#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hc1 s ARG 1677N 0.00 3.59 0.42 1.20 0.52 -1.26 -5.00 118.95 118.42 2hc1 s ARG 1677Ca 0.00 0.86 -0.25 0.00 -0.52 0.00 0.00 55.73 55.81 2hc1 s ARG 1677Cb 0.00 -2.08 -0.08 0.00 0.52 0.00 0.00 34.95 33.31 2hc1 s ARG 1677CO 0.00 -0.57 1.24 -1.59 0.02 0.00 0.00 175.30 174.40 2hc1 s LYS 1678N -4.81 3.93 0.00 3.54 -2.85 -1.26 -4.95 119.74 113.34 2hc1 s LYS 1678Ca 0.57 2.00 0.15 0.00 -1.00 0.00 0.00 55.97 57.69 2hc1 s LYS 1678Cb -0.11 -2.66 0.02 0.00 -2.06 0.00 0.00 37.83 33.01 2hc1 s LYS 1678CO 0.47 -0.47 0.85 0.25 0.10 0.00 0.00 175.35 176.54 2hc1 n THR 1679N -0.02 0.00 -3.63 3.79 -2.24 -1.26 -4.98 114.28 105.94 2hc1 n THR 1679Ca 0.05 -0.37 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 2hc1 n THR 1679Cb 0.45 1.20 -0.07 0.00 -2.10 0.00 0.00 70.33 69.81 2hc1 n THR 1679CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2hc1 s SER 1680N -1.71 -0.58 -0.42 3.42 0.15 -1.26 -4.15 113.70 109.15 2hc1 s SER 1680Ca 0.13 0.89 0.06 0.00 0.70 0.00 0.00 55.95 57.73 2hc1 s SER 1680Cb 0.12 0.87 0.20 0.00 -1.71 0.00 0.00 66.02 65.50 2hc1 s SER 1680CO 0.34 -0.38 0.47 0.00 1.20 0.00 0.00 173.24 174.87 2hc1 s PRO 1682N -0.17 4.45 -0.10 0.00 0.02 -1.26 -4.58 135.00 133.36 2hc1 s PRO 1682Ca 0.33 1.74 0.01 0.00 0.02 0.00 0.00 61.00 63.10 2hc1 s PRO 1682Cb 0.08 -2.97 0.02 0.00 0.02 0.00 0.00 34.50 31.65 2hc1 s PRO 1682CO -0.16 0.06 -0.13 0.42 -0.33 0.00 0.00 177.00 176.86 2hc1 s ILE 1683N -1.32 1.31 0.35 2.83 -1.09 0.13 -4.93 121.20 118.49 2hc1 s ILE 1683Ca 0.49 -0.52 -0.28 0.00 -2.23 0.00 0.00 60.65 58.11 2hc1 s ILE 1683Cb -0.29 -1.23 -0.11 0.00 -1.58 0.00 0.00 42.46 39.24 2hc1 s ILE 1683CO 0.37 0.41 1.47 0.29 -1.23 0.00 0.00 174.94 176.25 2hc1 n LYS 1684N 4.35 2.57 0.21 2.79 5.02 -1.26 -0.82 118.16 131.01 2hc1 n LYS 1684Ca -0.18 0.91 0.05 0.00 -2.02 0.00 0.00 58.31 57.07 2hc1 n LYS 1684Cb 0.51 -2.62 0.46 0.00 -0.02 0.00 0.00 35.03 33.36 2hc1 n LYS 1684CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2hc1 h ILE 1685N 2.96 1.05 0.00 -0.18 3.07 -1.67 -0.08 117.51 122.66 2hc1 h ILE 1685Ca -0.49 -1.00 0.00 0.00 1.55 0.00 0.00 64.86 64.91 2hc1 h ILE 1685Cb 1.25 1.56 0.00 0.00 -0.27 0.00 0.00 36.82 39.36 2hc1 h ILE 1685CO 0.67 0.27 0.00 -3.20 -1.05 0.00 0.00 178.15 174.84 2hc1 n ASN 1686N -3.99 0.37 -0.62 2.16 2.85 -1.26 -2.21 115.26 112.56 2hc1 n ASN 1686Ca -0.02 0.55 0.12 0.00 -0.11 0.00 0.00 54.58 55.11 2hc1 n ASN 1686Cb 0.35 -0.64 0.07 0.00 1.24 0.00 0.00 39.78 40.79 2hc1 n ASN 1686CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hc1 n GLN 1687N -1.86 1.53 -0.17 1.20 1.13 -0.08 -4.67 117.38 114.45 2hc1 n GLN 1687Ca 0.05 -1.24 -0.09 0.00 -1.94 0.00 0.00 57.00 53.79 2hc1 n GLN 1687Cb 0.34 -1.47 0.01 0.00 0.11 0.00 0.00 30.24 29.22 2hc1 n GLN 1687CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 2hc1 h PHE 1688N 3.02 0.79 -0.32 1.08 3.57 -0.98 -1.07 116.94 123.04 2hc1 h PHE 1688Ca 0.00 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.48 2hc1 h PHE 1688Cb 0.80 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 2hc1 h PHE 1688CO 0.00 0.69 -0.03 1.49 -2.23 0.00 0.00 178.31 178.24 2hc1 h GLU 1689N 0.66 0.06 -0.45 1.11 4.57 -1.83 -0.34 114.58 118.35 2hc1 h GLU 1689Ca 0.16 -0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.20 2hc1 h GLU 1689Cb 0.28 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2hc1 h GLU 1689CO -0.00 0.04 -0.24 0.78 -1.18 0.00 0.00 179.01 178.40 2hc1 h GLY 1690N 0.06 1.02 0.54 1.92 0.00 -1.84 -2.01 103.07 102.75 2hc1 h GLY 1690Ca 0.15 -0.91 0.05 0.00 0.00 0.00 0.00 47.33 46.62 2hc1 h GLY 1690CO -0.28 0.83 -0.02 0.84 0.00 0.00 0.00 176.54 177.90 2hc1 h HIS 1691N 0.80 -0.06 -0.20 5.60 -0.00 -0.69 -0.17 115.15 120.42 2hc1 h HIS 1691Ca 0.10 0.02 -0.13 0.00 -0.00 0.00 0.00 60.37 60.36 2hc1 h HIS 1691Cb 0.81 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 28.28 2hc1 h HIS 1691CO 0.05 -0.07 -0.44 0.35 -0.00 0.00 0.00 177.93 177.82 2hc1 h PHE 1692N 0.05 0.60 -0.48 5.26 3.57 -0.99 -0.25 116.94 124.69 2hc1 h PHE 1692Ca 0.13 -0.18 0.02 0.00 3.53 0.00 0.00 57.97 61.46 2hc1 h PHE 1692Cb 0.18 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 2hc1 h PHE 1692CO -0.23 0.85 0.30 0.52 -2.23 0.00 0.00 178.31 177.52 2hc1 h MET 1693N 0.41 0.59 -0.27 1.11 2.86 -1.07 -1.91 114.93 116.64 2hc1 h MET 1693Ca 0.03 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.54 2hc1 h MET 1693Cb 0.93 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 2hc1 h MET 1693CO 0.08 0.39 -0.23 0.87 1.06 0.00 0.00 176.91 179.08 2hc1 h LYS 1694N 0.61 0.51 -0.51 1.72 1.57 -0.56 -2.08 116.57 117.82 2hc1 h LYS 1694Ca 0.19 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2hc1 h LYS 1694Cb -0.02 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2hc1 h LYS 1694CO -0.07 0.71 0.13 -0.07 -0.57 0.00 0.00 179.45 179.57 2hc1 h LEU 1695N 0.45 0.72 0.00 2.94 3.38 -0.77 -3.02 115.31 119.01 2hc1 h LEU 1695Ca 0.07 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2hc1 h LEU 1695Cb 0.65 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2hc1 h LEU 1695CO 0.05 0.71 -0.32 0.00 0.09 0.00 0.00 178.44 178.96 2hc1 n GLN 1696N -4.29 0.18 -1.56 1.13 6.02 -0.74 -1.48 117.38 116.64 2hc1 n GLN 1696Ca 0.04 0.09 -0.35 0.00 -0.01 0.00 0.00 57.00 56.77 2hc1 n GLN 1696Cb 0.22 -1.66 0.08 0.00 1.02 0.00 0.00 30.24 29.90 2hc1 n GLN 1696CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hc1 s ALA 1697N -3.09 2.22 -1.22 -1.58 0.00 -0.83 -1.23 121.76 116.03 2hc1 s ALA 1697Ca 0.10 0.93 -0.04 0.00 0.00 0.00 0.00 51.96 52.94 2hc1 s ALA 1697Cb 0.15 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.78 2hc1 s ALA 1697CO 0.65 -1.73 0.79 -0.25 0.00 0.00 0.00 175.76 175.22 2hc1 n ASP 1698N -2.46 -2.86 -3.71 0.00 8.00 -1.26 -2.15 116.55 112.10 2hc1 n ASP 1698Ca 0.14 -0.81 -0.27 0.00 0.71 0.00 0.00 54.79 54.56 2hc1 n ASP 1698Cb 0.50 -4.29 0.03 0.00 -0.02 0.00 0.00 41.12 37.34 2hc1 n ASP 1698CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2hc1 n SER 1699N -3.03 -3.54 -2.67 -2.24 7.64 -1.23 -2.54 113.62 106.01 2hc1 n SER 1699Ca -0.23 -0.96 -0.21 0.00 1.01 0.00 0.00 58.87 58.48 2hc1 n SER 1699Cb 0.65 -3.56 0.02 0.00 -1.01 0.00 0.00 64.21 60.31 2hc1 n SER 1699CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2hc1 n ASN 1700N -2.85 -5.92 0.06 6.43 5.03 -0.36 -4.89 115.26 112.75 2hc1 n ASN 1700Ca -0.18 -0.17 -0.11 0.00 0.87 0.00 0.00 54.58 54.99 2hc1 n ASN 1700Cb 0.63 -4.82 -0.05 0.00 -1.02 0.00 0.00 39.78 34.52 2hc1 n ASN 1700CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 2hc1 h TYR 1701N -0.80 -0.50 0.09 3.10 3.20 -1.14 0.34 116.97 121.26 2hc1 h TYR 1701Ca -0.50 0.02 -0.26 0.00 3.14 0.00 0.00 58.73 61.13 2hc1 h TYR 1701Cb 1.36 0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.85 2hc1 h TYR 1701CO 0.52 -0.27 -1.15 -0.07 -1.64 0.00 0.00 178.16 175.55 2hc1 h LEU 1702N -0.31 0.44 -0.37 2.82 3.38 -1.77 -2.53 115.31 116.97 2hc1 h LEU 1702Ca 0.06 -0.44 0.05 0.00 0.09 0.00 0.00 57.88 57.63 2hc1 h LEU 1702Cb 0.38 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 2hc1 h LEU 1702CO -0.18 1.31 0.12 0.25 0.09 0.00 0.00 178.44 180.03 2hc1 h LEU 1703N 0.11 0.12 -0.39 1.67 6.46 -1.05 -0.45 115.31 121.79 2hc1 h LEU 1703Ca -0.12 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.67 2hc1 h LEU 1703Cb 1.85 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 41.79 2hc1 h LEU 1703CO 0.19 0.11 0.19 0.28 -0.62 0.00 0.00 178.44 178.58 2hc1 h SER 1704N 0.27 0.51 -0.73 1.25 0.02 -0.93 -0.04 113.55 113.92 2hc1 h SER 1704Ca 0.17 -0.13 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 2hc1 h SER 1704Cb 0.16 -0.13 -0.06 0.00 0.14 0.00 0.00 62.40 62.51 2hc1 h SER 1704CO -0.18 0.49 0.41 0.50 -1.14 0.00 0.00 176.83 176.92 2hc1 h LYS 1705N 0.49 0.73 -0.15 3.45 3.64 -1.21 -0.29 116.57 123.23 2hc1 h LYS 1705Ca 0.13 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2hc1 h LYS 1705Cb 0.12 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2hc1 h LYS 1705CO -0.02 0.48 0.01 1.49 -2.27 0.00 0.00 179.45 179.14 2hc1 h GLU 1706N 0.75 0.25 -0.71 1.90 4.81 -0.72 -2.80 114.58 118.07 2hc1 h GLU 1706Ca 0.33 -0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.56 2hc1 h GLU 1706Cb 0.22 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.51 2hc1 h GLU 1706CO -0.19 0.46 0.38 -0.92 -0.73 0.00 0.00 179.01 178.00 2hc1 h TYR 1707N 0.01 0.69 -0.35 0.92 3.20 -0.74 -1.62 116.97 119.08 2hc1 h TYR 1707Ca 0.04 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.98 2hc1 h TYR 1707Cb 0.34 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 2hc1 h TYR 1707CO 0.03 0.29 0.24 1.49 -1.64 0.00 0.00 178.16 178.56 2hc1 h GLU 1708N 0.67 0.30 0.00 1.82 4.22 -0.96 -1.63 114.58 119.00 2hc1 h GLU 1708Ca 0.34 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.74 2hc1 h GLU 1708Cb 0.29 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2hc1 h GLU 1708CO -0.23 0.20 -0.09 0.93 -2.18 0.00 0.00 179.01 177.63 2hc1 h GLU 1709N 0.30 0.00 0.00 1.92 5.08 -1.02 -1.74 114.58 119.12 2hc1 h GLU 1709Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2hc1 h GLU 1709Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2hc1 h GLU 1709CO -0.03 0.09 0.00 1.28 -1.00 0.00 0.00 179.01 179.35 2hc1 n LEU 1710N -3.43 0.00 -0.26 1.33 4.77 -0.61 -4.56 117.00 114.24 2hc1 n LEU 1710Ca -0.01 0.28 -0.03 0.00 -0.03 0.00 0.00 56.01 56.22 2hc1 n LEU 1710Cb 0.25 -0.28 0.09 0.00 -2.33 0.00 0.00 43.42 41.15 2hc1 n LEU 1710CO 0.29 -0.01 1.15 0.50 -1.33 0.00 0.00 177.39 177.99 2hc1 h LYS 1711N 0.00 0.86 -0.17 3.23 3.64 -1.42 -2.26 116.57 120.45 2hc1 h LYS 1711Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2hc1 h LYS 1711Cb 0.27 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2hc1 h LYS 1711CO 0.00 0.57 0.00 -0.25 -2.27 0.00 0.00 179.45 177.50 2hc1 n ASP 1712N -4.65 2.34 -4.71 4.20 8.00 -1.26 -4.90 116.55 115.57 2hc1 n ASP 1712Ca 0.08 -1.79 -0.42 0.00 0.71 0.00 0.00 54.79 53.37 2hc1 n ASP 1712Cb 0.10 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 2hc1 n ASP 1712CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2hc1 s VAL 1713N -1.80 2.50 0.00 2.53 1.01 -0.85 -1.51 120.40 122.28 2hc1 s VAL 1713Ca 0.34 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2hc1 s VAL 1713Cb 0.20 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2hc1 s VAL 1713CO 0.30 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.02 2hc1 n GLY 1714N 3.92 2.77 0.03 4.51 0.00 -1.26 -4.58 105.19 110.58 2hc1 n GLY 1714Ca 0.15 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.33 2hc1 n GLY 1714CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hc1 n ARG 1715N -2.00 0.93 0.00 1.61 5.12 -0.57 -2.45 116.66 119.30 2hc1 n ARG 1715Ca 0.00 -0.06 0.13 0.00 -1.93 0.00 0.00 57.85 55.98 2hc1 n ARG 1715Cb 0.00 -1.50 0.59 0.00 -1.16 0.00 0.00 32.46 30.39 2hc1 n ARG 1715CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2hc1 n ASN 1716N -0.98 0.00 -4.85 0.55 6.94 -1.26 -4.91 115.26 110.75 2hc1 n ASN 1716Ca 0.22 0.25 -0.36 0.00 -0.02 0.00 0.00 54.58 54.67 2hc1 n ASN 1716Cb 0.15 -0.41 -0.06 0.00 -2.36 0.00 0.00 39.78 37.10 2hc1 n ASN 1716CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2hc1 s GLN 1717N -2.82 3.92 0.35 -3.83 -0.21 -1.03 -5.08 119.66 110.96 2hc1 s GLN 1717Ca 0.18 0.40 -0.05 0.00 0.02 0.00 0.00 55.36 55.90 2hc1 s GLN 1717Cb 0.17 -3.05 -0.05 0.00 1.00 0.00 0.00 33.01 31.08 2hc1 s GLN 1717CO 0.44 0.57 0.63 -1.12 -2.12 0.00 0.00 175.29 173.68 2hc1 s SER 1718N -1.52 6.41 -0.38 5.90 0.01 -1.26 -4.97 113.70 117.89 2hc1 s SER 1718Ca 0.32 0.78 0.08 0.00 1.31 0.00 0.00 55.95 58.44 2hc1 s SER 1718Cb -0.15 -2.17 0.44 0.00 0.21 0.00 0.00 66.02 64.34 2hc1 s SER 1718CO 0.17 -0.31 1.11 0.00 0.41 0.00 0.00 173.24 174.63 2hc1 h ASP 1720N 2.52 0.94 -0.21 0.00 3.32 -1.95 -2.50 116.42 118.54 2hc1 h ASP 1720Ca 0.26 -0.11 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 2hc1 h ASP 1720Cb 1.12 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.42 2hc1 h ASP 1720CO 0.76 0.81 -0.33 0.40 -1.72 0.00 0.00 179.24 179.16 2hc1 h ILE 1721N 1.03 1.33 -0.07 0.35 2.04 -1.92 -2.71 117.51 117.56 2hc1 h ILE 1721Ca 0.25 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.59 2hc1 h ILE 1721Cb 0.13 1.80 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2hc1 h ILE 1721CO -0.03 0.48 0.07 0.00 0.00 0.00 0.00 178.15 178.67 2hc1 h ALA 1722N 0.62 1.73 -0.00 1.87 0.00 -1.79 -1.72 119.26 119.97 2hc1 h ALA 1722Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2hc1 h ALA 1722Cb 0.92 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2hc1 h ALA 1722CO 0.08 -0.11 -0.23 1.28 0.00 0.00 0.00 179.25 180.27 2hc1 n LEU 1723N -3.99 0.57 -4.53 0.00 4.77 -0.96 -4.60 117.00 108.26 2hc1 n LEU 1723Ca -0.01 -0.01 -0.39 0.00 -0.03 0.00 0.00 56.01 55.57 2hc1 n LEU 1723Cb 0.17 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 40.98 2hc1 n LEU 1723CO 0.29 0.11 2.04 0.18 -1.33 0.00 0.00 177.39 178.68 2hc1 n LEU 1724N -1.06 1.88 0.19 2.23 4.77 -0.65 -4.70 117.00 119.66 2hc1 n LEU 1724Ca 0.11 -0.20 0.07 0.00 -0.03 0.00 0.00 56.01 55.97 2hc1 n LEU 1724Cb 0.32 -1.39 0.12 0.00 -2.33 0.00 0.00 43.42 40.13 2hc1 n LEU 1724CO 0.27 -1.22 1.07 -0.65 -1.33 0.00 0.00 177.39 175.53 2hc1 h PRO 1725N 16.70 0.00 0.00 3.23 0.11 -1.90 2.43 132.00 152.58 2hc1 h PRO 1725Ca -0.21 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.85 2hc1 h PRO 1725Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 2hc1 h PRO 1725CO 1.18 0.00 -0.44 1.05 -0.21 0.00 0.00 178.00 179.59 2hc1 h GLU 1726N 0.00 0.00 0.00 1.05 4.11 -1.94 -2.36 114.58 115.44 2hc1 h GLU 1726Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.56 2hc1 h GLU 1726Cb 2.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.48 2hc1 h GLU 1726CO -0.00 0.19 0.00 0.09 0.07 0.00 0.00 179.01 179.36 2hc1 n ASN 1727N -3.06 0.00 -0.37 3.06 3.02 0.82 -4.32 115.26 114.40 2hc1 n ASN 1727Ca 0.02 -0.45 0.02 0.00 -0.03 0.00 0.00 54.58 54.13 2hc1 n ASN 1727Cb 0.63 -0.16 0.16 0.00 -0.61 0.00 0.00 39.78 39.80 2hc1 n ASN 1727CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2hc1 h ARG 1728N 0.00 1.19 0.00 3.52 3.08 -1.52 -0.34 114.38 120.31 2hc1 h ARG 1728Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2hc1 h ARG 1728Cb 0.15 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.93 2hc1 h ARG 1728CO 0.00 0.79 0.00 0.78 -1.07 0.00 0.00 179.97 180.47 2hc1 h GLY 1729N 1.23 0.00 0.15 0.04 0.00 -1.81 -2.40 103.07 100.28 2hc1 h GLY 1729Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2hc1 h GLY 1729CO -0.15 0.00 -0.20 0.28 0.00 0.00 0.00 176.54 176.47 2hc1 n LYS 1730N -2.75 0.98 -3.90 4.80 5.02 -0.14 -4.78 118.16 117.38 2hc1 n LYS 1730Ca 0.01 -0.56 -0.36 0.00 -2.02 0.00 0.00 58.31 55.38 2hc1 n LYS 1730Cb 0.25 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.65 2hc1 n LYS 1730CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2hc1 s ASN 1731N -2.41 5.24 0.15 4.39 0.01 -0.90 -4.52 114.94 116.90 2hc1 s ASN 1731Ca 0.27 -0.12 -0.14 0.00 -0.71 0.00 0.00 52.86 52.16 2hc1 s ASN 1731Cb 0.20 -1.92 0.04 0.00 0.41 0.00 0.00 41.25 39.97 2hc1 s ASN 1731CO 0.48 0.05 1.71 -0.09 -1.51 0.00 0.00 177.10 177.74 2hc1 h ARG 1732N 7.64 0.74 -4.84 -0.60 2.43 -1.86 -3.40 114.38 114.49 2hc1 h ARG 1732Ca -0.37 -0.13 -0.62 0.00 -0.81 0.00 0.00 59.98 58.05 2hc1 h ARG 1732Cb 1.18 -0.12 -0.35 0.00 -0.42 0.00 0.00 29.97 30.26 2hc1 h ARG 1732CO 0.61 0.66 -0.84 0.71 -1.51 0.00 0.00 179.97 179.60 2hc1 s TYR 1733N -5.57 2.23 0.18 2.20 2.02 -1.26 -5.02 117.35 112.14 2hc1 s TYR 1733Ca -0.13 -1.15 0.35 0.00 -0.37 0.00 0.00 57.07 55.77 2hc1 s TYR 1733Cb 0.11 -1.59 1.56 0.00 -0.40 0.00 0.00 41.96 41.64 2hc1 s TYR 1733CO 0.77 -0.58 2.05 -0.91 -1.57 0.00 0.00 175.55 175.31 2hc1 h ASN 1734N 7.61 0.00 -0.72 2.29 2.35 -1.91 -2.08 115.58 123.11 2hc1 h ASN 1734Ca -0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 2hc1 h ASN 1734Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2hc1 h ASN 1734CO 0.53 0.00 0.00 -0.46 -1.65 0.00 0.00 177.43 175.85 2hc1 n ASN 1735N -3.05 3.95 -3.81 5.81 6.94 -1.26 -4.77 115.26 119.06 2hc1 n ASN 1735Ca -0.00 -2.00 -0.30 0.00 -0.02 0.00 0.00 54.58 52.26 2hc1 n ASN 1735Cb 0.26 -0.48 -0.15 0.00 -2.36 0.00 0.00 39.78 37.05 2hc1 n ASN 1735CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2hc1 s ILE 1736N -1.03 1.44 0.06 1.53 1.01 -0.78 -5.10 121.20 118.32 2hc1 s ILE 1736Ca 0.49 -1.98 0.04 0.00 0.00 0.00 0.00 60.65 59.19 2hc1 s ILE 1736Cb 0.26 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.64 2hc1 s ILE 1736CO 0.33 -0.71 -0.11 -0.76 0.00 0.00 0.00 174.94 173.69 2hc1 s LEU 1737N 1.07 2.25 0.40 2.97 1.43 -1.26 -4.71 118.68 120.84 2hc1 s LEU 1737Ca 0.12 -0.56 -0.25 0.00 -1.03 0.00 0.00 54.13 52.41 2hc1 s LEU 1737Cb -0.20 -0.38 -0.09 0.00 0.03 0.00 0.00 46.19 45.56 2hc1 s LEU 1737CO -0.14 -0.12 1.12 -2.16 0.23 0.00 0.00 176.35 175.28 2hc1 s PRO 1738N -1.59 4.09 0.41 1.29 0.04 -1.26 -4.69 135.00 133.29 2hc1 s PRO 1738Ca -0.05 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.44 2hc1 s PRO 1738Cb -0.10 -2.63 -0.09 0.00 0.04 0.00 0.00 34.50 31.72 2hc1 s PRO 1738CO 0.01 -0.25 1.39 0.71 0.04 0.00 0.00 177.00 178.91 2hc1 s TYR 1739N -1.50 2.65 0.28 0.56 2.02 -1.26 -4.55 117.35 115.54 2hc1 s TYR 1739Ca 0.57 1.30 0.01 0.00 -0.37 0.00 0.00 57.07 58.58 2hc1 s TYR 1739Cb -0.27 -3.84 0.56 0.00 -0.40 0.00 0.00 41.96 38.01 2hc1 s TYR 1739CO 0.34 -2.59 1.80 -0.44 -1.57 0.00 0.00 175.55 173.09 2hc1 h ASP 1740N 2.66 0.75 0.75 2.29 3.32 -1.35 -2.49 116.42 122.34 2hc1 h ASP 1740Ca -0.50 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.60 2hc1 h ASP 1740Cb 1.25 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.73 2hc1 h ASP 1740CO 0.62 0.35 -0.09 0.00 -1.72 0.00 0.00 179.24 178.40 2hc1 h ALA 1741N 1.56 1.07 0.00 3.45 0.00 -1.91 -3.21 119.26 120.21 2hc1 h ALA 1741Ca 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2hc1 h ALA 1741Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2hc1 h ALA 1741CO -0.32 0.12 -0.01 0.25 0.00 0.00 0.00 179.25 179.29 2hc1 n THR 1742N -3.30 0.74 -2.26 0.00 -2.24 -1.04 -5.07 114.28 101.11 2hc1 n THR 1742Ca -0.00 -0.76 -0.34 0.00 -2.27 0.00 0.00 64.05 60.67 2hc1 n THR 1742Cb 0.30 0.60 -0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2hc1 n THR 1742CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hc1 s ARG 1743N -0.80 3.44 0.03 -0.78 1.70 -0.97 -0.78 118.95 120.79 2hc1 s ARG 1743Ca 0.02 1.42 -0.21 0.00 -0.47 0.00 0.00 55.73 56.50 2hc1 s ARG 1743Cb 0.02 -2.03 -0.06 0.00 -0.57 0.00 0.00 34.95 32.30 2hc1 s ARG 1743CO 0.00 -0.74 0.60 0.08 -1.08 0.00 0.00 175.30 174.16 2hc1 s VAL 1744N -2.04 4.82 -0.11 4.99 1.01 -0.55 -4.77 120.40 123.76 2hc1 s VAL 1744Ca 0.68 1.27 -0.00 0.00 0.00 0.00 0.00 61.98 63.93 2hc1 s VAL 1744Cb -0.19 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2hc1 s VAL 1744CO 0.28 0.47 -0.08 -0.54 0.00 0.00 0.00 175.10 175.23 2hc1 s LYS 1745N -0.55 3.15 0.33 2.72 1.02 -1.26 -4.15 119.74 121.00 2hc1 s LYS 1745Ca 0.31 -0.59 -0.23 0.00 0.02 0.00 0.00 55.97 55.48 2hc1 s LYS 1745Cb -0.19 -2.67 -0.10 0.00 -0.52 0.00 0.00 37.83 34.35 2hc1 s LYS 1745CO 0.18 0.43 0.89 -0.51 -0.92 0.00 0.00 175.35 175.42 2hc1 s LEU 1746N -0.18 4.23 0.77 3.17 1.43 0.15 -5.04 118.68 123.21 2hc1 s LEU 1746Ca 0.02 1.69 -0.13 0.00 -1.03 0.00 0.00 54.13 54.67 2hc1 s LEU 1746Cb -0.13 -4.05 0.06 0.00 0.03 0.00 0.00 46.19 42.10 2hc1 s LEU 1746CO 0.03 -0.12 1.16 -0.94 0.23 0.00 0.00 176.35 176.70 2hc1 s SER 1747N -1.79 4.08 0.00 2.29 1.04 -1.26 -4.29 113.70 113.77 2hc1 s SER 1747Ca 0.52 2.17 0.00 0.00 0.48 0.00 0.00 55.95 59.12 2hc1 s SER 1747Cb -0.16 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.40 2hc1 s SER 1747CO 0.20 -2.33 0.00 0.61 0.98 0.00 0.00 173.24 172.71 2hc1 n GLY 1748N -0.05 -1.83 0.09 7.32 0.00 -1.26 -4.64 105.19 104.82 2hc1 n GLY 1748Ca 0.12 -1.95 0.12 0.00 0.00 0.00 0.00 46.02 44.31 2hc1 n GLY 1748CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2hc1 h GLY 1749N 0.00 0.00 -7.21 -0.02 0.00 -2.07 -3.38 103.07 90.40 2hc1 h GLY 1749Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.70 2hc1 h GLY 1749CO 0.00 0.00 -0.69 -0.45 0.00 0.00 0.00 176.54 175.40 2hc1 s SER 1755N -4.51 4.02 0.00 0.19 0.15 -1.26 -5.00 113.70 107.29 2hc1 s SER 1755Ca 0.07 -2.72 0.29 0.00 0.70 0.00 0.00 55.95 54.30 2hc1 s SER 1755Cb 0.12 -1.32 1.29 0.00 -1.71 0.00 0.00 66.02 64.40 2hc1 s SER 1755CO 0.68 -0.27 1.88 -0.90 1.20 0.00 0.00 173.24 175.83 2hc1 n ASP 1756N 3.46 1.01 -4.71 5.45 5.68 -1.26 -4.77 116.55 121.41 2hc1 n ASP 1756Ca 0.06 -1.29 -0.41 0.00 -0.50 0.00 0.00 54.79 52.65 2hc1 n ASP 1756Cb 0.34 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.29 2hc1 n ASP 1756CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2hc1 s TYR 1757N -2.04 3.63 0.00 2.11 5.04 -1.26 -0.67 117.35 124.15 2hc1 s TYR 1757Ca 0.40 1.51 -0.03 0.00 -2.44 0.00 0.00 57.07 56.51 2hc1 s TYR 1757Cb 0.21 -2.98 -0.01 0.00 0.35 0.00 0.00 41.96 39.53 2hc1 s TYR 1757CO 0.36 0.04 0.05 -1.50 -1.34 0.00 0.00 175.55 173.15 2hc1 s ILE 1758N 0.90 0.07 -1.04 3.14 2.07 -1.26 -4.88 121.20 120.19 2hc1 s ILE 1758Ca 0.46 -0.54 -0.23 0.00 -1.41 0.00 0.00 60.65 58.93 2hc1 s ILE 1758Cb -0.20 -0.25 0.04 0.00 0.13 0.00 0.00 42.46 42.18 2hc1 s ILE 1758CO 0.24 -0.30 1.55 0.21 -1.91 0.00 0.00 174.94 174.73 2hc1 s ASN 1759N -0.93 6.33 -0.13 4.50 3.84 -1.26 -4.65 114.94 122.65 2hc1 s ASN 1759Ca -0.10 -1.46 -0.29 0.00 0.21 0.00 0.00 52.86 51.22 2hc1 s ASN 1759Cb -0.06 -2.57 0.08 0.00 -0.55 0.00 0.00 41.25 38.15 2hc1 s ASN 1759CO 0.00 -1.66 0.77 0.00 -2.79 0.00 0.00 177.10 173.42 2hc1 s ALA 1760N 5.66 -1.82 -0.00 1.71 0.00 -1.26 -2.95 121.76 123.10 2hc1 s ALA 1760Ca 0.50 1.54 0.02 0.00 0.00 0.00 0.00 51.96 54.03 2hc1 s ALA 1760Cb -0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 2hc1 s ALA 1760CO -0.07 -0.34 -0.08 -1.12 0.00 0.00 0.00 175.76 174.15 2hc1 s SER 1761N -0.78 0.90 0.22 0.00 0.01 0.55 -1.48 113.70 113.13 2hc1 s SER 1761Ca -0.06 -0.18 -0.22 0.00 1.31 0.00 0.00 55.95 56.80 2hc1 s SER 1761Cb -0.01 -0.09 -0.08 0.00 0.21 0.00 0.00 66.02 66.04 2hc1 s SER 1761CO 0.06 0.07 0.77 -0.31 0.41 0.00 0.00 173.24 174.24 2hc1 s TYR 1762N -0.28 3.74 -0.16 2.43 2.02 0.04 -0.64 117.35 124.50 2hc1 s TYR 1762Ca 0.02 1.53 0.01 0.00 -0.37 0.00 0.00 57.07 58.25 2hc1 s TYR 1762Cb -0.04 -2.71 0.02 0.00 -0.40 0.00 0.00 41.96 38.83 2hc1 s TYR 1762CO -0.00 0.37 -0.16 0.42 -1.57 0.00 0.00 175.55 174.61 2hc1 s ILE 1763N -1.42 1.74 0.57 2.71 -1.09 -0.05 -4.91 121.20 118.76 2hc1 s ILE 1763Ca 0.42 -0.74 -0.17 0.00 -2.23 0.00 0.00 60.65 57.93 2hc1 s ILE 1763Cb -0.19 -1.60 -0.05 0.00 -1.58 0.00 0.00 42.46 39.04 2hc1 s ILE 1763CO 0.23 0.49 1.06 -2.16 -1.23 0.00 0.00 174.94 173.33 2hc1 s PRO 1764N 1.38 3.39 0.66 2.79 0.04 -1.26 -1.04 135.00 140.97 2hc1 s PRO 1764Ca 0.04 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.35 2hc1 s PRO 1764Cb -0.13 -2.04 0.10 0.00 0.04 0.00 0.00 34.50 32.47 2hc1 s PRO 1764CO -0.11 -0.76 0.92 0.20 0.04 0.00 0.00 177.00 177.30 2hc1 s GLY 1765N -2.56 1.78 0.46 0.56 0.00 0.27 -4.65 107.32 103.17 2hc1 s GLY 1765Ca 0.65 -1.62 0.20 0.00 0.00 0.00 0.00 44.72 43.95 2hc1 s GLY 1765CO 0.33 -1.14 1.98 3.43 0.00 0.00 0.00 173.10 177.70 2hc1 h ASN 1766N -0.32 0.00 0.00 1.64 2.35 -1.98 -3.31 115.58 113.96 2hc1 h ASN 1766Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 2hc1 h ASN 1766Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 2hc1 h ASN 1766CO 0.44 0.20 -0.41 0.59 -1.65 0.00 0.00 177.43 176.60 2hc1 n ASN 1767N -3.95 1.11 -3.51 5.81 3.02 -1.26 -5.06 115.26 111.42 2hc1 n ASN 1767Ca -0.02 -0.45 -0.10 0.00 -0.03 0.00 0.00 54.58 53.99 2hc1 n ASN 1767Cb 0.29 1.04 -0.03 0.00 -0.61 0.00 0.00 39.78 40.47 2hc1 n ASN 1767CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2hc1 s PHE 1768N -1.57 -0.38 0.97 3.10 5.36 -1.25 -5.17 117.98 119.05 2hc1 s PHE 1768Ca 0.01 0.34 -0.11 0.00 -0.96 0.00 0.00 56.93 56.20 2hc1 s PHE 1768Cb 0.03 0.52 0.18 0.00 -0.34 0.00 0.00 43.02 43.40 2hc1 s PHE 1768CO 0.16 -0.53 1.09 -0.98 -1.46 0.00 0.00 175.22 173.49 2hc1 s ARG 1769N -2.72 0.60 -1.26 10.12 1.70 -1.26 -0.57 118.95 125.56 2hc1 s ARG 1769Ca 0.03 1.05 -0.01 0.00 -0.47 0.00 0.00 55.73 56.32 2hc1 s ARG 1769Cb -0.01 -1.72 0.00 0.00 -0.57 0.00 0.00 34.95 32.66 2hc1 s ARG 1769CO -0.06 -2.76 0.89 0.54 -1.08 0.00 0.00 175.30 172.83 2hc1 n ARG 1770N -4.27 -6.00 -0.12 3.89 1.74 -1.24 -4.52 116.66 106.14 2hc1 n ARG 1770Ca 0.07 0.75 -0.12 0.00 -0.77 0.00 0.00 57.85 57.78 2hc1 n ARG 1770Cb 0.54 -5.59 -0.03 0.00 -1.02 0.00 0.00 32.46 26.36 2hc1 n ARG 1770CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2hc1 h GLU 1771N -1.94 0.77 -5.55 5.56 4.81 -1.28 -3.34 114.58 113.61 2hc1 h GLU 1771Ca -0.60 -0.36 -0.44 0.00 -0.13 0.00 0.00 59.36 57.83 2hc1 h GLU 1771Cb 1.35 -0.01 -0.19 0.00 0.63 0.00 0.00 28.75 30.53 2hc1 h GLU 1771CO 0.53 0.98 -0.77 0.71 -0.73 0.00 0.00 179.01 179.73 2hc1 s TYR 1772N -4.54 1.47 -0.16 0.92 2.02 -0.90 -1.43 117.35 114.72 2hc1 s TYR 1772Ca -0.12 -0.52 0.01 0.00 -0.37 0.00 0.00 57.07 56.07 2hc1 s TYR 1772Cb 0.10 -0.77 0.01 0.00 -0.40 0.00 0.00 41.96 40.89 2hc1 s TYR 1772CO 0.83 0.16 -0.18 0.42 -1.57 0.00 0.00 175.55 175.22 2hc1 s ILE 1773N -1.92 2.37 -0.17 2.71 1.01 -0.10 -0.87 121.20 124.23 2hc1 s ILE 1773Ca 0.08 -0.86 -0.09 0.00 0.00 0.00 0.00 60.65 59.78 2hc1 s ILE 1773Cb -0.06 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 2hc1 s ILE 1773CO 0.03 0.53 0.13 -0.69 0.00 0.00 0.00 174.94 174.94 2hc1 s VAL 1774N 0.98 5.43 0.19 2.92 1.01 0.19 -0.90 120.40 130.22 2hc1 s VAL 1774Ca -0.03 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.10 2hc1 s VAL 1774Cb -0.15 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2hc1 s VAL 1774CO -0.04 0.51 0.20 0.28 0.00 0.00 0.00 175.10 176.05 2hc1 s THR 1775N -0.18 0.04 0.78 3.92 -1.32 -0.92 -0.33 115.64 117.63 2hc1 s THR 1775Ca 0.11 -1.77 -0.12 0.00 -1.21 0.00 0.00 61.69 58.70 2hc1 s THR 1775Cb -0.11 -2.23 0.06 0.00 -1.51 0.00 0.00 72.50 68.71 2hc1 s THR 1775CO 0.00 -0.16 1.13 0.00 -2.21 0.00 0.00 174.62 173.38 2hc1 s GLN 1776N -4.08 2.23 -0.03 7.08 -2.07 -1.15 -3.35 119.66 118.29 2hc1 s GLN 1776Ca 0.29 0.36 -0.30 0.00 -1.82 0.00 0.00 55.36 53.89 2hc1 s GLN 1776Cb 0.05 -1.96 -0.06 0.00 -1.09 0.00 0.00 33.01 29.95 2hc1 s GLN 1776CO 0.07 -1.46 1.67 0.20 -1.32 0.00 0.00 175.29 174.46 2hc1 s GLY 1777N -4.31 1.54 0.39 2.60 0.00 0.42 -4.87 107.32 103.09 2hc1 s GLY 1777Ca 0.61 1.01 -0.25 0.00 0.00 0.00 0.00 44.72 46.08 2hc1 s GLY 1777CO 0.51 3.04 1.09 -1.05 0.00 0.00 0.00 173.10 176.70 2hc1 n PRO 1778N 6.91 1.55 -3.13 2.90 -0.02 -1.26 -4.70 135.00 137.25 2hc1 n PRO 1778Ca 0.17 0.55 -0.25 0.00 -2.02 0.00 0.00 63.50 61.95 2hc1 n PRO 1778Cb 0.42 -2.11 -0.01 0.00 -0.02 0.00 0.00 33.50 31.78 2hc1 n PRO 1778CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2hc1 s LEU 1779N -0.67 3.88 0.36 2.45 1.43 -1.26 -1.57 118.68 123.29 2hc1 s LEU 1779Ca 0.61 0.60 0.12 0.00 -1.03 0.00 0.00 54.13 54.43 2hc1 s LEU 1779Cb -0.57 -3.49 0.93 0.00 0.03 0.00 0.00 46.19 43.09 2hc1 s LEU 1779CO 0.58 -0.40 1.79 -0.65 0.23 0.00 0.00 176.35 177.90 2hc1 h PRO 1780N 0.57 0.55 -0.01 1.29 0.11 -1.97 -0.21 132.00 132.34 2hc1 h PRO 1780Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2hc1 h PRO 1780Cb 1.22 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2hc1 h PRO 1780CO 0.61 0.37 -0.06 0.41 -0.21 0.00 0.00 178.00 179.12 2hc1 n GLY 1781N -1.41 -0.47 0.00 -0.55 0.00 -1.26 -3.77 105.19 97.73 2hc1 n GLY 1781Ca 0.23 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2hc1 n GLY 1781CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hc1 n THR 1782N -0.40 0.46 -0.19 2.61 -2.24 -0.21 -4.78 114.28 109.53 2hc1 n THR 1782Ca 0.18 -0.71 -0.03 0.00 -2.27 0.00 0.00 64.05 61.22 2hc1 n THR 1782Cb 0.29 0.79 0.16 0.00 -2.10 0.00 0.00 70.33 69.47 2hc1 n THR 1782CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2hc1 h LYS 1783N 0.00 0.97 -0.61 -0.78 2.10 -1.33 -0.18 116.57 116.73 2hc1 h LYS 1783Ca 0.00 -0.18 -0.03 0.00 -2.00 0.00 0.00 60.65 58.45 2hc1 h LYS 1783Cb 0.26 -0.16 -0.03 0.00 -0.90 0.00 0.00 32.23 31.40 2hc1 h LYS 1783CO 0.00 0.81 0.27 -0.44 -2.00 0.00 0.00 179.45 178.09 2hc1 h ASP 1784N 0.94 0.83 -0.65 7.07 3.32 -1.86 -2.00 116.42 124.07 2hc1 h ASP 1784Ca 0.22 -0.15 0.06 0.00 0.02 0.00 0.00 57.03 57.17 2hc1 h ASP 1784Cb 0.23 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.51 2hc1 h ASP 1784CO -0.01 0.75 0.35 0.44 -1.72 0.00 0.00 179.24 179.05 2hc1 h ASP 1785N 0.85 0.52 -0.15 6.45 3.32 -1.69 -0.81 116.42 124.90 2hc1 h ASP 1785Ca 0.21 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.31 2hc1 h ASP 1785Cb 0.16 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2hc1 h ASP 1785CO -0.02 0.34 0.01 0.15 -1.72 0.00 0.00 179.24 178.00 2hc1 h PHE 1786N 0.66 0.02 -0.09 4.55 3.57 -0.76 -0.45 116.94 124.43 2hc1 h PHE 1786Ca 0.29 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.68 2hc1 h PHE 1786Cb 0.19 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2hc1 h PHE 1786CO -0.08 -0.00 -0.51 -1.49 -2.23 0.00 0.00 178.31 174.00 2hc1 h TRP 1787N 0.07 0.31 -0.39 0.41 4.06 -1.18 -0.98 115.95 118.24 2hc1 h TRP 1787Ca 0.07 -0.10 0.02 0.00 2.06 0.00 0.00 58.89 60.94 2hc1 h TRP 1787Cb 0.07 -0.06 -0.03 0.00 -1.00 0.00 0.00 29.16 28.14 2hc1 h TRP 1787CO -0.14 0.71 0.21 -0.22 -3.56 0.00 0.00 178.44 175.43 2hc1 h LYS 1788N 0.20 0.41 -0.31 0.49 3.64 -0.87 -0.42 116.57 119.70 2hc1 h LYS 1788Ca 0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2hc1 h LYS 1788Cb 0.96 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 2hc1 h LYS 1788CO 0.08 0.27 0.20 1.98 -2.27 0.00 0.00 179.45 179.72 2hc1 h MET 1789N 0.42 0.41 -0.45 1.90 4.05 -0.57 0.50 114.93 121.19 2hc1 h MET 1789Ca 0.16 -0.02 0.09 0.00 -0.28 0.00 0.00 59.70 59.64 2hc1 h MET 1789Cb 0.05 -0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 30.68 2hc1 h MET 1789CO -0.10 0.27 0.01 0.28 0.23 0.00 0.00 176.91 177.60 2hc1 h VAL 1790N 0.42 0.66 0.18 -5.77 2.07 -0.94 0.12 116.25 112.98 2hc1 h VAL 1790Ca 0.11 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 2hc1 h VAL 1790Cb -0.04 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2hc1 h VAL 1790CO -0.03 0.02 -0.08 -0.25 0.02 0.00 0.00 177.57 177.25 2hc1 h TRP 1791N 0.12 -0.22 0.00 1.57 2.91 -0.69 -2.05 115.95 117.59 2hc1 h TRP 1791Ca 0.23 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.17 2hc1 h TRP 1791Cb 0.33 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.04 2hc1 h TRP 1791CO -0.29 0.01 -0.36 0.93 -1.03 0.00 0.00 178.44 177.70 2hc1 h GLU 1792N -0.43 0.00 -0.23 2.65 5.08 -0.68 -2.82 114.58 118.16 2hc1 h GLU 1792Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2hc1 h GLU 1792Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2hc1 h GLU 1792CO 0.04 0.36 0.00 1.04 -1.00 0.00 0.00 179.01 179.45 2hc1 n GLN 1793N -3.85 2.07 -1.99 2.33 1.13 0.01 -4.94 117.38 112.13 2hc1 n GLN 1793Ca -0.01 -1.60 -0.13 0.00 -1.94 0.00 0.00 57.00 53.32 2hc1 n GLN 1793Cb 0.43 -1.45 -0.02 0.00 0.11 0.00 0.00 30.24 29.31 2hc1 n GLN 1793CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2hc1 n ASN 1794N 0.83 -4.12 -4.74 1.08 3.02 -1.06 -4.27 115.26 106.00 2hc1 n ASN 1794Ca 0.17 0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 54.39 2hc1 n ASN 1794Cb 0.46 -3.15 -0.03 0.00 -0.61 0.00 0.00 39.78 36.44 2hc1 n ASN 1794CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2hc1 s VAL 1795N -2.58 3.23 -0.21 2.41 1.01 -0.79 -3.72 120.40 119.76 2hc1 s VAL 1795Ca 0.00 1.01 0.06 0.00 0.00 0.00 0.00 61.98 63.05 2hc1 s VAL 1795Cb 0.00 -3.64 -0.08 0.00 0.00 0.00 0.00 36.38 32.66 2hc1 s VAL 1795CO 0.00 0.15 0.22 1.41 0.00 0.00 0.00 175.10 176.88 2hc1 n HIS 1796N 2.70 0.00 -3.86 5.22 8.25 -0.52 -4.84 115.22 122.16 2hc1 n HIS 1796Ca 0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.38 2hc1 n HIS 1796Cb 0.43 -0.04 -0.15 0.00 1.12 0.00 0.00 29.99 31.34 2hc1 n HIS 1796CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2hc1 s ASN 1797N -1.93 0.15 -0.06 0.41 -0.87 -1.26 -1.06 114.94 110.32 2hc1 s ASN 1797Ca 0.01 0.00 0.04 0.00 -1.57 0.00 0.00 52.86 51.34 2hc1 s ASN 1797Cb 0.04 -0.07 0.00 0.00 -0.02 0.00 0.00 41.25 41.20 2hc1 s ASN 1797CO 0.26 -0.07 -0.19 -0.63 -2.57 0.00 0.00 177.10 173.91 2hc1 s ILE 1798N 0.61 1.58 -0.18 0.60 1.01 -0.09 -1.77 121.20 122.97 2hc1 s ILE 1798Ca -0.05 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 2hc1 s ILE 1798Cb -0.08 -1.37 -0.00 0.00 0.01 0.00 0.00 42.46 41.02 2hc1 s ILE 1798CO -0.02 0.45 -0.12 -0.69 0.00 0.00 0.00 174.94 174.56 2hc1 s VAL 1799N 0.22 2.81 -0.18 2.92 1.01 0.92 -0.42 120.40 127.67 2hc1 s VAL 1799Ca -0.10 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 2hc1 s VAL 1799Cb -0.14 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.03 2hc1 s VAL 1799CO 0.04 0.49 -0.16 -0.32 0.00 0.00 0.00 175.10 175.16 2hc1 s MET 1800N 1.10 3.11 -0.32 2.72 0.00 0.03 -0.98 119.30 124.96 2hc1 s MET 1800Ca 0.00 -0.77 0.08 0.00 0.00 0.00 0.00 55.69 55.00 2hc1 s MET 1800Cb -0.14 -2.67 0.46 0.00 0.00 0.00 0.00 34.83 32.47 2hc1 s MET 1800CO -0.04 -0.17 1.17 1.33 0.00 0.00 0.00 175.02 177.32 2hc1 n VAL 1801N 4.56 2.42 -3.94 10.11 0.24 -0.08 -0.67 118.33 130.98 2hc1 n VAL 1801Ca -0.20 -4.27 -0.09 0.00 -2.04 0.00 0.00 64.34 57.74 2hc1 n VAL 1801Cb 0.50 -1.03 -0.09 0.00 -1.47 0.00 0.00 33.84 31.75 2hc1 n VAL 1801CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2hc1 s THR 1802N -4.71 0.13 0.57 3.34 -1.32 -1.26 -4.75 115.64 107.64 2hc1 s THR 1802Ca 0.49 -1.10 -0.06 0.00 -1.21 0.00 0.00 61.69 59.81 2hc1 s THR 1802Cb 0.40 -0.87 -0.00 0.00 -1.51 0.00 0.00 72.50 70.53 2hc1 s THR 1802CO -0.00 -0.61 0.88 -1.10 -2.21 0.00 0.00 174.62 171.58 2hc1 s GLN 1803N -2.55 3.07 0.25 7.08 -0.21 -1.26 -4.84 119.66 121.20 2hc1 s GLN 1803Ca -0.05 0.05 0.04 0.00 0.02 0.00 0.00 55.36 55.42 2hc1 s GLN 1803Cb -0.02 -2.29 0.31 0.00 1.00 0.00 0.00 33.01 32.01 2hc1 s GLN 1803CO -0.04 -0.59 1.61 0.00 -2.12 0.00 0.00 175.29 174.14 2hc1 s VAL 1805N -3.93 1.15 -0.04 0.00 1.01 -1.26 -0.07 120.40 117.26 2hc1 s VAL 1805Ca -0.04 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.42 2hc1 s VAL 1805Cb 0.12 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.49 2hc1 s VAL 1805CO 0.79 0.35 -0.02 -1.61 0.00 0.00 0.00 175.10 174.61 2hc1 s GLU 1806N 0.45 0.60 -1.61 2.72 2.02 -0.55 -4.85 118.70 117.47 2hc1 s GLU 1806Ca -0.10 -0.01 -0.13 0.00 0.02 0.00 0.00 54.97 54.74 2hc1 s GLU 1806Cb -0.14 -0.71 0.11 0.00 0.10 0.00 0.00 34.13 33.50 2hc1 s GLU 1806CO 0.03 -0.12 0.73 1.63 0.02 0.00 0.00 175.26 177.55 2hc1 n LYS 1807N 4.18 -3.59 -0.90 1.61 5.02 -1.26 -1.31 118.16 121.91 2hc1 n LYS 1807Ca -0.24 0.42 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 2hc1 n LYS 1807Cb 0.51 -5.03 0.00 0.00 -0.02 0.00 0.00 35.03 30.48 2hc1 n LYS 1807CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hc1 n GLY 1808N -1.59 0.75 3.37 0.72 0.00 -1.26 -5.01 105.19 102.18 2hc1 n GLY 1808Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 2hc1 n GLY 1808CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hc1 s ARG 1809N -0.10 2.77 0.07 1.61 1.81 -0.43 -5.09 118.95 119.58 2hc1 s ARG 1809Ca 0.00 -0.77 -0.31 0.00 -1.72 0.00 0.00 55.73 52.94 2hc1 s ARG 1809Cb 0.00 -2.37 -0.06 0.00 -0.45 0.00 0.00 34.95 32.06 2hc1 s ARG 1809CO 0.00 0.42 1.28 0.08 -0.68 0.00 0.00 175.30 176.40 2hc1 s VAL 1810N -0.22 3.78 -0.01 3.52 1.01 -1.26 -1.48 120.40 125.74 2hc1 s VAL 1810Ca -0.00 1.26 0.01 0.00 0.00 0.00 0.00 61.98 63.25 2hc1 s VAL 1810Cb -0.13 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 2hc1 s VAL 1810CO 0.03 0.09 0.02 0.29 0.00 0.00 0.00 175.10 175.52 2hc1 n LYS 1811N 4.11 1.75 -3.61 2.72 4.76 0.89 -4.94 118.16 123.85 2hc1 n LYS 1811Ca 0.10 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.41 2hc1 n LYS 1811Cb 0.45 -1.03 -0.07 0.00 -1.84 0.00 0.00 35.03 32.54 2hc1 n LYS 1811CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2hc1 s ASP 1813N -0.07 6.09 -1.30 0.00 -1.08 -0.61 -4.54 116.67 115.16 2hc1 s ASP 1813Ca -0.01 1.95 -0.18 0.00 -0.52 0.00 0.00 52.55 53.79 2hc1 s ASP 1813Cb -0.04 -2.56 0.04 0.00 -1.46 0.00 0.00 42.92 38.91 2hc1 s ASP 1813CO 0.01 -0.96 1.84 1.57 0.52 0.00 0.00 175.17 178.14 2hc1 n HIS 1814N -1.28 4.24 1.69 -5.34 -0.00 -1.26 -4.77 115.22 108.50 2hc1 n HIS 1814Ca 0.10 -2.69 0.13 0.00 -0.00 0.00 0.00 57.72 55.25 2hc1 n HIS 1814Cb 0.52 -2.61 0.64 0.00 -0.00 0.00 0.00 29.99 28.55 2hc1 n HIS 1814CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 2hc1 n TYR 1815N 8.66 0.04 -4.30 1.57 0.18 -1.26 -4.76 117.16 117.28 2hc1 n TYR 1815Ca 0.49 -0.02 -0.23 0.00 1.88 0.00 0.00 57.90 60.02 2hc1 n TYR 1815Cb 0.45 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.33 2hc1 n TYR 1815CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2hc1 s TRP 1816N -1.96 2.63 0.58 -3.48 -2.14 -1.26 -5.01 118.94 108.29 2hc1 s TRP 1816Ca 0.39 -0.28 -0.20 0.00 2.66 0.00 0.00 56.10 58.67 2hc1 s TRP 1816Cb 0.19 -1.25 -0.04 0.00 -3.10 0.00 0.00 33.47 29.27 2hc1 s TRP 1816CO 0.32 0.59 1.22 -2.30 -2.66 0.00 0.00 176.95 174.11 2hc1 n PRO 1817N -0.90 1.32 0.12 3.25 -0.02 -1.26 -4.93 135.00 132.58 2hc1 n PRO 1817Ca -0.06 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.05 2hc1 n PRO 1817Cb 0.60 -2.43 0.32 0.00 -0.02 0.00 0.00 33.50 31.97 2hc1 n PRO 1817CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hc1 h ALA 1818N 0.97 0.92 -2.53 3.55 0.00 -1.93 -3.48 119.26 116.76 2hc1 h ALA 1818Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2hc1 h ALA 1818Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2hc1 h ALA 1818CO 0.54 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.39 2hc1 n ASP 1819N -2.39 0.00 -0.74 0.00 5.68 -1.26 -5.06 116.55 112.77 2hc1 n ASP 1819Ca 0.05 -0.61 0.10 0.00 -0.50 0.00 0.00 54.79 53.83 2hc1 n ASP 1819Cb 0.45 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.72 2hc1 n ASP 1819CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2hc1 n GLN 1820N 0.00 1.96 -2.73 0.11 6.02 -1.26 -4.32 117.38 117.16 2hc1 n GLN 1820Ca 0.00 -1.47 -0.42 0.00 -0.01 0.00 0.00 57.00 55.11 2hc1 n GLN 1820Cb 0.00 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 29.83 2hc1 n GLN 1820CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2hc1 s ASP 1821N -1.38 7.32 0.65 1.08 1.01 -1.26 -4.52 116.67 119.56 2hc1 s ASP 1821Ca 0.32 1.60 -0.17 0.00 0.71 0.00 0.00 52.55 55.02 2hc1 s ASP 1821Cb 0.18 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.55 2hc1 s ASP 1821CO 0.25 -0.28 1.17 -0.94 0.21 0.00 0.00 175.17 175.58 2hc1 s SER 1822N 1.01 4.93 -0.08 0.27 1.04 -1.26 -4.76 113.70 114.85 2hc1 s SER 1822Ca 0.50 2.25 -0.09 0.00 0.48 0.00 0.00 55.95 59.09 2hc1 s SER 1822Cb -0.20 -2.58 0.02 0.00 0.10 0.00 0.00 66.02 63.36 2hc1 s SER 1822CO 0.26 -1.76 0.25 -0.76 0.98 0.00 0.00 173.24 172.21 2hc1 s LEU 1823N -4.57 1.04 0.34 2.42 1.43 -0.58 -5.00 118.68 113.76 2hc1 s LEU 1823Ca 0.73 0.42 -0.28 0.00 -1.03 0.00 0.00 54.13 53.97 2hc1 s LEU 1823Cb -0.27 0.91 -0.09 0.00 0.03 0.00 0.00 46.19 46.77 2hc1 s LEU 1823CO 0.38 -0.15 1.21 -0.31 0.23 0.00 0.00 176.35 177.71 2hc1 s TYR 1824N -0.13 3.17 -0.30 0.29 2.02 -1.26 -1.14 117.35 119.99 2hc1 s TYR 1824Ca -0.03 1.53 0.01 0.00 -0.37 0.00 0.00 57.07 58.22 2hc1 s TYR 1824Cb -0.03 -3.49 0.09 0.00 -0.40 0.00 0.00 41.96 38.14 2hc1 s TYR 1824CO 0.01 -1.37 0.05 0.71 -1.57 0.00 0.00 175.55 173.38 2hc1 s TYR 1825N -1.24 2.55 0.00 2.71 2.02 0.42 -4.93 117.35 118.88 2hc1 s TYR 1825Ca 0.51 -2.16 0.00 0.00 -0.37 0.00 0.00 57.07 55.05 2hc1 s TYR 1825Cb -0.35 -2.09 0.00 0.00 -0.40 0.00 0.00 41.96 39.13 2hc1 s TYR 1825CO 0.45 -0.87 0.00 0.41 -1.57 0.00 0.00 175.55 173.97 2hc1 n GLY 1826N 4.61 3.89 0.13 0.71 0.00 -1.26 -1.56 105.19 111.72 2hc1 n GLY 1826Ca -0.02 -0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.13 2hc1 n GLY 1826CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2hc1 n ASP 1827N 6.56 0.52 -4.93 1.61 8.00 -1.26 -4.90 116.55 122.15 2hc1 n ASP 1827Ca 0.00 -0.66 -0.27 0.00 0.71 0.00 0.00 54.79 54.57 2hc1 n ASP 1827Cb 0.00 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 2hc1 n ASP 1827CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2hc1 s LEU 1828N -2.42 4.29 -0.05 0.64 1.43 -0.60 -4.75 118.68 117.22 2hc1 s LEU 1828Ca 0.30 0.29 0.05 0.00 -1.03 0.00 0.00 54.13 53.75 2hc1 s LEU 1828Cb 0.20 -3.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 2hc1 s LEU 1828CO 0.46 0.02 -0.20 -0.51 0.23 0.00 0.00 176.35 176.35 2hc1 s ILE 1829N -1.78 2.55 0.00 -0.59 2.07 -0.52 -0.43 121.20 122.50 2hc1 s ILE 1829Ca 0.36 -0.90 0.06 0.00 -1.41 0.00 0.00 60.65 58.76 2hc1 s ILE 1829Cb -0.11 -1.96 -0.02 0.00 0.13 0.00 0.00 42.46 40.50 2hc1 s ILE 1829CO 0.29 0.58 -0.19 -0.22 -1.91 0.00 0.00 174.94 173.48 2hc1 s LEU 1830N -0.46 2.08 -0.07 8.50 2.96 -0.30 -1.55 118.68 129.85 2hc1 s LEU 1830Ca 0.05 -0.39 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 2hc1 s LEU 1830Cb -0.12 -0.94 0.04 0.00 0.50 0.00 0.00 46.19 45.68 2hc1 s LEU 1830CO 0.01 0.20 0.15 -1.58 -1.32 0.00 0.00 176.35 173.81 2hc1 s GLN 1831N -0.66 0.07 0.01 1.98 0.74 -0.16 -1.53 119.66 120.09 2hc1 s GLN 1831Ca 0.07 0.45 -0.30 0.00 0.05 0.00 0.00 55.36 55.63 2hc1 s GLN 1831Cb -0.08 -0.22 -0.04 0.00 1.10 0.00 0.00 33.01 33.78 2hc1 s GLN 1831CO 0.00 -0.23 1.05 1.41 -0.55 0.00 0.00 175.29 176.97 2hc1 s MET 1832N 1.66 4.51 -0.21 1.67 -2.45 -1.26 -0.32 119.30 122.90 2hc1 s MET 1832Ca -0.04 1.52 0.08 0.00 -1.25 0.00 0.00 55.69 56.01 2hc1 s MET 1832Cb -0.12 -3.44 -0.21 0.00 1.25 0.00 0.00 34.83 32.31 2hc1 s MET 1832CO -0.06 -0.14 -0.01 1.28 1.05 0.00 0.00 175.02 177.14 2hc1 n LEU 1833N 4.02 1.62 -3.66 4.11 4.77 0.49 -4.45 117.00 123.91 2hc1 n LEU 1833Ca 0.07 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 2hc1 n LEU 1833Cb 0.49 -0.29 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 2hc1 n LEU 1833CO 0.53 0.72 0.14 -0.94 -1.33 0.00 0.00 177.39 176.51 2hc1 s SER 1834N -6.12 -0.23 -0.22 -1.43 1.04 -1.15 -4.97 113.70 100.62 2hc1 s SER 1834Ca -0.22 -0.21 -0.04 0.00 0.48 0.00 0.00 55.95 55.96 2hc1 s SER 1834Cb 0.08 0.45 0.11 0.00 0.10 0.00 0.00 66.02 66.75 2hc1 s SER 1834CO 0.72 -0.77 0.32 -0.70 0.98 0.00 0.00 173.24 173.78 2hc1 s GLU 1835N -3.29 0.27 -0.24 4.02 2.12 -1.26 -1.72 118.70 118.60 2hc1 s GLU 1835Ca -0.00 0.46 0.01 0.00 0.36 0.00 0.00 54.97 55.80 2hc1 s GLU 1835Cb 0.01 -0.66 0.06 0.00 0.26 0.00 0.00 34.13 33.81 2hc1 s GLU 1835CO -0.08 -0.60 -0.05 -1.12 -0.54 0.00 0.00 175.26 172.87 2hc1 s SER 1836N 2.46 3.94 -0.26 -1.70 0.01 0.16 -4.99 113.70 113.32 2hc1 s SER 1836Ca 0.09 -1.25 -0.21 0.00 1.31 0.00 0.00 55.95 55.89 2hc1 s SER 1836Cb -0.15 -1.22 -0.01 0.00 0.21 0.00 0.00 66.02 64.85 2hc1 s SER 1836CO -0.14 -0.24 0.67 -0.69 0.41 0.00 0.00 173.24 173.25 2hc1 s VAL 1837N 1.36 4.94 0.45 3.43 1.01 -1.26 -0.88 120.40 129.44 2hc1 s VAL 1837Ca -0.05 1.15 0.07 0.00 0.00 0.00 0.00 61.98 63.15 2hc1 s VAL 1837Cb -0.19 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2hc1 s VAL 1837CO -0.07 -0.03 0.25 -0.76 0.00 0.00 0.00 175.10 174.49 2hc1 s LEU 1838N 2.60 3.04 0.39 3.92 1.43 0.15 -5.00 118.68 125.21 2hc1 s LEU 1838Ca 0.28 -1.08 0.07 0.00 -1.03 0.00 0.00 54.13 52.36 2hc1 s LEU 1838Cb -0.15 -1.46 0.82 0.00 0.03 0.00 0.00 46.19 45.42 2hc1 s LEU 1838CO 0.09 -0.70 2.03 -0.65 0.23 0.00 0.00 176.35 177.35 2hc1 h PRO 1839N 1.21 0.61 0.00 1.29 0.11 -2.02 -3.30 132.00 129.89 2hc1 h PRO 1839Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2hc1 h PRO 1839Cb 1.27 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2hc1 h PRO 1839CO 0.65 0.40 0.00 0.39 -0.21 0.00 0.00 178.00 179.24 2hc1 n GLU 1840N -4.47 3.51 -3.89 1.05 1.02 -1.26 -4.99 120.64 111.62 2hc1 n GLU 1840Ca 0.05 -0.10 -0.09 0.00 -0.02 0.00 0.00 57.16 57.00 2hc1 n GLU 1840Cb 0.11 -0.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.95 2hc1 n GLU 1840CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 2hc1 s TRP 1841N -0.53 0.23 -0.06 -0.32 -2.14 -1.24 -1.58 118.94 113.29 2hc1 s TRP 1841Ca 0.00 -0.64 0.05 0.00 2.66 0.00 0.00 56.10 58.17 2hc1 s TRP 1841Cb 0.00 -0.07 -0.01 0.00 -3.10 0.00 0.00 33.47 30.30 2hc1 s TRP 1841CO 0.00 -0.59 -0.21 0.99 -2.66 0.00 0.00 176.95 174.48 2hc1 s THR 1842N -3.89 1.79 -0.16 0.66 2.01 0.03 -0.68 115.64 115.41 2hc1 s THR 1842Ca 0.08 -0.91 -0.01 0.00 0.31 0.00 0.00 61.69 61.17 2hc1 s THR 1842Cb 0.05 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 2hc1 s THR 1842CO -0.08 0.50 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.61 2hc1 s ILE 1843N 0.03 3.01 0.13 1.82 1.01 -0.06 -0.73 121.20 126.42 2hc1 s ILE 1843Ca -0.07 -0.65 0.11 0.00 0.00 0.00 0.00 60.65 60.03 2hc1 s ILE 1843Cb -0.14 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 2hc1 s ILE 1843CO 0.04 0.50 -0.26 -0.13 0.00 0.00 0.00 174.94 175.09 2hc1 s ARG 1844N 0.75 1.37 -0.05 2.79 0.52 -0.10 -0.66 118.95 123.57 2hc1 s ARG 1844Ca -0.05 -1.35 0.05 0.00 -0.52 0.00 0.00 55.73 53.87 2hc1 s ARG 1844Cb -0.15 -1.81 -0.01 0.00 0.52 0.00 0.00 34.95 33.50 2hc1 s ARG 1844CO 0.01 0.42 -0.21 -2.00 0.02 0.00 0.00 175.30 173.54 2hc1 s GLU 1845N -2.13 2.20 0.09 3.54 2.12 -0.70 -0.45 118.70 123.37 2hc1 s GLU 1845Ca 0.14 -0.77 0.08 0.00 0.36 0.00 0.00 54.97 54.78 2hc1 s GLU 1845Cb -0.10 -1.88 -0.03 0.00 0.26 0.00 0.00 34.13 32.38 2hc1 s GLU 1845CO 0.06 0.32 -0.21 -0.06 -0.54 0.00 0.00 175.26 174.83 2hc1 s PHE 1846N -0.07 1.78 -0.07 5.30 0.40 0.17 -0.38 117.98 125.11 2hc1 s PHE 1846Ca -0.04 -0.41 -0.13 0.00 -0.60 0.00 0.00 56.93 55.75 2hc1 s PHE 1846Cb -0.13 -0.99 -0.05 0.00 0.51 0.00 0.00 43.02 42.36 2hc1 s PHE 1846CO 0.03 0.18 0.32 0.21 0.70 0.00 0.00 175.22 176.66 2hc1 s LYS 1847N -1.75 3.91 0.01 0.44 2.36 0.57 -0.49 119.74 124.78 2hc1 s LYS 1847Ca 0.06 0.22 0.03 0.00 -2.55 0.00 0.00 55.97 53.73 2hc1 s LYS 1847Cb -0.10 -3.27 -0.01 0.00 -1.05 0.00 0.00 37.83 33.40 2hc1 s LYS 1847CO 0.04 0.58 -0.09 -1.50 1.55 0.00 0.00 175.35 175.92 2hc1 s ILE 1848N -0.62 0.72 -0.04 5.43 2.07 -0.28 -0.99 121.20 127.49 2hc1 s ILE 1848Ca 0.20 -0.64 0.00 0.00 -1.41 0.00 0.00 60.65 58.80 2hc1 s ILE 1848Cb -0.15 -0.65 0.03 0.00 0.13 0.00 0.00 42.46 41.82 2hc1 s ILE 1848CO 0.09 0.02 -0.00 0.00 -1.91 0.00 0.00 174.94 173.14 2hc1 n GLY 1850N 4.30 5.32 3.72 0.00 0.00 -1.26 -1.44 105.19 115.82 2hc1 n GLY 1850Ca -0.23 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 2hc1 n GLY 1850CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hc1 s GLU 1851N -0.34 4.23 0.04 1.61 2.12 -1.26 -4.87 118.70 120.23 2hc1 s GLU 1851Ca 0.00 2.33 -0.30 0.00 0.36 0.00 0.00 54.97 57.36 2hc1 s GLU 1851Cb 0.00 -3.16 -0.08 0.00 0.26 0.00 0.00 34.13 31.15 2hc1 s GLU 1851CO 0.00 -0.58 1.74 -2.00 -0.54 0.00 0.00 175.26 173.88 2hc1 s GLU 1852N 1.00 4.18 0.00 4.30 2.12 -1.26 -4.90 118.70 124.13 2hc1 s GLU 1852Ca 0.69 2.39 0.00 0.00 0.36 0.00 0.00 54.97 58.40 2hc1 s GLU 1852Cb -0.43 -3.79 0.00 0.00 0.26 0.00 0.00 34.13 30.17 2hc1 s GLU 1852CO 0.32 -0.82 0.00 1.04 -0.54 0.00 0.00 175.26 175.27 2hc1 n GLN 1853N 6.33 0.00 0.23 4.30 1.13 -1.26 -4.95 117.38 123.16 2hc1 n GLN 1853Ca 0.17 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.37 2hc1 n GLN 1853Cb 0.41 0.00 0.37 0.00 0.11 0.00 0.00 30.24 31.13 2hc1 n GLN 1853CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2hc1 h LEU 1854N 0.00 0.00 -8.41 1.08 3.38 -1.96 -3.45 115.31 105.95 2hc1 h LEU 1854Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 2hc1 h LEU 1854Cb 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 2hc1 h LEU 1854CO 0.00 0.00 -0.58 1.51 0.09 0.00 0.00 178.44 179.46 2hc1 s ASP 1855N -5.85 0.23 -0.01 -0.43 1.47 -1.26 -5.06 116.67 105.76 2hc1 s ASP 1855Ca 0.05 -1.19 0.09 0.00 1.18 0.00 0.00 52.55 52.68 2hc1 s ASP 1855Cb 0.07 0.34 -0.12 0.00 -0.34 0.00 0.00 42.92 42.87 2hc1 s ASP 1855CO 0.61 -0.78 0.29 0.00 0.68 0.00 0.00 175.17 175.97 2hc1 n ALA 1856N -0.15 2.75 -3.48 2.11 0.00 -1.26 -4.41 120.51 116.07 2hc1 n ALA 1856Ca -0.04 -0.23 -0.13 0.00 0.00 0.00 0.00 53.44 53.04 2hc1 n ALA 1856Cb 0.64 -0.31 -0.03 0.00 0.00 0.00 0.00 19.45 19.74 2hc1 n ALA 1856CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2hc1 s HIS 1857N -2.22 -0.52 -0.04 0.00 -3.43 -1.26 -4.54 115.29 103.29 2hc1 s HIS 1857Ca 0.00 0.55 -0.19 0.00 -0.80 0.00 0.00 55.06 54.62 2hc1 s HIS 1857Cb 0.06 0.50 0.04 0.00 -1.43 0.00 0.00 32.58 31.75 2hc1 s HIS 1857CO 0.37 -0.67 0.43 0.50 -2.00 0.00 0.00 174.74 173.36 2hc1 s ARG 1858N -2.68 0.76 -0.18 -0.38 3.52 -0.31 -5.00 118.95 114.67 2hc1 s ARG 1858Ca -0.02 0.01 -0.09 0.00 -0.13 0.00 0.00 55.73 55.50 2hc1 s ARG 1858Cb -0.01 0.35 -0.05 0.00 -1.56 0.00 0.00 34.95 33.68 2hc1 s ARG 1858CO -0.05 -0.21 0.13 -1.17 -0.81 0.00 0.00 175.30 173.19 2hc1 s LEU 1859N -1.14 4.24 -0.04 -0.88 2.96 -1.26 -1.12 118.68 121.44 2hc1 s LEU 1859Ca -0.12 0.27 0.07 0.00 -0.22 0.00 0.00 54.13 54.14 2hc1 s LEU 1859Cb -0.04 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 2hc1 s LEU 1859CO 0.05 0.22 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.43 2hc1 s ILE 1860N 0.10 2.03 -0.02 6.68 1.01 0.36 -4.81 121.20 126.55 2hc1 s ILE 1860Ca 0.09 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.69 2hc1 s ILE 1860Cb -0.11 -1.70 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 2hc1 s ILE 1860CO -0.01 0.57 -0.07 -0.13 0.00 0.00 0.00 174.94 175.30 2hc1 s ARG 1861N -0.34 2.63 -0.11 2.79 0.52 -0.22 -0.65 118.95 123.56 2hc1 s ARG 1861Ca 0.02 -0.66 0.01 0.00 -0.52 0.00 0.00 55.73 54.58 2hc1 s ARG 1861Cb -0.12 -2.54 0.02 0.00 0.52 0.00 0.00 34.95 32.83 2hc1 s ARG 1861CO 0.02 0.63 -0.11 -1.58 0.02 0.00 0.00 175.30 174.27 2hc1 s HIS 1862N -0.93 1.73 -0.33 -0.53 5.65 0.40 -0.91 115.29 120.37 2hc1 s HIS 1862Ca 0.15 -0.84 -0.02 0.00 0.25 0.00 0.00 55.06 54.60 2hc1 s HIS 1862Cb -0.11 -1.32 0.06 0.00 -1.18 0.00 0.00 32.58 30.03 2hc1 s HIS 1862CO 0.05 -0.49 0.05 -0.06 -0.65 0.00 0.00 174.74 173.64 2hc1 s PHE 1863N 1.31 3.35 -0.40 3.88 0.40 0.44 -0.92 117.98 126.04 2hc1 s PHE 1863Ca -0.01 -2.01 -0.07 0.00 -0.60 0.00 0.00 56.93 54.24 2hc1 s PHE 1863Cb -0.14 -2.39 0.08 0.00 0.51 0.00 0.00 43.02 41.09 2hc1 s PHE 1863CO -0.05 -0.84 0.22 -1.58 0.70 0.00 0.00 175.22 173.66 2hc1 s HIS 1864N 1.22 3.40 -0.23 0.36 2.46 0.10 -0.79 115.29 121.80 2hc1 s HIS 1864Ca -0.02 -1.82 -0.29 0.00 0.47 0.00 0.00 55.06 53.41 2hc1 s HIS 1864Cb -0.20 -2.94 0.01 0.00 -0.13 0.00 0.00 32.58 29.31 2hc1 s HIS 1864CO -0.02 -0.88 1.02 -0.47 -2.47 0.00 0.00 174.74 171.92 2hc1 s TYR 1865N 1.33 3.34 -1.20 3.88 5.04 0.16 -0.79 117.35 129.11 2hc1 s TYR 1865Ca 0.03 1.44 0.13 0.00 -2.44 0.00 0.00 57.07 56.23 2hc1 s TYR 1865Cb -0.23 -3.25 0.30 0.00 0.35 0.00 0.00 41.96 39.14 2hc1 s TYR 1865CO -0.00 -0.47 1.21 0.25 -1.34 0.00 0.00 175.55 175.20 2hc1 n THR 1866N 5.30 0.78 -0.82 4.34 -2.24 -0.62 -4.04 114.28 116.99 2hc1 n THR 1866Ca 0.11 -0.89 0.01 0.00 -2.27 0.00 0.00 64.05 61.01 2hc1 n THR 1866Cb 0.46 0.67 0.01 0.00 -2.10 0.00 0.00 70.33 69.37 2hc1 n THR 1866CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2hc1 n VAL 1867N 0.69 0.44 -1.69 2.28 0.24 -1.26 -4.88 118.33 114.15 2hc1 n VAL 1867Ca 0.12 -0.46 -0.44 0.00 -2.04 0.00 0.00 64.34 61.52 2hc1 n VAL 1867Cb 0.43 0.70 -0.04 0.00 -1.47 0.00 0.00 33.84 33.46 2hc1 n VAL 1867CO 0.00 0.00 0.00 1.87 -2.14 0.00 0.00 176.83 176.56 2hc1 n TRP 1868N -0.25 2.50 -1.46 6.34 -0.00 -1.26 -4.93 117.44 118.37 2hc1 n TRP 1868Ca 0.01 0.07 -0.34 0.00 -0.00 0.00 0.00 57.50 57.24 2hc1 n TRP 1868Cb 0.46 -2.64 0.09 0.00 -0.00 0.00 0.00 31.31 29.21 2hc1 n TRP 1868CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 177.69 175.55 2hc1 s PRO 1869N 1.76 2.22 0.00 5.87 0.02 -1.26 -4.88 135.00 138.72 2hc1 s PRO 1869Ca 0.80 1.68 0.06 0.00 0.02 0.00 0.00 61.00 63.56 2hc1 s PRO 1869Cb -0.58 -1.85 0.26 0.00 0.02 0.00 0.00 34.50 32.35 2hc1 s PRO 1869CO 0.38 -1.76 1.09 -0.25 -0.33 0.00 0.00 177.00 176.13 2hc1 n ASP 1870N -2.73 0.00 0.00 2.53 8.00 -1.26 -4.13 116.55 118.97 2hc1 n ASP 1870Ca 0.13 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.97 2hc1 n ASP 1870Cb 0.51 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 2hc1 n ASP 1870CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hc1 n HIS 1871N -1.38 0.00 0.00 1.24 1.44 -1.26 -5.04 115.22 110.21 2hc1 n HIS 1871Ca 0.02 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.73 2hc1 n HIS 1871Cb 0.05 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.16 2hc1 n HIS 1871CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2hc1 n GLY 1872N 0.00 -1.29 3.98 -1.39 0.00 -1.26 -5.00 105.19 100.22 2hc1 n GLY 1872Ca 0.00 -2.00 -0.21 0.00 0.00 0.00 0.00 46.02 43.81 2hc1 n GLY 1872CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hc1 s VAL 1873N 0.00 2.94 0.64 1.61 -7.23 -1.26 -4.45 120.40 112.66 2hc1 s VAL 1873Ca 0.00 -0.69 -0.18 0.00 -1.81 0.00 0.00 61.98 59.30 2hc1 s VAL 1873Cb 0.00 -3.08 -0.02 0.00 0.56 0.00 0.00 36.38 33.84 2hc1 s VAL 1873CO 0.00 -0.05 1.11 -2.65 -0.31 0.00 0.00 175.10 173.20 2hc1 n PRO 1874N -2.22 0.92 0.20 4.82 -0.02 -1.26 -4.66 135.00 132.78 2hc1 n PRO 1874Ca 0.07 0.37 0.06 0.00 -2.02 0.00 0.00 63.50 61.98 2hc1 n PRO 1874Cb 0.59 -2.34 0.43 0.00 -0.02 0.00 0.00 33.50 32.16 2hc1 n PRO 1874CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2hc1 h GLU 1875N 0.36 0.00 -6.47 -0.52 4.57 -1.97 -3.43 114.58 107.13 2hc1 h GLU 1875Ca -0.49 0.00 -0.63 0.00 -1.18 0.00 0.00 59.36 57.05 2hc1 h GLU 1875Cb 1.35 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 29.70 2hc1 h GLU 1875CO 0.51 0.32 -0.86 0.95 -1.18 0.00 0.00 179.01 178.75 2hc1 s THR 1876N -3.93 1.94 0.30 0.32 -4.23 -1.26 -5.01 115.64 103.78 2hc1 s THR 1876Ca -0.02 -1.44 0.02 0.00 -1.18 0.00 0.00 61.69 59.08 2hc1 s THR 1876Cb 0.13 -1.70 0.13 0.00 1.34 0.00 0.00 72.50 72.39 2hc1 s THR 1876CO 0.68 0.18 1.81 0.71 -0.54 0.00 0.00 174.62 177.46 2hc1 h THR 1877N 4.16 1.22 -0.81 3.99 1.35 -1.95 -3.27 112.91 117.61 2hc1 h THR 1877Ca -0.46 -0.95 0.08 0.00 -0.55 0.00 0.00 66.41 64.53 2hc1 h THR 1877Cb 1.16 1.02 -0.07 0.00 -1.73 0.00 0.00 68.15 68.53 2hc1 h THR 1877CO 0.42 0.32 0.48 0.06 -0.25 0.00 0.00 175.52 176.54 2hc1 h GLN 1878N 0.54 0.81 -0.01 4.72 -0.00 -1.98 -1.52 115.11 117.67 2hc1 h GLN 1878Ca 0.11 -0.05 -0.00 0.00 -0.00 0.00 0.00 58.65 58.71 2hc1 h GLN 1878Cb 0.43 -0.18 -0.00 0.00 -0.00 0.00 0.00 27.48 27.73 2hc1 h GLN 1878CO 0.02 0.53 0.01 0.66 -0.00 0.00 0.00 178.83 180.05 2hc1 h SER 1879N 0.83 0.02 0.52 0.06 4.64 -1.99 -0.79 113.55 116.83 2hc1 h SER 1879Ca 0.37 -0.09 -0.21 0.00 -0.47 0.00 0.00 61.79 61.40 2hc1 h SER 1879Cb 0.27 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2hc1 h SER 1879CO -0.21 0.10 -0.90 0.25 -0.87 0.00 0.00 176.83 175.20 2hc1 h LEU 1880N -0.07 0.33 -0.47 5.97 5.85 -1.66 -1.30 115.31 123.97 2hc1 h LEU 1880Ca 0.00 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.51 2hc1 h LEU 1880Cb 0.09 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 2hc1 h LEU 1880CO -0.00 1.07 0.18 0.40 -0.34 0.00 0.00 178.44 179.75 2hc1 h ILE 1881N 0.14 0.87 -0.26 4.05 2.04 -1.17 -0.08 117.51 123.09 2hc1 h ILE 1881Ca -0.05 -0.12 -0.17 0.00 1.00 0.00 0.00 64.86 65.51 2hc1 h ILE 1881Cb 1.53 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.08 2hc1 h ILE 1881CO 0.14 0.07 -0.53 -0.61 0.00 0.00 0.00 178.15 177.22 2hc1 h GLN 1882N 0.36 0.77 0.04 2.37 5.75 -1.01 -0.72 115.11 122.66 2hc1 h GLN 1882Ca 0.22 -0.48 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 2hc1 h GLN 1882Cb 0.21 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 2hc1 h GLN 1882CO -0.21 1.10 -0.05 0.35 -2.65 0.00 0.00 178.83 177.37 2hc1 h PHE 1883N 0.59 -0.12 -0.61 3.99 3.57 -1.02 0.65 116.94 124.00 2hc1 h PHE 1883Ca 0.02 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.53 2hc1 h PHE 1883Cb 1.11 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.87 2hc1 h PHE 1883CO 0.06 -0.07 0.39 0.28 -2.23 0.00 0.00 178.31 176.74 2hc1 h VAL 1884N -0.10 1.13 -0.50 1.41 2.07 -0.94 -1.27 116.25 118.04 2hc1 h VAL 1884Ca 0.01 -0.27 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 2hc1 h VAL 1884Cb 0.10 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 2hc1 h VAL 1884CO -0.02 0.14 -0.12 0.03 0.02 0.00 0.00 177.57 177.63 2hc1 h ARG 1885N 0.79 0.94 -0.08 1.57 3.08 -0.93 -0.87 114.38 118.89 2hc1 h ARG 1885Ca 0.23 -0.34 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 2hc1 h ARG 1885Cb -0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 2hc1 h ARG 1885CO -0.07 1.00 0.05 1.15 -1.07 0.00 0.00 179.97 181.03 2hc1 h THR 1886N 0.84 1.07 -0.58 2.04 2.02 -0.61 -0.27 112.91 117.42 2hc1 h THR 1886Ca 0.13 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.14 2hc1 h THR 1886Cb 0.66 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 2hc1 h THR 1886CO 0.05 0.06 0.38 0.58 0.37 0.00 0.00 175.52 176.95 2hc1 h VAL 1887N 0.06 1.13 -0.87 3.16 2.07 -1.08 -1.89 116.25 118.83 2hc1 h VAL 1887Ca 0.03 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 2hc1 h VAL 1887Cb 0.05 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.08 2hc1 h VAL 1887CO -0.00 0.14 0.46 -0.09 0.02 0.00 0.00 177.57 178.09 2hc1 h ARG 1888N 0.77 1.23 -0.45 1.57 9.65 -0.98 -0.40 114.38 125.77 2hc1 h ARG 1888Ca 0.22 -0.16 -0.03 0.00 -1.10 0.00 0.00 59.98 58.91 2hc1 h ARG 1888Cb -0.07 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.26 2hc1 h ARG 1888CO -0.06 0.92 0.17 -0.44 2.80 0.00 0.00 179.97 183.36 2hc1 h ASP 1889N 1.23 0.63 -0.55 -3.80 3.32 -0.69 -0.25 116.42 116.31 2hc1 h ASP 1889Ca 0.30 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.18 2hc1 h ASP 1889Cb 0.06 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 2hc1 h ASP 1889CO -0.05 0.64 0.36 1.88 -1.72 0.00 0.00 179.24 180.35 2hc1 h TYR 1890N 0.58 0.68 -0.28 4.55 -1.99 -0.89 -2.12 116.97 117.50 2hc1 h TYR 1890Ca 0.15 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.92 2hc1 h TYR 1890Cb 0.21 -0.23 -0.03 0.00 2.00 0.00 0.00 36.73 38.68 2hc1 h TYR 1890CO 0.00 0.43 0.11 0.82 -0.00 0.00 0.00 178.16 179.52 2hc1 h ILE 1891N 0.73 0.94 0.00 -2.88 2.04 -0.79 -2.82 117.51 114.73 2hc1 h ILE 1891Ca 0.20 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.95 2hc1 h ILE 1891Cb -0.08 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2hc1 h ILE 1891CO -0.05 0.04 -0.15 0.78 0.00 0.00 0.00 178.15 178.78 2hc1 h ASN 1892N 0.24 0.00 0.45 1.72 2.35 -0.81 -2.30 115.58 117.22 2hc1 h ASN 1892Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 2hc1 h ASN 1892Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2hc1 h ASN 1892CO -0.12 0.15 -0.36 -2.11 -1.65 0.00 0.00 177.43 173.34 2hc1 n ARG 1893N -3.52 0.31 -2.07 0.81 1.85 -0.82 -4.87 116.66 108.35 2hc1 n ARG 1893Ca -0.01 -0.17 -0.39 0.00 -1.00 0.00 0.00 57.85 56.29 2hc1 n ARG 1893Cb 0.30 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.21 2hc1 n ARG 1893CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2hc1 s SER 1894N -2.81 6.09 0.30 2.89 0.15 -0.87 -4.93 113.70 114.53 2hc1 s SER 1894Ca 0.17 2.57 0.26 0.00 0.70 0.00 0.00 55.95 59.64 2hc1 s SER 1894Cb 0.18 -2.63 1.00 0.00 -1.71 0.00 0.00 66.02 62.86 2hc1 s SER 1894CO 0.62 -1.00 1.76 1.55 1.20 0.00 0.00 173.24 177.37 2hc1 h PRO 1895N 2.28 0.00 0.00 5.44 0.13 -1.89 -3.43 132.00 134.53 2hc1 h PRO 1895Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2hc1 h PRO 1895Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2hc1 h PRO 1895CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 2hc1 n GLY 1896N 0.24 -0.55 0.08 1.56 0.00 -1.26 -5.08 105.19 100.18 2hc1 n GLY 1896Ca 0.02 0.85 -0.04 0.00 0.00 0.00 0.00 46.02 46.86 2hc1 n GLY 1896CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hc1 n ALA 1897N 0.00 1.79 -0.60 4.61 0.00 -1.26 -4.89 120.51 120.16 2hc1 n ALA 1897Ca 0.00 -0.84 0.07 0.00 0.00 0.00 0.00 53.44 52.67 2hc1 n ALA 1897Cb 0.00 -0.67 -0.02 0.00 0.00 0.00 0.00 19.45 18.76 2hc1 n ALA 1897CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hc1 n GLY 1898N 1.53 -1.98 3.76 0.00 0.00 -1.24 -1.44 105.19 105.81 2hc1 n GLY 1898Ca -0.18 -1.34 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 2hc1 n GLY 1898CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2hc1 s PRO 1899N -1.18 3.36 -0.18 1.61 0.02 -1.26 -4.76 135.00 132.62 2hc1 s PRO 1899Ca 0.00 2.34 -0.16 0.00 0.02 0.00 0.00 61.00 63.20 2hc1 s PRO 1899Cb 0.00 -2.43 -0.04 0.00 0.02 0.00 0.00 34.50 32.05 2hc1 s PRO 1899CO 0.00 -1.05 0.41 0.99 -0.33 0.00 0.00 177.00 177.02 2hc1 s THR 1900N -1.25 5.20 0.07 0.99 2.01 -0.51 -4.14 115.64 118.01 2hc1 s THR 1900Ca 0.67 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 63.16 2hc1 s THR 1900Cb -0.43 -3.75 -0.06 0.00 0.01 0.00 0.00 72.50 68.28 2hc1 s THR 1900CO 0.52 0.28 0.85 -0.69 -0.69 0.00 0.00 174.62 174.89 2hc1 s VAL 1901N 1.09 4.64 -0.05 3.82 1.01 -0.73 -0.92 120.40 129.26 2hc1 s VAL 1901Ca 0.21 1.82 0.02 0.00 0.00 0.00 0.00 61.98 64.02 2hc1 s VAL 1901Cb -0.15 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 32.05 2hc1 s VAL 1901CO 0.08 0.34 -0.09 -0.69 0.00 0.00 0.00 175.10 174.74 2hc1 s VAL 1902N -0.01 0.86 -0.01 2.92 1.01 -0.08 -0.06 120.40 125.03 2hc1 s VAL 1902Ca 0.42 -0.32 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 2hc1 s VAL 1902Cb -0.22 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.36 2hc1 s VAL 1902CO 0.26 0.29 0.19 -1.38 0.00 0.00 0.00 175.10 174.46 2hc1 s HIS 1903N 0.74 -0.03 0.00 5.22 -3.43 -0.16 -2.17 115.29 115.47 2hc1 s HIS 1903Ca -0.13 0.01 0.00 0.00 -0.80 0.00 0.00 55.06 54.13 2hc1 s HIS 1903Cb -0.15 -0.00 0.00 0.00 -1.43 0.00 0.00 32.58 31.00 2hc1 s HIS 1903CO 0.02 -0.31 0.00 0.00 -2.00 0.00 0.00 174.74 172.46 2hc1 h SER 1905N 0.00 0.38 0.00 0.00 0.87 -1.87 -2.50 113.55 110.43 2hc1 h SER 1905Ca 0.00 -0.85 0.00 0.00 -1.23 0.00 0.00 61.79 59.71 2hc1 h SER 1905Cb 0.00 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 2hc1 h SER 1905CO 0.00 1.19 -0.64 0.00 -0.53 0.00 0.00 176.83 176.85 2hc1 n ALA 1906N -2.60 3.22 -2.20 6.23 0.00 -1.26 -0.44 120.51 123.46 2hc1 n ALA 1906Ca -0.11 -0.29 -0.05 0.00 0.00 0.00 0.00 53.44 52.99 2hc1 n ALA 1906Cb 0.66 -0.38 0.02 0.00 0.00 0.00 0.00 19.45 19.76 2hc1 n ALA 1906CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hc1 n GLY 1907N 1.34 0.22 0.00 0.00 0.00 -1.21 -4.21 105.19 101.33 2hc1 n GLY 1907Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2hc1 n GLY 1907CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hc1 n VAL 1908N -2.05 0.00 -0.09 1.61 0.24 -1.26 -4.87 118.33 111.92 2hc1 n VAL 1908Ca -0.05 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.19 2hc1 n VAL 1908Cb 0.54 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.92 2hc1 n VAL 1908CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2hc1 h GLY 1909N 0.00 0.33 0.99 7.63 0.00 -1.77 -0.69 103.07 109.56 2hc1 h GLY 1909Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 2hc1 h GLY 1909CO 0.00 -0.06 0.27 3.21 0.00 0.00 0.00 176.54 179.96 2hc1 h ARG 1910N 0.12 0.84 -0.37 4.80 3.08 -1.94 -0.11 114.38 120.80 2hc1 h ARG 1910Ca 0.15 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 2hc1 h ARG 1910Cb 0.20 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2hc1 h ARG 1910CO -0.24 0.69 0.13 1.79 -1.07 0.00 0.00 179.97 181.28 2hc1 h THR 1911N 0.79 1.20 -0.61 2.04 1.35 -1.80 -0.97 112.91 114.90 2hc1 h THR 1911Ca 0.20 -0.63 -0.02 0.00 -0.55 0.00 0.00 66.41 65.40 2hc1 h THR 1911Cb 0.14 0.92 -0.03 0.00 -1.73 0.00 0.00 68.15 67.45 2hc1 h THR 1911CO -0.02 0.22 0.28 1.23 -0.25 0.00 0.00 175.52 176.98 2hc1 h GLY 1912N 0.45 0.93 0.96 5.82 0.00 -0.88 -1.62 103.07 108.74 2hc1 h GLY 1912Ca 0.12 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 2hc1 h GLY 1912CO -0.01 0.43 -0.02 -0.84 0.00 0.00 0.00 176.54 176.10 2hc1 h THR 1913N 0.87 1.26 0.04 4.70 2.02 -0.75 0.06 112.91 121.12 2hc1 h THR 1913Ca 0.21 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.36 2hc1 h THR 1913Cb 0.11 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 2hc1 h THR 1913CO -0.03 0.36 -0.19 0.15 0.37 0.00 0.00 175.52 176.18 2hc1 h PHE 1914N 0.56 -0.49 -0.42 3.16 3.57 -0.91 -0.81 116.94 121.60 2hc1 h PHE 1914Ca 0.11 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 2hc1 h PHE 1914Cb 0.51 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 2hc1 h PHE 1914CO 0.04 -0.27 -0.07 0.82 -2.23 0.00 0.00 178.31 176.60 2hc1 h ILE 1915N -0.33 1.27 -0.59 1.41 2.04 -1.17 -1.19 117.51 118.94 2hc1 h ILE 1915Ca 0.05 -1.15 0.04 0.00 1.00 0.00 0.00 64.86 64.79 2hc1 h ILE 1915Cb 0.38 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 2hc1 h ILE 1915CO -0.15 0.39 0.34 0.00 0.00 0.00 0.00 178.15 178.73 2hc1 h ALA 1916N 0.86 0.78 -0.87 1.87 0.00 -0.91 -1.00 119.26 120.00 2hc1 h ALA 1916Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2hc1 h ALA 1916Cb 0.59 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2hc1 h ALA 1916CO 0.04 0.05 0.43 1.25 0.00 0.00 0.00 179.25 181.01 2hc1 h LEU 1917N 0.66 1.13 -0.24 0.00 5.85 -0.92 0.69 115.31 122.48 2hc1 h LEU 1917Ca 0.25 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2hc1 h LEU 1917Cb 0.09 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2hc1 h LEU 1917CO -0.13 0.94 0.02 -0.78 -0.34 0.00 0.00 178.44 178.15 2hc1 h ASP 1918N 1.23 -0.05 -0.48 1.25 1.82 -0.59 0.16 116.42 119.77 2hc1 h ASP 1918Ca 0.30 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.98 2hc1 h ASP 1918Cb 0.10 0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.17 2hc1 h ASP 1918CO -0.04 0.01 0.27 0.03 -1.61 0.00 0.00 179.24 177.90 2hc1 h ARG 1919N 0.10 0.67 -0.06 0.28 -0.00 -0.69 -2.33 114.38 112.35 2hc1 h ARG 1919Ca 0.11 -0.08 -0.18 0.00 -0.50 0.00 0.00 59.98 59.34 2hc1 h ARG 1919Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 29.97 29.96 2hc1 h ARG 1919CO -0.17 0.52 -0.74 -0.84 0.00 0.00 0.00 179.97 178.74 2hc1 h ILE 1920N 0.64 1.40 -0.43 2.04 3.07 -0.58 -0.45 117.51 123.20 2hc1 h ILE 1920Ca 0.17 -2.20 -0.07 0.00 1.55 0.00 0.00 64.86 64.31 2hc1 h ILE 1920Cb 0.04 2.16 -0.02 0.00 -0.27 0.00 0.00 36.82 38.73 2hc1 h ILE 1920CO -0.03 0.65 -0.01 -0.07 -1.05 0.00 0.00 178.15 177.65 2hc1 h LEU 1921N 0.23 0.68 -0.55 0.16 3.38 -0.91 -0.93 115.31 117.37 2hc1 h LEU 1921Ca -0.03 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 2hc1 h LEU 1921Cb 1.31 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2hc1 h LEU 1921CO 0.12 0.76 0.04 1.56 0.09 0.00 0.00 178.44 181.00 2hc1 h GLN 1922N 0.67 0.95 -0.50 1.13 4.20 -1.13 -2.78 115.11 117.66 2hc1 h GLN 1922Ca 0.13 -0.28 0.08 0.00 0.06 0.00 0.00 58.65 58.64 2hc1 h GLN 1922Cb 0.43 -0.09 -0.07 0.00 0.30 0.00 0.00 27.48 28.05 2hc1 h GLN 1922CO 0.02 0.94 0.11 1.96 -0.67 0.00 0.00 178.83 181.18 2hc1 h GLN 1923N 0.83 0.24 0.00 1.46 4.20 -0.62 -1.92 115.11 119.29 2hc1 h GLN 1923Ca 0.16 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 2hc1 h GLN 1923Cb 0.49 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 2hc1 h GLN 1923CO 0.02 0.16 -0.04 -0.07 -0.67 0.00 0.00 178.83 178.23 2hc1 h LEU 1924N 0.25 0.00 -0.08 1.46 3.38 -1.00 0.86 115.31 120.18 2hc1 h LEU 1924Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2hc1 h LEU 1924Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2hc1 h LEU 1924CO -0.32 0.04 -0.33 0.47 0.09 0.00 0.00 178.44 178.39 2hc1 n ASP 1925N -3.38 0.45 0.00 -0.43 8.00 -0.75 -4.53 116.55 115.92 2hc1 n ASP 1925Ca -0.02 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.27 2hc1 n ASP 1925Cb 0.16 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 2hc1 n ASP 1925CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2hc1 n SER 1926N -1.34 4.26 -4.46 -2.24 3.41 -0.52 -5.10 113.62 107.62 2hc1 n SER 1926Ca 0.08 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.45 2hc1 n SER 1926Cb 0.33 0.35 -0.10 0.00 -0.26 0.00 0.00 64.21 64.53 2hc1 n SER 1926CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2hc1 s LYS 1927N -1.89 1.63 -0.05 4.33 1.02 0.18 -5.04 119.74 119.93 2hc1 s LYS 1927Ca 0.00 -1.77 0.20 0.00 0.02 0.00 0.00 55.97 54.42 2hc1 s LYS 1927Cb 0.00 -1.57 0.65 0.00 -0.52 0.00 0.00 37.83 36.39 2hc1 s LYS 1927CO 0.00 0.23 1.55 -0.40 -0.92 0.00 0.00 175.35 175.82 2hc1 n ASP 1928N -0.61 4.12 -4.17 2.83 5.75 -1.26 -4.66 116.55 118.55 2hc1 n ASP 1928Ca -0.06 -2.18 -0.15 0.00 -0.01 0.00 0.00 54.79 52.39 2hc1 n ASP 1928Cb 0.61 -0.51 -0.11 0.00 -1.03 0.00 0.00 41.12 40.08 2hc1 n ASP 1928CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2hc1 s SER 1929N -0.95 1.48 -0.02 -1.12 0.01 -1.26 -1.65 113.70 110.19 2hc1 s SER 1929Ca 0.48 -0.76 0.07 0.00 1.31 0.00 0.00 55.95 57.05 2hc1 s SER 1929Cb 0.28 -0.00 -0.02 0.00 0.21 0.00 0.00 66.02 66.48 2hc1 s SER 1929CO 0.28 -0.22 -0.23 0.54 0.41 0.00 0.00 173.24 174.03 2hc1 s VAL 1930N -2.16 1.81 -0.54 3.43 0.11 -0.00 -4.81 120.40 118.23 2hc1 s VAL 1930Ca 0.03 -0.98 0.05 0.00 -2.93 0.00 0.00 61.98 58.16 2hc1 s VAL 1930Cb -0.05 -1.50 0.19 0.00 -1.53 0.00 0.00 36.38 33.50 2hc1 s VAL 1930CO 0.01 0.51 0.48 -0.67 -3.33 0.00 0.00 175.10 172.09 2hc1 n ASP 1931N 2.53 1.40 -0.17 3.54 2.03 -1.26 -0.69 116.55 123.92 2hc1 n ASP 1931Ca -0.16 -2.85 -0.08 0.00 0.52 0.00 0.00 54.79 52.22 2hc1 n ASP 1931Cb 0.52 -0.65 0.01 0.00 -0.72 0.00 0.00 41.12 40.28 2hc1 n ASP 1931CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2hc1 h ILE 1932N 3.97 1.21 -0.30 5.18 2.04 -1.99 -1.74 117.51 125.88 2hc1 h ILE 1932Ca 0.19 -0.66 0.06 0.00 1.00 0.00 0.00 64.86 65.45 2hc1 h ILE 1932Cb 0.82 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 2hc1 h ILE 1932CO 0.57 0.25 -0.09 0.22 0.00 0.00 0.00 178.15 179.09 2hc1 h TYR 1933N 0.63 -0.20 -0.93 1.37 3.20 -1.92 -1.71 116.97 117.41 2hc1 h TYR 1933Ca 0.16 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 2hc1 h TYR 1933Cb 0.20 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 2hc1 h TYR 1933CO 0.00 -0.15 0.53 0.78 -1.64 0.00 0.00 178.16 177.69 2hc1 h GLY 1934N -0.03 1.37 1.00 1.82 0.00 -1.69 0.45 103.07 105.99 2hc1 h GLY 1934Ca 0.15 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2hc1 h GLY 1934CO -0.32 0.58 0.38 0.00 0.00 0.00 0.00 176.54 177.17 2hc1 h ALA 1935N 1.29 0.80 -0.22 3.60 0.00 -0.70 -0.07 119.26 123.97 2hc1 h ALA 1935Ca 0.33 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2hc1 h ALA 1935Cb -0.01 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2hc1 h ALA 1935CO -0.06 0.28 -0.16 0.28 0.00 0.00 0.00 179.25 179.59 2hc1 h VAL 1936N 0.85 1.32 -0.50 0.00 2.07 -1.04 -2.85 116.25 116.09 2hc1 h VAL 1936Ca 0.23 -1.28 0.10 0.00 0.82 0.00 0.00 66.70 66.56 2hc1 h VAL 1936Cb -0.02 1.68 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 2hc1 h VAL 1936CO -0.04 0.39 -0.00 -0.74 0.02 0.00 0.00 177.57 177.20 2hc1 h HIS 1937N 0.18 -0.04 -0.32 1.57 6.17 -0.73 -0.86 115.15 121.12 2hc1 h HIS 1937Ca 0.04 0.04 -0.03 0.00 0.71 0.00 0.00 60.37 61.13 2hc1 h HIS 1937Cb 0.68 0.09 -0.02 0.00 2.52 0.00 0.00 27.41 30.69 2hc1 h HIS 1937CO 0.07 -0.12 0.06 -0.44 0.71 0.00 0.00 177.93 178.21 2hc1 h ASP 1938N 0.11 0.42 -0.10 3.26 3.32 -0.95 -2.59 116.42 119.89 2hc1 h ASP 1938Ca 0.25 -0.06 -0.20 0.00 0.02 0.00 0.00 57.03 57.05 2hc1 h ASP 1938Cb 0.38 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.84 2hc1 h ASP 1938CO -0.42 0.44 -0.72 -0.07 -1.72 0.00 0.00 179.24 176.74 2hc1 h LEU 1939N 0.45 0.81 -2.16 1.55 3.38 -1.11 -3.25 115.31 114.98 2hc1 h LEU 1939Ca 0.11 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2hc1 h LEU 1939Cb 0.20 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2hc1 h LEU 1939CO -0.00 1.35 0.00 0.03 0.09 0.00 0.00 178.44 179.91 2hc1 h ARG 1940N 0.33 0.00 0.00 1.13 2.47 -0.82 -0.42 114.38 117.06 2hc1 h ARG 1940Ca -0.06 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2hc1 h ARG 1940Cb 1.37 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.69 2hc1 h ARG 1940CO 0.15 0.00 -0.04 -0.07 0.56 0.00 0.00 179.97 180.56 2hc1 h LEU 1941N 0.00 0.00 0.00 3.04 3.38 -1.50 -3.28 115.31 116.95 2hc1 h LEU 1941Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2hc1 h LEU 1941Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2hc1 h LEU 1941CO -0.00 0.04 -1.48 1.41 0.09 0.00 0.00 178.44 178.51 2hc1 n HIS 1942N -3.98 0.00 -3.60 1.13 8.25 -0.19 -4.79 115.22 112.05 2hc1 n HIS 1942Ca -0.03 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.28 2hc1 n HIS 1942Cb 0.13 -0.26 -0.07 0.00 1.12 0.00 0.00 29.99 30.91 2hc1 n HIS 1942CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2hc1 s ARG 1943N -2.84 0.90 0.51 -0.41 3.52 -1.10 -4.66 118.95 114.87 2hc1 s ARG 1943Ca -0.04 0.49 -0.23 0.00 -0.13 0.00 0.00 55.73 55.83 2hc1 s ARG 1943Cb 0.09 0.43 -0.06 0.00 -1.56 0.00 0.00 34.95 33.84 2hc1 s ARG 1943CO 0.55 -0.21 1.32 0.54 -0.81 0.00 0.00 175.30 176.69 2hc1 s VAL 1944N -0.55 2.35 -1.40 7.11 0.11 -1.26 -3.65 120.40 123.11 2hc1 s VAL 1944Ca -0.07 0.27 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 2hc1 s VAL 1944Cb -0.02 -3.14 0.00 0.00 -1.53 0.00 0.00 36.38 31.69 2hc1 s VAL 1944CO 0.06 0.00 0.00 1.41 -3.33 0.00 0.00 175.10 173.24 2hc1 n HIS 1945N -0.73 -0.25 -2.30 1.54 8.25 -1.26 -4.76 115.22 115.71 2hc1 n HIS 1945Ca 0.09 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.15 2hc1 n HIS 1945Cb 0.45 -2.72 -0.03 0.00 1.12 0.00 0.00 29.99 28.81 2hc1 n HIS 1945CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2hc1 s MET 1946N -3.77 2.97 -0.02 -0.41 -1.94 -1.24 -2.12 119.30 112.78 2hc1 s MET 1946Ca 0.00 0.26 -0.02 0.00 -1.71 0.00 0.00 55.69 54.22 2hc1 s MET 1946Cb 0.00 -4.26 0.01 0.00 2.01 0.00 0.00 34.83 32.59 2hc1 s MET 1946CO 0.00 -2.36 0.03 0.28 -0.01 0.00 0.00 175.02 172.96 2hc1 n VAL 1947N 6.83 -8.23 0.04 -6.03 0.31 -1.25 -4.53 118.33 105.46 2hc1 n VAL 1947Ca 0.12 1.67 0.00 0.00 -0.01 0.00 0.00 64.34 66.12 2hc1 n VAL 1947Cb 0.50 -4.79 -0.01 0.00 -0.91 0.00 0.00 33.84 28.64 2hc1 n VAL 1947CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2hc1 n GLN 1948N 0.97 5.30 -4.22 5.55 7.27 -1.24 -4.93 117.38 126.08 2hc1 n GLN 1948Ca -0.05 -0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.84 2hc1 n GLN 1948Cb 0.08 -0.65 -0.11 0.00 2.41 0.00 0.00 30.24 31.98 2hc1 n GLN 1948CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2hc1 s THR 1949N -1.30 1.23 0.38 1.69 -4.23 -1.26 -5.02 115.64 107.13 2hc1 s THR 1949Ca 0.00 -1.63 0.07 0.00 -1.18 0.00 0.00 61.69 58.95 2hc1 s THR 1949Cb 0.01 -1.42 0.29 0.00 1.34 0.00 0.00 72.50 72.72 2hc1 s THR 1949CO 0.04 -0.41 1.98 -0.08 -0.54 0.00 0.00 174.62 175.62 2hc1 h GLU 1950N 3.66 0.65 -0.86 3.99 4.81 -1.99 -2.14 114.58 122.70 2hc1 h GLU 1950Ca -0.40 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.78 2hc1 h GLU 1950Cb 1.19 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.39 2hc1 h GLU 1950CO 0.49 0.43 0.48 0.00 -0.73 0.00 0.00 179.01 179.68 2hc1 h GLN 1952N 1.19 1.03 -0.52 0.00 4.20 -1.83 -0.96 115.11 118.22 2hc1 h GLN 1952Ca 0.30 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2hc1 h GLN 1952Cb 0.01 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2hc1 h GLN 1952CO -0.05 0.99 0.25 -0.92 -0.67 0.00 0.00 178.83 178.43 2hc1 h TYR 1953N 0.93 0.76 -0.53 2.96 3.20 -0.75 -1.51 116.97 122.02 2hc1 h TYR 1953Ca 0.18 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.01 2hc1 h TYR 1953Cb 0.49 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2hc1 h TYR 1953CO 0.04 0.60 0.35 0.28 -1.64 0.00 0.00 178.16 177.78 2hc1 h VAL 1954N 0.70 1.13 -0.67 1.81 2.07 -0.72 -2.75 116.25 117.82 2hc1 h VAL 1954Ca 0.18 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2hc1 h VAL 1954Cb 0.13 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 2hc1 h VAL 1954CO -0.02 0.13 0.42 0.22 0.02 0.00 0.00 177.57 178.34 2hc1 h TYR 1955N 0.71 0.80 -0.77 1.57 3.20 -0.72 0.20 116.97 121.96 2hc1 h TYR 1955Ca 0.19 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.14 2hc1 h TYR 1955Cb -0.08 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 37.87 2hc1 h TYR 1955CO -0.04 0.46 0.46 -0.07 -1.64 0.00 0.00 178.16 177.34 2hc1 h LEU 1956N 0.84 0.72 -0.74 2.82 3.38 -1.10 -0.31 115.31 120.91 2hc1 h LEU 1956Ca 0.27 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2hc1 h LEU 1956Cb -0.00 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2hc1 h LEU 1956CO -0.10 0.47 0.36 0.45 0.09 0.00 0.00 178.44 179.72 2hc1 h HIS 1957N 0.86 1.07 -0.68 1.13 3.86 -1.02 -2.35 115.15 118.01 2hc1 h HIS 1957Ca 0.34 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.44 2hc1 h HIS 1957Cb 0.15 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.26 2hc1 h HIS 1957CO -0.05 0.78 0.22 1.96 0.86 0.00 0.00 177.93 181.70 2hc1 h GLN 1958N 1.04 1.04 -0.19 2.45 4.20 -0.42 0.81 115.11 124.05 2hc1 h GLN 1958Ca 0.26 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 2hc1 h GLN 1958Cb 0.11 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2hc1 h GLN 1958CO -0.03 0.89 0.11 0.00 -0.67 0.00 0.00 178.83 179.12 2hc1 h VAL 1960N 0.21 1.20 -0.51 0.00 2.07 -1.19 -1.60 116.25 116.43 2hc1 h VAL 1960Ca 0.07 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.12 2hc1 h VAL 1960Cb 0.05 0.60 -0.07 0.00 -1.52 0.00 0.00 31.29 30.34 2hc1 h VAL 1960CO -0.01 0.22 0.11 -0.09 0.02 0.00 0.00 177.57 177.82 2hc1 h ARG 1961N 0.70 0.25 -0.29 1.57 2.43 -0.66 -1.25 114.38 117.12 2hc1 h ARG 1961Ca 0.18 -0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.16 2hc1 h ARG 1961Cb 0.11 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2hc1 h ARG 1961CO -0.02 0.16 -0.48 -0.44 -1.51 0.00 0.00 179.97 177.68 2hc1 h ASP 1962N 0.26 0.93 -0.42 -3.80 3.32 -0.93 0.22 116.42 116.00 2hc1 h ASP 1962Ca 0.25 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 2hc1 h ASP 1962Cb 0.33 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2hc1 h ASP 1962CO -0.32 1.27 0.24 0.58 -1.72 0.00 0.00 179.24 179.29 2hc1 h VAL 1963N 0.61 1.14 -0.36 -1.35 2.07 -1.00 -2.37 116.25 115.00 2hc1 h VAL 1963Ca 0.02 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.07 2hc1 h VAL 1963Cb 1.09 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2hc1 h VAL 1963CO 0.11 0.15 -0.29 -0.07 0.02 0.00 0.00 177.57 177.49 2hc1 h LEU 1964N 0.55 0.79 -0.65 2.57 3.38 -1.08 -1.29 115.31 119.58 2hc1 h LEU 1964Ca 0.15 -0.31 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2hc1 h LEU 1964Cb 0.02 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 2hc1 h LEU 1964CO -0.03 1.03 0.38 0.03 0.09 0.00 0.00 178.44 179.94 2hc1 h ARG 1965N 0.65 0.71 -0.31 1.13 3.08 -0.87 -1.08 114.38 117.69 2hc1 h ARG 1965Ca 0.08 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 2hc1 h ARG 1965Cb 0.81 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 2hc1 h ARG 1965CO 0.07 0.47 0.07 0.00 -1.07 0.00 0.00 179.97 179.51 2hc1 h ALA 1966N 1.30 0.41 -0.22 0.04 0.00 -1.10 -3.23 119.26 116.47 2hc1 h ALA 1966Ca 0.27 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2hc1 h ALA 1966Cb 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2hc1 h ALA 1966CO -0.13 0.09 -0.26 0.00 0.00 0.00 0.00 179.25 178.95 2hc1 h ARG 1967N 0.35 0.42 -0.25 0.00 3.08 -0.93 -2.80 114.38 114.24 2hc1 h ARG 1967Ca 0.10 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 60.07 2hc1 h ARG 1967Cb 0.31 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 2hc1 h ARG 1967CO 0.00 0.65 0.19 -0.22 -1.07 0.00 0.00 179.97 179.52 2hc1 h LYS 1968N 0.37 0.00 -0.02 0.04 3.64 -1.22 -1.79 116.57 117.59 2hc1 h LYS 1968Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2hc1 h LYS 1968Cb 0.65 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2hc1 h LYS 1968CO 0.05 0.00 -0.07 1.28 -2.27 0.00 0.00 179.45 178.44 2hc1 n LEU 1969N -4.40 2.38 -0.11 5.20 4.77 -1.06 -5.13 117.00 118.65 2hc1 n LEU 1969Ca 0.03 -0.80 0.01 0.00 -0.03 0.00 0.00 56.01 55.23 2hc1 n LEU 1969Cb 0.34 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2hc1 n LEU 1969CO 0.35 0.40 0.29 0.54 -1.33 0.00 0.00 177.39 177.64