#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hnn s ASP 515 N 0.00 7.43 -0.23 3.54 -1.08 -1.26 -4.96 116.67 120.12 1hnn s ASP 515 Ca 0.00 1.81 0.08 0.00 -0.52 0.00 0.00 52.55 53.93 1hnn s ASP 515 Cb 0.00 -2.59 -0.20 0.00 -1.46 0.00 0.00 42.92 38.68 1hnn s ASP 515 CO 0.00 -0.14 -0.10 -1.54 0.52 0.00 0.00 175.17 173.91 1hnn n SER 516 N 2.99 1.29 -0.33 -0.34 3.41 -1.26 -4.61 113.62 114.77 1hnn n SER 516 Ca 0.03 -0.08 0.16 0.00 -0.26 0.00 0.00 58.87 58.72 1hnn n SER 516 Cb 0.49 0.18 0.36 0.00 -0.26 0.00 0.00 64.21 64.97 1hnn n SER 516 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hnn h ALA 517 N 0.40 1.64 -0.00 7.33 0.00 -1.99 -2.79 119.26 123.84 1hnn h ALA 517 Ca -0.54 0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.53 1hnn h ALA 517 Cb 2.00 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.86 1hnn h ALA 517 CO -0.04 -0.32 -0.09 -1.35 0.00 0.00 0.00 179.25 177.45 1hnn h PRO 518 N 0.49 -0.15 0.02 0.00 0.11 -1.99 0.63 132.00 131.10 1hnn h PRO 518 Ca 0.61 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.73 1hnn h PRO 518 Cb 1.18 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1hnn h PRO 518 CO -0.51 -0.10 -0.01 0.78 -0.21 0.00 0.00 178.00 177.95 1hnn h GLY 519 N -0.16 -0.02 0.18 -0.55 0.00 -1.79 -2.54 103.07 98.18 1hnn h GLY 519 Ca 0.04 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.42 1hnn h GLY 519 CO -0.09 -0.01 -0.33 1.46 0.00 0.00 0.00 176.54 177.57 1hnn h GLN 520 N -0.18 -0.41 -0.96 4.80 4.20 -1.43 -1.17 115.11 119.96 1hnn h GLN 520 Ca -0.00 0.03 0.25 0.00 0.06 0.00 0.00 58.65 58.98 1hnn h GLN 520 Cb 0.18 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.98 1hnn h GLN 520 CO 0.00 -0.27 0.65 0.00 -0.67 0.00 0.00 178.83 178.55 1hnn h ALA 521 N 0.36 2.47 0.03 3.87 0.00 -0.79 0.37 119.26 125.57 1hnn h ALA 521 Ca 0.09 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1hnn h ALA 521 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1hnn h ALA 521 CO -0.34 -0.79 -0.01 0.00 0.00 0.00 0.00 179.25 178.11 1hnn h ALA 522 N 1.58 -0.04 0.36 0.00 0.00 -0.80 -1.62 119.26 118.73 1hnn h ALA 522 Ca 0.50 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1hnn h ALA 522 Cb 1.51 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 1hnn h ALA 522 CO -0.14 -0.30 -0.31 0.28 0.00 0.00 0.00 179.25 178.78 1hnn h VAL 523 N -0.49 0.36 -0.87 0.00 2.07 -0.11 0.22 116.25 117.43 1hnn h VAL 523 Ca -0.00 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.71 1hnn h VAL 523 Cb 0.46 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1hnn h VAL 523 CO 0.01 0.00 0.58 0.00 0.02 0.00 0.00 177.57 178.18 1hnn h ALA 524 N -0.15 2.25 0.07 1.67 0.00 -0.43 -0.05 119.26 122.61 1hnn h ALA 524 Ca -0.03 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1hnn h ALA 524 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1hnn h ALA 524 CO -0.03 -0.51 -0.03 1.03 0.00 0.00 0.00 179.25 179.70 1hnn h SER 525 N 0.36 -0.08 -0.49 0.00 0.87 -0.28 -3.21 113.55 110.72 1hnn h SER 525 Ca 0.44 -0.42 0.09 0.00 -1.23 0.00 0.00 61.79 60.67 1hnn h SER 525 Cb 1.15 0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 63.06 1hnn h SER 525 CO -0.15 0.40 0.05 0.00 -0.53 0.00 0.00 176.83 176.60 1hnn h ALA 526 N 0.28 0.51 0.00 6.23 0.00 0.12 -1.73 119.26 124.66 1hnn h ALA 526 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1hnn h ALA 526 Cb 0.50 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1hnn h ALA 526 CO 0.02 -0.35 0.00 0.66 0.00 0.00 0.00 179.25 179.58 1hnn n TYR 527 N -5.17 0.00 0.46 0.00 4.02 -0.38 -2.11 117.16 113.99 1hnn n TYR 527 Ca 0.05 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.06 1hnn n TYR 527 Cb 0.26 -0.46 0.46 0.00 -0.02 0.00 0.00 39.34 39.58 1hnn n TYR 527 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1hnn n GLN 528 N -1.46 0.18 -0.36 -0.72 1.13 -0.65 -2.29 117.38 113.21 1hnn n GLN 528 Ca 0.03 0.36 0.07 0.00 -1.94 0.00 0.00 57.00 55.52 1hnn n GLN 528 Cb 0.10 -1.82 0.23 0.00 0.11 0.00 0.00 30.24 28.86 1hnn n GLN 528 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1hnn n ARG 529 N -2.16 2.97 -2.25 -1.09 5.12 -0.90 -5.00 116.66 113.36 1hnn n ARG 529 Ca 0.03 -2.56 -0.42 0.00 -1.93 0.00 0.00 57.85 52.97 1hnn n ARG 529 Cb 0.26 -1.64 -0.03 0.00 -1.16 0.00 0.00 32.46 29.89 1hnn n ARG 529 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1hnn s PHE 530 N -2.12 3.14 -0.42 -1.55 5.36 -0.97 -3.41 117.98 118.00 1hnn s PHE 530 Ca 0.36 0.98 -0.05 0.00 -0.96 0.00 0.00 56.93 57.26 1hnn s PHE 530 Cb 0.26 -3.62 0.11 0.00 -0.34 0.00 0.00 43.02 39.43 1hnn s PHE 530 CO 0.12 -2.16 0.24 -1.21 -1.46 0.00 0.00 175.22 170.75 1hnn s GLU 531 N 1.59 2.19 0.18 10.12 2.02 0.45 -5.00 118.70 130.24 1hnn s GLU 531 Ca 0.63 -1.76 -0.23 0.00 0.02 0.00 0.00 54.97 53.64 1hnn s GLU 531 Cb -0.33 -3.67 0.09 0.00 0.10 0.00 0.00 34.13 30.31 1hnn s GLU 531 CO 0.28 -1.08 1.58 -1.35 0.02 0.00 0.00 175.26 174.72 1hnn h PRO 532 N 8.18 -0.20 -0.61 0.39 0.11 -1.92 0.19 132.00 138.14 1hnn h PRO 532 Ca -0.16 0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.04 1hnn h PRO 532 Cb 1.06 0.04 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 1hnn h PRO 532 CO 0.74 -0.13 0.28 0.00 -0.21 0.00 0.00 178.00 178.68 1hnn h ARG 533 N -0.21 0.50 -0.53 1.05 2.47 -1.95 0.44 114.38 116.15 1hnn h ARG 533 Ca 0.20 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.85 1hnn h ARG 533 Cb 0.55 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.74 1hnn h ARG 533 CO -0.64 0.33 0.17 0.00 0.56 0.00 0.00 179.97 180.38 1hnn h ALA 534 N 1.37 0.69 -0.01 0.04 0.00 -1.62 -0.73 119.26 119.00 1hnn h ALA 534 Ca 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1hnn h ALA 534 Cb 0.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1hnn h ALA 534 CO -0.24 0.35 -0.01 -0.92 0.00 0.00 0.00 179.25 178.43 1hnn h TYR 535 N 0.72 -0.01 -0.24 0.00 3.20 0.42 -0.41 116.97 120.66 1hnn h TYR 535 Ca 0.17 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.08 1hnn h TYR 535 Cb 0.27 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 1hnn h TYR 535 CO 0.02 -0.01 0.03 -0.07 -1.64 0.00 0.00 178.16 176.48 1hnn h LEU 536 N -0.01 -0.03 -0.70 2.82 3.38 0.00 -1.26 115.31 119.50 1hnn h LEU 536 Ca 0.01 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1hnn h LEU 536 Cb 0.02 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1hnn h LEU 536 CO -0.01 0.01 0.45 -0.09 0.09 0.00 0.00 178.44 178.88 1hnn h ARG 537 N 0.11 0.85 0.00 1.13 2.43 -0.96 0.69 114.38 118.63 1hnn h ARG 537 Ca 0.11 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.13 1hnn h ARG 537 Cb 0.12 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1hnn h ARG 537 CO -0.16 0.56 -0.48 -0.91 -1.51 0.00 0.00 179.97 177.47 1hnn h ASN 538 N 0.88 0.00 0.00 -3.80 2.35 -0.66 -3.27 115.58 111.08 1hnn h ASN 538 Ca 0.28 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.98 1hnn h ASN 538 Cb -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1hnn h ASN 538 CO -0.10 0.48 -1.33 0.59 -1.65 0.00 0.00 177.43 175.42 1hnn n ASN 539 N -3.71 3.62 -0.28 5.81 3.02 -0.51 -4.77 115.26 118.44 1hnn n ASN 539 Ca -0.01 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.57 1hnn n ASN 539 Cb 0.55 0.95 0.06 0.00 -0.61 0.00 0.00 39.78 40.72 1hnn n ASN 539 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1hnn n TYR 540 N -1.97 0.17 -3.98 3.10 4.02 0.24 -4.15 117.16 114.59 1hnn n TYR 540 Ca -0.05 -0.40 -0.22 0.00 -0.01 0.00 0.00 57.90 57.21 1hnn n TYR 540 Cb 0.43 -0.03 -0.05 0.00 -0.02 0.00 0.00 39.34 39.66 1hnn n TYR 540 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1hnn s ALA 541 N -0.89 3.64 0.72 -0.72 0.00 -1.17 -4.09 121.76 119.25 1hnn s ALA 541 Ca 0.10 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 50.12 1hnn s ALA 541 Cb 0.05 -0.88 0.03 0.00 0.00 0.00 0.00 23.12 22.32 1hnn s ALA 541 CO 0.07 0.01 1.25 -2.14 0.00 0.00 0.00 175.76 174.95 1hnn s PRO 542 N -3.91 2.15 0.05 0.00 0.02 -1.26 0.10 135.00 132.15 1hnn s PRO 542 Ca 0.39 1.92 0.27 0.00 0.02 0.00 0.00 61.00 63.60 1hnn s PRO 542 Cb -0.03 -1.82 1.08 0.00 0.02 0.00 0.00 34.50 33.76 1hnn s PRO 542 CO 0.24 -1.87 1.85 -0.35 -0.33 0.00 0.00 177.00 176.54 1hnn n PRO 543 N -2.53 0.06 0.12 5.54 -0.04 -1.26 -4.68 135.00 132.21 1hnn n PRO 543 Ca 0.15 0.08 -0.00 0.00 -0.04 0.00 0.00 63.50 63.69 1hnn n PRO 543 Cb 0.49 -1.58 0.05 0.00 -0.04 0.00 0.00 33.50 32.42 1hnn n PRO 543 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hnn h ARG 544 N 0.00 0.00 -0.64 0.54 3.08 -1.74 -3.13 114.38 112.49 1hnn h ARG 544 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1hnn h ARG 544 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1hnn h ARG 544 CO 0.00 0.64 0.00 0.41 -1.07 0.00 0.00 179.97 179.95 1hnn n GLY 545 N 1.01 2.15 3.41 0.04 0.00 0.28 -4.07 105.19 108.01 1hnn n GLY 545 Ca 0.01 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 44.96 1hnn n GLY 545 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hnn s ASP 546 N -0.72 6.20 0.00 1.61 2.15 -1.19 -4.38 116.67 120.34 1hnn s ASP 546 Ca 0.38 -1.17 0.19 0.00 0.43 0.00 0.00 52.55 52.38 1hnn s ASP 546 Cb 0.25 -2.26 0.85 0.00 -0.30 0.00 0.00 42.92 41.45 1hnn s ASP 546 CO 0.16 -0.88 1.58 0.18 -0.17 0.00 0.00 175.17 176.04 1hnn n LEU 547 N 5.94 1.02 0.09 -1.34 4.77 -1.26 -4.03 117.00 122.19 1hnn n LEU 547 Ca -0.09 -0.43 -0.13 0.00 -0.03 0.00 0.00 56.01 55.33 1hnn n LEU 547 Cb 0.44 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.38 1hnn n LEU 547 CO 0.53 0.22 0.61 0.00 -1.33 0.00 0.00 177.39 177.42 1hnn s ASN 549 N -5.29 5.90 0.59 0.00 3.84 -1.26 -4.84 114.94 113.89 1hnn s ASN 549 Ca -0.15 2.01 0.29 0.00 0.21 0.00 0.00 52.86 55.22 1hnn s ASN 549 Cb 0.02 -2.52 1.67 0.00 -0.55 0.00 0.00 41.25 39.87 1hnn s ASN 549 CO 0.60 -1.59 2.11 1.55 -2.79 0.00 0.00 177.10 176.98 1hnn h PRO 550 N 13.00 0.00 -1.10 0.43 0.13 -1.93 -2.62 132.00 139.91 1hnn h PRO 550 Ca -0.42 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.07 1hnn h PRO 550 Cb 1.22 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.01 1hnn h PRO 550 CO 0.97 0.00 0.22 0.09 -0.23 0.00 0.00 178.00 179.05 1hnn n ASN 551 N -3.81 6.54 -4.81 1.44 3.02 -1.26 -4.69 115.26 111.69 1hnn n ASN 551 Ca 0.01 -3.78 -0.25 0.00 -0.03 0.00 0.00 54.58 50.53 1hnn n ASN 551 Cb 0.30 -0.74 0.01 0.00 -0.61 0.00 0.00 39.78 38.74 1hnn n ASN 551 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hnn n GLY 552 N -0.76 2.68 0.22 7.41 0.00 -0.99 -5.01 105.19 108.75 1hnn n GLY 552 Ca 0.54 -2.29 -0.12 0.00 0.00 0.00 0.00 46.02 44.14 1hnn n GLY 552 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1hnn h VAL 553 N 0.62 0.54 -0.87 1.61 2.07 -1.89 -2.99 116.25 115.34 1hnn h VAL 553 Ca -0.34 -0.65 0.12 0.00 0.82 0.00 0.00 66.70 66.65 1hnn h VAL 553 Cb 1.26 0.81 -0.13 0.00 -1.52 0.00 0.00 31.29 31.70 1hnn h VAL 553 CO 0.53 0.10 -0.44 1.23 0.02 0.00 0.00 177.57 179.01 1hnn h GLY 554 N -0.89 -0.29 0.56 2.17 0.00 -1.89 0.17 103.07 102.91 1hnn h GLY 554 Ca -0.05 0.59 0.05 0.00 0.00 0.00 0.00 47.33 47.93 1hnn h GLY 554 CO 0.08 -0.13 0.05 -2.55 0.00 0.00 0.00 176.54 173.99 1hnn h PRO 555 N -0.07 0.16 -0.35 4.80 0.11 -1.86 -1.65 132.00 133.14 1hnn h PRO 555 Ca 0.25 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.40 1hnn h PRO 555 Cb 0.54 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.58 1hnn h PRO 555 CO -0.88 0.11 0.11 2.35 -0.21 0.00 0.00 178.00 179.47 1hnn h TRP 556 N 0.16 0.20 0.64 0.65 7.01 -0.69 0.26 115.95 124.19 1hnn h TRP 556 Ca 0.16 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.15 1hnn h TRP 556 Cb 0.19 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.22 1hnn h TRP 556 CO -0.20 0.08 -0.34 0.87 -2.79 0.00 0.00 178.44 176.06 1hnn h LYS 557 N 0.25 -0.87 -0.92 2.65 1.57 -0.47 -1.19 116.57 117.60 1hnn h LYS 557 Ca 0.16 0.06 0.14 0.00 -1.87 0.00 0.00 60.65 59.14 1hnn h LYS 557 Cb 0.15 0.20 -0.09 0.00 0.08 0.00 0.00 32.23 32.56 1hnn h LYS 557 CO -0.17 -0.58 0.53 -0.07 -0.57 0.00 0.00 179.45 178.58 1hnn h LEU 558 N -0.90 0.71 0.04 2.94 3.38 -1.13 -0.96 115.31 119.39 1hnn h LEU 558 Ca -0.08 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1hnn h LEU 558 Cb 0.71 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1hnn h LEU 558 CO 0.12 0.33 -0.02 -0.09 0.09 0.00 0.00 178.44 178.87 1hnn h ARG 559 N 0.78 -0.05 -0.41 1.13 2.43 -0.22 0.15 114.38 118.18 1hnn h ARG 559 Ca 0.48 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.71 1hnn h ARG 559 Cb 0.61 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.13 1hnn h ARG 559 CO -0.32 -0.03 0.15 0.00 -1.51 0.00 0.00 179.97 178.26 1hnn h LEU 561 N 0.32 -0.39 0.06 0.00 3.38 -1.02 -2.37 115.31 115.30 1hnn h LEU 561 Ca 0.19 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.11 1hnn h LEU 561 Cb 0.16 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1hnn h LEU 561 CO -0.18 -0.16 -0.29 0.00 0.09 0.00 0.00 178.44 177.90 1hnn h ALA 562 N -0.00 -0.45 -0.95 1.53 0.00 -0.41 -1.95 119.26 117.03 1hnn h ALA 562 Ca -0.05 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 54.98 1hnn h ALA 562 Cb 0.44 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 1hnn h ALA 562 CO 0.08 -0.81 0.60 1.96 0.00 0.00 0.00 179.25 181.08 1hnn h GLN 563 N -0.47 0.78 -0.14 0.00 4.20 -0.72 0.41 115.11 119.17 1hnn h GLN 563 Ca 0.05 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 1hnn h GLN 563 Cb 0.53 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 1hnn h GLN 563 CO -0.20 0.52 -0.11 1.15 -0.67 0.00 0.00 178.83 179.51 1hnn h THR 564 N 0.80 1.34 0.00 -0.54 2.02 -0.84 -2.80 112.91 112.89 1hnn h THR 564 Ca 0.49 -1.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.43 1hnn h THR 564 Cb 0.68 1.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 1hnn h THR 564 CO -0.25 0.36 -0.00 -0.26 0.37 0.00 0.00 175.52 175.73 1hnn h PHE 565 N -0.04 0.00 0.00 3.16 -1.00 -1.03 -2.77 116.94 115.26 1hnn h PHE 565 Ca 0.03 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.79 1hnn h PHE 565 Cb 0.62 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.18 1hnn h PHE 565 CO 0.08 0.00 -0.08 0.00 -1.61 0.00 0.00 178.31 176.70 1hnn h ALA 566 N 2.00 1.31 0.00 2.45 0.00 -0.64 -1.06 119.26 123.31 1hnn h ALA 566 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1hnn h ALA 566 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1hnn h ALA 566 CO 0.00 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.60 1hnn n THR 567 N -3.63 0.58 -0.89 0.00 -2.24 -1.04 -4.88 114.28 102.17 1hnn n THR 567 Ca -0.02 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1hnn n THR 567 Cb 0.20 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 1hnn n THR 567 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hnn n GLY 568 N 0.73 0.29 0.03 3.38 0.00 -0.40 -4.84 105.19 104.38 1hnn n GLY 568 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 1hnn n GLY 568 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1hnn n GLU 569 N -1.20 0.09 -3.77 1.61 1.02 -1.26 -4.60 120.64 112.53 1hnn n GLU 569 Ca 0.00 0.05 -0.36 0.00 -0.02 0.00 0.00 57.16 56.82 1hnn n GLU 569 Cb 0.18 -1.58 -0.11 0.00 -0.02 0.00 0.00 31.44 29.91 1hnn n GLU 569 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1hnn s VAL 570 N -3.04 3.31 0.36 2.62 1.01 -1.26 -5.03 120.40 118.36 1hnn s VAL 570 Ca 0.11 -2.10 -0.13 0.00 0.00 0.00 0.00 61.98 59.87 1hnn s VAL 570 Cb 0.17 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 33.32 1hnn s VAL 570 CO 0.63 -0.70 0.69 -0.94 0.00 0.00 0.00 175.10 174.78 1hnn s SER 571 N 1.78 0.22 0.00 3.32 1.04 -1.26 -4.93 113.70 113.87 1hnn s SER 571 Ca 0.09 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.33 1hnn s SER 571 Cb -0.23 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1hnn s SER 571 CO -0.04 -1.55 0.00 0.61 0.98 0.00 0.00 173.24 173.24 1hnn n GLY 572 N -0.53 0.03 0.13 7.32 0.00 -1.22 -4.85 105.19 106.06 1hnn n GLY 572 Ca -0.05 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.28 1hnn n GLY 572 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hnn n ARG 573 N 0.00 0.70 -4.62 1.61 3.00 -1.26 -4.16 116.66 111.93 1hnn n ARG 573 Ca 0.00 0.19 -0.34 0.00 -0.01 0.00 0.00 57.85 57.70 1hnn n ARG 573 Cb 0.00 -1.61 -0.11 0.00 0.00 0.00 0.00 32.46 30.73 1hnn n ARG 573 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1hnn s THR 574 N -2.54 3.71 -0.04 0.55 2.01 -1.26 -0.82 115.64 117.25 1hnn s THR 574 Ca -0.27 -0.48 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 1hnn s THR 574 Cb 0.08 -2.52 0.01 0.00 0.01 0.00 0.00 72.50 70.08 1hnn s THR 574 CO 0.70 0.59 0.11 -0.22 -0.69 0.00 0.00 174.62 175.11 1hnn s LEU 575 N -0.76 1.56 -0.07 4.42 0.20 -0.62 -1.32 118.68 122.10 1hnn s LEU 575 Ca 0.12 0.23 0.03 0.00 0.69 0.00 0.00 54.13 55.20 1hnn s LEU 575 Cb -0.11 0.39 0.01 0.00 -0.43 0.00 0.00 46.19 46.05 1hnn s LEU 575 CO 0.02 -0.04 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.25 1hnn s ILE 576 N 0.06 1.37 -0.28 6.68 1.01 -0.77 -1.20 121.20 128.07 1hnn s ILE 576 Ca -0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1hnn s ILE 576 Cb -0.01 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.20 1hnn s ILE 576 CO 0.00 0.40 0.18 -0.62 0.00 0.00 0.00 174.94 174.91 1hnn s ASP 577 N 0.44 5.98 -0.31 3.58 2.15 0.20 -0.82 116.67 127.89 1hnn s ASP 577 Ca -0.12 -0.02 -0.18 0.00 0.43 0.00 0.00 52.55 52.66 1hnn s ASP 577 Cb -0.15 -2.11 -0.02 0.00 -0.30 0.00 0.00 42.92 40.34 1hnn s ASP 577 CO 0.04 -0.05 0.50 -0.63 -0.17 0.00 0.00 175.17 174.87 1hnn s ILE 578 N 1.75 5.05 -0.78 4.11 -1.09 0.52 -2.55 121.20 128.20 1hnn s ILE 578 Ca 0.07 0.56 -0.01 0.00 -2.23 0.00 0.00 60.65 59.04 1hnn s ILE 578 Cb -0.16 -3.89 -0.01 0.00 -1.58 0.00 0.00 42.46 36.82 1hnn s ILE 578 CO 0.11 -0.07 0.66 0.61 -1.23 0.00 0.00 174.94 175.02 1hnn n GLY 579 N 4.64 -0.20 0.35 6.18 0.00 -1.16 -4.26 105.19 110.74 1hnn n GLY 579 Ca -0.05 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.04 1hnn n GLY 579 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1hnn h SER 580 N -1.14 0.84 0.00 1.61 0.02 -0.07 -3.43 113.55 111.37 1hnn h SER 580 Ca -0.40 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1hnn h SER 580 Cb 1.22 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1hnn h SER 580 CO 0.33 0.45 0.00 0.61 -1.14 0.00 0.00 176.83 177.07 1hnn n GLY 581 N -1.34 0.57 1.50 -3.77 0.00 -1.25 -3.10 105.19 97.80 1hnn n GLY 581 Ca 0.18 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.41 1hnn n GLY 581 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hnn n PRO 582 N 6.10 4.05 -4.15 1.61 -0.04 -1.26 -4.59 135.00 136.72 1hnn n PRO 582 Ca 0.00 -2.98 -0.22 0.00 -0.04 0.00 0.00 63.50 60.26 1hnn n PRO 582 Cb 0.00 -2.04 -0.05 0.00 -0.04 0.00 0.00 33.50 31.37 1hnn n PRO 582 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1hnn s THR 583 N -2.54 4.23 0.00 0.52 -4.23 -1.18 -4.75 115.64 107.69 1hnn s THR 583 Ca 0.49 -1.51 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 1hnn s THR 583 Cb 0.37 -3.28 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1hnn s THR 583 CO 0.16 -0.35 0.00 0.52 -0.54 0.00 0.00 174.62 174.41 1hnn n VAL 584 N -1.10 0.00 -0.05 2.29 0.31 -1.26 -4.85 118.33 113.67 1hnn n VAL 584 Ca -0.08 -0.04 0.24 0.00 -0.01 0.00 0.00 64.34 64.45 1hnn n VAL 584 Cb 0.58 0.36 0.72 0.00 -0.91 0.00 0.00 33.84 34.59 1hnn n VAL 584 CO 0.00 0.00 0.00 0.10 -1.32 0.00 0.00 176.83 175.61 1hnn h TYR 585 N 0.00 0.00 0.00 3.52 -0.00 -1.97 -0.66 116.97 117.86 1hnn h TYR 585 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1hnn h TYR 585 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1hnn h TYR 585 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 179.20 1hnn n GLN 586 N -4.14 0.03 -0.00 0.10 3.00 -1.26 -2.47 117.38 112.64 1hnn n GLN 586 Ca 0.13 0.27 0.08 0.00 -0.01 0.00 0.00 57.00 57.47 1hnn n GLN 586 Cb 0.76 -1.56 -0.10 0.00 0.00 0.00 0.00 30.24 29.33 1hnn n GLN 586 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1hnn n LEU 587 N -1.63 0.56 -0.20 1.08 4.77 -0.26 -4.67 117.00 116.65 1hnn n LEU 587 Ca 0.03 -0.36 -0.10 0.00 -0.03 0.00 0.00 56.01 55.55 1hnn n LEU 587 Cb 0.19 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1hnn n LEU 587 CO 0.15 0.14 0.54 -0.07 -1.33 0.00 0.00 177.39 176.82 1hnn h LEU 588 N 0.00 -1.68 -0.01 2.23 4.07 -1.53 0.12 115.31 118.51 1hnn h LEU 588 Ca 0.00 0.25 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1hnn h LEU 588 Cb 0.50 0.74 0.00 0.00 1.08 0.00 0.00 40.66 42.98 1hnn h LEU 588 CO 0.00 -0.35 -0.18 -1.20 -1.08 0.00 0.00 178.44 175.64 1hnn n SER 589 N -5.38 0.20 0.02 -0.43 7.64 -1.26 -3.61 113.62 110.79 1hnn n SER 589 Ca 0.00 0.17 -0.09 0.00 1.01 0.00 0.00 58.87 59.96 1hnn n SER 589 Cb 0.34 -0.22 -0.13 0.00 -1.01 0.00 0.00 64.21 63.19 1hnn n SER 589 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hnn h ALA 590 N 3.05 0.57 -0.98 -0.43 0.00 -1.51 -3.36 119.26 116.58 1hnn h ALA 590 Ca 0.00 -1.23 0.15 0.00 0.00 0.00 0.00 54.91 53.83 1hnn h ALA 590 Cb 0.49 0.24 -0.16 0.00 0.00 0.00 0.00 17.79 18.36 1hnn h ALA 590 CO 0.00 1.42 -0.39 0.00 0.00 0.00 0.00 179.25 180.28 1hnn n SER 592 N -5.47 0.43 0.00 0.00 3.41 -1.26 -2.97 113.62 107.76 1hnn n SER 592 Ca 0.10 -0.89 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 1hnn n SER 592 Cb 0.40 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1hnn n SER 592 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1hnn n HIS 593 N 0.26 0.00 -3.76 7.33 8.25 0.56 -5.08 115.22 122.79 1hnn n HIS 593 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1hnn n HIS 593 Cb 0.11 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.06 1hnn n HIS 593 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1hnn s PHE 594 N -0.01 -0.03 0.22 4.41 0.40 -1.16 -3.45 117.98 118.37 1hnn s PHE 594 Ca 0.00 0.24 0.05 0.00 -0.60 0.00 0.00 56.93 56.62 1hnn s PHE 594 Cb 0.00 -0.20 0.18 0.00 0.51 0.00 0.00 43.02 43.51 1hnn s PHE 594 CO 0.00 -0.12 1.51 0.93 0.70 0.00 0.00 175.22 178.24 1hnn h GLU 595 N 7.31 0.18 -4.75 0.44 5.08 -1.67 -3.43 114.58 117.74 1hnn h GLU 595 Ca -0.44 -0.14 -0.64 0.00 -1.00 0.00 0.00 59.36 57.13 1hnn h GLU 595 Cb 1.13 0.03 -0.37 0.00 0.50 0.00 0.00 28.75 30.04 1hnn h GLU 595 CO 0.46 0.80 -0.82 0.34 -1.00 0.00 0.00 179.01 178.79 1hnn s ASP 596 N -6.89 3.57 -0.07 1.42 3.68 0.00 -4.76 116.67 113.63 1hnn s ASP 596 Ca -0.03 -0.95 0.04 0.00 2.13 0.00 0.00 52.55 53.74 1hnn s ASP 596 Cb 0.11 -1.36 -0.02 0.00 -1.45 0.00 0.00 42.92 40.21 1hnn s ASP 596 CO 0.80 -0.12 -0.19 -0.63 0.13 0.00 0.00 175.17 175.16 1hnn s ILE 597 N 1.31 2.58 -0.11 4.11 1.01 -0.17 -1.58 121.20 128.34 1hnn s ILE 597 Ca -0.02 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1hnn s ILE 597 Cb -0.16 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 1hnn s ILE 597 CO -0.08 0.56 -0.18 -0.89 0.00 0.00 0.00 174.94 174.35 1hnn s THR 598 N -0.19 2.65 0.20 2.92 2.01 -0.34 -0.75 115.64 122.14 1hnn s THR 598 Ca -0.02 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.24 1hnn s THR 598 Cb -0.13 -2.07 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 1hnn s THR 598 CO 0.03 0.54 0.06 -0.04 -0.69 0.00 0.00 174.62 174.52 1hnn s MET 599 N 0.27 2.57 0.07 4.92 -1.94 -0.52 -0.63 119.30 124.04 1hnn s MET 599 Ca -0.13 -1.10 -0.17 0.00 -1.71 0.00 0.00 55.69 52.59 1hnn s MET 599 Cb -0.16 -2.42 0.03 0.00 2.01 0.00 0.00 34.83 34.29 1hnn s MET 599 CO 0.07 0.44 0.39 0.95 -0.01 0.00 0.00 175.02 176.85 1hnn s THR 600 N -1.90 0.07 -0.18 2.05 -4.23 -1.06 -0.64 115.64 109.75 1hnn s THR 600 Ca 0.30 -0.54 -0.30 0.00 -1.18 0.00 0.00 61.69 59.97 1hnn s THR 600 Cb -0.09 -1.02 0.14 0.00 1.34 0.00 0.00 72.50 72.86 1hnn s THR 600 CO 0.21 -0.30 1.05 -0.62 -0.54 0.00 0.00 174.62 174.42 1hnn s ASP 601 N -2.26 -0.33 0.02 3.99 2.15 -0.51 0.56 116.67 120.29 1hnn s ASP 601 Ca -0.03 0.36 -0.25 0.00 0.43 0.00 0.00 52.55 53.07 1hnn s ASP 601 Cb 0.00 0.28 -0.18 0.00 -0.30 0.00 0.00 42.92 42.71 1hnn s ASP 601 CO -0.05 -0.30 1.41 0.15 -0.17 0.00 0.00 175.17 176.21 1hnn h PHE 602 N 2.52 -0.03 -3.51 -5.34 3.57 -1.87 -2.83 116.94 109.45 1hnn h PHE 602 Ca -0.17 -0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.80 1hnn h PHE 602 Cb 1.17 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 1hnn h PHE 602 CO 0.28 0.29 0.38 -0.51 -2.23 0.00 0.00 178.31 176.53 1hnn s LEU 603 N -9.55 4.46 0.32 0.59 1.43 -1.26 -4.75 118.68 109.92 1hnn s LEU 603 Ca -0.15 1.79 0.19 0.00 -1.03 0.00 0.00 54.13 54.93 1hnn s LEU 603 Cb 0.03 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.81 1hnn s LEU 603 CO 0.66 -0.15 1.43 1.05 0.23 0.00 0.00 176.35 179.57 1hnn h GLU 604 N 5.92 0.00 0.00 1.70 4.11 -1.99 -2.94 114.58 121.38 1hnn h GLU 604 Ca -0.42 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.99 1hnn h GLU 604 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1hnn h GLU 604 CO 0.73 0.26 -0.09 -0.39 0.07 0.00 0.00 179.01 179.59 1hnn h VAL 605 N 0.00 0.88 0.12 -1.06 -1.51 -1.97 -0.59 116.25 112.11 1hnn h VAL 605 Ca -0.01 -0.35 -0.20 0.00 -1.23 0.00 0.00 66.70 64.91 1hnn h VAL 605 Cb 1.23 1.20 0.02 0.00 -2.13 0.00 0.00 31.29 31.61 1hnn h VAL 605 CO 0.03 0.09 -0.86 0.78 -1.23 0.00 0.00 177.57 176.38 1hnn h ASN 606 N 0.00 0.56 -0.05 4.19 2.35 -1.86 -2.59 115.58 118.18 1hnn h ASN 606 Ca -0.00 -0.89 0.01 0.00 -0.55 0.00 0.00 56.30 54.87 1hnn h ASN 606 Cb 0.19 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 1hnn h ASN 606 CO 0.01 1.40 0.06 0.03 -1.65 0.00 0.00 177.43 177.28 1hnn h ARG 607 N -0.20 0.00 0.23 0.81 3.08 -1.16 -0.09 114.38 117.05 1hnn h ARG 607 Ca -0.14 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.58 1hnn h ARG 607 Cb 1.64 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.72 1hnn h ARG 607 CO 0.16 0.00 -1.49 1.96 -1.07 0.00 0.00 179.97 179.54 1hnn h GLN 608 N 0.00 0.48 -0.72 0.04 4.20 -1.14 -1.05 115.11 116.93 1hnn h GLN 608 Ca 0.02 -0.82 0.00 0.00 0.06 0.00 0.00 58.65 57.91 1hnn h GLN 608 Cb 0.15 0.31 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 1hnn h GLN 608 CO -0.00 1.39 0.46 1.49 -0.67 0.00 0.00 178.83 181.50 1hnn h GLU 609 N 0.13 0.96 -0.00 1.46 4.57 -0.71 0.41 114.58 121.40 1hnn h GLU 609 Ca -0.25 -0.07 -0.14 0.00 -1.18 0.00 0.00 59.36 57.72 1hnn h GLU 609 Cb 2.14 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 30.49 1hnn h GLU 609 CO 0.25 0.65 -0.67 -0.07 -1.18 0.00 0.00 179.01 178.00 1hnn h LEU 610 N 0.99 0.03 -0.98 1.64 3.38 -1.08 -2.79 115.31 116.50 1hnn h LEU 610 Ca 0.26 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.11 1hnn h LEU 610 Cb -0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1hnn h LEU 610 CO -0.05 0.69 -0.48 1.23 0.09 0.00 0.00 178.44 179.92 1hnn h GLY 611 N 1.95 0.00 1.10 0.83 0.00 0.63 -1.56 103.07 106.03 1hnn h GLY 611 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.14 1hnn h GLY 611 CO 0.09 0.00 -0.55 3.21 0.00 0.00 0.00 176.54 179.29 1hnn h ARG 612 N 0.00 0.80 -0.48 4.80 3.08 -0.06 -2.44 114.38 120.08 1hnn h ARG 612 Ca -0.00 -0.54 -0.08 0.00 0.07 0.00 0.00 59.98 59.42 1hnn h ARG 612 Cb 0.90 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.01 1hnn h ARG 612 CO 0.06 1.16 -0.03 2.35 -1.07 0.00 0.00 179.97 182.45 1hnn h TRP 613 N 0.55 0.95 -0.93 3.04 7.01 -1.38 -1.87 115.95 123.32 1hnn h TRP 613 Ca -0.00 -0.18 0.07 0.00 2.11 0.00 0.00 58.89 60.89 1hnn h TRP 613 Cb 1.16 -0.24 -0.07 0.00 -2.10 0.00 0.00 29.16 27.92 1hnn h TRP 613 CO 0.08 0.91 0.59 -0.07 -2.79 0.00 0.00 178.44 177.16 1hnn h LEU 614 N 0.72 0.93 -0.22 0.65 4.07 -1.24 0.22 115.31 120.44 1hnn h LEU 614 Ca 0.13 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1hnn h LEU 614 Cb 0.55 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.11 1hnn h LEU 614 CO 0.03 0.59 0.00 0.00 -1.08 0.00 0.00 178.44 177.98 1hnn n GLN 615 N -4.57 1.15 -3.84 1.13 6.02 -0.92 -4.90 117.38 111.44 1hnn n GLN 615 Ca 0.14 -0.22 -0.26 0.00 -0.01 0.00 0.00 57.00 56.66 1hnn n GLN 615 Cb 0.19 -1.42 0.02 0.00 1.02 0.00 0.00 30.24 30.04 1hnn n GLN 615 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1hnn n GLU 616 N -0.67 -4.73 -2.66 -1.09 2.13 0.77 -4.96 120.64 109.42 1hnn n GLU 616 Ca 0.20 0.56 -0.31 0.00 0.66 0.00 0.00 57.16 58.26 1hnn n GLU 616 Cb 0.15 -5.16 -0.04 0.00 0.27 0.00 0.00 31.44 26.66 1hnn n GLU 616 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1hnn s GLU 617 N -6.34 3.90 0.14 5.31 2.02 -0.75 -4.99 118.70 117.99 1hnn s GLU 617 Ca 0.25 0.74 -0.17 0.00 0.02 0.00 0.00 54.97 55.81 1hnn s GLU 617 Cb -0.13 -2.27 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 1hnn s GLU 617 CO 0.84 -0.13 1.78 -1.35 0.02 0.00 0.00 175.26 176.42 1hnn h PRO 618 N 1.21 0.45 -0.58 0.39 0.11 -1.93 -2.66 132.00 128.99 1hnn h PRO 618 Ca -0.47 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.74 1hnn h PRO 618 Cb 1.18 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1hnn h PRO 618 CO 0.63 0.32 0.40 0.78 -0.21 0.00 0.00 178.00 179.92 1hnn h GLY 619 N 0.44 0.25 -2.18 -0.55 0.00 -1.95 -3.44 103.07 95.65 1hnn h GLY 619 Ca 0.12 -0.07 -0.54 0.00 0.00 0.00 0.00 47.33 46.84 1hnn h GLY 619 CO -0.02 0.03 -0.64 0.00 0.00 0.00 0.00 176.54 175.91 1hnn n ALA 620 N -2.59 -2.58 -1.83 3.60 0.00 -1.01 -4.90 120.51 111.20 1hnn n ALA 620 Ca 0.11 -0.52 -0.41 0.00 0.00 0.00 0.00 53.44 52.61 1hnn n ALA 620 Cb 0.54 -1.76 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 1hnn n ALA 620 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1hnn s PHE 621 N -2.25 3.35 -0.42 0.00 5.36 -1.26 -4.98 117.98 117.78 1hnn s PHE 621 Ca 0.57 1.52 -0.21 0.00 -0.96 0.00 0.00 56.93 57.85 1hnn s PHE 621 Cb -0.24 -3.47 0.02 0.00 -0.34 0.00 0.00 43.02 38.98 1hnn s PHE 621 CO 0.66 -1.22 0.69 1.21 -1.46 0.00 0.00 175.22 175.10 1hnn s ASN 622 N -0.48 6.38 -0.00 6.13 2.47 -1.26 -4.92 114.94 123.26 1hnn s ASN 622 Ca 0.48 -0.15 0.18 0.00 0.42 0.00 0.00 52.86 53.80 1hnn s ASN 622 Cb -0.35 -2.34 0.52 0.00 -1.45 0.00 0.00 41.25 37.63 1hnn s ASN 622 CO 0.44 -0.77 1.43 0.79 -3.72 0.00 0.00 177.10 175.27 1hnn n TRP 623 N 6.35 0.80 -0.30 0.43 7.02 -1.26 -4.59 117.44 125.89 1hnn n TRP 623 Ca -0.00 -0.40 0.13 0.00 -1.02 0.00 0.00 57.50 56.21 1hnn n TRP 623 Cb 0.48 -0.01 0.31 0.00 -2.42 0.00 0.00 31.31 29.67 1hnn n TRP 623 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1hnn h SER 624 N 3.42 0.30 -0.89 -0.99 4.64 -1.98 0.13 113.55 118.18 1hnn h SER 624 Ca 0.00 0.16 -0.01 0.00 -0.47 0.00 0.00 61.79 61.47 1hnn h SER 624 Cb 0.81 0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.00 1hnn h SER 624 CO 0.01 -0.02 0.54 0.24 -0.87 0.00 0.00 176.83 176.73 1hnn h MET 625 N 0.38 1.21 -0.16 4.77 2.86 -1.96 0.21 114.93 122.24 1hnn h MET 625 Ca 0.56 -0.11 -0.15 0.00 -2.06 0.00 0.00 59.70 57.94 1hnn h MET 625 Cb 1.08 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 32.49 1hnn h MET 625 CO -0.54 0.85 -0.49 1.88 1.06 0.00 0.00 176.91 179.67 1hnn h TYR 626 N 1.23 0.80 -0.52 -0.22 -1.99 -1.26 -2.15 116.97 112.85 1hnn h TYR 626 Ca 0.32 -0.32 0.04 0.00 2.00 0.00 0.00 58.73 60.77 1hnn h TYR 626 Cb -0.05 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.50 1hnn h TYR 626 CO 0.00 1.10 0.28 0.77 -0.00 0.00 0.00 178.16 180.31 1hnn h SER 627 N 0.28 0.41 0.26 3.88 0.02 -0.52 -0.15 113.55 117.74 1hnn h SER 627 Ca -0.02 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1hnn h SER 627 Cb 1.11 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1hnn h SER 627 CO 0.10 0.29 -0.13 -0.61 -1.14 0.00 0.00 176.83 175.34 1hnn h GLN 628 N 0.54 -0.34 -0.83 3.45 -0.00 -0.58 -1.77 115.11 115.58 1hnn h GLN 628 Ca 0.23 0.02 0.02 0.00 -0.00 0.00 0.00 58.65 58.92 1hnn h GLN 628 Cb 0.11 0.08 -0.04 0.00 0.00 0.00 0.00 27.48 27.62 1hnn h GLN 628 CO -0.14 -0.19 0.55 1.25 0.00 0.00 0.00 178.83 180.29 1hnn h HIS 629 N -0.40 1.03 -0.19 3.99 2.76 -1.19 0.17 115.15 121.33 1hnn h HIS 629 Ca -0.04 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1hnn h HIS 629 Cb 0.31 -0.35 -0.02 0.00 1.55 0.00 0.00 27.41 28.90 1hnn h HIS 629 CO -0.05 0.63 0.08 0.00 -1.30 0.00 0.00 177.93 177.29 1hnn h ALA 630 N 1.32 0.22 -0.87 5.26 0.00 -0.84 0.37 119.26 124.71 1hnn h ALA 630 Ca 0.32 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.26 1hnn h ALA 630 Cb -0.08 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1hnn h ALA 630 CO -0.08 -0.34 0.57 0.00 0.00 0.00 0.00 179.25 179.40 1hnn h LEU 632 N 1.14 -0.18 -0.62 0.00 6.46 0.41 -2.69 115.31 119.82 1hnn h LEU 632 Ca 0.33 0.01 -0.11 0.00 -0.12 0.00 0.00 57.88 57.98 1hnn h LEU 632 Cb -0.07 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 1hnn h LEU 632 CO -0.08 -0.13 -0.14 0.40 -0.62 0.00 0.00 178.44 177.87 1hnn h ILE 633 N -0.21 1.27 0.00 4.05 2.04 0.43 -3.08 117.51 122.00 1hnn h ILE 633 Ca -0.02 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 1hnn h ILE 633 Cb 0.17 1.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1hnn h ILE 633 CO 0.03 0.44 -0.04 -0.33 0.00 0.00 0.00 178.15 178.25 1hnn h GLU 634 N 0.84 0.00 -1.97 2.37 5.08 -0.60 -3.47 114.58 116.82 1hnn h GLU 634 Ca 0.13 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 58.07 1hnn h GLU 634 Cb 0.68 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.84 1hnn h GLU 634 CO 0.05 0.04 -0.46 0.41 -1.00 0.00 0.00 179.01 178.06 1hnn n GLY 635 N -0.27 0.75 0.88 -3.84 0.00 -1.02 -4.85 105.19 96.83 1hnn n GLY 635 Ca -0.01 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1hnn n GLY 635 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hnn n LYS 636 N -2.69 2.16 -2.01 1.61 4.76 -1.26 -4.92 118.16 115.80 1hnn n LYS 636 Ca -0.23 -1.75 -0.19 0.00 -2.87 0.00 0.00 58.31 53.28 1hnn n LYS 636 Cb 0.68 -1.46 -0.04 0.00 -1.84 0.00 0.00 35.03 32.37 1hnn n LYS 636 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hnn n GLY 637 N 1.34 0.55 3.81 0.72 0.00 -1.26 -4.97 105.19 105.38 1hnn n GLY 637 Ca 0.18 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1hnn n GLY 637 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1hnn s GLU 638 N -4.37 4.31 0.19 1.61 2.12 -1.26 -5.05 118.70 116.25 1hnn s GLU 638 Ca 0.00 1.14 -0.12 0.00 0.36 0.00 0.00 54.97 56.35 1hnn s GLU 638 Cb 0.00 -2.37 -0.07 0.00 0.26 0.00 0.00 34.13 31.95 1hnn s GLU 638 CO 0.00 0.07 0.55 0.00 -0.54 0.00 0.00 175.26 175.35 1hnn h TRP 640 N 2.99 0.63 0.00 0.00 5.08 -1.91 -1.40 115.95 121.33 1hnn h TRP 640 Ca -0.48 0.03 -0.00 0.00 1.08 0.00 0.00 58.89 59.52 1hnn h TRP 640 Cb 1.18 -0.18 -0.00 0.00 -3.00 0.00 0.00 29.16 27.16 1hnn h TRP 640 CO 0.63 0.23 -0.00 -0.56 -1.28 0.00 0.00 178.44 177.46 1hnn h GLN 641 N 0.60 0.00 0.09 0.12 -0.00 -1.94 -0.14 115.11 113.84 1hnn h GLN 641 Ca 0.34 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.73 1hnn h GLN 641 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.83 1hnn h GLN 641 CO -0.26 0.00 -1.15 -0.44 -0.00 0.00 0.00 178.83 176.98 1hnn h ASP 642 N 0.00 0.46 -0.20 0.06 3.32 -1.67 -2.77 116.42 115.62 1hnn h ASP 642 Ca -0.00 -0.45 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 1hnn h ASP 642 Cb 0.01 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1hnn h ASP 642 CO 0.00 1.32 0.09 0.50 -1.72 0.00 0.00 179.24 179.42 1hnn h LYS 643 N 0.12 0.30 -0.12 3.56 3.64 -0.69 -1.84 116.57 121.55 1hnn h LYS 643 Ca -0.12 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.12 1hnn h LYS 643 Cb 1.85 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.61 1hnn h LYS 643 CO 0.19 0.36 -0.32 0.93 -2.27 0.00 0.00 179.45 178.34 1hnn h GLU 644 N 0.18 0.23 -0.44 1.90 5.08 -1.24 -0.95 114.58 119.35 1hnn h GLU 644 Ca 0.07 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.20 1hnn h GLU 644 Cb 0.16 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1hnn h GLU 644 CO -0.01 0.53 -0.26 -0.09 -1.00 0.00 0.00 179.01 178.18 1hnn h ARG 645 N 0.21 0.96 -0.07 2.33 2.43 -1.34 -1.48 114.38 117.42 1hnn h ARG 645 Ca 0.03 -0.44 -0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1hnn h ARG 645 Cb 0.66 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1hnn h ARG 645 CO 0.05 1.11 -0.00 0.37 -1.51 0.00 0.00 179.97 179.99 1hnn h GLN 646 N 0.80 0.13 -0.45 0.20 5.75 -1.02 -2.57 115.11 117.95 1hnn h GLN 646 Ca 0.09 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1hnn h GLN 646 Cb 0.85 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.35 1hnn h GLN 646 CO 0.07 0.40 0.25 1.25 -2.65 0.00 0.00 178.83 178.16 1hnn h LEU 647 N -0.16 0.38 -1.75 -2.39 5.85 -1.15 -0.75 115.31 115.35 1hnn h LEU 647 Ca 0.02 0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.87 1hnn h LEU 647 Cb 0.35 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1hnn h LEU 647 CO 0.00 0.27 0.38 0.03 -0.34 0.00 0.00 178.44 178.79 1hnn h ARG 648 N 0.50 0.27 0.10 1.25 3.08 -1.20 -1.58 114.38 116.80 1hnn h ARG 648 Ca 0.19 -0.02 -0.26 0.00 0.07 0.00 0.00 59.98 59.96 1hnn h ARG 648 Cb 0.06 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1hnn h ARG 648 CO -0.11 0.18 -1.18 0.00 -1.07 0.00 0.00 179.97 177.79 1hnn h ALA 649 N 1.72 0.16 0.00 0.04 0.00 -0.81 -3.29 119.26 117.08 1hnn h ALA 649 Ca 0.26 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1hnn h ALA 649 Cb 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1hnn h ALA 649 CO -0.06 0.95 0.00 0.00 0.00 0.00 0.00 179.25 180.14 1hnn h ARG 650 N 0.10 0.00 -6.18 0.00 3.08 -0.26 -3.41 114.38 107.70 1hnn h ARG 650 Ca -0.12 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.37 1hnn h ARG 650 Cb 1.89 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.85 1hnn h ARG 650 CO 0.19 0.00 0.92 0.08 -1.07 0.00 0.00 179.97 180.10 1hnn s VAL 651 N -3.30 3.91 -0.87 2.04 1.01 -0.74 -1.00 120.40 121.45 1hnn s VAL 651 Ca 0.06 0.31 0.27 0.00 0.00 0.00 0.00 61.98 62.62 1hnn s VAL 651 Cb 0.09 -4.83 0.20 0.00 0.00 0.00 0.00 36.38 31.84 1hnn s VAL 651 CO 0.56 -1.68 1.74 0.29 0.00 0.00 0.00 175.10 176.00 1hnn n LYS 652 N 8.84 0.12 -3.65 2.72 4.76 0.07 -4.94 118.16 126.08 1hnn n LYS 652 Ca 0.02 0.08 -0.01 0.00 -2.87 0.00 0.00 58.31 55.53 1hnn n LYS 652 Cb 0.48 -1.62 -0.04 0.00 -1.84 0.00 0.00 35.03 32.01 1hnn n LYS 652 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1hnn s ARG 653 N -3.05 0.00 -0.35 1.97 1.70 -1.25 -5.06 118.95 112.90 1hnn s ARG 653 Ca 0.12 0.00 0.02 0.00 -0.47 0.00 0.00 55.73 55.39 1hnn s ARG 653 Cb 0.16 0.00 0.10 0.00 -0.57 0.00 0.00 34.95 34.64 1hnn s ARG 653 CO 0.60 -0.00 0.08 0.08 -1.08 0.00 0.00 175.30 174.97 1hnn s VAL 654 N -0.99 2.60 0.01 4.99 1.01 -1.26 -1.44 120.40 125.32 1hnn s VAL 654 Ca 0.10 -2.14 -0.02 0.00 0.00 0.00 0.00 61.98 59.92 1hnn s VAL 654 Cb -0.01 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 1hnn s VAL 654 CO -0.09 -0.54 0.19 -0.76 0.00 0.00 0.00 175.10 173.89 1hnn s LEU 655 N 1.01 4.35 0.48 3.92 1.43 0.19 -4.95 118.68 125.11 1hnn s LEU 655 Ca 0.07 0.32 -0.20 0.00 -1.03 0.00 0.00 54.13 53.29 1hnn s LEU 655 Cb -0.20 -2.70 -0.09 0.00 0.03 0.00 0.00 46.19 43.23 1hnn s LEU 655 CO -0.06 0.24 1.03 -2.16 0.23 0.00 0.00 176.35 175.63 1hnn s PRO 656 N -2.09 3.86 -0.01 1.29 0.04 -1.26 -1.43 135.00 135.40 1hnn s PRO 656 Ca 0.29 1.35 -0.17 0.00 0.04 0.00 0.00 61.00 62.51 1hnn s PRO 656 Cb -0.13 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.32 1hnn s PRO 656 CO 0.21 -0.38 0.36 -1.50 0.04 0.00 0.00 177.00 175.73 1hnn s ILE 657 N -1.98 0.05 -0.23 0.56 2.07 -1.07 -4.74 121.20 115.87 1hnn s ILE 657 Ca 0.66 -0.45 -0.02 0.00 -1.41 0.00 0.00 60.65 59.43 1hnn s ILE 657 Cb -0.16 -0.72 0.07 0.00 0.13 0.00 0.00 42.46 41.78 1hnn s ILE 657 CO 0.20 -0.25 0.05 -0.62 -1.91 0.00 0.00 174.94 172.41 1hnn s ASP 658 N -1.45 3.21 0.63 4.50 -1.08 -0.54 -3.37 116.67 118.57 1hnn s ASP 658 Ca -0.12 -1.03 0.41 0.00 -0.52 0.00 0.00 52.55 51.29 1hnn s ASP 658 Cb -0.04 -0.64 2.11 0.00 -1.46 0.00 0.00 42.92 42.89 1hnn s ASP 658 CO 0.04 -0.34 2.26 0.58 0.52 0.00 0.00 175.17 178.23 1hnn h VAL 659 N 6.51 0.03 0.00 1.11 2.07 -1.96 -2.65 116.25 121.36 1hnn h VAL 659 Ca -0.16 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1hnn h VAL 659 Cb 1.09 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1hnn h VAL 659 CO 0.37 0.00 -0.33 0.45 0.02 0.00 0.00 177.57 178.09 1hnn h HIS 660 N 0.00 0.00 -4.30 1.57 3.86 -1.94 -3.41 115.15 110.93 1hnn h HIS 660 Ca -0.00 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.71 1hnn h HIS 660 Cb 0.15 0.00 0.06 0.00 1.06 0.00 0.00 27.41 28.68 1hnn h HIS 660 CO 0.00 0.00 0.39 -0.65 0.86 0.00 0.00 177.93 178.53 1hnn s GLN 661 N -3.14 3.49 0.46 2.45 -1.52 -1.00 -4.94 119.66 115.46 1hnn s GLN 661 Ca 0.08 0.90 0.26 0.00 -1.95 0.00 0.00 55.36 54.65 1hnn s GLN 661 Cb 0.12 -2.07 0.94 0.00 -0.22 0.00 0.00 33.01 31.78 1hnn s GLN 661 CO 0.67 -0.66 1.83 -1.35 -0.25 0.00 0.00 175.29 175.53 1hnn h PRO 662 N -0.05 0.00 -3.15 2.91 0.11 -1.89 -3.29 132.00 126.64 1hnn h PRO 662 Ca -0.45 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.04 1hnn h PRO 662 Cb 1.20 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.90 1hnn h PRO 662 CO 0.60 0.16 -0.66 -0.65 -0.21 0.00 0.00 178.00 177.24 1hnn s GLN 663 N -3.58 1.85 0.36 1.05 -0.21 -1.26 -4.83 119.66 113.04 1hnn s GLN 663 Ca 0.01 -2.61 0.15 0.00 0.02 0.00 0.00 55.36 52.94 1hnn s GLN 663 Cb 0.09 -2.97 1.06 0.00 1.00 0.00 0.00 33.01 32.19 1hnn s GLN 663 CO 0.62 -1.18 1.70 -1.35 -2.12 0.00 0.00 175.29 172.96 1hnn h PRO 664 N 6.24 0.39 -0.02 2.91 0.11 -1.70 0.54 132.00 140.48 1hnn h PRO 664 Ca 0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1hnn h PRO 664 Cb 0.87 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1hnn h PRO 664 CO 0.62 0.26 -0.18 1.28 -0.21 0.00 0.00 178.00 179.77 1hnn n LEU 665 N -4.87 1.77 0.00 2.35 7.99 -1.26 -1.46 117.00 121.52 1hnn n LEU 665 Ca 0.29 -0.58 0.00 0.00 -0.01 0.00 0.00 56.01 55.71 1hnn n LEU 665 Cb 0.93 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 44.20 1hnn n LEU 665 CO 0.16 0.31 0.00 0.61 -1.51 0.00 0.00 177.39 176.96 1hnn n GLY 666 N 1.31 0.31 0.00 -0.72 0.00 0.18 -4.54 105.19 101.74 1hnn n GLY 666 Ca 0.14 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1hnn n GLY 666 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hnn n ALA 667 N 0.65 -0.43 -2.72 4.61 0.00 -1.26 -3.99 120.51 117.37 1hnn n ALA 667 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1hnn n ALA 667 Cb 0.00 0.03 0.01 0.00 0.00 0.00 0.00 19.45 19.49 1hnn n ALA 667 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hnn n GLY 668 N -0.96 5.46 3.76 0.00 0.00 -1.26 -5.01 105.19 107.18 1hnn n GLY 668 Ca 0.00 -2.53 -0.39 0.00 0.00 0.00 0.00 46.02 43.10 1hnn n GLY 668 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hnn s SER 669 N -1.19 7.14 0.49 1.61 0.15 -1.26 -4.93 113.70 115.72 1hnn s SER 669 Ca 0.36 2.21 0.23 0.00 0.70 0.00 0.00 55.95 59.46 1hnn s SER 669 Cb 0.11 -2.62 1.28 0.00 -1.71 0.00 0.00 66.02 63.08 1hnn s SER 669 CO 0.00 -0.23 2.03 1.55 1.20 0.00 0.00 173.24 177.79 1hnn h PRO 670 N 3.50 0.00 -6.65 5.44 0.13 -1.95 -3.45 132.00 129.03 1hnn h PRO 670 Ca -0.47 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.08 1hnn h PRO 670 Cb 1.21 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.44 1hnn h PRO 670 CO 0.66 0.16 0.55 0.00 -0.23 0.00 0.00 178.00 179.13 1hnn n ALA 671 N -2.34 1.12 -2.33 -0.56 0.00 -1.26 -4.89 120.51 110.25 1hnn n ALA 671 Ca -0.02 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.39 1hnn n ALA 671 Cb 0.26 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.43 1hnn n ALA 671 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1hnn s PRO 672 N -1.05 4.35 0.06 0.00 0.02 -1.26 -5.00 135.00 132.12 1hnn s PRO 672 Ca 0.63 1.85 0.08 0.00 0.02 0.00 0.00 61.00 63.57 1hnn s PRO 672 Cb -0.62 -3.45 -0.03 0.00 0.02 0.00 0.00 34.50 30.42 1hnn s PRO 672 CO 0.55 -0.43 -0.21 -0.51 -0.33 0.00 0.00 177.00 176.07 1hnn s LEU 673 N 1.76 2.20 0.34 -5.54 2.01 -1.26 -3.86 118.68 114.32 1hnn s LEU 673 Ca 0.60 -0.56 -0.09 0.00 0.01 0.00 0.00 54.13 54.09 1hnn s LEU 673 Cb -0.30 -0.96 -0.06 0.00 0.01 0.00 0.00 46.19 44.88 1hnn s LEU 673 CO 0.27 0.14 0.67 -2.16 1.01 0.00 0.00 176.35 176.28 1hnn s PRO 674 N -1.35 3.75 0.50 1.29 0.04 -1.26 -5.14 135.00 132.83 1hnn s PRO 674 Ca 0.07 0.31 -0.21 0.00 0.04 0.00 0.00 61.00 61.21 1hnn s PRO 674 Cb -0.09 -2.51 -0.07 0.00 0.04 0.00 0.00 34.50 31.87 1hnn s PRO 674 CO 0.02 0.10 1.13 0.00 0.04 0.00 0.00 177.00 178.30 1hnn s ALA 675 N -2.19 2.83 -0.24 8.56 0.00 0.40 -4.64 121.76 126.48 1hnn s ALA 675 Ca 0.49 0.84 0.21 0.00 0.00 0.00 0.00 51.96 53.50 1hnn s ALA 675 Cb -0.11 -3.36 0.36 0.00 0.00 0.00 0.00 23.12 20.02 1hnn s ALA 675 CO 0.29 -0.67 1.59 -0.44 0.00 0.00 0.00 175.76 176.53 1hnn h ASP 676 N 1.59 0.00 -5.09 0.00 5.19 -1.52 -0.98 116.42 115.61 1hnn h ASP 676 Ca -0.50 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.89 1hnn h ASP 676 Cb 1.25 0.00 -0.11 0.00 0.18 0.00 0.00 39.33 40.65 1hnn h ASP 676 CO 0.58 0.21 0.01 0.00 -3.12 0.00 0.00 179.24 176.93 1hnn s ALA 677 N -3.19 -0.94 0.01 3.45 0.00 -0.71 -3.39 121.76 116.99 1hnn s ALA 677 Ca 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.82 1hnn s ALA 677 Cb 0.07 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 24.01 1hnn s ALA 677 CO 0.69 -0.77 0.00 -0.51 0.00 0.00 0.00 175.76 175.17 1hnn s LEU 678 N -2.86 2.07 0.01 0.00 1.43 -0.39 -1.85 118.68 117.10 1hnn s LEU 678 Ca 0.08 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 1hnn s LEU 678 Cb -0.00 0.15 -0.01 0.00 0.03 0.00 0.00 46.19 46.36 1hnn s LEU 678 CO -0.05 -0.22 -0.08 0.68 0.23 0.00 0.00 176.35 176.92 1hnn s VAL 679 N -1.00 0.57 -0.22 -1.59 -7.23 -0.00 -1.15 120.40 109.78 1hnn s VAL 679 Ca -0.11 -0.59 -0.09 0.00 -1.81 0.00 0.00 61.98 59.38 1hnn s VAL 679 Cb -0.07 -0.54 0.09 0.00 0.56 0.00 0.00 36.38 36.42 1hnn s VAL 679 CO -0.00 -0.03 0.50 -0.55 -0.31 0.00 0.00 175.10 174.71 1hnn s SER 680 N -0.68 -0.59 -0.13 4.85 0.15 -0.68 -0.36 113.70 116.26 1hnn s SER 680 Ca -0.01 1.16 0.02 0.00 0.70 0.00 0.00 55.95 57.82 1hnn s SER 680 Cb -0.05 1.42 0.01 0.00 -1.71 0.00 0.00 66.02 65.69 1hnn s SER 680 CO 0.00 -0.22 -0.18 0.00 1.20 0.00 0.00 173.24 174.04 1hnn s ALA 681 N 2.26 1.98 -1.33 5.45 0.00 -1.26 -1.23 121.76 127.64 1hnn s ALA 681 Ca -0.05 -0.93 -0.06 0.00 0.00 0.00 0.00 51.96 50.92 1hnn s ALA 681 Cb -0.10 -0.94 0.04 0.00 0.00 0.00 0.00 23.12 22.12 1hnn s ALA 681 CO -0.15 -0.09 0.41 1.19 0.00 0.00 0.00 175.76 177.13 1hnn n PHE 682 N 4.20 -1.75 0.00 0.00 3.01 0.26 -4.91 117.46 118.27 1hnn n PHE 682 Ca -0.19 0.38 0.00 0.00 1.01 0.00 0.00 57.45 58.65 1hnn n PHE 682 Cb 0.51 -3.37 0.00 0.00 -0.01 0.00 0.00 39.48 36.61 1hnn n PHE 682 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1hnn n LEU 684 N -1.83 -0.17 -0.27 0.00 4.77 -1.26 -0.50 117.00 117.74 1hnn n LEU 684 Ca 0.00 1.08 0.33 0.00 -0.03 0.00 0.00 56.01 57.39 1hnn n LEU 684 Cb 0.00 -0.43 0.74 0.00 -2.33 0.00 0.00 43.42 41.40 1hnn n LEU 684 CO 0.00 -0.63 1.30 -0.33 -1.33 0.00 0.00 177.39 176.40 1hnn h GLU 685 N 0.00 0.00 -0.37 3.23 3.07 -1.91 0.23 114.58 118.83 1hnn h GLU 685 Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1hnn h GLU 685 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1hnn h GLU 685 CO -0.15 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.46 1hnn n ALA 686 N -2.74 2.45 -0.09 3.43 0.00 0.35 -3.47 120.51 120.44 1hnn n ALA 686 Ca 0.23 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1hnn n ALA 686 Cb 1.15 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1hnn n ALA 686 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hnn n VAL 687 N 0.85 0.00 -4.38 0.00 0.31 0.77 -4.92 118.33 110.97 1hnn n VAL 687 Ca 0.17 -0.21 -0.34 0.00 -0.01 0.00 0.00 64.34 63.95 1hnn n VAL 687 Cb 0.42 1.09 -0.14 0.00 -0.91 0.00 0.00 33.84 34.30 1hnn n VAL 687 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1hnn s SER 688 N -0.35 4.04 0.19 4.52 1.04 -0.90 -4.92 113.70 117.31 1hnn s SER 688 Ca 0.00 -0.38 -0.14 0.00 0.48 0.00 0.00 55.95 55.91 1hnn s SER 688 Cb 0.00 -1.65 0.18 0.00 0.10 0.00 0.00 66.02 64.65 1hnn s SER 688 CO 0.00 0.08 1.67 -0.65 0.98 0.00 0.00 173.24 175.32 1hnn h PRO 689 N 7.35 0.08 -5.02 4.02 0.11 -1.91 -3.34 132.00 133.29 1hnn h PRO 689 Ca -0.34 -0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.41 1hnn h PRO 689 Cb 1.19 -0.02 -0.14 0.00 0.11 0.00 0.00 31.00 32.13 1hnn h PRO 689 CO 0.58 0.05 -0.66 0.16 -0.21 0.00 0.00 178.00 177.93 1hnn s ASP 690 N -5.24 1.68 0.61 -2.05 3.84 -1.26 -4.30 116.67 109.95 1hnn s ASP 690 Ca -0.14 -1.20 0.29 0.00 -0.00 0.00 0.00 52.55 51.50 1hnn s ASP 690 Cb 0.16 0.04 1.56 0.00 -1.38 0.00 0.00 42.92 43.30 1hnn s ASP 690 CO 0.72 -0.52 1.94 0.25 -0.00 0.00 0.00 175.17 177.56 1hnn h LEU 691 N 2.53 0.00 -0.22 2.11 5.85 -1.94 0.74 115.31 124.38 1hnn h LEU 691 Ca -0.38 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.12 1hnn h LEU 691 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1hnn h LEU 691 CO 0.64 0.00 -0.89 0.00 -0.34 0.00 0.00 178.44 177.84 1hnn h ALA 692 N 1.48 0.41 -0.26 1.25 0.00 -1.97 -2.48 119.26 117.69 1hnn h ALA 692 Ca 0.13 -0.69 -0.12 0.00 0.00 0.00 0.00 54.91 54.23 1hnn h ALA 692 Cb 0.89 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1hnn h ALA 692 CO -0.00 0.80 -0.34 1.03 0.00 0.00 0.00 179.25 180.75 1hnn h SER 693 N 0.25 0.59 0.41 0.00 0.87 -1.25 -2.19 113.55 112.23 1hnn h SER 693 Ca -0.07 -0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.24 1hnn h SER 693 Cb 1.52 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.31 1hnn h SER 693 CO 0.15 0.89 -0.24 0.15 -0.53 0.00 0.00 176.83 177.25 1hnn h PHE 694 N 0.48 -0.64 -0.16 2.24 3.57 -1.30 0.21 116.94 121.35 1hnn h PHE 694 Ca 0.05 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.60 1hnn h PHE 694 Cb 0.82 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.72 1hnn h PHE 694 CO 0.03 -0.38 -0.24 1.96 -2.23 0.00 0.00 178.31 177.45 1hnn h GLN 695 N -0.62 -0.28 -0.65 1.11 1.08 -1.34 0.21 115.11 114.62 1hnn h GLN 695 Ca -0.05 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.23 1hnn h GLN 695 Cb 0.51 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.95 1hnn h GLN 695 CO 0.06 -0.19 0.36 0.00 -0.95 0.00 0.00 178.83 178.11 1hnn h ARG 696 N -0.29 0.65 -0.46 1.46 3.08 -1.19 0.68 114.38 118.32 1hnn h ARG 696 Ca 0.11 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1hnn h ARG 696 Cb 0.45 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1hnn h ARG 696 CO -0.32 0.43 0.30 0.00 -1.07 0.00 0.00 179.97 179.31 1hnn h ALA 697 N 1.33 0.58 -0.81 0.04 0.00 0.13 -0.95 119.26 119.58 1hnn h ALA 697 Ca 0.29 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1hnn h ALA 697 Cb 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1hnn h ALA 697 CO -0.17 0.03 0.43 1.25 0.00 0.00 0.00 179.25 180.79 1hnn h LEU 698 N 0.62 1.01 -0.71 0.00 5.85 0.37 -2.01 115.31 120.44 1hnn h LEU 698 Ca 0.17 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 1hnn h LEU 698 Cb -0.07 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 1hnn h LEU 698 CO -0.04 0.82 -0.14 0.44 -0.34 0.00 0.00 178.44 179.19 1hnn h ASP 699 N 1.14 0.84 -0.07 1.25 3.32 -0.37 -1.12 116.42 121.41 1hnn h ASP 699 Ca 0.28 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1hnn h ASP 699 Cb 0.04 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 1hnn h ASP 699 CO -0.04 0.99 0.02 0.45 -1.72 0.00 0.00 179.24 178.94 1hnn h HIS 700 N 0.76 0.11 -0.38 4.55 3.86 -0.87 -2.96 115.15 120.22 1hnn h HIS 700 Ca 0.12 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.38 1hnn h HIS 700 Cb 0.65 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 29.03 1hnn h HIS 700 CO 0.04 0.26 0.07 0.82 0.86 0.00 0.00 177.93 179.98 1hnn h ILE 701 N -0.07 0.80 0.00 2.45 1.08 -1.29 -0.54 117.51 119.94 1hnn h ILE 701 Ca 0.02 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 1hnn h ILE 701 Cb 0.20 0.59 0.00 0.00 -3.07 0.00 0.00 36.82 34.54 1hnn h ILE 701 CO -0.00 0.04 0.00 0.41 -0.69 0.00 0.00 178.15 177.90 1hnn n THR 702 N -5.10 1.57 0.09 -0.27 -1.04 -0.43 -0.79 114.28 108.31 1hnn n THR 702 Ca 0.02 0.39 -0.07 0.00 -2.04 0.00 0.00 64.05 62.35 1hnn n THR 702 Cb 0.17 -1.37 -0.01 0.00 -1.82 0.00 0.00 70.33 67.30 1hnn n THR 702 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1hnn h THR 703 N 0.00 1.55 0.00 12.58 2.02 -0.93 -3.24 112.91 124.90 1hnn h THR 703 Ca 0.00 -2.79 0.00 0.00 0.77 0.00 0.00 66.41 64.39 1hnn h THR 703 Cb 0.02 2.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.98 1hnn h THR 703 CO 0.00 0.80 0.00 -0.07 0.37 0.00 0.00 175.52 176.62 1hnn h LEU 704 N 0.05 0.00 -9.49 2.58 3.38 -1.07 -3.45 115.31 107.31 1hnn h LEU 704 Ca -0.03 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.35 1hnn h LEU 704 Cb 1.53 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.21 1hnn h LEU 704 CO 0.13 0.00 -0.17 -0.22 0.09 0.00 0.00 178.44 178.27 1hnn s LEU 705 N -5.80 4.37 0.64 1.67 2.96 -1.23 -0.45 118.68 120.85 1hnn s LEU 705 Ca 0.06 0.89 -0.16 0.00 -0.22 0.00 0.00 54.13 54.71 1hnn s LEU 705 Cb 0.07 -2.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.10 1hnn s LEU 705 CO 0.62 0.16 1.11 0.00 -1.32 0.00 0.00 176.35 176.91 1hnn s ARG 706 N -0.19 2.90 0.37 1.98 1.70 -0.37 -4.87 118.95 120.48 1hnn s ARG 706 Ca 0.25 1.41 -0.28 0.00 -0.47 0.00 0.00 55.73 56.64 1hnn s ARG 706 Cb -0.16 -1.96 -0.10 0.00 -0.57 0.00 0.00 34.95 32.16 1hnn s ARG 706 CO 0.12 -1.17 1.34 -1.25 -1.08 0.00 0.00 175.30 173.26 1hnn s PRO 707 N -3.98 4.17 0.00 3.89 0.04 -1.26 -0.83 135.00 137.02 1hnn s PRO 707 Ca 0.68 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.98 1hnn s PRO 707 Cb -0.21 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1hnn s PRO 707 CO 0.39 -0.37 0.00 0.41 0.04 0.00 0.00 177.00 177.48 1hnn n GLY 708 N 0.69 0.81 3.83 0.56 0.00 0.16 -5.00 105.19 106.23 1hnn n GLY 708 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1hnn n GLY 708 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hnn s GLY 709 N -1.73 1.71 0.05 -0.02 0.00 -0.01 -4.73 107.32 102.59 1hnn s GLY 709 Ca 0.00 -1.08 0.07 0.00 0.00 0.00 0.00 44.72 43.70 1hnn s GLY 709 CO 0.00 -0.30 -0.19 0.30 0.00 0.00 0.00 173.10 172.91 1hnn s HIS 710 N -3.61 1.69 -0.03 1.90 3.76 -1.22 -0.75 115.29 117.03 1hnn s HIS 710 Ca 0.72 -0.37 0.05 0.00 -0.15 0.00 0.00 55.06 55.31 1hnn s HIS 710 Cb -0.06 -1.00 -0.01 0.00 1.11 0.00 0.00 32.58 32.62 1hnn s HIS 710 CO 0.54 0.09 -0.17 -1.17 -0.85 0.00 0.00 174.74 173.18 1hnn s LEU 711 N -1.21 1.95 -0.24 0.89 2.96 0.18 -1.26 118.68 121.96 1hnn s LEU 711 Ca 0.06 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.65 1hnn s LEU 711 Cb -0.09 -0.92 0.03 0.00 0.50 0.00 0.00 46.19 45.72 1hnn s LEU 711 CO 0.02 0.17 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.35 1hnn s LEU 712 N -0.12 3.02 -0.14 -0.68 1.43 -0.30 -1.48 118.68 120.41 1hnn s LEU 712 Ca 0.00 -0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 52.12 1hnn s LEU 712 Cb -0.10 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.52 1hnn s LEU 712 CO 0.01 -0.12 -0.12 -0.76 0.23 0.00 0.00 176.35 175.59 1hnn s LEU 713 N 1.25 2.75 -0.05 1.79 1.43 -0.24 -1.69 118.68 123.91 1hnn s LEU 713 Ca -0.01 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1hnn s LEU 713 Cb -0.17 -1.63 -0.00 0.00 0.03 0.00 0.00 46.19 44.42 1hnn s LEU 713 CO -0.07 0.14 -0.18 -0.63 0.23 0.00 0.00 176.35 175.85 1hnn s ILE 714 N 0.48 1.51 0.26 -0.59 1.01 -0.37 0.37 121.20 123.87 1hnn s ILE 714 Ca -0.09 -0.74 -0.20 0.00 0.00 0.00 0.00 60.65 59.62 1hnn s ILE 714 Cb -0.16 -1.30 0.02 0.00 0.01 0.00 0.00 42.46 41.03 1hnn s ILE 714 CO 0.04 0.43 0.68 -0.83 0.00 0.00 0.00 174.94 175.26 1hnn s GLY 715 N 0.15 -0.07 0.30 6.18 0.00 -0.68 0.90 107.32 114.10 1hnn s GLY 715 Ca -0.07 -0.30 -0.28 0.00 0.00 0.00 0.00 44.72 44.07 1hnn s GLY 715 CO 0.03 -0.13 1.05 0.00 0.00 0.00 0.00 173.10 174.05 1hnn s ALA 716 N -3.91 3.31 -0.20 3.20 0.00 -1.26 -0.92 121.76 121.98 1hnn s ALA 716 Ca 0.11 0.78 -0.04 0.00 0.00 0.00 0.00 51.96 52.82 1hnn s ALA 716 Cb -0.05 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 1hnn s ALA 716 CO 0.05 -0.09 -0.04 -1.17 0.00 0.00 0.00 175.76 174.51 1hnn s LEU 717 N -1.71 3.02 -1.27 0.00 2.96 0.13 -4.64 118.68 117.17 1hnn s LEU 717 Ca 0.47 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 54.08 1hnn s LEU 717 Cb -0.28 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.66 1hnn s LEU 717 CO 0.35 0.05 0.87 1.21 -1.32 0.00 0.00 176.35 177.52 1hnn n GLU 718 N 4.33 -5.88 -5.09 1.98 4.07 -0.06 -1.62 120.64 118.39 1hnn n GLU 718 Ca -0.18 0.74 -0.32 0.00 -0.06 0.00 0.00 57.16 57.34 1hnn n GLU 718 Cb 0.52 -5.55 -0.15 0.00 -0.06 0.00 0.00 31.44 26.19 1hnn n GLU 718 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1hnn s GLU 719 N -5.72 2.74 -0.01 5.31 2.12 -1.26 -4.12 118.70 117.76 1hnn s GLU 719 Ca 0.05 -0.82 0.12 0.00 0.36 0.00 0.00 54.97 54.68 1hnn s GLU 719 Cb -0.02 -2.31 -0.16 0.00 0.26 0.00 0.00 34.13 31.90 1hnn s GLU 719 CO 0.77 0.39 0.36 -1.13 -0.54 0.00 0.00 175.26 175.11 1hnn n SER 720 N 2.96 1.53 -3.44 -1.70 3.41 -1.26 -2.23 113.62 112.89 1hnn n SER 720 Ca -0.18 -0.34 -0.12 0.00 -0.26 0.00 0.00 58.87 57.98 1hnn n SER 720 Cb 0.52 1.30 -0.02 0.00 -0.26 0.00 0.00 64.21 65.76 1hnn n SER 720 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1hnn s TRP 721 N -2.50 -0.52 -0.12 7.33 1.48 -1.26 0.11 118.94 123.47 1hnn s TRP 721 Ca -0.01 0.30 -0.30 0.00 -1.06 0.00 0.00 56.10 55.03 1hnn s TRP 721 Cb 0.08 0.55 0.09 0.00 -1.16 0.00 0.00 33.47 33.03 1hnn s TRP 721 CO 0.48 -0.85 0.81 1.52 -4.06 0.00 0.00 176.95 174.85 1hnn s TYR 722 N -3.76 -0.56 0.17 1.66 -0.85 -0.56 -2.90 117.35 110.55 1hnn s TYR 722 Ca 0.01 1.04 -0.07 0.00 -0.52 0.00 0.00 57.07 57.53 1hnn s TYR 722 Cb -0.01 0.41 -0.06 0.00 0.38 0.00 0.00 41.96 42.68 1hnn s TYR 722 CO -0.13 -0.48 0.44 -0.51 -1.52 0.00 0.00 175.55 173.36 1hnn s LEU 723 N -0.93 4.24 -0.31 -3.49 1.43 0.98 -0.58 118.68 120.01 1hnn s LEU 723 Ca -0.06 0.73 0.18 0.00 -1.03 0.00 0.00 54.13 53.95 1hnn s LEU 723 Cb -0.01 -3.42 0.46 0.00 0.03 0.00 0.00 46.19 43.26 1hnn s LEU 723 CO 0.05 0.02 0.99 0.00 0.23 0.00 0.00 176.35 177.64 1hnn n ALA 724 N 0.09 3.22 0.00 4.21 0.00 -0.05 -4.76 120.51 123.22 1hnn n ALA 724 Ca -0.02 -2.99 0.00 0.00 0.00 0.00 0.00 53.44 50.43 1hnn n ALA 724 Cb 0.52 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1hnn n ALA 724 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hnn n GLY 725 N -0.17 1.07 0.09 0.00 0.00 -1.26 -0.41 105.19 104.50 1hnn n GLY 725 Ca 0.08 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 1hnn n GLY 725 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1hnn h GLU 726 N 0.00 0.15 -6.13 1.61 4.22 -1.97 -3.43 114.58 109.03 1hnn h GLU 726 Ca 0.00 -0.06 -0.58 0.00 0.08 0.00 0.00 59.36 58.80 1hnn h GLU 726 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1hnn h GLU 726 CO 0.00 0.50 1.38 0.00 -2.18 0.00 0.00 179.01 178.71 1hnn s ALA 727 N -4.64 2.88 -0.46 2.92 0.00 -1.22 -4.97 121.76 116.26 1hnn s ALA 727 Ca -0.15 0.65 -0.17 0.00 0.00 0.00 0.00 51.96 52.29 1hnn s ALA 727 Cb 0.04 -4.02 0.05 0.00 0.00 0.00 0.00 23.12 19.19 1hnn s ALA 727 CO 0.70 -2.58 0.45 0.50 0.00 0.00 0.00 175.76 174.83 1hnn s ARG 728 N 5.86 3.04 -0.17 0.00 3.52 -1.26 -0.87 118.95 129.07 1hnn s ARG 728 Ca 0.91 -1.07 -0.17 0.00 -0.13 0.00 0.00 55.73 55.27 1hnn s ARG 728 Cb -0.30 -4.07 -0.04 0.00 -1.56 0.00 0.00 34.95 28.98 1hnn s ARG 728 CO 0.35 -1.01 0.45 -0.51 -0.81 0.00 0.00 175.30 173.77 1hnn s LEU 729 N 2.01 4.20 0.00 -0.88 1.02 0.25 -4.91 118.68 120.37 1hnn s LEU 729 Ca 0.09 0.66 -0.20 0.00 0.02 0.00 0.00 54.13 54.70 1hnn s LEU 729 Cb -0.21 -2.62 -0.05 0.00 0.02 0.00 0.00 46.19 43.33 1hnn s LEU 729 CO 0.10 -0.07 0.57 0.42 0.02 0.00 0.00 176.35 177.39 1hnn s THR 730 N 1.12 4.91 0.10 5.49 -4.23 -1.26 -1.49 115.64 120.27 1hnn s THR 730 Ca 0.22 1.20 0.00 0.00 -1.18 0.00 0.00 61.69 61.94 1hnn s THR 730 Cb -0.15 -3.91 -0.04 0.00 1.34 0.00 0.00 72.50 69.74 1hnn s THR 730 CO 0.09 0.44 -0.03 0.68 -0.54 0.00 0.00 174.62 175.27 1hnn s VAL 731 N -0.33 0.43 -0.37 2.29 -7.23 0.30 -4.92 120.40 110.57 1hnn s VAL 731 Ca 0.30 -1.89 -0.28 0.00 -1.81 0.00 0.00 61.98 58.30 1hnn s VAL 731 Cb -0.18 -1.74 0.02 0.00 0.56 0.00 0.00 36.38 35.04 1hnn s VAL 731 CO 0.17 -0.80 1.03 0.54 -0.31 0.00 0.00 175.10 175.72 1hnn s VAL 732 N -3.80 4.48 0.21 1.32 0.11 -1.23 -4.13 120.40 117.37 1hnn s VAL 732 Ca 0.14 1.42 -0.30 0.00 -2.93 0.00 0.00 61.98 60.30 1hnn s VAL 732 Cb 0.07 -4.42 -0.09 0.00 -1.53 0.00 0.00 36.38 30.41 1hnn s VAL 732 CO -0.05 -0.61 1.33 -2.16 -3.33 0.00 0.00 175.10 170.29 1hnn s PRO 733 N 3.74 4.37 0.17 1.54 0.04 -0.95 -4.76 135.00 139.14 1hnn s PRO 733 Ca 0.43 2.10 0.08 0.00 0.04 0.00 0.00 61.00 63.65 1hnn s PRO 733 Cb -0.11 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 1hnn s PRO 733 CO 0.20 -0.28 -0.17 0.14 0.04 0.00 0.00 177.00 176.94 1hnn s VAL 734 N 0.05 1.74 0.48 -0.36 -7.23 -1.26 -4.85 120.40 108.98 1hnn s VAL 734 Ca 0.57 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.82 1hnn s VAL 734 Cb -0.37 -1.87 0.01 0.00 0.56 0.00 0.00 36.38 34.71 1hnn s VAL 734 CO 0.39 -0.42 0.38 -0.94 -0.31 0.00 0.00 175.10 174.21 1hnn s SER 735 N -2.85 4.76 0.22 4.85 1.04 -1.26 -0.88 113.70 119.59 1hnn s SER 735 Ca 0.17 -1.04 0.05 0.00 0.48 0.00 0.00 55.95 55.61 1hnn s SER 735 Cb -0.04 -0.04 0.20 0.00 0.10 0.00 0.00 66.02 66.24 1hnn s SER 735 CO 0.06 -0.89 1.52 1.05 0.98 0.00 0.00 173.24 175.97 1hnn h GLU 736 N 0.91 0.18 -0.35 4.02 4.11 -1.98 -1.55 114.58 119.91 1hnn h GLU 736 Ca -0.39 -0.14 0.00 0.00 0.07 0.00 0.00 59.36 58.90 1hnn h GLU 736 Cb 1.28 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 1hnn h GLU 736 CO 0.58 0.79 0.22 0.93 0.07 0.00 0.00 179.01 181.61 1hnn h GLU 737 N 0.12 0.47 -0.82 1.06 5.08 -1.99 0.25 114.58 118.76 1hnn h GLU 737 Ca -0.01 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1hnn h GLU 737 Cb 1.21 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 1hnn h GLU 737 CO 0.10 0.34 0.54 0.93 -1.00 0.00 0.00 179.01 179.92 1hnn h GLU 738 N 0.47 1.05 -0.57 2.33 5.08 -1.90 -0.38 114.58 120.66 1hnn h GLU 738 Ca 0.13 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1hnn h GLU 738 Cb -0.02 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 1hnn h GLU 738 CO -0.03 0.70 -0.00 0.28 -1.00 0.00 0.00 179.01 178.96 1hnn h VAL 739 N 1.08 1.26 0.02 3.13 2.07 -0.64 -0.93 116.25 122.26 1hnn h VAL 739 Ca 0.31 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1hnn h VAL 739 Cb -0.09 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1hnn h VAL 739 CO -0.08 0.41 -0.01 -0.09 0.02 0.00 0.00 177.57 177.82 1hnn h ARG 740 N 0.91 -0.03 -0.44 1.57 2.43 0.12 -2.26 114.38 116.68 1hnn h ARG 740 Ca 0.17 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.39 1hnn h ARG 740 Cb 0.54 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 1hnn h ARG 740 CO 0.03 0.05 0.18 1.49 -1.51 0.00 0.00 179.97 180.21 1hnn h GLU 741 N -0.11 0.36 -0.81 0.20 4.57 -0.92 -1.61 114.58 116.25 1hnn h GLU 741 Ca -0.00 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.21 1hnn h GLU 741 Cb 0.10 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 28.55 1hnn h GLU 741 CO 0.01 0.24 0.51 0.00 -1.18 0.00 0.00 179.01 178.58 1hnn h ALA 742 N 1.27 1.10 -0.19 2.92 0.00 -1.03 0.11 119.26 123.45 1hnn h ALA 742 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1hnn h ALA 742 Cb 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1hnn h ALA 742 CO -0.18 0.27 0.05 -0.07 0.00 0.00 0.00 179.25 179.32 1hnn h LEU 743 N 0.94 0.28 0.22 0.00 3.38 -0.80 -0.72 115.31 118.61 1hnn h LEU 743 Ca 0.35 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1hnn h LEU 743 Cb 0.12 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1hnn h LEU 743 CO -0.15 0.42 -0.14 0.58 0.09 0.00 0.00 178.44 179.23 1hnn h VAL 744 N 0.12 0.70 -0.51 1.22 2.07 -0.88 -1.13 116.25 117.84 1hnn h VAL 744 Ca 0.06 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.73 1hnn h VAL 744 Cb 0.24 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1hnn h VAL 744 CO -0.00 0.00 0.40 0.03 0.02 0.00 0.00 177.57 178.02 1hnn h ARG 745 N -0.35 0.00 -0.00 1.57 3.08 -0.67 0.54 114.38 118.55 1hnn h ARG 745 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1hnn h ARG 745 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1hnn h ARG 745 CO 0.01 0.00 -0.14 0.43 -1.07 0.00 0.00 179.97 179.21 1hnn n SER 746 N -4.19 0.47 -0.04 7.04 7.64 -0.29 -4.92 113.62 119.33 1hnn n SER 746 Ca 0.09 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.49 1hnn n SER 746 Cb 0.61 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1hnn n SER 746 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hnn n GLY 747 N 1.32 1.40 3.60 0.23 0.00 0.19 -4.95 105.19 106.98 1hnn n GLY 747 Ca 0.13 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1hnn n GLY 747 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hnn s TYR 748 N -2.08 2.80 -0.20 1.61 2.02 -0.52 -0.76 117.35 120.22 1hnn s TYR 748 Ca 0.00 -0.13 -0.12 0.00 -0.37 0.00 0.00 57.07 56.45 1hnn s TYR 748 Cb 0.00 -1.45 -0.05 0.00 -0.40 0.00 0.00 41.96 40.06 1hnn s TYR 748 CO 0.00 0.44 0.23 0.21 -1.57 0.00 0.00 175.55 174.87 1hnn s LYS 749 N -2.27 4.17 -0.46 -0.62 2.20 -0.05 -4.12 119.74 118.59 1hnn s LYS 749 Ca 0.23 -0.07 -0.26 0.00 -0.36 0.00 0.00 55.97 55.50 1hnn s LYS 749 Cb -0.11 -3.48 0.03 0.00 -1.51 0.00 0.00 37.83 32.75 1hnn s LYS 749 CO 0.15 0.15 0.95 0.08 -0.36 0.00 0.00 175.35 176.32 1hnn s VAL 750 N 0.79 4.44 -0.03 4.02 1.01 -1.26 -1.61 120.40 127.76 1hnn s VAL 750 Ca 0.12 0.84 0.12 0.00 0.00 0.00 0.00 61.98 63.07 1hnn s VAL 750 Cb -0.13 -4.45 -0.15 0.00 0.00 0.00 0.00 36.38 31.65 1hnn s VAL 750 CO 0.03 -0.84 1.05 0.03 0.00 0.00 0.00 175.10 175.38 1hnn h ARG 751 N 9.05 0.00 -1.82 2.72 3.08 -0.64 -3.47 114.38 123.30 1hnn h ARG 751 Ca -0.24 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.82 1hnn h ARG 751 Cb 1.07 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.89 1hnn h ARG 751 CO 1.04 0.62 0.26 0.34 -1.07 0.00 0.00 179.97 181.16 1hnn s ASP 752 N -6.30 -0.64 -0.22 7.04 2.15 -0.63 -4.95 116.67 113.11 1hnn s ASP 752 Ca -0.01 1.20 -0.03 0.00 0.43 0.00 0.00 52.55 54.14 1hnn s ASP 752 Cb 0.09 1.23 0.12 0.00 -0.30 0.00 0.00 42.92 44.05 1hnn s ASP 752 CO 0.81 -0.21 0.33 -0.22 -0.17 0.00 0.00 175.17 175.71 1hnn s LEU 753 N 0.46 -0.46 0.17 -1.34 2.96 -1.25 0.13 118.68 119.35 1hnn s LEU 753 Ca 0.00 0.14 0.10 0.00 -0.22 0.00 0.00 54.13 54.15 1hnn s LEU 753 Cb -0.05 0.89 -0.04 0.00 0.50 0.00 0.00 46.19 47.48 1hnn s LEU 753 CO -0.04 -0.30 -0.19 -0.13 -1.32 0.00 0.00 176.35 174.37 1hnn s ARG 754 N 2.48 1.72 -0.05 1.98 0.52 0.84 -4.95 118.95 121.49 1hnn s ARG 754 Ca 0.10 -1.38 0.06 0.00 -0.52 0.00 0.00 55.73 53.98 1hnn s ARG 754 Cb -0.15 -1.99 -0.01 0.00 0.52 0.00 0.00 34.95 33.32 1hnn s ARG 754 CO -0.14 0.43 -0.22 0.99 0.02 0.00 0.00 175.30 176.37 1hnn s THR 755 N -1.57 1.82 -0.24 0.02 2.01 -1.26 -0.61 115.64 115.81 1hnn s THR 755 Ca 0.21 -0.94 -0.01 0.00 0.31 0.00 0.00 61.69 61.26 1hnn s THR 755 Cb -0.09 -1.55 0.03 0.00 0.01 0.00 0.00 72.50 70.90 1hnn s THR 755 CO 0.11 0.51 -0.08 -0.47 -0.69 0.00 0.00 174.62 174.00 1hnn s TYR 756 N -0.14 3.04 -0.33 4.92 5.04 0.11 -4.96 117.35 125.03 1hnn s TYR 756 Ca -0.02 -1.59 -0.28 0.00 -2.44 0.00 0.00 57.07 52.74 1hnn s TYR 756 Cb -0.13 -2.03 0.02 0.00 0.35 0.00 0.00 41.96 40.17 1hnn s TYR 756 CO 0.03 -0.74 1.03 0.42 -1.34 0.00 0.00 175.55 174.95 1hnn s ILE 757 N 1.31 4.54 0.04 3.14 1.01 -1.26 -0.25 121.20 129.74 1hnn s ILE 757 Ca 0.00 1.60 -0.31 0.00 0.00 0.00 0.00 60.65 61.94 1hnn s ILE 757 Cb -0.16 -4.38 -0.10 0.00 0.01 0.00 0.00 42.46 37.82 1hnn s ILE 757 CO -0.05 -0.48 1.92 0.80 0.00 0.00 0.00 174.94 177.12 1hnn n MET 758 N 6.82 2.73 -2.11 2.79 0.00 -0.55 -4.94 117.12 121.86 1hnn n MET 758 Ca 0.11 1.00 -0.31 0.00 -0.00 0.00 0.00 57.70 58.49 1hnn n MET 758 Cb 0.47 -2.92 -0.01 0.00 0.00 0.00 0.00 33.22 30.77 1hnn n MET 758 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1hnn s PRO 759 N 3.84 3.75 0.19 2.12 0.04 -1.26 -4.86 135.00 138.83 1hnn s PRO 759 Ca 0.87 0.84 -0.22 0.00 0.04 0.00 0.00 61.00 62.53 1hnn s PRO 759 Cb -0.49 -2.11 0.11 0.00 0.04 0.00 0.00 34.50 32.05 1hnn s PRO 759 CO 0.42 -0.43 1.57 0.00 0.04 0.00 0.00 177.00 178.59 1hnn h ALA 760 N 0.24 -0.13 -0.78 8.56 0.00 -1.96 0.26 119.26 125.45 1hnn h ALA 760 Ca -0.45 0.17 0.21 0.00 0.00 0.00 0.00 54.91 54.84 1hnn h ALA 760 Cb 1.19 0.97 -0.04 0.00 0.00 0.00 0.00 17.79 19.91 1hnn h ALA 760 CO 0.62 -0.74 0.55 1.25 0.00 0.00 0.00 179.25 180.92 1hnn h HIS 761 N -0.12 0.12 -0.02 0.00 -0.00 -2.03 0.11 115.15 113.21 1hnn h HIS 761 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.61 1hnn h HIS 761 Cb 0.56 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 27.93 1hnn h HIS 761 CO -0.77 0.04 -0.07 1.28 -0.00 0.00 0.00 177.93 178.41 1hnn n LEU 762 N -4.36 1.68 -4.56 0.26 4.77 0.05 -4.70 117.00 110.15 1hnn n LEU 762 Ca 0.16 -0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 55.17 1hnn n LEU 762 Cb 0.78 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.83 1hnn n LEU 762 CO 0.37 0.29 1.59 -1.10 -1.33 0.00 0.00 177.39 177.20 1hnn s GLN 763 N -2.11 3.72 0.24 3.23 -1.52 0.38 -4.95 119.66 118.65 1hnn s GLN 763 Ca 0.33 -1.46 0.05 0.00 -1.95 0.00 0.00 55.36 52.33 1hnn s GLN 763 Cb 0.20 -5.38 -0.03 0.00 -0.22 0.00 0.00 33.01 27.59 1hnn s GLN 763 CO 0.37 -2.18 0.35 0.95 -0.25 0.00 0.00 175.29 174.54 1hnn s THR 764 N 4.51 5.24 -1.45 -0.19 -4.23 -1.26 -4.96 115.64 113.29 1hnn s THR 764 Ca 0.47 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 1hnn s THR 764 Cb 0.01 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1hnn s THR 764 CO -0.04 -0.33 0.19 0.61 -0.54 0.00 0.00 174.62 174.51 1hnn n GLY 765 N -1.39 0.10 0.08 3.99 0.00 -1.26 -2.99 105.19 103.72 1hnn n GLY 765 Ca -0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.06 1hnn n GLY 765 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1hnn n VAL 766 N -0.02 0.43 -3.28 1.61 0.24 -1.26 -4.87 118.33 111.17 1hnn n VAL 766 Ca 0.00 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.06 1hnn n VAL 766 Cb 0.04 -0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 1hnn n VAL 766 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1hnn n ASP 767 N -2.09 0.00 -0.39 -1.34 3.85 -1.16 -0.02 116.55 115.40 1hnn n ASP 767 Ca 0.05 -0.75 0.04 0.00 -0.71 0.00 0.00 54.79 53.42 1hnn n ASP 767 Cb 0.42 0.00 0.05 0.00 -1.35 0.00 0.00 41.12 40.24 1hnn n ASP 767 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1hnn n ASP 768 N -0.35 0.88 -4.62 -1.12 3.85 -1.14 -4.82 116.55 109.23 1hnn n ASP 768 Ca 0.00 -2.42 -0.43 0.00 -0.71 0.00 0.00 54.79 51.23 1hnn n ASP 768 Cb 0.00 -0.29 -0.01 0.00 -1.35 0.00 0.00 41.12 39.47 1hnn n ASP 768 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 1hnn n VAL 769 N -0.50 2.06 0.18 2.12 0.24 -1.26 -4.63 118.33 116.54 1hnn n VAL 769 Ca 0.06 -0.50 0.09 0.00 -2.04 0.00 0.00 64.34 61.95 1hnn n VAL 769 Cb 0.70 -1.15 -0.12 0.00 -1.47 0.00 0.00 33.84 31.79 1hnn n VAL 769 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1hnn n LYS 770 N 0.59 0.75 -3.93 7.34 4.76 -0.64 -4.86 118.16 122.17 1hnn n LYS 770 Ca 0.08 -0.12 0.02 0.00 -2.87 0.00 0.00 58.31 55.42 1hnn n LYS 770 Cb 0.34 -1.38 0.01 0.00 -1.84 0.00 0.00 35.03 32.16 1hnn n LYS 770 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1hnn s GLY 771 N -3.65 -0.14 0.02 0.72 0.00 -1.16 -1.48 107.32 101.63 1hnn s GLY 771 Ca -0.03 0.08 0.04 0.00 0.00 0.00 0.00 44.72 44.80 1hnn s GLY 771 CO 0.71 4.54 -0.13 0.14 0.00 0.00 0.00 173.10 178.37 1hnn s VAL 772 N -2.09 1.01 0.10 1.40 1.01 0.66 0.20 120.40 122.68 1hnn s VAL 772 Ca 0.27 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.53 1hnn s VAL 772 Cb -0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 1hnn s VAL 772 CO -0.00 0.08 -0.23 0.72 0.00 0.00 0.00 175.10 175.67 1hnn s PHE 773 N -0.66 2.42 -0.06 5.22 -0.12 -0.10 0.04 117.98 124.72 1hnn s PHE 773 Ca 0.02 -0.33 0.02 0.00 -0.05 0.00 0.00 56.93 56.59 1hnn s PHE 773 Cb -0.07 -1.33 0.01 0.00 -0.63 0.00 0.00 43.02 41.01 1hnn s PHE 773 CO 0.01 0.31 -0.10 0.12 -0.05 0.00 0.00 175.22 175.50 1hnn s PHE 774 N -1.03 1.27 -0.00 3.49 5.36 0.21 -1.69 117.98 125.60 1hnn s PHE 774 Ca 0.15 -0.44 0.04 0.00 -0.96 0.00 0.00 56.93 55.72 1hnn s PHE 774 Cb -0.10 -0.96 -0.01 0.00 -0.34 0.00 0.00 43.02 41.61 1hnn s PHE 774 CO 0.07 -0.24 -0.14 0.00 -1.46 0.00 0.00 175.22 173.44 1hnn s ALA 775 N 0.67 1.17 -0.32 11.12 0.00 0.16 -0.11 121.76 134.45 1hnn s ALA 775 Ca -0.13 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1hnn s ALA 775 Cb -0.15 -0.28 0.07 0.00 0.00 0.00 0.00 23.12 22.76 1hnn s ALA 775 CO 0.03 0.28 0.02 -0.46 0.00 0.00 0.00 175.76 175.63 1hnn s TRP 776 N -0.40 3.44 0.01 0.00 -0.00 0.35 -1.07 118.94 121.26 1hnn s TRP 776 Ca 0.05 -2.34 0.07 0.00 -0.00 0.00 0.00 56.10 53.88 1hnn s TRP 776 Cb -0.06 -2.45 -0.02 0.00 -0.00 0.00 0.00 33.47 30.94 1hnn s TRP 776 CO -0.00 -0.89 -0.20 0.00 -0.00 0.00 0.00 176.95 175.86 1hnn s ALA 777 N 1.12 1.67 -0.13 5.86 0.00 -0.55 0.18 121.76 129.90 1hnn s ALA 777 Ca -0.00 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1hnn s ALA 777 Cb -0.20 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 1hnn s ALA 777 CO -0.04 0.39 -0.17 -1.14 0.00 0.00 0.00 175.76 174.81 1hnn s GLN 778 N -0.77 3.23 0.12 0.00 0.74 -0.63 0.49 119.66 122.85 1hnn s GLN 778 Ca 0.07 -0.76 -0.31 0.00 0.05 0.00 0.00 55.36 54.41 1hnn s GLN 778 Cb -0.08 -2.55 -0.08 0.00 1.10 0.00 0.00 33.01 31.40 1hnn s GLN 778 CO 0.00 0.12 1.41 0.21 -0.55 0.00 0.00 175.29 176.48 1hnn s LYS 779 N 0.55 4.31 0.00 1.67 2.20 0.07 -0.87 119.74 127.66 1hnn s LYS 779 Ca -0.10 2.11 0.27 0.00 -0.36 0.00 0.00 55.97 57.88 1hnn s LYS 779 Cb -0.16 -3.23 0.81 0.00 -1.51 0.00 0.00 37.83 33.73 1hnn s LYS 779 CO 0.04 -0.45 1.61 0.28 -0.36 0.00 0.00 175.35 176.47