 0.31 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.99 1n7j h ARG 533 Cb 0.58 -0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.74 1n7j h ARG 533 CO -0.91 0.37 0.36 0.00 0.56 0.00 0.00 179.97 180.35 1n7j h ALA 534 N 1.26 0.78 0.07 0.04 0.00 -1.59 0.16 119.26 119.97 1n7j h ALA 534 Ca 0.22 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1n7j h ALA 534 Cb 0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1n7j h ALA 534 CO -0.13 0.27 -0.09 -0.92 0.00 0.00 0.00 179.25 178.38 1n7j h TYR 535 N 0.82 -0.22 -0.74 0.00 3.20 -0.63 -0.95 116.97 118.45 1n7j h TYR 535 Ca 0.22 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.14 1n7j h TYR 535 Cb -0.00 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.30 1n7j h TYR 535 CO -0.02 -0.13 0.45 -0.07 -1.64 0.00 0.00 178.16 176.75 1n7j h LEU 536 N -0.18 0.71 -0.67 2.82 3.38 -0.42 -0.99 115.31 119.97 1n7j h LEU 536 Ca 0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1n7j h LEU 536 Cb 0.19 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1n7j h LEU 536 CO -0.04 0.47 0.28 -0.09 0.09 0.00 0.00 178.44 179.15 1n7j h ARG 537 N 0.85 0.99 -0.02 1.13 2.43 -0.64 0.98 114.38 120.10 1n7j h ARG 537 Ca 0.32 -0.17 -0.18 0.00 -0.81 0.00 0.00 59.98 59.13 1n7j h ARG 537 Cb 0.12 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1n7j h ARG 537 CO -0.15 0.82 -0.78 -0.91 -1.51 0.00 0.00 179.97 177.43 1n7j h ASN 538 N 0.94 0.28 0.00 -3.80 2.35 -0.65 -3.18 115.58 111.52 1n7j h ASN 538 Ca 0.22 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1n7j h ASN 538 Cb 0.19 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1n7j h ASN 538 CO -0.02 0.96 -1.08 0.59 -1.65 0.00 0.00 177.43 176.23 1n7j n ASN 539 N -3.74 1.72 0.00 5.81 3.02 -0.42 -4.71 115.26 116.94 1n7j n ASN 539 Ca -0.03 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 1n7j n ASN 539 Cb 0.74 1.29 0.00 0.00 -0.61 0.00 0.00 39.78 41.20 1n7j n ASN 539 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1n7j n TYR 540 N -1.61 0.00 -3.94 3.10 4.02 0.32 -4.43 117.16 114.63 1n7j n TYR 540 Ca -0.00 -0.23 -0.22 0.00 -0.01 0.00 0.00 57.90 57.44 1n7j n TYR 540 Cb 0.23 -0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.48 1n7j n TYR 540 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1n7j s ALA 541 N -0.45 3.69 0.75 -0.72 0.00 -1.12 -4.22 121.76 119.68 1n7j s ALA 541 Ca 0.00 -1.72 -0.15 0.00 0.00 0.00 0.00 51.96 50.09 1n7j s ALA 541 Cb 0.00 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.17 1n7j s ALA 541 CO 0.00 0.03 1.19 -2.30 0.00 0.00 0.00 175.76 174.68 1n7j n PRO 542 N -1.27 0.50 0.14 0.00 -0.02 -1.26 0.13 135.00 133.21 1n7j n PRO 542 Ca -0.02 0.24 0.01 0.00 -2.02 0.00 0.00 63.50 61.70 1n7j n PRO 542 Cb 0.60 -2.43 0.11 0.00 -0.02 0.00 0.00 33.50 31.76 1n7j n PRO 542 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1n7j h PRO 543 N -0.40 0.00 -0.02 0.52 0.13 -1.93 -3.42 132.00 126.89 1n7j h PRO 543 Ca -0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 1n7j h PRO 543 Cb 1.32 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 1n7j h PRO 543 CO 0.48 0.59 -0.10 0.00 -0.23 0.00 0.00 178.00 178.74 1n7j h ARG 544 N 0.00 0.02 -0.19 0.86 3.08 -1.84 -1.19 114.38 115.12 1n7j h ARG 544 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1n7j h ARG 544 Cb 1.28 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1n7j h ARG 544 CO 0.08 0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.52 1n7j n GLY 545 N -1.21 0.01 3.50 0.04 0.00 0.34 -4.29 105.19 103.58 1n7j n GLY 545 Ca -0.02 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1n7j n GLY 545 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n7j s ASP 546 N -1.18 6.31 -0.02 1.61 2.15 -0.45 -4.41 116.67 120.68 1n7j s ASP 546 Ca 0.20 -0.50 0.08 0.00 0.43 0.00 0.00 52.55 52.77 1n7j s ASP 546 Cb 0.11 -2.36 0.28 0.00 -0.30 0.00 0.00 42.92 40.64 1n7j s ASP 546 CO 0.15 -1.01 1.17 0.18 -0.17 0.00 0.00 175.17 175.50 1n7j n LEU 547 N 6.76 1.86 -0.03 -1.34 4.77 -1.26 -3.95 117.00 123.81 1n7j n LEU 547 Ca -0.01 -0.93 -0.15 0.00 -0.03 0.00 0.00 56.01 54.88 1n7j n LEU 547 Cb 0.47 -0.28 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 1n7j n LEU 547 CO 0.58 0.40 0.40 0.00 -1.33 0.00 0.00 177.39 177.44 1n7j s ASN 549 N -6.28 6.20 0.56 0.00 3.84 -1.25 -4.83 114.94 113.17 1n7j s ASN 549 Ca -0.16 2.33 0.33 0.00 0.21 0.00 0.00 52.86 55.57 1n7j s ASN 549 Cb 0.01 -2.53 1.56 0.00 -0.55 0.00 0.00 41.25 39.74 1n7j s ASN 549 CO 0.73 -1.30 2.07 1.55 -2.79 0.00 0.00 177.10 177.37 1n7j h PRO 550 N 11.67 0.00 -0.90 0.43 0.13 -1.93 -2.64 132.00 138.76 1n7j h PRO 550 Ca -0.45 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.19 1n7j h PRO 550 Cb 1.22 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.07 1n7j h PRO 550 CO 0.95 0.06 0.55 0.09 -0.23 0.00 0.00 178.00 179.43 1n7j n ASN 551 N -3.26 3.99 -4.98 1.44 3.02 -1.26 -4.69 115.26 109.52 1n7j n ASN 551 Ca -0.01 -3.66 -0.20 0.00 -0.03 0.00 0.00 54.58 50.68 1n7j n ASN 551 Cb 0.25 -0.82 0.02 0.00 -0.61 0.00 0.00 39.78 38.62 1n7j n ASN 551 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1n7j s GLY 552 N -1.57 1.96 0.16 7.41 0.00 -1.00 -4.99 107.32 109.30 1n7j s GLY 552 Ca 0.56 -1.83 -0.08 0.00 0.00 0.00 0.00 44.72 43.37 1n7j s GLY 552 CO 0.08 -1.66 1.50 -2.08 0.00 0.00 0.00 173.10 170.94 1n7j h VAL 553 N 0.56 1.28 0.78 1.40 2.07 -1.89 -2.64 116.25 117.81 1n7j h VAL 553 Ca -0.36 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 65.54 1n7j h VAL 553 Cb 1.28 1.45 0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1n7j h VAL 553 CO 0.47 0.52 -0.39 1.23 0.02 0.00 0.00 177.57 179.42 1n7j h GLY 554 N 0.86 -1.13 0.29 2.17 0.00 -1.89 0.15 103.07 103.52 1n7j h GLY 554 Ca 0.05 0.43 0.10 0.00 0.00 0.00 0.00 47.33 47.91 1n7j h GLY 554 CO 0.09 -0.41 0.17 -2.55 0.00 0.00 0.00 176.54 173.85 1n7j h PRO 555 N -1.07 0.32 -0.27 4.80 0.11 -1.84 -0.67 132.00 133.37 1n7j h PRO 555 Ca -0.10 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.02 1n7j h PRO 555 Cb 0.83 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.84 1n7j h PRO 555 CO 0.16 0.21 0.07 2.35 -0.21 0.00 0.00 178.00 180.58 1n7j h TRP 556 N 0.33 0.12 0.45 0.65 7.01 -1.15 0.16 115.95 123.52 1n7j h TRP 556 Ca 0.31 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.30 1n7j h TRP 556 Cb 0.42 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.47 1n7j h TRP 556 CO -0.21 0.05 -0.24 0.87 -2.79 0.00 0.00 178.44 176.12 1n7j h LYS 557 N 0.18 -0.61 -0.82 2.65 1.57 -0.00 -1.51 116.57 118.02 1n7j h LYS 557 Ca 0.12 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 59.01 1n7j h LYS 557 Cb 0.11 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 1n7j h LYS 557 CO -0.15 -0.41 0.54 -0.07 -0.57 0.00 0.00 179.45 178.79 1n7j h LEU 558 N -0.64 0.79 -0.59 2.94 3.38 -0.92 -1.12 115.31 119.16 1n7j h LEU 558 Ca -0.06 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1n7j h LEU 558 Cb 0.50 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1n7j h LEU 558 CO 0.08 0.50 0.14 -0.09 0.09 0.00 0.00 178.44 179.17 1n7j h ARG 559 N 0.89 0.94 -0.23 1.13 2.43 -0.44 0.15 114.38 119.26 1n7j h ARG 559 Ca 0.36 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1n7j h ARG 559 Cb 0.24 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1n7j h ARG 559 CO -0.13 0.87 0.10 0.00 -1.51 0.00 0.00 179.97 179.31 1n7j h LEU 561 N 0.23 -0.12 0.59 0.00 3.38 -1.06 -2.39 115.31 115.94 1n7j h LEU 561 Ca 0.08 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1n7j h LEU 561 Cb 0.13 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1n7j h LEU 561 CO -0.01 0.03 -0.49 0.00 0.09 0.00 0.00 178.44 178.05 1n7j h ALA 562 N 0.62 -1.16 -0.97 1.53 0.00 -0.58 -2.22 119.26 116.48 1n7j h ALA 562 Ca -0.01 -0.21 0.24 0.00 0.00 0.00 0.00 54.91 54.92 1n7j h ALA 562 Cb 0.22 0.68 -0.12 0.00 0.00 0.00 0.00 17.79 18.56 1n7j h ALA 562 CO 0.02 -1.19 0.53 1.96 0.00 0.00 0.00 179.25 180.58 1n7j h GLN 563 N -1.06 0.51 0.17 0.00 4.20 -0.89 -0.75 115.11 117.28 1n7j h GLN 563 Ca -0.07 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1n7j h GLN 563 Cb 0.90 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1n7j h GLN 563 CO -0.01 0.34 -0.08 1.15 -0.67 0.00 0.00 178.83 179.56 1n7j h THR 564 N 0.52 0.95 0.00 -0.54 2.02 -1.06 -3.00 112.91 111.80 1n7j h THR 564 Ca 0.62 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1n7j h THR 564 Cb 1.17 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.91 1n7j h THR 564 CO -0.49 0.15 -0.13 -0.26 0.37 0.00 0.00 175.52 175.15 1n7j h PHE 565 N -0.55 0.00 0.00 3.16 -1.00 -1.00 -2.23 116.94 115.32 1n7j h PHE 565 Ca -0.02 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.74 1n7j h PHE 565 Cb 0.42 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.98 1n7j h PHE 565 CO 0.03 0.13 -0.08 0.00 -1.61 0.00 0.00 178.31 176.78 1n7j h ALA 566 N 1.87 1.33 0.00 2.45 0.00 -1.01 -0.28 119.26 123.62 1n7j h ALA 566 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1n7j h ALA 566 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1n7j h ALA 566 CO 0.02 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.62 1n7j n THR 567 N -3.66 0.38 -0.72 0.00 -2.24 -0.84 -4.86 114.28 102.34 1n7j n THR 567 Ca -0.02 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1n7j n THR 567 Cb 0.19 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.68 1n7j n THR 567 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n7j n GLY 568 N 0.52 0.12 0.15 3.38 0.00 -0.11 -4.81 105.19 104.43 1n7j n GLY 568 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 1n7j n GLY 568 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1n7j h GLU 569 N 0.33 0.00 -4.46 1.61 5.08 -1.80 -3.41 114.58 111.93 1n7j h GLU 569 Ca 0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1n7j h GLU 569 Cb 0.30 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 29.25 1n7j h GLU 569 CO 0.00 0.00 -0.49 0.08 -1.00 0.00 0.00 179.01 177.60 1n7j s VAL 570 N -3.16 4.00 0.37 3.13 1.01 -1.26 -5.03 120.40 119.46 1n7j s VAL 570 Ca 0.09 -1.54 -0.04 0.00 0.00 0.00 0.00 61.98 60.49 1n7j s VAL 570 Cb 0.09 -3.50 0.02 0.00 0.00 0.00 0.00 36.38 32.99 1n7j s VAL 570 CO 0.62 -0.54 0.56 -1.54 0.00 0.00 0.00 175.10 174.20 1n7j n SER 571 N 4.85 -1.58 0.00 3.32 3.41 -1.26 -4.94 113.62 117.41 1n7j n SER 571 Ca -0.09 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.62 1n7j n SER 571 Cb 0.42 2.87 0.00 0.00 -0.26 0.00 0.00 64.21 67.25 1n7j n SER 571 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n7j n GLY 572 N -0.59 0.85 0.18 5.00 0.00 -1.26 -4.84 105.19 104.54 1n7j n GLY 572 Ca -0.01 -1.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.03 1n7j n GLY 572 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n7j n ARG 573 N 0.00 0.49 -4.11 1.61 3.00 -1.26 -4.39 116.66 112.00 1n7j n ARG 573 Ca 0.00 0.15 -0.35 0.00 -0.01 0.00 0.00 57.85 57.64 1n7j n ARG 573 Cb 0.00 -1.36 -0.09 0.00 0.00 0.00 0.00 32.46 31.01 1n7j n ARG 573 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1n7j s THR 574 N -2.40 4.77 -0.00 0.55 2.01 -1.26 -1.59 115.64 117.72 1n7j s THR 574 Ca -0.28 -0.06 -0.00 0.00 0.31 0.00 0.00 61.69 61.66 1n7j s THR 574 Cb 0.09 -3.09 -0.00 0.00 0.01 0.00 0.00 72.50 69.51 1n7j s THR 574 CO 0.44 0.54 0.00 -0.22 -0.69 0.00 0.00 174.62 174.69 1n7j s LEU 575 N -0.33 2.00 -0.05 4.42 0.20 -0.74 -0.11 118.68 124.06 1n7j s LEU 575 Ca 0.09 -0.04 0.04 0.00 0.69 0.00 0.00 54.13 54.90 1n7j s LEU 575 Cb -0.12 0.04 0.00 0.00 -0.43 0.00 0.00 46.19 45.68 1n7j s LEU 575 CO 0.02 -0.04 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.25 1n7j s ILE 576 N -0.17 1.37 -0.43 6.68 1.01 -0.73 -0.54 121.20 128.39 1n7j s ILE 576 Ca -0.02 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 1n7j s ILE 576 Cb -0.01 -1.19 0.05 0.00 0.01 0.00 0.00 42.46 41.31 1n7j s ILE 576 CO -0.00 0.40 0.32 -0.62 0.00 0.00 0.00 174.94 175.03 1n7j s ASP 577 N 0.24 6.01 -0.20 3.58 2.15 0.55 -1.36 116.67 127.65 1n7j s ASP 577 Ca -0.08 -1.13 -0.29 0.00 0.43 0.00 0.00 52.55 51.48 1n7j s ASP 577 Cb -0.13 -2.13 0.00 0.00 -0.30 0.00 0.00 42.92 40.36 1n7j s ASP 577 CO 0.03 -0.52 1.05 -0.63 -0.17 0.00 0.00 175.17 174.93 1n7j s ILE 578 N 1.62 4.67 -0.98 4.11 -1.09 0.54 -2.51 121.20 127.56 1n7j s ILE 578 Ca 0.04 1.99 -0.00 0.00 -2.23 0.00 0.00 60.65 60.45 1n7j s ILE 578 Cb -0.21 -4.29 -0.01 0.00 -1.58 0.00 0.00 42.46 36.37 1n7j s ILE 578 CO 0.07 -0.14 0.82 0.61 -1.23 0.00 0.00 174.94 175.08 1n7j n GLY 579 N 3.29 -0.28 0.39 6.18 0.00 -1.22 -4.24 105.19 109.31 1n7j n GLY 579 Ca 0.11 0.04 0.20 0.00 0.00 0.00 0.00 46.02 46.38 1n7j n GLY 579 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1n7j h SER 580 N -1.51 0.54 0.00 1.61 0.02 0.11 -3.44 113.55 110.87 1n7j h SER 580 Ca -0.49 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1n7j h SER 580 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1n7j h SER 580 CO 0.41 0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.83 1n7j n GLY 581 N -1.42 0.44 1.91 -3.77 0.00 -1.25 -2.99 105.19 98.10 1n7j n GLY 581 Ca 0.25 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1n7j n GLY 581 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n7j n PRO 582 N 1.20 2.81 -4.18 1.61 -0.04 -1.26 -4.67 135.00 130.47 1n7j n PRO 582 Ca 0.00 -3.06 -0.23 0.00 -0.04 0.00 0.00 63.50 60.17 1n7j n PRO 582 Cb 0.00 -2.12 -0.06 0.00 -0.04 0.00 0.00 33.50 31.27 1n7j n PRO 582 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1n7j s THR 583 N -3.15 3.55 0.00 0.52 -4.23 -1.16 -4.81 115.64 106.35 1n7j s THR 583 Ca 0.54 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 1n7j s THR 583 Cb 0.45 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 71.27 1n7j s THR 583 CO 0.10 -0.31 0.00 0.52 -0.54 0.00 0.00 174.62 174.39 1n7j n VAL 584 N -1.05 0.00 -0.51 2.29 0.31 -1.26 -4.85 118.33 113.26 1n7j n VAL 584 Ca -0.06 0.00 0.44 0.00 -0.01 0.00 0.00 64.34 64.72 1n7j n VAL 584 Cb 0.59 -0.40 0.76 0.00 -0.91 0.00 0.00 33.84 33.88 1n7j n VAL 584 CO 0.00 0.00 0.00 0.10 -1.32 0.00 0.00 176.83 175.61 1n7j h TYR 585 N 0.00 0.00 0.00 3.52 -0.00 -1.96 0.15 116.97 118.68 1n7j h TYR 585 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1n7j h TYR 585 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.15 1n7j h TYR 585 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 179.20 1n7j n GLN 586 N -3.91 0.22 0.00 0.10 3.00 -1.26 -3.06 117.38 112.47 1n7j n GLN 586 Ca 0.35 0.11 0.03 0.00 -0.01 0.00 0.00 57.00 57.48 1n7j n GLN 586 Cb 1.69 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 30.40 1n7j n GLN 586 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1n7j n LEU 587 N -1.34 0.43 -0.17 1.08 4.77 0.52 -4.65 117.00 117.65 1n7j n LEU 587 Ca 0.09 -0.55 -0.06 0.00 -0.03 0.00 0.00 56.01 55.46 1n7j n LEU 587 Cb 0.18 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1n7j n LEU 587 CO 0.17 0.10 0.64 -0.07 -1.33 0.00 0.00 177.39 176.89 1n7j h LEU 588 N 0.14 -1.11 0.12 2.23 4.07 -1.58 0.73 115.31 119.91 1n7j h LEU 588 Ca 0.00 0.21 -0.28 0.00 0.08 0.00 0.00 57.88 57.89 1n7j h LEU 588 Cb 0.17 0.54 -0.00 0.00 1.08 0.00 0.00 40.66 42.45 1n7j h LEU 588 CO 0.00 -0.31 -1.31 0.28 -1.08 0.00 0.00 178.44 176.02 1n7j h SER 589 N -0.19 0.39 0.19 -0.43 0.02 -1.86 -3.21 113.55 108.46 1n7j h SER 589 Ca 0.21 -0.45 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 1n7j h SER 589 Cb 0.54 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 1n7j h SER 589 CO -0.62 1.36 -0.14 0.00 -1.14 0.00 0.00 176.83 176.29 1n7j h ALA 590 N 0.58 1.61 -0.99 3.77 0.00 -1.73 -3.20 119.26 119.30 1n7j h ALA 590 Ca -0.16 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.75 1n7j h ALA 590 Cb 1.98 -0.02 -0.14 0.00 0.00 0.00 0.00 17.79 19.60 1n7j h ALA 590 CO 0.19 0.17 -0.49 0.00 0.00 0.00 0.00 179.25 179.12 1n7j n SER 592 N -5.36 4.54 0.00 0.00 3.41 -1.21 -3.40 113.62 111.59 1n7j n SER 592 Ca 0.06 -2.33 0.00 0.00 -0.26 0.00 0.00 58.87 56.34 1n7j n SER 592 Cb 0.33 -0.89 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 1n7j n SER 592 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1n7j n HIS 593 N 1.00 0.00 -3.88 7.33 8.25 -0.77 -5.08 115.22 122.07 1n7j n HIS 593 Ca 0.03 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.21 1n7j n HIS 593 Cb 0.53 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.48 1n7j n HIS 593 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1n7j s PHE 594 N 0.00 1.64 0.25 4.41 0.40 -1.20 -3.99 117.98 119.49 1n7j s PHE 594 Ca 0.00 -1.04 -0.06 0.00 -0.60 0.00 0.00 56.93 55.24 1n7j s PHE 594 Cb 0.00 -1.28 0.28 0.00 0.51 0.00 0.00 43.02 42.53 1n7j s PHE 594 CO 0.00 -0.60 1.92 0.93 0.70 0.00 0.00 175.22 178.17 1n7j h GLU 595 N 8.13 1.30 -4.85 0.44 5.08 -1.74 -3.39 114.58 119.55 1n7j h GLU 595 Ca -0.24 -0.08 -0.67 0.00 -1.00 0.00 0.00 59.36 57.37 1n7j h GLU 595 Cb 1.11 -0.29 -0.37 0.00 0.50 0.00 0.00 28.75 29.70 1n7j h GLU 595 CO 0.39 0.86 -0.79 0.34 -1.00 0.00 0.00 179.01 178.82 1n7j s ASP 596 N -6.10 4.50 -0.12 1.42 3.68 -0.62 -4.61 116.67 114.83 1n7j s ASP 596 Ca -0.13 -1.44 -0.03 0.00 2.13 0.00 0.00 52.55 53.08 1n7j s ASP 596 Cb 0.18 -1.57 -0.03 0.00 -1.45 0.00 0.00 42.92 40.05 1n7j s ASP 596 CO 0.82 -0.21 -0.01 -0.63 0.13 0.00 0.00 175.17 175.27 1n7j s ILE 597 N 1.10 4.19 -0.22 4.11 1.01 -0.14 -1.78 121.20 129.46 1n7j s ILE 597 Ca -0.07 -0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.31 1n7j s ILE 597 Cb -0.20 -2.80 0.03 0.00 0.01 0.00 0.00 42.46 39.50 1n7j s ILE 597 CO -0.05 0.55 -0.13 -0.89 0.00 0.00 0.00 174.94 174.42 1n7j s THR 598 N -0.31 2.35 0.24 2.92 2.01 0.30 -1.21 115.64 121.93 1n7j s THR 598 Ca 0.06 -1.16 -0.02 0.00 0.31 0.00 0.00 61.69 60.88 1n7j s THR 598 Cb -0.12 -2.17 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 1n7j s THR 598 CO 0.02 0.27 0.45 -0.04 -0.69 0.00 0.00 174.62 174.64 1n7j s MET 599 N 1.25 3.56 0.15 4.92 -1.94 -0.88 -0.33 119.30 126.02 1n7j s MET 599 Ca -0.01 -0.22 -0.12 0.00 -1.71 0.00 0.00 55.69 53.64 1n7j s MET 599 Cb -0.16 -2.76 0.01 0.00 2.01 0.00 0.00 34.83 33.92 1n7j s MET 599 CO -0.08 0.33 0.34 0.95 -0.01 0.00 0.00 175.02 176.55 1n7j s THR 600 N -1.96 0.07 -0.25 2.05 -4.23 -1.04 -0.87 115.64 109.40 1n7j s THR 600 Ca 0.40 -1.07 -0.32 0.00 -1.18 0.00 0.00 61.69 59.52 1n7j s THR 600 Cb -0.11 -1.58 0.17 0.00 1.34 0.00 0.00 72.50 72.32 1n7j s THR 600 CO 0.29 -0.32 1.29 -0.62 -0.54 0.00 0.00 174.62 174.72 1n7j s ASP 601 N -2.90 -0.09 -0.03 3.99 2.15 -0.75 0.14 116.67 119.17 1n7j s ASP 601 Ca 0.11 0.07 -0.25 0.00 0.43 0.00 0.00 52.55 52.90 1n7j s ASP 601 Cb 0.02 0.08 -0.19 0.00 -0.30 0.00 0.00 42.92 42.53 1n7j s ASP 601 CO -0.05 -0.11 1.15 0.15 -0.17 0.00 0.00 175.17 176.14 1n7j h PHE 602 N 2.09 -0.08 -3.52 -5.34 3.57 -1.86 -0.42 116.94 111.40 1n7j h PHE 602 Ca -0.08 -0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.89 1n7j h PHE 602 Cb 1.17 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.91 1n7j h PHE 602 CO 0.24 0.42 0.34 -0.51 -2.23 0.00 0.00 178.31 176.58 1n7j s LEU 603 N -9.13 4.46 0.44 0.59 1.43 -1.26 -4.67 118.68 110.53 1n7j s LEU 603 Ca -0.15 1.73 0.23 0.00 -1.03 0.00 0.00 54.13 54.91 1n7j s LEU 603 Cb 0.01 -3.55 0.46 0.00 0.03 0.00 0.00 46.19 43.14 1n7j s LEU 603 CO 0.62 -0.10 1.65 1.05 0.23 0.00 0.00 176.35 179.80 1n7j h GLU 604 N 5.87 0.00 0.00 1.70 4.11 -1.99 -2.75 114.58 121.52 1n7j h GLU 604 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1n7j h GLU 604 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1n7j h GLU 604 CO 0.72 0.06 0.00 -0.39 0.07 0.00 0.00 179.01 179.48 1n7j h VAL 605 N 0.00 0.00 0.11 -1.06 -1.51 -1.98 -0.01 116.25 111.80 1n7j h VAL 605 Ca -0.00 -0.34 -0.36 0.00 -1.23 0.00 0.00 66.70 64.77 1n7j h VAL 605 Cb 0.97 1.22 -0.02 0.00 -2.13 0.00 0.00 31.29 31.34 1n7j h VAL 605 CO 0.01 0.00 -1.97 0.59 -1.23 0.00 0.00 177.57 174.97 1n7j n ASN 606 N -2.76 2.10 0.08 4.19 3.02 -1.08 -2.63 115.26 118.18 1n7j n ASN 606 Ca 0.01 0.21 0.07 0.00 -0.03 0.00 0.00 54.58 54.83 1n7j n ASN 606 Cb 0.24 -0.85 0.52 0.00 -0.61 0.00 0.00 39.78 39.08 1n7j n ASN 606 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1n7j h ARG 607 N -0.02 0.31 -0.09 3.52 3.08 -1.15 -0.60 114.38 119.43 1n7j h ARG 607 Ca -0.43 -0.02 -0.23 0.00 0.07 0.00 0.00 59.98 59.37 1n7j h ARG 607 Cb 1.97 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 31.97 1n7j h ARG 607 CO 0.06 0.21 -0.85 1.96 -1.07 0.00 0.00 179.97 180.27 1n7j h GLN 608 N 0.32 0.74 -0.41 0.04 4.20 -1.11 -0.27 115.11 118.62 1n7j h GLN 608 Ca 0.11 -0.67 -0.01 0.00 0.06 0.00 0.00 58.65 58.14 1n7j h GLN 608 Cb 0.06 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1n7j h GLN 608 CO -0.02 1.27 0.21 1.49 -0.67 0.00 0.00 178.83 181.11 1n7j h GLU 609 N 0.45 0.56 -0.18 1.46 4.57 -1.08 0.82 114.58 121.17 1n7j h GLU 609 Ca -0.08 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 57.94 1n7j h GLU 609 Cb 1.50 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.97 1n7j h GLU 609 CO 0.17 0.42 -0.30 -0.07 -1.18 0.00 0.00 179.01 178.05 1n7j h LEU 610 N 0.57 0.58 -1.61 1.64 3.38 -1.02 -2.97 115.31 115.89 1n7j h LEU 610 Ca 0.15 -0.53 0.15 0.00 0.09 0.00 0.00 57.88 57.73 1n7j h LEU 610 Cb 0.03 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1n7j h LEU 610 CO -0.02 1.00 0.50 1.23 0.09 0.00 0.00 178.44 181.24 1n7j h GLY 611 N 0.18 0.66 0.89 0.83 0.00 0.39 0.08 103.07 106.11 1n7j h GLY 611 Ca 0.01 -0.17 -0.07 0.00 0.00 0.00 0.00 47.33 47.11 1n7j h GLY 611 CO 0.07 0.06 -0.10 3.21 0.00 0.00 0.00 176.54 179.78 1n7j h ARG 612 N 0.39 0.58 -0.24 4.80 3.08 -0.75 -1.77 114.38 120.48 1n7j h ARG 612 Ca 0.36 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 60.11 1n7j h ARG 612 Cb 0.87 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.88 1n7j h ARG 612 CO -0.11 0.79 -0.17 2.35 -1.07 0.00 0.00 179.97 181.76 1n7j h TRP 613 N 0.34 0.44 -0.38 3.04 7.01 -1.08 -2.20 115.95 123.12 1n7j h TRP 613 Ca 0.07 -0.07 -0.05 0.00 2.11 0.00 0.00 58.89 60.95 1n7j h TRP 613 Cb 0.60 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 1n7j h TRP 613 CO 0.05 0.57 0.06 -0.07 -2.79 0.00 0.00 178.44 176.26 1n7j h LEU 614 N 0.38 0.60 0.00 0.65 4.07 -0.80 -2.02 115.31 118.18 1n7j h LEU 614 Ca 0.07 -0.26 0.00 0.00 0.08 0.00 0.00 57.88 57.76 1n7j h LEU 614 Cb 0.53 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.11 1n7j h LEU 614 CO 0.03 0.71 0.00 0.00 -1.08 0.00 0.00 178.44 178.10 1n7j n GLN 615 N -4.54 0.89 -3.80 1.13 6.02 -0.68 -4.88 117.38 111.51 1n7j n GLN 615 Ca -0.01 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.72 1n7j n GLN 615 Cb 0.23 -1.35 0.04 0.00 1.02 0.00 0.00 30.24 30.17 1n7j n GLN 615 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1n7j n GLU 616 N -0.85 -5.59 -2.34 -1.09 2.13 -0.76 -4.97 120.64 107.17 1n7j n GLU 616 Ca 0.15 0.63 -0.32 0.00 0.66 0.00 0.00 57.16 58.29 1n7j n GLU 616 Cb 0.07 -5.43 -0.03 0.00 0.27 0.00 0.00 31.44 26.32 1n7j n GLU 616 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1n7j s GLU 617 N -6.34 3.90 0.21 5.31 2.02 -0.86 -4.99 118.70 117.96 1n7j s GLU 617 Ca 0.41 0.92 -0.05 0.00 0.02 0.00 0.00 54.97 56.27 1n7j s GLU 617 Cb -0.20 -2.13 0.17 0.00 0.10 0.00 0.00 34.13 32.07 1n7j s GLU 617 CO 0.81 -0.31 1.64 -1.35 0.02 0.00 0.00 175.26 176.07 1n7j h PRO 618 N 0.76 0.84 -0.88 0.39 0.11 -1.93 -2.92 132.00 128.36 1n7j h PRO 618 Ca -0.46 -0.32 0.10 0.00 0.11 0.00 0.00 66.00 65.43 1n7j h PRO 618 Cb 1.19 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.18 1n7j h PRO 618 CO 0.62 0.94 0.57 0.78 -0.21 0.00 0.00 178.00 180.70 1n7j h GLY 619 N 0.96 1.25 -3.18 -0.55 0.00 -1.94 -3.44 103.07 96.17 1n7j h GLY 619 Ca 0.11 -0.36 -0.58 0.00 0.00 0.00 0.00 47.33 46.51 1n7j h GLY 619 CO 0.05 0.20 -0.68 0.00 0.00 0.00 0.00 176.54 176.11 1n7j n ALA 620 N -2.41 -2.01 -2.05 3.60 0.00 -1.11 -4.88 120.51 111.66 1n7j n ALA 620 Ca 0.15 -0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 1n7j n ALA 620 Cb 0.32 -1.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 1n7j n ALA 620 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1n7j s PHE 621 N -1.86 3.17 -0.40 0.00 5.36 -1.26 -4.97 117.98 118.01 1n7j s PHE 621 Ca 0.63 0.91 -0.25 0.00 -0.96 0.00 0.00 56.93 57.26 1n7j s PHE 621 Cb -0.41 -3.76 0.02 0.00 -0.34 0.00 0.00 43.02 38.53 1n7j s PHE 621 CO 0.60 -2.64 0.89 1.21 -1.46 0.00 0.00 175.22 173.82 1n7j s ASN 622 N 0.92 6.58 -0.06 6.13 2.47 -1.26 -4.89 114.94 124.83 1n7j s ASN 622 Ca 0.64 0.34 0.21 0.00 0.42 0.00 0.00 52.86 54.47 1n7j s ASN 622 Cb -0.39 -2.44 0.69 0.00 -1.45 0.00 0.00 41.25 37.66 1n7j s ASN 622 CO 0.33 -0.90 1.59 0.79 -3.72 0.00 0.00 177.10 175.20 1n7j n TRP 623 N 6.83 1.25 -0.29 0.43 7.02 -1.26 -4.62 117.44 126.79 1n7j n TRP 623 Ca 0.06 -0.55 0.12 0.00 -1.02 0.00 0.00 57.50 56.11 1n7j n TRP 623 Cb 0.48 -0.12 0.28 0.00 -2.42 0.00 0.00 31.31 29.53 1n7j n TRP 623 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1n7j h SER 624 N 4.25 0.19 -0.76 -0.99 4.64 -1.98 0.34 113.55 119.25 1n7j h SER 624 Ca 0.00 0.16 0.06 0.00 -0.47 0.00 0.00 61.79 61.55 1n7j h SER 624 Cb 1.22 0.18 -0.06 0.00 -0.31 0.00 0.00 62.40 63.43 1n7j h SER 624 CO 0.11 -0.05 0.45 0.24 -0.87 0.00 0.00 176.83 176.71 1n7j h MET 625 N 0.33 0.79 0.08 4.77 2.86 -1.98 0.39 114.93 122.17 1n7j h MET 625 Ca 0.53 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 58.12 1n7j h MET 625 Cb 1.02 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1n7j h MET 625 CO -0.56 0.52 -0.04 1.88 1.06 0.00 0.00 176.91 179.78 1n7j h TYR 626 N 0.81 -0.10 -0.50 -0.22 -1.99 -1.36 -1.82 116.97 111.79 1n7j h TYR 626 Ca 0.34 -0.00 0.09 0.00 2.00 0.00 0.00 58.73 61.16 1n7j h TYR 626 Cb 0.19 0.03 -0.08 0.00 2.00 0.00 0.00 36.73 38.87 1n7j h TYR 626 CO -0.06 0.28 0.02 0.77 -0.00 0.00 0.00 178.16 179.18 1n7j h SER 627 N -0.51 -0.17 0.61 3.88 0.02 -0.64 0.23 113.55 116.98 1n7j h SER 627 Ca -0.01 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1n7j h SER 627 Cb 0.43 0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 1n7j h SER 627 CO 0.02 -0.05 -0.34 -0.61 -1.14 0.00 0.00 176.83 174.71 1n7j h GLN 628 N 0.14 -0.85 -0.95 3.45 -0.00 -0.22 -1.77 115.11 114.91 1n7j h GLN 628 Ca 0.25 0.06 0.17 0.00 -0.00 0.00 0.00 58.65 59.13 1n7j h GLN 628 Cb 0.37 0.19 -0.08 0.00 0.00 0.00 0.00 27.48 27.96 1n7j h GLN 628 CO -0.40 -0.57 0.60 1.25 0.00 0.00 0.00 178.83 179.72 1n7j h HIS 629 N -0.88 0.89 -0.67 3.99 2.76 -0.58 0.29 115.15 120.95 1n7j h HIS 629 Ca -0.08 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.08 1n7j h HIS 629 Cb 0.70 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.36 1n7j h HIS 629 CO -0.07 0.27 0.27 0.00 -1.30 0.00 0.00 177.93 177.09 1n7j h ALA 630 N 1.61 0.87 -0.07 5.26 0.00 -0.17 0.15 119.26 126.91 1n7j h ALA 630 Ca 0.51 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.14 1n7j h ALA 630 Cb 0.85 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1n7j h ALA 630 CO -0.27 0.49 -0.39 0.00 0.00 0.00 0.00 179.25 179.08 1n7j h LEU 632 N 0.12 -0.30 -0.56 0.00 6.46 0.16 -3.07 115.31 118.12 1n7j h LEU 632 Ca 0.01 -0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.59 1n7j h LEU 632 Cb 0.75 0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 40.74 1n7j h LEU 632 CO 0.06 -0.02 0.21 0.40 -0.62 0.00 0.00 178.44 178.47 1n7j h ILE 633 N -0.58 1.23 0.00 4.05 1.08 -0.75 -2.95 117.51 119.59 1n7j h ILE 633 Ca -0.04 -0.72 -0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1n7j h ILE 633 Cb 0.42 0.65 -0.00 0.00 -3.07 0.00 0.00 36.82 34.82 1n7j h ILE 633 CO 0.06 0.27 -0.02 -0.33 -0.69 0.00 0.00 178.15 177.44 1n7j h GLU 634 N 0.77 0.00 -4.39 2.37 5.08 -0.99 -3.47 114.58 113.95 1n7j h GLU 634 Ca 0.19 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.16 1n7j h GLU 634 Cb 0.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.47 1n7j h GLU 634 CO -0.01 0.02 -0.55 0.41 -1.00 0.00 0.00 179.01 177.88 1n7j n GLY 635 N -0.57 -0.51 0.89 -3.84 0.00 -1.12 -4.85 105.19 95.20 1n7j n GLY 635 Ca -0.01 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1n7j n GLY 635 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n7j n LYS 636 N -3.65 2.04 -1.77 1.61 4.76 -1.26 -4.94 118.16 114.96 1n7j n LYS 636 Ca -0.12 -1.85 -0.11 0.00 -2.87 0.00 0.00 58.31 53.37 1n7j n LYS 636 Cb 0.61 -1.42 -0.03 0.00 -1.84 0.00 0.00 35.03 32.36 1n7j n LYS 636 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n7j n GLY 637 N 1.23 0.56 3.81 0.72 0.00 -1.26 -5.00 105.19 105.25 1n7j n GLY 637 Ca 0.13 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1n7j n GLY 637 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n7j s GLU 638 N -3.74 3.75 0.04 1.61 2.12 -1.26 -5.05 118.70 116.17 1n7j s GLU 638 Ca 0.00 1.20 -0.07 0.00 0.36 0.00 0.00 54.97 56.45 1n7j s GLU 638 Cb 0.00 -2.10 -0.05 0.00 0.26 0.00 0.00 34.13 32.24 1n7j s GLU 638 CO 0.00 -0.45 0.32 0.00 -0.54 0.00 0.00 175.26 174.58 1n7j h TRP 640 N 3.76 0.98 0.00 0.00 5.08 -1.90 -1.44 115.95 122.43 1n7j h TRP 640 Ca -0.49 0.02 -0.02 0.00 1.08 0.00 0.00 58.89 59.48 1n7j h TRP 640 Cb 1.19 -0.33 -0.00 0.00 -3.00 0.00 0.00 29.16 27.02 1n7j h TRP 640 CO 0.67 0.60 -0.11 -0.56 -1.28 0.00 0.00 178.44 177.76 1n7j h GLN 641 N 1.04 0.00 0.15 0.12 -0.00 -1.94 -0.34 115.11 114.14 1n7j h GLN 641 Ca 0.30 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.69 1n7j h GLN 641 Cb -0.07 0.00 0.03 0.00 -0.00 0.00 0.00 27.48 27.44 1n7j h GLN 641 CO -0.07 0.11 -1.10 -0.44 -0.00 0.00 0.00 178.83 177.32 1n7j h ASP 642 N 0.00 0.71 -0.35 0.06 5.19 -1.69 -3.00 116.42 117.34 1n7j h ASP 642 Ca -0.00 -0.88 0.01 0.00 -0.62 0.00 0.00 57.03 55.54 1n7j h ASP 642 Cb 0.25 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 1n7j h ASP 642 CO 0.01 1.53 0.22 0.50 -3.12 0.00 0.00 179.24 178.39 1n7j h LYS 643 N 0.01 0.44 -0.10 3.56 3.64 -0.82 -1.78 116.57 121.52 1n7j h LYS 643 Ca -0.18 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1n7j h LYS 643 Cb 1.83 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.54 1n7j h LYS 643 CO 0.21 0.29 -0.08 0.93 -2.27 0.00 0.00 179.45 178.54 1n7j h GLU 644 N 0.46 0.15 -0.29 1.90 5.08 -1.17 -1.61 114.58 119.09 1n7j h GLU 644 Ca 0.13 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.32 1n7j h GLU 644 Cb -0.03 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1n7j h GLU 644 CO -0.04 0.24 -0.42 -0.09 -1.00 0.00 0.00 179.01 177.70 1n7j h ARG 645 N 0.15 0.71 -0.47 2.33 2.43 -1.26 -1.07 114.38 117.19 1n7j h ARG 645 Ca 0.03 -0.38 -0.12 0.00 -0.81 0.00 0.00 59.98 58.70 1n7j h ARG 645 Cb 0.24 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1n7j h ARG 645 CO 0.01 1.00 -0.18 0.37 -1.51 0.00 0.00 179.97 179.66 1n7j h GLN 646 N 0.58 0.93 0.27 0.20 4.15 -0.54 -1.29 115.11 119.40 1n7j h GLN 646 Ca 0.04 -0.37 -0.01 0.00 0.77 0.00 0.00 58.65 59.08 1n7j h GLN 646 Cb 0.97 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.61 1n7j h GLN 646 CO 0.09 1.03 -0.13 1.25 -1.93 0.00 0.00 178.83 179.14 1n7j h LEU 647 N 0.81 -0.31 -1.43 -2.39 5.85 -1.18 -0.65 115.31 116.01 1n7j h LEU 647 Ca 0.11 -0.17 0.19 0.00 0.84 0.00 0.00 57.88 58.85 1n7j h LEU 647 Cb 0.73 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.77 1n7j h LEU 647 CO 0.06 0.02 0.59 0.03 -0.34 0.00 0.00 178.44 178.79 1n7j h ARG 648 N -0.65 0.48 -0.06 1.25 3.08 -1.13 -1.60 114.38 115.74 1n7j h ARG 648 Ca -0.04 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1n7j h ARG 648 Cb 0.46 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 1n7j h ARG 648 CO 0.06 0.31 -0.09 0.00 -1.07 0.00 0.00 179.97 179.19 1n7j h ALA 649 N 1.61 0.09 0.00 0.04 0.00 -0.88 -3.29 119.26 116.83 1n7j h ALA 649 Ca 0.47 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1n7j h ALA 649 Cb 1.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1n7j h ALA 649 CO -0.19 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1n7j h ARG 650 N -0.33 0.00 -6.08 0.00 3.08 -0.51 -3.41 114.38 107.13 1n7j h ARG 650 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 1n7j h ARG 650 Cb 0.64 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.63 1n7j h ARG 650 CO 0.02 0.00 1.18 0.08 -1.07 0.00 0.00 179.97 180.18 1n7j s VAL 651 N -3.35 3.59 -2.03 2.04 1.01 -0.66 -0.97 120.40 120.03 1n7j s VAL 651 Ca 0.05 0.00 0.28 0.00 0.00 0.00 0.00 61.98 62.32 1n7j s VAL 651 Cb 0.09 -4.47 0.79 0.00 0.00 0.00 0.00 36.38 32.80 1n7j s VAL 651 CO 0.51 -1.41 2.07 0.29 0.00 0.00 0.00 175.10 176.57 1n7j n LYS 652 N 9.14 1.05 0.00 2.72 4.76 -0.35 -4.91 118.16 130.57 1n7j n LYS 652 Ca 0.20 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 1n7j n LYS 652 Cb 0.50 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.24 1n7j n LYS 652 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1n7j n ARG 653 N -0.87 0.00 -3.77 1.97 1.85 -1.25 -5.05 116.66 109.54 1n7j n ARG 653 Ca 0.21 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.69 1n7j n ARG 653 Cb 0.11 0.00 -0.12 0.00 -1.05 0.00 0.00 32.46 31.40 1n7j n ARG 653 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1n7j s VAL 654 N -1.27 3.61 0.05 8.89 1.01 -1.26 -2.08 120.40 129.36 1n7j s VAL 654 Ca 0.00 -1.31 0.01 0.00 0.00 0.00 0.00 61.98 60.68 1n7j s VAL 654 Cb 0.00 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1n7j s VAL 654 CO 0.00 -0.25 0.13 -0.76 0.00 0.00 0.00 175.10 174.22 1n7j s LEU 655 N 1.35 4.05 0.41 3.92 1.43 -0.05 -4.96 118.68 124.82 1n7j s LEU 655 Ca -0.01 0.14 -0.23 0.00 -1.03 0.00 0.00 54.13 53.00 1n7j s LEU 655 Cb -0.20 -2.62 -0.10 0.00 0.03 0.00 0.00 46.19 43.30 1n7j s LEU 655 CO 0.01 0.19 1.00 -2.16 0.23 0.00 0.00 176.35 175.63 1n7j s PRO 656 N -2.29 4.19 -0.04 1.29 0.04 -1.26 -1.82 135.00 135.11 1n7j s PRO 656 Ca 0.30 1.36 -0.14 0.00 0.04 0.00 0.00 61.00 62.56 1n7j s PRO 656 Cb -0.12 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1n7j s PRO 656 CO 0.22 -0.09 0.32 -1.50 0.04 0.00 0.00 177.00 175.99 1n7j s ILE 657 N -1.83 0.04 -0.26 0.56 2.07 -0.16 -4.75 121.20 116.87 1n7j s ILE 657 Ca 0.59 -0.37 -0.01 0.00 -1.41 0.00 0.00 60.65 59.45 1n7j s ILE 657 Cb -0.17 -0.59 0.08 0.00 0.13 0.00 0.00 42.46 41.91 1n7j s ILE 657 CO 0.22 -0.20 0.04 -0.62 -1.91 0.00 0.00 174.94 172.47 1n7j s ASP 658 N -1.00 3.73 0.43 4.50 -1.08 -0.91 -2.97 116.67 119.36 1n7j s ASP 658 Ca -0.11 -1.35 0.29 0.00 -0.52 0.00 0.00 52.55 50.86 1n7j s ASP 658 Cb -0.05 -0.91 1.56 0.00 -1.46 0.00 0.00 42.92 42.07 1n7j s ASP 658 CO 0.03 -0.34 1.88 0.58 0.52 0.00 0.00 175.17 177.84 1n7j h VAL 659 N 6.54 0.00 0.00 1.11 2.07 -1.95 -2.72 116.25 121.29 1n7j h VAL 659 Ca -0.15 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1n7j h VAL 659 Cb 1.06 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1n7j h VAL 659 CO 0.42 0.00 -0.61 1.41 0.02 0.00 0.00 177.57 178.81 1n7j n HIS 660 N -2.51 0.40 -2.76 1.57 8.25 -1.26 -4.43 115.22 114.48 1n7j n HIS 660 Ca -0.02 0.12 -0.32 0.00 -0.26 0.00 0.00 57.72 57.23 1n7j n HIS 660 Cb 0.05 -0.55 -0.06 0.00 1.12 0.00 0.00 29.99 30.56 1n7j n HIS 660 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1n7j s GLN 661 N -3.13 4.07 0.46 -0.41 -1.52 -1.03 -4.93 119.66 113.18 1n7j s GLN 661 Ca 0.07 0.94 0.13 0.00 -1.95 0.00 0.00 55.36 54.55 1n7j s GLN 661 Cb 0.15 -2.23 1.09 0.00 -0.22 0.00 0.00 33.01 31.79 1n7j s GLN 661 CO 0.72 -0.07 2.06 -1.35 -0.25 0.00 0.00 175.29 176.40 1n7j h PRO 662 N 1.63 0.28 -3.23 2.91 0.11 -1.90 -3.14 132.00 128.67 1n7j h PRO 662 Ca -0.48 -0.02 -0.64 0.00 0.11 0.00 0.00 66.00 64.97 1n7j h PRO 662 Cb 1.18 -0.06 -0.41 0.00 0.11 0.00 0.00 31.00 31.82 1n7j h PRO 662 CO 0.62 0.18 -0.54 -0.65 -0.21 0.00 0.00 178.00 177.41 1n7j s GLN 663 N -5.29 2.38 0.50 1.05 -0.21 -1.26 -4.77 119.66 112.06 1n7j s GLN 663 Ca -0.07 -3.06 0.41 0.00 0.02 0.00 0.00 55.36 52.66 1n7j s GLN 663 Cb 0.18 -3.45 1.61 0.00 1.00 0.00 0.00 33.01 32.35 1n7j s GLN 663 CO 0.72 -1.22 1.58 -1.35 -2.12 0.00 0.00 175.29 172.90 1n7j h PRO 664 N 5.90 0.01 -0.02 2.91 0.11 -1.72 -0.84 132.00 138.35 1n7j h PRO 664 Ca 0.06 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1n7j h PRO 664 Cb 0.82 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1n7j h PRO 664 CO 0.72 0.01 -0.18 1.28 -0.21 0.00 0.00 178.00 179.62 1n7j n LEU 665 N -4.35 2.47 0.00 2.35 7.99 -1.26 -2.15 117.00 122.04 1n7j n LEU 665 Ca 0.42 -0.90 0.00 0.00 -0.01 0.00 0.00 56.01 55.52 1n7j n LEU 665 Cb 1.77 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 45.08 1n7j n LEU 665 CO 0.31 0.43 0.00 0.61 -1.51 0.00 0.00 177.39 177.23 1n7j n GLY 666 N 1.28 1.66 0.16 -0.72 0.00 -0.32 -4.60 105.19 102.65 1n7j n GLY 666 Ca 0.11 -2.07 -0.06 0.00 0.00 0.00 0.00 46.02 44.00 1n7j n GLY 666 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n7j h ALA 667 N 0.00 -0.68 -0.94 4.61 0.00 -1.99 -3.35 119.26 116.90 1n7j h ALA 667 Ca 0.00 -0.08 -0.73 0.00 0.00 0.00 0.00 54.91 54.10 1n7j h ALA 667 Cb 0.00 0.15 -0.24 0.00 0.00 0.00 0.00 17.79 17.70 1n7j h ALA 667 CO 0.00 -0.66 1.05 0.41 0.00 0.00 0.00 179.25 180.05 1n7j n GLY 668 N 0.02 5.43 3.69 0.00 0.00 -1.26 -5.02 105.19 108.04 1n7j n GLY 668 Ca -0.05 -2.36 -0.41 0.00 0.00 0.00 0.00 46.02 43.21 1n7j n GLY 668 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1n7j n SER 669 N 0.02 2.26 0.16 1.61 2.88 -1.26 -4.89 113.62 114.41 1n7j n SER 669 Ca 0.52 1.07 0.03 0.00 -1.33 0.00 0.00 58.87 59.16 1n7j n SER 669 Cb 0.30 -1.48 0.26 0.00 -0.75 0.00 0.00 64.21 62.54 1n7j n SER 669 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1n7j h PRO 670 N 1.86 0.00 -6.49 -1.46 0.13 -1.95 -3.45 132.00 120.64 1n7j h PRO 670 Ca -0.48 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.05 1n7j h PRO 670 Cb 1.31 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.53 1n7j h PRO 670 CO 0.59 0.48 0.33 0.00 -0.23 0.00 0.00 178.00 179.17 1n7j n ALA 671 N -2.35 0.12 -2.32 -0.56 0.00 -1.26 -4.86 120.51 109.28 1n7j n ALA 671 Ca -0.01 0.41 -0.43 0.00 0.00 0.00 0.00 53.44 53.42 1n7j n ALA 671 Cb 0.56 -2.11 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 1n7j n ALA 671 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1n7j s PRO 672 N -0.96 3.62 0.02 0.00 0.02 -1.26 -4.99 135.00 131.46 1n7j s PRO 672 Ca 0.65 1.06 0.04 0.00 0.02 0.00 0.00 61.00 62.77 1n7j s PRO 672 Cb -0.72 -4.02 -0.03 0.00 0.02 0.00 0.00 34.50 29.75 1n7j s PRO 672 CO 0.55 -1.51 -0.09 -0.51 -0.33 0.00 0.00 177.00 175.12 1n7j s LEU 673 N 5.38 3.08 0.39 -5.54 2.01 -1.26 -3.59 118.68 119.15 1n7j s LEU 673 Ca 0.63 -0.21 -0.11 0.00 0.01 0.00 0.00 54.13 54.44 1n7j s LEU 673 Cb -0.15 -1.79 -0.07 0.00 0.01 0.00 0.00 46.19 44.19 1n7j s LEU 673 CO 0.31 0.26 0.76 -2.16 1.01 0.00 0.00 176.35 176.53 1n7j s PRO 674 N -1.54 3.79 0.67 1.29 0.04 -1.26 -5.14 135.00 132.86 1n7j s PRO 674 Ca 0.17 0.47 -0.11 0.00 0.04 0.00 0.00 61.00 61.57 1n7j s PRO 674 Cb -0.11 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 1n7j s PRO 674 CO 0.08 -0.00 1.05 0.00 0.04 0.00 0.00 177.00 178.17 1n7j s ALA 675 N -2.32 2.82 -0.28 8.56 0.00 0.30 -4.68 121.76 126.17 1n7j s ALA 675 Ca 0.51 0.01 0.21 0.00 0.00 0.00 0.00 51.96 52.69 1n7j s ALA 675 Cb -0.10 -3.14 0.10 0.00 0.00 0.00 0.00 23.12 19.98 1n7j s ALA 675 CO 0.30 -1.05 1.24 -0.44 0.00 0.00 0.00 175.76 175.81 1n7j h ASP 676 N -0.59 0.00 -5.04 0.00 5.19 -0.83 -1.60 116.42 113.54 1n7j h ASP 676 Ca -0.44 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 55.92 1n7j h ASP 676 Cb 1.21 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 40.58 1n7j h ASP 676 CO 0.59 0.12 0.01 0.00 -3.12 0.00 0.00 179.24 176.84 1n7j s ALA 677 N -3.22 -1.18 0.11 3.45 0.00 -0.96 -2.89 121.76 117.06 1n7j s ALA 677 Ca 0.02 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.30 1n7j s ALA 677 Cb 0.08 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 1n7j s ALA 677 CO 0.75 -0.61 -0.11 -0.51 0.00 0.00 0.00 175.76 175.28 1n7j s LEU 678 N -2.47 2.42 -0.06 0.00 1.43 -0.10 -1.78 118.68 118.12 1n7j s LEU 678 Ca -0.01 -0.84 -0.05 0.00 -1.03 0.00 0.00 54.13 52.21 1n7j s LEU 678 Cb 0.00 -0.37 0.02 0.00 0.03 0.00 0.00 46.19 45.87 1n7j s LEU 678 CO -0.08 -0.24 0.15 0.68 0.23 0.00 0.00 176.35 177.08 1n7j s VAL 679 N -2.48 -0.01 -0.19 -1.59 -7.23 -0.46 -1.06 120.40 107.38 1n7j s VAL 679 Ca 0.08 0.03 -0.09 0.00 -1.81 0.00 0.00 61.98 60.19 1n7j s VAL 679 Cb -0.03 -0.22 0.08 0.00 0.56 0.00 0.00 36.38 36.77 1n7j s VAL 679 CO 0.01 0.01 0.44 -0.55 -0.31 0.00 0.00 175.10 174.70 1n7j s SER 680 N 0.27 -0.44 -0.16 4.85 0.15 -0.17 -0.34 113.70 117.87 1n7j s SER 680 Ca -0.02 0.99 0.00 0.00 0.70 0.00 0.00 55.95 57.63 1n7j s SER 680 Cb -0.03 1.09 0.03 0.00 -1.71 0.00 0.00 66.02 65.40 1n7j s SER 680 CO -0.01 -0.21 -0.13 0.00 1.20 0.00 0.00 173.24 174.09 1n7j s ALA 681 N 1.98 1.89 -1.48 5.45 0.00 -1.26 -1.05 121.76 127.29 1n7j s ALA 681 Ca -0.06 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 50.90 1n7j s ALA 681 Cb -0.10 -1.11 0.00 0.00 0.00 0.00 0.00 23.12 21.92 1n7j s ALA 681 CO -0.13 -0.49 0.35 1.19 0.00 0.00 0.00 175.76 176.68 1n7j n PHE 682 N 4.75 -1.46 0.00 0.00 3.01 0.17 -4.93 117.46 119.01 1n7j n PHE 682 Ca -0.16 0.30 0.00 0.00 1.01 0.00 0.00 57.45 58.60 1n7j n PHE 682 Cb 0.49 -4.00 0.00 0.00 -0.01 0.00 0.00 39.48 35.96 1n7j n PHE 682 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1n7j h LEU 684 N 0.00 -1.73 -1.48 0.00 3.38 -1.92 0.45 115.31 114.02 1n7j h LEU 684 Ca 0.00 0.31 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1n7j h LEU 684 Cb 0.00 0.82 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 1n7j h LEU 684 CO 0.00 -0.27 0.34 -0.33 0.09 0.00 0.00 178.44 178.26 1n7j h GLU 685 N -0.04 0.69 -0.66 1.13 3.07 -1.91 -2.22 114.58 114.64 1n7j h GLU 685 Ca 0.25 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1n7j h GLU 685 Cb 0.52 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1n7j h GLU 685 CO -0.92 0.46 0.00 0.00 -1.40 0.00 0.00 179.01 177.15 1n7j n ALA 686 N -2.46 2.74 -0.28 3.43 0.00 0.12 -3.31 120.51 120.75 1n7j n ALA 686 Ca 0.05 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1n7j n ALA 686 Cb 0.05 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1n7j n ALA 686 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1n7j n VAL 687 N 0.14 0.00 -4.55 0.00 0.31 -0.87 -4.94 118.33 108.41 1n7j n VAL 687 Ca 0.07 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.07 1n7j n VAL 687 Cb 0.40 0.99 -0.13 0.00 -0.91 0.00 0.00 33.84 34.18 1n7j n VAL 687 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1n7j s SER 688 N 0.00 4.50 0.12 4.52 1.04 -1.00 -4.90 113.70 117.98 1n7j s SER 688 Ca 0.00 -0.20 -0.24 0.00 0.48 0.00 0.00 55.95 55.99 1n7j s SER 688 Cb 0.00 -1.69 -0.04 0.00 0.10 0.00 0.00 66.02 64.39 1n7j s SER 688 CO 0.00 0.18 1.66 -0.65 0.98 0.00 0.00 173.24 175.40 1n7j h PRO 689 N 6.62 -0.28 -5.32 4.02 0.11 -1.89 -3.30 132.00 131.96 1n7j h PRO 689 Ca -0.30 0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.30 1n7j h PRO 689 Cb 1.20 0.06 -0.14 0.00 0.11 0.00 0.00 31.00 32.24 1n7j h PRO 689 CO 0.60 -0.19 -0.59 0.16 -0.21 0.00 0.00 178.00 177.77 1n7j s ASP 690 N -4.97 2.86 0.63 -2.05 3.84 -1.26 -4.28 116.67 111.44 1n7j s ASP 690 Ca -0.15 -1.41 0.41 0.00 -0.00 0.00 0.00 52.55 51.40 1n7j s ASP 690 Cb 0.09 -0.08 2.12 0.00 -1.38 0.00 0.00 42.92 43.67 1n7j s ASP 690 CO 0.67 -0.61 2.27 0.25 -0.00 0.00 0.00 175.17 177.75 1n7j h LEU 691 N 1.97 0.00 -0.15 2.11 5.85 -1.94 -1.83 115.31 121.32 1n7j h LEU 691 Ca -0.41 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.08 1n7j h LEU 691 Cb 1.25 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.29 1n7j h LEU 691 CO 0.72 0.00 -0.85 0.00 -0.34 0.00 0.00 178.44 177.97 1n7j h ALA 692 N 2.00 0.30 -0.48 1.25 0.00 -1.98 -1.98 119.26 118.38 1n7j h ALA 692 Ca -0.00 -0.63 -0.07 0.00 0.00 0.00 0.00 54.91 54.21 1n7j h ALA 692 Cb 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1n7j h ALA 692 CO 0.00 0.70 0.04 1.03 0.00 0.00 0.00 179.25 181.02 1n7j h SER 693 N 0.47 0.79 0.06 0.00 0.87 -1.74 -1.90 113.55 112.09 1n7j h SER 693 Ca -0.07 -0.28 0.03 0.00 -1.23 0.00 0.00 61.79 60.23 1n7j h SER 693 Cb 1.48 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 63.18 1n7j h SER 693 CO 0.17 0.88 -0.32 0.15 -0.53 0.00 0.00 176.83 177.17 1n7j h PHE 694 N 0.68 -0.88 -0.16 2.24 3.57 -1.31 0.19 116.94 121.25 1n7j h PHE 694 Ca 0.14 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.72 1n7j h PHE 694 Cb 0.45 0.38 -0.06 0.00 2.79 0.00 0.00 35.95 39.51 1n7j h PHE 694 CO 0.03 -0.42 -0.24 1.96 -2.23 0.00 0.00 178.31 177.42 1n7j h GLN 695 N -0.51 -0.27 -0.34 1.11 1.08 -1.17 0.18 115.11 115.19 1n7j h GLN 695 Ca 0.05 0.02 0.06 0.00 -1.45 0.00 0.00 58.65 57.32 1n7j h GLN 695 Cb 0.57 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 28.01 1n7j h GLN 695 CO -0.23 -0.18 0.01 0.00 -0.95 0.00 0.00 178.83 177.48 1n7j h ARG 696 N -0.28 0.10 -0.27 1.46 3.08 -0.87 0.53 114.38 118.13 1n7j h ARG 696 Ca 0.11 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.21 1n7j h ARG 696 Cb 0.45 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 1n7j h ARG 696 CO -0.32 0.07 -0.04 0.00 -1.07 0.00 0.00 179.97 178.60 1n7j h ALA 697 N 1.29 0.20 -0.33 0.04 0.00 -0.13 -0.57 119.26 119.77 1n7j h ALA 697 Ca 0.16 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1n7j h ALA 697 Cb 0.22 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1n7j h ALA 697 CO -0.27 -0.45 0.17 1.25 0.00 0.00 0.00 179.25 179.95 1n7j h LEU 698 N 0.03 0.39 -0.32 0.00 5.85 -0.28 -1.67 115.31 119.30 1n7j h LEU 698 Ca 0.13 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 1n7j h LEU 698 Cb 0.19 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1n7j h LEU 698 CO -0.26 0.33 -0.12 0.44 -0.34 0.00 0.00 178.44 178.49 1n7j h ASP 699 N 0.45 0.66 -0.58 1.25 3.32 0.43 -1.96 116.42 120.00 1n7j h ASP 699 Ca 0.12 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 1n7j h ASP 699 Cb 0.03 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1n7j h ASP 699 CO -0.02 0.90 0.36 0.45 -1.72 0.00 0.00 179.24 179.21 1n7j h HIS 700 N 0.42 0.75 -0.15 4.55 3.86 -0.57 -2.70 115.15 121.31 1n7j h HIS 700 Ca 0.08 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1n7j h HIS 700 Cb 0.63 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 1n7j h HIS 700 CO 0.06 0.50 0.08 0.82 0.86 0.00 0.00 177.93 180.25 1n7j h ILE 701 N 0.78 1.11 0.00 2.45 1.08 -1.32 -2.04 117.51 119.57 1n7j h ILE 701 Ca 0.21 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1n7j h ILE 701 Cb -0.04 1.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.75 1n7j h ILE 701 CO -0.04 0.10 0.15 0.74 -0.69 0.00 0.00 178.15 178.42 1n7j h THR 702 N 0.13 0.00 0.00 -0.27 2.02 -1.07 0.13 112.91 113.86 1n7j h THR 702 Ca 0.05 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.18 1n7j h THR 702 Cb 0.10 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1n7j h THR 702 CO -0.01 0.00 -0.27 0.74 0.37 0.00 0.00 175.52 176.35 1n7j h THR 703 N 0.00 1.13 0.00 3.16 2.02 -1.06 -2.70 112.91 115.46 1n7j h THR 703 Ca 0.00 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.23 1n7j h THR 703 Cb 0.31 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1n7j h THR 703 CO 0.00 0.26 -0.19 0.18 0.37 0.00 0.00 175.52 176.15 1n7j n LEU 704 N -4.12 0.50 -4.76 2.58 4.77 0.47 -4.85 117.00 111.59 1n7j n LEU 704 Ca -0.02 0.41 -0.36 0.00 -0.03 0.00 0.00 56.01 56.01 1n7j n LEU 704 Cb 0.33 -0.34 -0.07 0.00 -2.33 0.00 0.00 43.42 41.01 1n7j n LEU 704 CO 0.37 -0.06 -0.06 -0.22 -1.33 0.00 0.00 177.39 176.09 1n7j s LEU 705 N -3.79 4.28 0.55 2.23 2.96 -1.02 -0.53 118.68 123.35 1n7j s LEU 705 Ca 0.11 0.50 -0.20 0.00 -0.22 0.00 0.00 54.13 54.31 1n7j s LEU 705 Cb 0.15 -2.30 -0.05 0.00 0.50 0.00 0.00 46.19 44.49 1n7j s LEU 705 CO 0.61 0.18 1.21 0.00 -1.32 0.00 0.00 176.35 177.03 1n7j s ARG 706 N 0.08 3.24 0.41 1.98 1.70 -0.60 -4.89 118.95 120.88 1n7j s ARG 706 Ca 0.15 1.84 -0.27 0.00 -0.47 0.00 0.00 55.73 56.99 1n7j s ARG 706 Cb -0.13 -2.10 -0.10 0.00 -0.57 0.00 0.00 34.95 32.05 1n7j s ARG 706 CO 0.04 -0.99 1.48 -1.25 -1.08 0.00 0.00 175.30 173.49 1n7j s PRO 707 N -3.11 3.91 0.00 3.89 0.04 -1.26 -0.35 135.00 138.12 1n7j s PRO 707 Ca 0.73 2.54 0.00 0.00 0.04 0.00 0.00 61.00 64.31 1n7j s PRO 707 Cb -0.30 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1n7j s PRO 707 CO 0.35 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1n7j n GLY 708 N 0.49 0.81 3.89 0.56 0.00 0.13 -4.98 105.19 106.08 1n7j n GLY 708 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1n7j n GLY 708 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n7j s GLY 709 N -1.85 1.70 -0.02 -0.02 0.00 0.53 -4.68 107.32 102.97 1n7j s GLY 709 Ca 0.00 -0.98 0.07 0.00 0.00 0.00 0.00 44.72 43.82 1n7j s GLY 709 CO 0.00 -0.29 -0.25 0.30 0.00 0.00 0.00 173.10 172.86 1n7j s HIS 710 N -3.69 2.38 -0.07 1.90 3.76 -1.14 -0.28 115.29 118.14 1n7j s HIS 710 Ca 0.70 -0.41 0.05 0.00 -0.15 0.00 0.00 55.06 55.25 1n7j s HIS 710 Cb -0.07 -1.52 -0.00 0.00 1.11 0.00 0.00 32.58 32.10 1n7j s HIS 710 CO 0.52 -0.01 -0.22 -1.17 -0.85 0.00 0.00 174.74 173.00 1n7j s LEU 711 N -0.62 2.02 -0.35 0.89 2.96 0.97 -0.92 118.68 123.62 1n7j s LEU 711 Ca 0.10 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 1n7j s LEU 711 Cb -0.10 -1.27 0.10 0.00 0.50 0.00 0.00 46.19 45.41 1n7j s LEU 711 CO -0.01 0.19 0.08 -0.76 -1.32 0.00 0.00 176.35 174.53 1n7j s LEU 712 N 0.09 4.76 -0.15 -0.68 1.43 -0.22 -1.87 118.68 122.04 1n7j s LEU 712 Ca -0.09 -2.02 -0.08 0.00 -1.03 0.00 0.00 54.13 50.91 1n7j s LEU 712 Cb -0.15 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 1n7j s LEU 712 CO 0.05 -0.40 0.13 -0.76 0.23 0.00 0.00 176.35 175.59 1n7j s LEU 713 N 1.00 4.26 -0.04 1.79 1.43 -0.37 -1.00 118.68 125.75 1n7j s LEU 713 Ca 0.08 0.36 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 1n7j s LEU 713 Cb -0.20 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 43.98 1n7j s LEU 713 CO -0.06 0.33 -0.08 -0.63 0.23 0.00 0.00 176.35 176.14 1n7j s ILE 714 N -0.53 0.74 0.37 -0.59 1.01 -0.21 0.09 121.20 122.08 1n7j s ILE 714 Ca 0.12 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.40 1n7j s ILE 714 Cb -0.12 -0.71 0.03 0.00 0.01 0.00 0.00 42.46 41.68 1n7j s ILE 714 CO 0.02 0.26 0.65 -0.83 0.00 0.00 0.00 174.94 175.04 1n7j s GLY 715 N 0.64 0.89 0.06 6.18 0.00 -0.57 0.46 107.32 114.98 1n7j s GLY 715 Ca -0.10 -1.11 -0.20 0.00 0.00 0.00 0.00 44.72 43.31 1n7j s GLY 715 CO 0.01 -0.62 0.59 0.00 0.00 0.00 0.00 173.10 173.08 1n7j s ALA 716 N -2.59 3.55 -0.27 3.20 0.00 -1.26 -1.36 121.76 123.03 1n7j s ALA 716 Ca 0.22 0.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.14 1n7j s ALA 716 Cb -0.03 -2.69 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 1n7j s ALA 716 CO 0.16 0.32 0.14 -0.51 0.00 0.00 0.00 175.76 175.87 1n7j s LEU 717 N -0.84 3.79 -1.33 0.00 1.02 0.11 -4.58 118.68 116.86 1n7j s LEU 717 Ca 0.30 -0.09 -0.02 0.00 0.02 0.00 0.00 54.13 54.34 1n7j s LEU 717 Cb -0.19 -2.04 0.01 0.00 0.02 0.00 0.00 46.19 43.99 1n7j s LEU 717 CO 0.19 -0.04 0.79 1.21 0.02 0.00 0.00 176.35 178.51 1n7j n GLU 718 N 5.00 -5.31 -4.74 1.70 4.07 0.81 -2.42 120.64 119.74 1n7j n GLU 718 Ca -0.15 0.65 -0.33 0.00 -0.06 0.00 0.00 57.16 57.27 1n7j n GLU 718 Cb 0.52 -5.33 -0.12 0.00 -0.06 0.00 0.00 31.44 26.45 1n7j n GLU 718 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1n7j s GLU 719 N -6.00 2.61 -0.00 5.31 2.12 -1.26 -4.35 118.70 117.12 1n7j s GLU 719 Ca 0.11 -0.63 0.06 0.00 0.36 0.00 0.00 54.97 54.87 1n7j s GLU 719 Cb -0.05 -2.48 -0.08 0.00 0.26 0.00 0.00 34.13 31.78 1n7j s GLU 719 CO 0.80 0.64 0.18 -1.13 -0.54 0.00 0.00 175.26 175.21 1n7j n SER 720 N 2.22 2.26 -3.50 -1.70 3.41 -1.25 -2.41 113.62 112.64 1n7j n SER 720 Ca -0.17 -0.26 -0.12 0.00 -0.26 0.00 0.00 58.87 58.05 1n7j n SER 720 Cb 0.53 1.16 -0.04 0.00 -0.26 0.00 0.00 64.21 65.60 1n7j n SER 720 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1n7j s TRP 721 N -2.06 -0.49 0.03 7.33 1.48 -1.26 0.84 118.94 124.82 1n7j s TRP 721 Ca -0.00 0.55 -0.23 0.00 -1.06 0.00 0.00 56.10 55.36 1n7j s TRP 721 Cb 0.04 0.50 0.05 0.00 -1.16 0.00 0.00 33.47 32.90 1n7j s TRP 721 CO 0.24 -0.62 0.52 1.52 -4.06 0.00 0.00 176.95 174.56 1n7j s TYR 722 N -2.47 -0.43 -0.02 1.66 -0.85 -0.66 -2.69 117.35 111.89 1n7j s TYR 722 Ca -0.01 0.53 -0.05 0.00 -0.52 0.00 0.00 57.07 57.01 1n7j s TYR 722 Cb -0.01 0.33 -0.04 0.00 0.38 0.00 0.00 41.96 42.62 1n7j s TYR 722 CO -0.04 -0.62 0.22 -0.51 -1.52 0.00 0.00 175.55 173.09 1n7j s LEU 723 N -1.82 4.37 -0.35 -3.49 1.43 0.15 -0.89 118.68 118.08 1n7j s LEU 723 Ca -0.07 0.48 0.15 0.00 -1.03 0.00 0.00 54.13 53.67 1n7j s LEU 723 Cb -0.01 -2.56 0.42 0.00 0.03 0.00 0.00 46.19 44.07 1n7j s LEU 723 CO 0.00 0.28 0.88 0.00 0.23 0.00 0.00 176.35 177.75 1n7j n ALA 724 N 1.20 3.06 0.00 4.21 0.00 -0.19 -4.70 120.51 124.10 1n7j n ALA 724 Ca -0.12 -3.31 0.00 0.00 0.00 0.00 0.00 53.44 50.01 1n7j n ALA 724 Cb 0.53 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1n7j n ALA 724 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n7j n GLY 725 N 0.03 1.28 0.13 0.00 0.00 -1.26 -1.12 105.19 104.25 1n7j n GLY 725 Ca 0.16 -0.86 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 1n7j n GLY 725 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1n7j h GLU 726 N 0.00 -0.22 -6.55 1.61 4.22 -1.96 -3.45 114.58 108.23 1n7j h GLU 726 Ca 0.00 0.01 -0.54 0.00 0.08 0.00 0.00 59.36 58.91 1n7j h GLU 726 Cb 0.00 0.05 0.05 0.00 0.50 0.00 0.00 28.75 29.35 1n7j h GLU 726 CO 0.00 0.21 1.02 0.00 -2.18 0.00 0.00 179.01 178.06 1n7j n ALA 727 N -2.51 2.24 -3.66 2.92 0.00 -1.24 -4.98 120.51 113.28 1n7j n ALA 727 Ca -0.08 0.37 -0.37 0.00 0.00 0.00 0.00 53.44 53.36 1n7j n ALA 727 Cb 0.27 -2.52 -0.11 0.00 0.00 0.00 0.00 19.45 17.08 1n7j n ALA 727 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1n7j s ARG 728 N 1.86 2.19 -0.15 0.00 3.52 -1.26 -1.02 118.95 124.09 1n7j s ARG 728 Ca 0.79 -1.67 -0.20 0.00 -0.13 0.00 0.00 55.73 54.52 1n7j s ARG 728 Cb -0.54 -3.57 -0.03 0.00 -1.56 0.00 0.00 34.95 29.25 1n7j s ARG 728 CO 0.36 -0.99 0.56 -0.51 -0.81 0.00 0.00 175.30 173.91 1n7j s LEU 729 N 1.21 4.22 0.13 -0.88 1.02 -0.07 -4.90 118.68 119.41 1n7j s LEU 729 Ca 0.05 0.85 -0.24 0.00 0.02 0.00 0.00 54.13 54.81 1n7j s LEU 729 Cb -0.23 -2.81 -0.07 0.00 0.02 0.00 0.00 46.19 43.10 1n7j s LEU 729 CO -0.03 -0.13 0.72 0.42 0.02 0.00 0.00 176.35 177.35 1n7j s THR 730 N 1.24 4.49 0.02 5.49 -4.23 -1.26 -1.66 115.64 119.73 1n7j s THR 730 Ca 0.28 1.57 -0.01 0.00 -1.18 0.00 0.00 61.69 62.35 1n7j s THR 730 Cb -0.16 -4.08 -0.02 0.00 1.34 0.00 0.00 72.50 69.59 1n7j s THR 730 CO 0.11 0.52 -0.01 0.68 -0.54 0.00 0.00 174.62 175.39 1n7j s VAL 731 N -1.06 0.11 -0.01 2.29 -7.23 0.25 -4.90 120.40 109.85 1n7j s VAL 731 Ca 0.34 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 59.31 1n7j s VAL 731 Cb -0.22 -0.31 -0.06 0.00 0.56 0.00 0.00 36.38 36.35 1n7j s VAL 731 CO 0.24 -0.49 1.59 0.54 -0.31 0.00 0.00 175.10 176.67 1n7j s VAL 732 N -1.50 3.48 -0.00 1.32 0.11 -1.21 -3.84 120.40 118.76 1n7j s VAL 732 Ca -0.15 0.74 -0.30 0.00 -2.93 0.00 0.00 61.98 59.34 1n7j s VAL 732 Cb -0.09 -3.48 -0.03 0.00 -1.53 0.00 0.00 36.38 31.25 1n7j s VAL 732 CO -0.01 -0.04 0.98 -2.16 -3.33 0.00 0.00 175.10 170.55 1n7j s PRO 733 N 3.31 4.56 0.12 1.54 0.04 -1.01 -4.66 135.00 138.89 1n7j s PRO 733 Ca 0.71 1.43 0.09 0.00 0.04 0.00 0.00 61.00 63.27 1n7j s PRO 733 Cb -0.34 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.70 1n7j s PRO 733 CO 0.29 -0.06 -0.23 0.14 0.04 0.00 0.00 177.00 177.19 1n7j s VAL 734 N 1.02 1.92 0.33 -0.36 -7.23 -1.26 -4.81 120.40 110.01 1n7j s VAL 734 Ca 0.52 -1.65 0.06 0.00 -1.81 0.00 0.00 61.98 59.10 1n7j s VAL 734 Cb -0.21 -1.73 -0.01 0.00 0.56 0.00 0.00 36.38 34.98 1n7j s VAL 734 CO 0.28 -0.02 0.48 -0.94 -0.31 0.00 0.00 175.10 174.58 1n7j s SER 735 N -2.01 6.01 0.35 4.85 1.04 -1.26 -0.13 113.70 122.55 1n7j s SER 735 Ca 0.10 -0.09 0.06 0.00 0.48 0.00 0.00 55.95 56.50 1n7j s SER 735 Cb -0.10 -1.36 0.67 0.00 0.10 0.00 0.00 66.02 65.33 1n7j s SER 735 CO 0.05 -0.41 1.88 1.05 0.98 0.00 0.00 173.24 176.79 1n7j h GLU 736 N 0.87 0.40 -0.55 4.02 4.11 -1.99 -1.85 114.58 119.59 1n7j h GLU 736 Ca -0.47 -0.09 -0.02 0.00 0.07 0.00 0.00 59.36 58.86 1n7j h GLU 736 Cb 1.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1n7j h GLU 736 CO 0.54 0.48 0.28 0.93 0.07 0.00 0.00 179.01 181.32 1n7j h GLU 737 N 0.38 0.79 -0.62 1.06 5.08 -1.99 0.09 114.58 119.36 1n7j h GLU 737 Ca 0.08 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1n7j h GLU 737 Cb 0.37 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1n7j h GLU 737 CO 0.02 0.63 0.29 0.93 -1.00 0.00 0.00 179.01 179.88 1n7j h GLU 738 N 0.74 0.88 -0.38 2.33 5.08 -1.80 -1.10 114.58 120.33 1n7j h GLU 738 Ca 0.19 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1n7j h GLU 738 Cb 0.10 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1n7j h GLU 738 CO -0.03 0.69 -0.05 0.28 -1.00 0.00 0.00 179.01 178.90 1n7j h VAL 739 N 0.88 1.27 -0.30 3.13 2.07 -0.60 -0.47 116.25 122.22 1n7j h VAL 739 Ca 0.22 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1n7j h VAL 739 Cb 0.10 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1n7j h VAL 739 CO -0.03 0.36 0.19 -0.09 0.02 0.00 0.00 177.57 178.03 1n7j h ARG 740 N 0.51 0.38 -0.51 1.57 2.43 -0.47 -1.88 114.38 116.41 1n7j h ARG 740 Ca 0.10 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1n7j h ARG 740 Cb 0.54 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 1n7j h ARG 740 CO 0.03 0.25 0.31 1.49 -1.51 0.00 0.00 179.97 180.54 1n7j h GLU 741 N 0.40 0.61 -0.58 0.20 4.57 -1.12 -1.79 114.58 116.86 1n7j h GLU 741 Ca 0.11 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.30 1n7j h GLU 741 Cb -0.04 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.37 1n7j h GLU 741 CO -0.03 0.40 0.33 0.00 -1.18 0.00 0.00 179.01 178.53 1n7j h ALA 742 N 1.22 0.75 -0.02 2.92 0.00 -0.76 -0.10 119.26 123.28 1n7j h ALA 742 Ca 0.20 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1n7j h ALA 742 Cb -0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1n7j h ALA 742 CO -0.08 0.02 0.01 -0.07 0.00 0.00 0.00 179.25 179.12 1n7j h LEU 743 N 0.63 0.02 -0.17 0.00 3.38 -1.05 -1.70 115.31 116.43 1n7j h LEU 743 Ca 0.25 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.10 1n7j h LEU 743 Cb 0.10 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1n7j h LEU 743 CO -0.14 0.16 0.00 0.58 0.09 0.00 0.00 178.44 179.14 1n7j h VAL 744 N -0.12 0.89 -0.97 1.22 2.07 -1.05 -1.54 116.25 116.75 1n7j h VAL 744 Ca 0.01 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.57 1n7j h VAL 744 Cb 0.14 0.82 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 1n7j h VAL 744 CO -0.00 0.01 0.63 0.03 0.02 0.00 0.00 177.57 178.26 1n7j h ARG 745 N 0.06 1.07 0.00 1.57 3.08 -0.94 0.26 114.38 119.48 1n7j h ARG 745 Ca 0.08 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1n7j h ARG 745 Cb 0.09 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1n7j h ARG 745 CO -0.13 0.71 0.00 0.43 -1.07 0.00 0.00 179.97 179.91 1n7j n SER 746 N -4.51 0.00 -0.21 7.04 7.64 -0.65 -4.86 113.62 118.08 1n7j n SER 746 Ca 0.15 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 59.21 1n7j n SER 746 Cb 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1n7j n SER 746 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n7j n GLY 747 N 0.43 0.91 3.60 0.23 0.00 0.08 -4.95 105.19 105.49 1n7j n GLY 747 Ca 0.15 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 1n7j n GLY 747 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n7j s TYR 748 N -2.41 2.79 -0.29 1.61 2.02 -0.64 -1.08 117.35 119.35 1n7j s TYR 748 Ca 0.00 -0.13 -0.10 0.00 -0.37 0.00 0.00 57.07 56.47 1n7j s TYR 748 Cb 0.00 -1.46 -0.03 0.00 -0.40 0.00 0.00 41.96 40.07 1n7j s TYR 748 CO 0.00 0.44 0.16 0.21 -1.57 0.00 0.00 175.55 174.79 1n7j s LYS 749 N -2.22 3.73 -0.58 -0.62 2.20 0.43 -4.13 119.74 118.56 1n7j s LYS 749 Ca 0.22 -0.46 -0.27 0.00 -0.36 0.00 0.00 55.97 55.10 1n7j s LYS 749 Cb -0.11 -3.59 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 1n7j s LYS 749 CO 0.15 -0.25 1.54 0.08 -0.36 0.00 0.00 175.35 176.51 1n7j s VAL 750 N 1.70 3.65 -0.11 4.02 1.01 -1.26 -1.74 120.40 127.66 1n7j s VAL 750 Ca 0.06 0.51 0.14 0.00 0.00 0.00 0.00 61.98 62.69 1n7j s VAL 750 Cb -0.16 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 31.90 1n7j s VAL 750 CO 0.09 -1.12 1.30 0.03 0.00 0.00 0.00 175.10 175.39 1n7j h ARG 751 N 12.06 0.00 -1.79 2.72 3.08 -1.06 -3.47 114.38 125.92 1n7j h ARG 751 Ca -0.27 0.00 0.04 0.00 0.07 0.00 0.00 59.98 59.82 1n7j h ARG 751 Cb 1.11 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.92 1n7j h ARG 751 CO 1.19 0.52 0.24 0.34 -1.07 0.00 0.00 179.97 181.19 1n7j s ASP 752 N -6.36 -0.67 -0.10 7.04 2.15 -0.75 -4.95 116.67 113.03 1n7j s ASP 752 Ca 0.02 1.17 -0.04 0.00 0.43 0.00 0.00 52.55 54.14 1n7j s ASP 752 Cb 0.08 1.24 0.05 0.00 -0.30 0.00 0.00 42.92 43.99 1n7j s ASP 752 CO 0.77 -0.19 0.16 -0.22 -0.17 0.00 0.00 175.17 175.52 1n7j s LEU 753 N 0.93 -0.07 0.10 -1.34 2.96 -1.26 0.43 118.68 120.42 1n7j s LEU 753 Ca -0.04 0.26 0.08 0.00 -0.22 0.00 0.00 54.13 54.21 1n7j s LEU 753 Cb -0.05 0.27 -0.03 0.00 0.50 0.00 0.00 46.19 46.88 1n7j s LEU 753 CO -0.11 -0.26 -0.21 -0.13 -1.32 0.00 0.00 176.35 174.33 1n7j s ARG 754 N 2.29 1.16 -0.04 1.98 0.52 0.66 -4.97 118.95 120.55 1n7j s ARG 754 Ca 0.03 -1.14 0.07 0.00 -0.52 0.00 0.00 55.73 54.17 1n7j s ARG 754 Cb -0.12 -1.42 -0.02 0.00 0.52 0.00 0.00 34.95 33.91 1n7j s ARG 754 CO -0.06 0.33 -0.24 0.99 0.02 0.00 0.00 175.30 176.34 1n7j s THR 755 N -1.12 2.18 -0.24 0.02 2.01 -1.26 -0.89 115.64 116.34 1n7j s THR 755 Ca 0.07 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1n7j s THR 755 Cb -0.10 -1.78 0.04 0.00 0.01 0.00 0.00 72.50 70.67 1n7j s THR 755 CO 0.04 0.58 -0.11 -0.47 -0.69 0.00 0.00 174.62 173.97 1n7j s TYR 756 N -0.41 3.08 -0.59 4.92 5.04 0.78 -4.95 117.35 125.21 1n7j s TYR 756 Ca 0.04 -1.89 -0.28 0.00 -2.44 0.00 0.00 57.07 52.50 1n7j s TYR 756 Cb -0.12 -1.98 0.02 0.00 0.35 0.00 0.00 41.96 40.24 1n7j s TYR 756 CO 0.01 -0.81 1.29 0.42 -1.34 0.00 0.00 175.55 175.12 1n7j s ILE 757 N 1.23 3.89 -0.09 3.14 1.01 -1.26 -0.23 121.20 128.88 1n7j s ILE 757 Ca -0.02 0.75 -0.32 0.00 0.00 0.00 0.00 60.65 61.06 1n7j s ILE 757 Cb -0.17 -4.64 -0.10 0.00 0.01 0.00 0.00 42.46 37.56 1n7j s ILE 757 CO -0.07 -1.34 2.00 0.80 0.00 0.00 0.00 174.94 176.33 1n7j n MET 758 N 8.65 2.29 -1.31 2.79 1.56 -0.91 -4.92 117.12 125.26 1n7j n MET 758 Ca 0.09 0.80 -0.30 0.00 -0.27 0.00 0.00 57.70 58.03 1n7j n MET 758 Cb 0.49 -2.86 0.12 0.00 2.15 0.00 0.00 33.22 33.12 1n7j n MET 758 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1n7j s PRO 759 N 4.78 1.61 0.17 2.12 0.04 -1.26 -4.76 135.00 137.69 1n7j s PRO 759 Ca 0.94 0.80 -0.23 0.00 0.04 0.00 0.00 61.00 62.55 1n7j s PRO 759 Cb -0.56 -1.85 0.06 0.00 0.04 0.00 0.00 34.50 32.20 1n7j s PRO 759 CO 0.46 -2.00 1.59 0.00 0.04 0.00 0.00 177.00 177.09 1n7j h ALA 760 N -1.37 -0.21 -0.93 8.56 0.00 -1.97 -2.23 119.26 121.13 1n7j h ALA 760 Ca -0.48 0.11 0.17 0.00 0.00 0.00 0.00 54.91 54.71 1n7j h ALA 760 Cb 1.27 0.78 -0.08 0.00 0.00 0.00 0.00 17.79 19.77 1n7j h ALA 760 CO 0.56 -0.75 0.59 1.25 0.00 0.00 0.00 179.25 180.90 1n7j h HIS 761 N -0.24 0.79 -0.08 0.00 -0.00 -2.02 0.25 115.15 113.85 1n7j h HIS 761 Ca 0.18 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.58 1n7j h HIS 761 Cb 0.55 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.72 1n7j h HIS 761 CO -0.59 0.24 0.00 1.28 -0.00 0.00 0.00 177.93 178.85 1n7j n LEU 762 N -4.59 0.91 -4.52 0.26 4.77 -0.85 -4.72 117.00 108.27 1n7j n LEU 762 Ca 0.19 -0.37 -0.42 0.00 -0.03 0.00 0.00 56.01 55.39 1n7j n LEU 762 Cb 0.57 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1n7j n LEU 762 CO 0.28 0.18 1.11 -1.10 -1.33 0.00 0.00 177.39 176.53 1n7j s GLN 763 N -1.90 3.28 0.09 3.23 -1.52 0.07 -4.96 119.66 117.94 1n7j s GLN 763 Ca 0.32 -0.68 0.07 0.00 -1.95 0.00 0.00 55.36 53.12 1n7j s GLN 763 Cb 0.16 -4.47 -0.04 0.00 -0.22 0.00 0.00 33.01 28.44 1n7j s GLN 763 CO 0.26 -2.05 -0.13 0.95 -0.25 0.00 0.00 175.29 174.08 1n7j s THR 764 N 4.92 3.19 -1.25 -0.19 -4.23 -1.26 -4.98 115.64 111.84 1n7j s THR 764 Ca 0.34 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1n7j s THR 764 Cb -0.09 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.30 1n7j s THR 764 CO 0.07 0.17 0.01 0.61 -0.54 0.00 0.00 174.62 174.94 1n7j n GLY 765 N 0.93 0.00 0.23 3.99 0.00 -1.26 -2.43 105.19 106.65 1n7j n GLY 765 Ca -0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.00 1n7j n GLY 765 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1n7j h VAL 766 N 0.00 0.06 -1.98 1.61 -1.51 -1.95 -3.46 116.25 109.02 1n7j h VAL 766 Ca 0.00 -0.95 0.16 0.00 -1.23 0.00 0.00 66.70 64.68 1n7j h VAL 766 Cb 0.00 1.90 -0.03 0.00 -2.13 0.00 0.00 31.29 31.03 1n7j h VAL 766 CO 0.00 0.03 0.47 -0.90 -1.23 0.00 0.00 177.57 175.95 1n7j n ASP 767 N -3.11 -0.92 -0.57 4.19 3.85 -1.02 0.33 116.55 119.30 1n7j n ASP 767 Ca 0.03 -1.36 0.06 0.00 -0.71 0.00 0.00 54.79 52.81 1n7j n ASP 767 Cb 0.48 1.46 0.18 0.00 -1.35 0.00 0.00 41.12 41.90 1n7j n ASP 767 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1n7j n ASP 768 N -0.88 1.74 -4.78 -1.12 3.85 -1.10 -4.74 116.55 109.54 1n7j n ASP 768 Ca 0.01 -3.60 -0.41 0.00 -0.71 0.00 0.00 54.79 50.08 1n7j n ASP 768 Cb 0.37 -0.49 -0.00 0.00 -1.35 0.00 0.00 41.12 39.64 1n7j n ASP 768 CO 0.00 0.00 0.00 0.68 -1.01 0.00 0.00 177.20 176.87 1n7j s VAL 769 N -2.89 2.00 -0.48 2.12 -7.23 -1.26 -4.62 120.40 108.04 1n7j s VAL 769 Ca 0.36 0.00 0.18 0.00 -1.81 0.00 0.00 61.98 60.72 1n7j s VAL 769 Cb 0.35 -3.00 -0.24 0.00 0.56 0.00 0.00 36.38 34.05 1n7j s VAL 769 CO -0.06 0.00 0.60 0.29 -0.31 0.00 0.00 175.10 175.63 1n7j n LYS 770 N 0.51 0.81 0.00 4.82 4.76 -1.02 -4.83 118.16 123.21 1n7j n LYS 770 Ca 0.01 -0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1n7j n LYS 770 Cb 0.39 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 1n7j n LYS 770 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n7j n GLY 771 N 1.43 -0.80 3.14 0.72 0.00 -1.21 -2.15 105.19 106.32 1n7j n GLY 771 Ca 0.00 -1.01 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 1n7j n GLY 771 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n7j s VAL 772 N -2.00 0.98 0.06 1.61 1.01 0.67 0.10 120.40 122.83 1n7j s VAL 772 Ca 0.00 -1.16 0.10 0.00 0.00 0.00 0.00 61.98 60.91 1n7j s VAL 772 Cb 0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1n7j s VAL 772 CO 0.00 -0.19 -0.26 0.72 0.00 0.00 0.00 175.10 175.36 1n7j s PHE 773 N -1.16 2.32 -0.08 5.22 -0.12 -0.47 -0.16 117.98 123.53 1n7j s PHE 773 Ca -0.03 -0.41 0.04 0.00 -0.05 0.00 0.00 56.93 56.48 1n7j s PHE 773 Cb -0.09 -1.37 0.00 0.00 -0.63 0.00 0.00 43.02 40.93 1n7j s PHE 773 CO 0.02 0.16 -0.20 0.12 -0.05 0.00 0.00 175.22 175.26 1n7j s PHE 774 N -0.84 2.17 -0.03 3.49 5.36 -0.07 -1.51 117.98 126.54 1n7j s PHE 774 Ca 0.12 -0.83 0.02 0.00 -0.96 0.00 0.00 56.93 55.28 1n7j s PHE 774 Cb -0.10 -1.47 0.01 0.00 -0.34 0.00 0.00 43.02 41.12 1n7j s PHE 774 CO 0.03 -0.34 -0.07 0.00 -1.46 0.00 0.00 175.22 173.38 1n7j s ALA 775 N 0.35 0.79 -0.34 11.12 0.00 0.11 -0.25 121.76 133.55 1n7j s ALA 775 Ca -0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 1n7j s ALA 775 Cb -0.16 -0.36 0.08 0.00 0.00 0.00 0.00 23.12 22.68 1n7j s ALA 775 CO 0.06 0.08 0.06 -0.46 0.00 0.00 0.00 175.76 175.51 1n7j s TRP 776 N 0.47 3.46 0.06 0.00 -0.00 0.17 -1.24 118.94 121.86 1n7j s TRP 776 Ca -0.07 -2.30 0.08 0.00 -0.00 0.00 0.00 56.10 53.82 1n7j s TRP 776 Cb -0.11 -2.58 -0.03 0.00 -0.00 0.00 0.00 33.47 30.75 1n7j s TRP 776 CO 0.01 -0.89 -0.23 0.00 -0.00 0.00 0.00 176.95 175.84 1n7j s ALA 777 N 1.14 1.97 -0.11 5.86 0.00 -0.78 -0.35 121.76 129.49 1n7j s ALA 777 Ca 0.01 -1.19 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1n7j s ALA 777 Cb -0.21 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 1n7j s ALA 777 CO -0.04 0.45 -0.16 -1.14 0.00 0.00 0.00 175.76 174.87 1n7j s GLN 778 N -1.38 3.17 0.26 0.00 0.74 -0.71 -0.02 119.66 121.71 1n7j s GLN 778 Ca 0.09 -0.74 -0.30 0.00 0.05 0.00 0.00 55.36 54.47 1n7j s GLN 778 Cb -0.09 -2.51 -0.09 0.00 1.10 0.00 0.00 33.01 31.41 1n7j s GLN 778 CO 0.03 0.27 1.27 0.21 -0.55 0.00 0.00 175.29 176.51 1n7j s LYS 779 N 0.19 4.42 0.00 1.67 2.20 0.61 -0.43 119.74 128.40 1n7j s LYS 779 Ca -0.10 2.07 0.24 0.00 -0.36 0.00 0.00 55.97 57.82 1n7j s LYS 779 Cb -0.16 -3.15 0.20 0.00 -1.51 0.00 0.00 37.83 33.21 1n7j s LYS 779 CO 0.06 -0.15 1.26 0.28 -0.36 0.00 0.00 175.35 176.44