#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i5x n THR 1679N 0.00 0.02 -3.61 -0.18 -2.24 -1.26 -5.05 114.28 101.96 2i5x n THR 1679Ca 0.00 -0.34 -0.15 0.00 -2.27 0.00 0.00 64.05 61.29 2i5x n THR 1679Cb 0.00 1.32 -0.07 0.00 -2.10 0.00 0.00 70.33 69.48 2i5x n THR 1679CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2i5x s SER 1680N -0.02 -0.61 -0.42 3.42 0.15 -1.26 -4.31 113.70 110.65 2i5x s SER 1680Ca 0.00 0.94 0.07 0.00 0.70 0.00 0.00 55.95 57.66 2i5x s SER 1680Cb 0.00 0.90 0.24 0.00 -1.71 0.00 0.00 66.02 65.45 2i5x s SER 1680CO 0.00 -0.40 0.60 0.00 1.20 0.00 0.00 173.24 174.64 2i5x s PRO 1682N -0.68 4.49 -0.17 0.00 0.04 -1.26 -4.58 135.00 132.84 2i5x s PRO 1682Ca 0.34 1.87 0.01 0.00 0.04 0.00 0.00 61.00 63.26 2i5x s PRO 1682Cb 0.18 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.48 2i5x s PRO 1682CO -0.15 -0.10 -0.18 0.42 0.04 0.00 0.00 177.00 177.03 2i5x s ILE 1683N 0.03 2.28 0.25 0.56 -1.09 0.01 -4.92 121.20 118.31 2i5x s ILE 1683Ca 0.53 -0.88 -0.30 0.00 -2.23 0.00 0.00 60.65 57.77 2i5x s ILE 1683Cb -0.32 -1.96 -0.14 0.00 -1.58 0.00 0.00 42.46 38.46 2i5x s ILE 1683CO 0.36 0.53 1.22 0.29 -1.23 0.00 0.00 174.94 176.11 2i5x n LYS 1684N 4.44 1.64 -0.30 2.79 4.76 -1.26 -1.36 118.16 128.87 2i5x n LYS 1684Ca -0.20 0.58 0.01 0.00 -2.87 0.00 0.00 58.31 55.83 2i5x n LYS 1684Cb 0.51 -2.11 0.15 0.00 -1.84 0.00 0.00 35.03 31.74 2i5x n LYS 1684CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2i5x h ILE 1685N 2.59 0.99 0.00 -0.18 2.04 -1.70 0.57 117.51 121.83 2i5x h ILE 1685Ca -0.43 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.12 2i5x h ILE 1685Cb 1.31 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 2i5x h ILE 1685CO 0.68 0.16 0.00 -0.46 0.00 0.00 0.00 178.15 178.54 2i5x n ASN 1686N -4.67 0.00 -0.31 1.72 6.94 -1.26 -2.20 115.26 115.48 2i5x n ASN 1686Ca 0.13 0.37 0.05 0.00 -0.02 0.00 0.00 54.58 55.11 2i5x n ASN 1686Cb 0.21 -0.43 0.02 0.00 -2.36 0.00 0.00 39.78 37.22 2i5x n ASN 1686CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2i5x n GLN 1687N -1.43 1.38 -0.15 -3.83 6.02 0.14 -4.74 117.38 114.78 2i5x n GLN 1687Ca 0.03 -0.83 -0.11 0.00 -0.01 0.00 0.00 57.00 56.08 2i5x n GLN 1687Cb 0.11 -1.13 -0.01 0.00 1.02 0.00 0.00 30.24 30.23 2i5x n GLN 1687CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2i5x h PHE 1688N 1.53 0.91 -0.33 1.08 3.57 -0.93 -1.30 116.94 121.46 2i5x h PHE 1688Ca 0.00 -0.19 0.06 0.00 3.53 0.00 0.00 57.97 61.37 2i5x h PHE 1688Cb 0.38 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 2i5x h PHE 1688CO 0.00 0.91 -0.00 0.93 -2.23 0.00 0.00 178.31 177.92 2i5x h GLU 1689N 0.64 0.09 -0.29 1.11 3.07 -1.85 -0.60 114.58 116.74 2i5x h GLU 1689Ca 0.11 -0.01 -0.14 0.00 -0.50 0.00 0.00 59.36 58.83 2i5x h GLU 1689Cb 0.61 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 2i5x h GLU 1689CO 0.04 0.06 -0.38 0.78 -1.40 0.00 0.00 179.01 178.10 2i5x h GLY 1690N 0.09 0.74 0.67 -3.84 0.00 -1.86 -2.32 103.07 96.54 2i5x h GLY 1690Ca 0.16 -0.73 0.03 0.00 0.00 0.00 0.00 47.33 46.79 2i5x h GLY 1690CO -0.27 0.66 -0.08 0.84 0.00 0.00 0.00 176.54 177.70 2i5x h HIS 1691N 0.56 -0.18 -0.50 5.60 -0.00 -0.78 -1.15 115.15 118.70 2i5x h HIS 1691Ca 0.05 0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.35 2i5x h HIS 1691Cb 0.91 0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 28.40 2i5x h HIS 1691CO 0.04 -0.12 -0.04 0.35 -0.00 0.00 0.00 177.93 178.16 2i5x h PHE 1692N -0.08 0.93 -0.73 5.26 3.57 -1.05 -1.11 116.94 123.73 2i5x h PHE 1692Ca 0.07 -0.15 0.03 0.00 3.53 0.00 0.00 57.97 61.44 2i5x h PHE 1692Cb 0.18 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2i5x h PHE 1692CO -0.19 0.87 0.46 0.52 -2.23 0.00 0.00 178.31 177.74 2i5x h MET 1693N 0.79 0.88 -0.51 1.11 2.86 -1.20 -0.20 114.93 118.66 2i5x h MET 1693Ca 0.14 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2i5x h MET 1693Cb 0.54 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 2i5x h MET 1693CO 0.03 0.58 0.33 -0.22 1.06 0.00 0.00 176.91 178.69 2i5x h LYS 1694N 0.91 0.69 -0.48 1.72 3.64 -0.61 -1.78 116.57 120.66 2i5x h LYS 1694Ca 0.29 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2i5x h LYS 1694Cb 0.01 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2i5x h LYS 1694CO -0.11 0.48 0.23 -0.07 -2.27 0.00 0.00 179.45 177.72 2i5x h LEU 1695N 0.69 0.59 -0.06 5.20 3.38 -0.60 -2.63 115.31 121.89 2i5x h LEU 1695Ca 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2i5x h LEU 1695Cb -0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.55 2i5x h LEU 1695CO -0.04 0.50 0.00 1.56 0.09 0.00 0.00 178.44 180.55 2i5x h GLN 1696N 0.66 0.00 -7.14 1.13 4.20 -0.59 -2.09 115.11 111.28 2i5x h GLN 1696Ca 0.17 0.00 -0.55 0.00 0.06 0.00 0.00 58.65 58.33 2i5x h GLN 1696Cb 0.06 0.00 0.16 0.00 0.30 0.00 0.00 27.48 28.00 2i5x h GLN 1696CO -0.02 0.00 0.46 0.00 -0.67 0.00 0.00 178.83 178.59 2i5x s ALA 1697N -3.20 2.24 -1.19 3.87 0.00 -0.71 -1.14 121.76 121.63 2i5x s ALA 1697Ca 0.08 1.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.98 2i5x s ALA 1697Cb 0.07 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2i5x s ALA 1697CO 0.64 -1.75 0.75 -0.25 0.00 0.00 0.00 175.76 175.16 2i5x n ASP 1698N -2.30 -4.02 -3.70 0.00 8.00 -1.26 -2.13 116.55 111.14 2i5x n ASP 1698Ca 0.15 -0.92 -0.25 0.00 0.71 0.00 0.00 54.79 54.47 2i5x n ASP 1698Cb 0.49 -3.79 0.03 0.00 -0.02 0.00 0.00 41.12 37.83 2i5x n ASP 1698CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2i5x n SER 1699N -2.88 -3.03 -2.34 -2.24 7.64 -1.23 -2.74 113.62 106.80 2i5x n SER 1699Ca -0.16 -0.92 -0.19 0.00 1.01 0.00 0.00 58.87 58.61 2i5x n SER 1699Cb 0.63 -3.73 0.01 0.00 -1.01 0.00 0.00 64.21 60.10 2i5x n SER 1699CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2i5x n ASN 1700N -2.92 -5.52 0.10 6.43 3.02 -0.29 -4.90 115.26 111.19 2i5x n ASN 1700Ca -0.21 -0.10 -0.13 0.00 -0.03 0.00 0.00 54.58 54.12 2i5x n ASN 1700Cb 0.64 -4.49 -0.06 0.00 -0.61 0.00 0.00 39.78 35.26 2i5x n ASN 1700CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2i5x h TYR 1701N -0.43 -0.30 -0.04 3.10 3.20 -1.23 0.92 116.97 122.20 2i5x h TYR 1701Ca -0.46 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.22 2i5x h TYR 1701Cb 1.33 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.71 2i5x h TYR 1701CO 0.49 -0.18 -0.80 -0.07 -1.64 0.00 0.00 178.16 175.96 2i5x h LEU 1702N -0.25 0.42 -0.10 2.82 3.38 -1.78 -2.42 115.31 117.38 2i5x h LEU 1702Ca 0.01 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2i5x h LEU 1702Cb 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2i5x h LEU 1702CO -0.04 1.06 0.05 0.25 0.09 0.00 0.00 178.44 179.86 2i5x h LEU 1703N 0.22 0.08 -0.81 1.67 6.46 -1.15 -1.59 115.31 120.18 2i5x h LEU 1703Ca -0.04 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2i5x h LEU 1703Cb 1.40 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 41.27 2i5x h LEU 1703CO 0.13 0.07 0.53 0.28 -0.62 0.00 0.00 178.44 178.83 2i5x h SER 1704N 0.11 0.90 -0.52 1.25 0.02 -0.79 -0.64 113.55 113.88 2i5x h SER 1704Ca 0.04 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2i5x h SER 1704Cb 0.00 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 2i5x h SER 1704CO -0.02 0.64 0.33 0.50 -1.14 0.00 0.00 176.83 177.14 2i5x h LYS 1705N 1.06 0.65 -0.14 3.45 3.64 -1.23 0.05 116.57 124.06 2i5x h LYS 1705Ca 0.31 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.64 2i5x h LYS 1705Cb -0.07 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 2i5x h LYS 1705CO -0.09 0.43 0.06 1.49 -2.27 0.00 0.00 179.45 179.07 2i5x h GLU 1706N 0.67 0.20 -0.52 1.90 4.81 -0.84 -2.66 114.58 118.15 2i5x h GLU 1706Ca 0.20 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 2i5x h GLU 1706Cb -0.04 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 2i5x h GLU 1706CO -0.06 0.29 0.19 -0.92 -0.73 0.00 0.00 179.01 177.77 2i5x h TYR 1707N 0.08 0.76 -0.70 0.92 3.20 -0.91 -2.55 116.97 117.77 2i5x h TYR 1707Ca 0.05 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 2i5x h TYR 1707Cb 0.15 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 2i5x h TYR 1707CO -0.02 0.60 0.23 0.93 -1.64 0.00 0.00 178.16 178.26 2i5x h GLU 1708N 0.74 1.06 -0.74 1.82 4.39 -0.84 -2.54 114.58 118.47 2i5x h GLU 1708Ca 0.18 -0.21 0.05 0.00 0.34 0.00 0.00 59.36 59.71 2i5x h GLU 1708Cb 0.17 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 2i5x h GLU 1708CO -0.01 0.90 0.45 0.93 -1.16 0.00 0.00 179.01 180.11 2i5x h GLU 1709N 1.03 0.82 0.00 2.33 5.08 -1.10 -1.99 114.58 120.75 2i5x h GLU 1709Ca 0.23 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2i5x h GLU 1709Cb 0.27 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2i5x h GLU 1709CO -0.01 0.54 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.41 2i5x h LEU 1710N 0.84 0.00 -1.56 1.33 3.38 -1.28 -1.89 115.31 116.13 2i5x h LEU 1710Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2i5x h LEU 1710Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2i5x h LEU 1710CO -0.15 0.06 0.00 0.11 0.09 0.00 0.00 178.44 178.55 2i5x h LYS 1711N 0.00 0.00 0.00 1.13 1.57 -1.28 -1.73 116.57 116.26 2i5x h LYS 1711Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2i5x h LYS 1711Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2i5x h LYS 1711CO 0.01 0.00 -0.39 -0.25 -0.57 0.00 0.00 179.45 178.24 2i5x n ASP 1712N -2.87 0.40 -4.73 0.86 8.00 -0.71 -4.87 116.55 112.63 2i5x n ASP 1712Ca 0.00 -0.07 -0.42 0.00 0.71 0.00 0.00 54.79 55.01 2i5x n ASP 1712Cb 0.24 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 2i5x n ASP 1712CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2i5x s VAL 1713N -3.01 3.38 0.00 2.53 1.01 -0.65 -2.75 120.40 120.92 2i5x s VAL 1713Ca 0.11 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.16 2i5x s VAL 1713Cb 0.18 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.88 2i5x s VAL 1713CO 0.66 0.12 0.00 0.61 0.00 0.00 0.00 175.10 176.50 2i5x n GLY 1714N 2.87 0.91 0.07 4.51 0.00 -1.26 -4.57 105.19 107.72 2i5x n GLY 1714Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 2i5x n GLY 1714CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2i5x n ARG 1715N -2.14 1.10 0.00 1.61 0.63 -1.11 -2.45 116.66 114.30 2i5x n ARG 1715Ca 0.00 -0.14 0.15 0.00 -0.92 0.00 0.00 57.85 56.94 2i5x n ARG 1715Cb 0.00 -1.43 0.87 0.00 0.45 0.00 0.00 32.46 32.35 2i5x n ARG 1715CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2i5x n ASN 1716N -0.77 0.00 -4.86 6.15 2.04 -1.26 -4.91 115.26 111.65 2i5x n ASN 1716Ca 0.20 -0.69 -0.37 0.00 -0.44 0.00 0.00 54.58 53.28 2i5x n ASN 1716Cb 0.13 -0.10 -0.06 0.00 -2.53 0.00 0.00 39.78 37.22 2i5x n ASN 1716CO 0.00 0.00 0.00 -1.10 -0.44 0.00 0.00 177.26 175.72 2i5x s GLN 1717N -2.20 3.65 0.49 -3.83 -0.21 -1.03 -5.09 119.66 111.44 2i5x s GLN 1717Ca 0.41 0.10 -0.05 0.00 0.02 0.00 0.00 55.36 55.84 2i5x s GLN 1717Cb 0.21 -3.20 -0.03 0.00 1.00 0.00 0.00 33.01 30.99 2i5x s GLN 1717CO 0.40 0.74 0.79 -1.54 -2.12 0.00 0.00 175.29 173.56 2i5x s SER 1718N -1.04 6.16 -0.33 5.90 1.04 -1.26 -4.94 113.70 119.22 2i5x s SER 1718Ca 0.19 0.87 0.13 0.00 0.48 0.00 0.00 55.95 57.61 2i5x s SER 1718Cb -0.14 -2.14 0.46 0.00 0.10 0.00 0.00 66.02 64.30 2i5x s SER 1718CO 0.08 -0.64 1.09 0.00 0.98 0.00 0.00 173.24 174.74 2i5x h ASP 1720N 2.60 1.02 -0.36 0.00 3.32 -1.95 -2.91 116.42 118.13 2i5x h ASP 1720Ca 0.11 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.95 2i5x h ASP 1720Cb 1.22 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.49 2i5x h ASP 1720CO 0.58 0.92 0.03 0.40 -1.72 0.00 0.00 179.24 179.45 2i5x h ILE 1721N 1.08 1.25 -0.00 0.35 1.08 -1.92 -2.13 117.51 117.22 2i5x h ILE 1721Ca 0.25 -0.92 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 2i5x h ILE 1721Cb 0.22 1.14 -0.00 0.00 -3.07 0.00 0.00 36.82 35.12 2i5x h ILE 1721CO -0.02 0.31 0.00 0.00 -0.69 0.00 0.00 178.15 177.75 2i5x h ALA 1722N 0.88 1.52 -0.01 1.87 0.00 -1.81 -1.96 119.26 119.75 2i5x h ALA 1722Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2i5x h ALA 1722Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2i5x h ALA 1722CO 0.01 -0.00 -0.20 1.28 0.00 0.00 0.00 179.25 180.34 2i5x n LEU 1723N -3.83 0.91 -4.77 0.00 4.77 -0.82 -4.53 117.00 108.74 2i5x n LEU 1723Ca -0.03 -0.21 -0.40 0.00 -0.03 0.00 0.00 56.01 55.34 2i5x n LEU 1723Cb 0.08 -0.13 0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2i5x n LEU 1723CO 0.27 0.17 1.09 -0.76 -1.33 0.00 0.00 177.39 176.83 2i5x s LEU 1724N -2.45 4.23 0.30 2.23 1.43 -0.74 -4.87 118.68 118.80 2i5x s LEU 1724Ca 0.27 2.96 0.05 0.00 -1.03 0.00 0.00 54.13 56.37 2i5x s LEU 1724Cb 0.20 -3.79 0.71 0.00 0.03 0.00 0.00 46.19 43.34 2i5x s LEU 1724CO 0.49 -0.98 1.77 -0.65 0.23 0.00 0.00 176.35 177.21 2i5x h PRO 1725N 2.72 0.72 0.00 1.29 0.11 -1.91 0.78 132.00 135.70 2i5x h PRO 1725Ca -0.51 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2i5x h PRO 1725Cb 1.25 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2i5x h PRO 1725CO 0.63 0.47 0.00 1.05 -0.21 0.00 0.00 178.00 179.94 2i5x h GLU 1726N 0.74 0.00 -0.01 1.05 4.11 -1.95 -2.74 114.58 115.77 2i5x h GLU 1726Ca 0.57 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.00 2i5x h GLU 1726Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2i5x h GLU 1726CO -0.39 0.00 -0.45 0.09 0.07 0.00 0.00 179.01 178.34 2i5x n ASN 1727N -2.47 1.80 -0.35 3.06 3.02 0.26 -4.65 115.26 115.93 2i5x n ASN 1727Ca 0.00 -1.40 0.05 0.00 -0.03 0.00 0.00 54.58 53.21 2i5x n ASN 1727Cb 0.16 0.51 0.21 0.00 -0.61 0.00 0.00 39.78 40.05 2i5x n ASN 1727CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2i5x h ARG 1728N 2.02 0.95 0.00 3.52 3.08 -1.38 0.72 114.38 123.29 2i5x h ARG 1728Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2i5x h ARG 1728Cb 0.65 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2i5x h ARG 1728CO 0.00 0.63 0.00 0.41 -1.07 0.00 0.00 179.97 179.94 2i5x n GLY 1729N -1.34 -0.99 0.71 0.04 0.00 -1.26 -3.06 105.19 99.29 2i5x n GLY 1729Ca 0.17 -0.13 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2i5x n GLY 1729CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i5x n LYS 1730N -1.19 1.74 -4.19 1.61 5.02 0.25 -4.86 118.16 116.54 2i5x n LYS 1730Ca 0.14 -1.42 -0.34 0.00 -2.02 0.00 0.00 58.31 54.66 2i5x n LYS 1730Cb 0.16 -1.47 -0.12 0.00 -0.02 0.00 0.00 35.03 33.57 2i5x n LYS 1730CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2i5x s ASN 1731N -2.25 4.85 0.12 4.39 0.01 -1.17 -4.53 114.94 116.37 2i5x s ASN 1731Ca 0.23 -0.16 -0.14 0.00 -0.71 0.00 0.00 52.86 52.08 2i5x s ASN 1731Cb 0.19 -1.82 -0.02 0.00 0.41 0.00 0.00 41.25 40.01 2i5x s ASN 1731CO 0.44 0.11 1.55 -0.09 -1.51 0.00 0.00 177.10 177.59 2i5x h ARG 1732N 7.17 0.74 -5.23 -0.60 2.43 -1.89 -3.41 114.38 113.59 2i5x h ARG 1732Ca -0.34 -0.26 -0.67 0.00 -0.81 0.00 0.00 59.98 57.89 2i5x h ARG 1732Cb 1.18 -0.05 -0.34 0.00 -0.42 0.00 0.00 29.97 30.34 2i5x h ARG 1732CO 0.62 0.86 -0.87 0.71 -1.51 0.00 0.00 179.97 179.77 2i5x s TYR 1733N -4.88 2.59 0.48 2.20 2.02 -1.26 -5.01 117.35 113.48 2i5x s TYR 1733Ca -0.13 -1.21 0.39 0.00 -0.37 0.00 0.00 57.07 55.76 2i5x s TYR 1733Cb 0.10 -1.75 2.02 0.00 -0.40 0.00 0.00 41.96 41.93 2i5x s TYR 1733CO 0.81 -0.53 2.23 -0.91 -1.57 0.00 0.00 175.55 175.58 2i5x h ASN 1734N 7.09 0.00 -0.41 2.29 2.35 -1.95 -2.34 115.58 122.60 2i5x h ASN 1734Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 2i5x h ASN 1734Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 2i5x h ASN 1734CO 0.52 0.01 0.00 -0.46 -1.65 0.00 0.00 177.43 175.85 2i5x n ASN 1735N -3.17 3.35 -3.91 5.81 6.94 -1.26 -4.79 115.26 118.23 2i5x n ASN 1735Ca -0.02 -2.17 -0.30 0.00 -0.02 0.00 0.00 54.58 52.07 2i5x n ASN 1735Cb 0.15 -0.34 -0.15 0.00 -2.36 0.00 0.00 39.78 37.09 2i5x n ASN 1735CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2i5x s ILE 1736N -1.31 1.94 0.05 1.53 -1.09 -0.88 -5.10 121.20 116.34 2i5x s ILE 1736Ca 0.31 -2.38 0.04 0.00 -2.23 0.00 0.00 60.65 56.39 2i5x s ILE 1736Cb 0.18 -2.41 -0.02 0.00 -1.58 0.00 0.00 42.46 38.63 2i5x s ILE 1736CO 0.18 -0.70 -0.12 -0.76 -1.23 0.00 0.00 174.94 172.31 2i5x s LEU 1737N 0.73 2.20 0.45 2.97 1.43 -1.26 -4.66 118.68 120.54 2i5x s LEU 1737Ca 0.13 -0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 52.51 2i5x s LEU 1737Cb -0.21 -0.47 -0.08 0.00 0.03 0.00 0.00 46.19 45.47 2i5x s LEU 1737CO -0.09 -0.04 1.15 -2.16 0.23 0.00 0.00 176.35 175.44 2i5x s PRO 1738N -1.31 3.83 0.34 1.29 0.04 -1.26 -4.67 135.00 133.25 2i5x s PRO 1738Ca -0.02 1.75 -0.29 0.00 0.04 0.00 0.00 61.00 62.49 2i5x s PRO 1738Cb -0.08 -2.44 -0.10 0.00 0.04 0.00 0.00 34.50 31.91 2i5x s PRO 1738CO 0.01 -0.49 1.36 0.71 0.04 0.00 0.00 177.00 178.64 2i5x s TYR 1739N -1.55 2.92 0.28 0.56 2.02 -1.26 -4.56 117.35 115.75 2i5x s TYR 1739Ca 0.62 1.32 0.01 0.00 -0.37 0.00 0.00 57.07 58.66 2i5x s TYR 1739Cb -0.28 -3.78 0.62 0.00 -0.40 0.00 0.00 41.96 38.12 2i5x s TYR 1739CO 0.34 -2.22 1.75 -0.44 -1.57 0.00 0.00 175.55 173.41 2i5x h ASP 1740N 3.41 0.54 0.49 2.29 3.32 -1.36 -1.88 116.42 123.23 2i5x h ASP 1740Ca -0.49 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 2i5x h ASP 1740Cb 1.23 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 2i5x h ASP 1740CO 0.66 0.18 -0.06 0.00 -1.72 0.00 0.00 179.24 178.30 2i5x h ALA 1741N 1.61 1.12 0.00 3.45 0.00 -1.92 -3.25 119.26 120.27 2i5x h ALA 1741Ca 0.51 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2i5x h ALA 1741Cb 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2i5x h ALA 1741CO -0.40 0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.17 2i5x n THR 1742N -3.33 0.32 -1.89 0.00 -2.24 -0.97 -5.08 114.28 101.08 2i5x n THR 1742Ca -0.01 -0.34 -0.34 0.00 -2.27 0.00 0.00 64.05 61.08 2i5x n THR 1742Cb 0.23 0.91 0.04 0.00 -2.10 0.00 0.00 70.33 69.41 2i5x n THR 1742CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i5x s ARG 1743N -0.32 2.88 -0.11 -0.78 1.70 -0.75 -1.27 118.95 120.30 2i5x s ARG 1743Ca 0.00 1.59 -0.25 0.00 -0.47 0.00 0.00 55.73 56.60 2i5x s ARG 1743Cb 0.00 -1.94 -0.03 0.00 -0.57 0.00 0.00 34.95 32.41 2i5x s ARG 1743CO 0.00 -1.23 0.78 0.08 -1.08 0.00 0.00 175.30 173.86 2i5x s VAL 1744N -1.99 4.96 -0.14 4.99 1.01 -0.52 -4.72 120.40 123.99 2i5x s VAL 1744Ca 0.72 1.58 -0.10 0.00 0.00 0.00 0.00 61.98 64.18 2i5x s VAL 1744Cb -0.25 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 31.98 2i5x s VAL 1744CO 0.36 0.14 0.19 -0.54 0.00 0.00 0.00 175.10 175.26 2i5x s LYS 1745N 1.42 3.86 0.38 2.72 1.02 -1.26 -4.12 119.74 123.77 2i5x s LYS 1745Ca 0.39 -0.06 -0.24 0.00 0.02 0.00 0.00 55.97 56.08 2i5x s LYS 1745Cb -0.18 -3.30 -0.10 0.00 -0.52 0.00 0.00 37.83 33.73 2i5x s LYS 1745CO 0.17 0.53 0.96 -0.51 -0.92 0.00 0.00 175.35 175.58 2i5x s LEU 1746N -0.35 4.14 0.31 3.17 1.43 0.09 -5.03 118.68 122.43 2i5x s LEU 1746Ca 0.14 1.80 -0.28 0.00 -1.03 0.00 0.00 54.13 54.75 2i5x s LEU 1746Cb -0.12 -4.27 -0.13 0.00 0.03 0.00 0.00 46.19 41.69 2i5x s LEU 1746CO 0.03 -0.26 1.19 -1.54 0.23 0.00 0.00 176.35 176.00 2i5x n SER 1747N -0.06 2.14 0.00 2.29 3.41 -1.26 -4.49 113.62 115.65 2i5x n SER 1747Ca 0.05 1.19 0.00 0.00 -0.26 0.00 0.00 58.87 59.84 2i5x n SER 1747Cb 0.52 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2i5x n SER 1747CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2i5x n ASN 1748N 1.12 0.00 -0.90 4.04 2.04 -1.26 -4.74 115.26 115.56 2i5x n ASN 1748Ca 0.08 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.22 2i5x n ASN 1748Cb 0.34 0.20 -0.00 0.00 -2.53 0.00 0.00 39.78 37.79 2i5x n ASN 1748CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 2i5x n PRO 1753N -0.71 -0.13 -1.05 -0.53 -0.04 -1.26 -4.19 135.00 127.10 2i5x n PRO 1753Ca 0.00 0.10 -0.19 0.00 -0.04 0.00 0.00 63.50 63.37 2i5x n PRO 1753Cb 0.00 -0.61 0.01 0.00 -0.04 0.00 0.00 33.50 32.86 2i5x n PRO 1753CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i5x n SER 1755N 0.55 0.00 -0.21 0.00 3.41 -1.26 -2.62 113.62 113.48 2i5x n SER 1755Ca 0.35 0.39 0.15 0.00 -0.26 0.00 0.00 58.87 59.50 2i5x n SER 1755Cb 0.58 -0.39 0.69 0.00 -0.26 0.00 0.00 64.21 64.83 2i5x n SER 1755CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2i5x n ASP 1756N -1.39 0.68 -4.71 4.04 5.75 -1.26 -4.74 116.55 114.92 2i5x n ASP 1756Ca 0.00 -1.05 -0.38 0.00 -0.01 0.00 0.00 54.79 53.35 2i5x n ASP 1756Cb 0.02 -0.02 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 2i5x n ASP 1756CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2i5x s TYR 1757N -2.15 3.50 0.03 2.11 5.04 -1.08 -0.73 117.35 124.07 2i5x s TYR 1757Ca 0.38 0.90 0.01 0.00 -2.44 0.00 0.00 57.07 55.92 2i5x s TYR 1757Cb 0.21 -2.58 -0.02 0.00 0.35 0.00 0.00 41.96 39.92 2i5x s TYR 1757CO 0.39 0.13 -0.05 -1.50 -1.34 0.00 0.00 175.55 173.18 2i5x s ILE 1758N 0.76 0.31 -1.12 3.14 2.07 -1.26 -4.91 121.20 120.19 2i5x s ILE 1758Ca 0.26 -0.90 -0.21 0.00 -1.41 0.00 0.00 60.65 58.39 2i5x s ILE 1758Cb -0.15 -0.40 0.04 0.00 0.13 0.00 0.00 42.46 42.08 2i5x s ILE 1758CO 0.11 -0.39 1.62 0.21 -1.91 0.00 0.00 174.94 174.57 2i5x s ASN 1759N -1.37 6.45 0.05 4.50 3.84 -1.26 -4.65 114.94 122.50 2i5x s ASN 1759Ca -0.12 -1.77 -0.26 0.00 0.21 0.00 0.00 52.86 50.93 2i5x s ASN 1759Cb -0.09 -2.57 0.06 0.00 -0.55 0.00 0.00 41.25 38.10 2i5x s ASN 1759CO -0.00 -1.56 0.60 0.00 -2.79 0.00 0.00 177.10 173.35 2i5x s ALA 1760N 5.40 -1.56 0.01 1.71 0.00 -1.26 -2.86 121.76 123.19 2i5x s ALA 1760Ca 0.52 0.81 0.00 0.00 0.00 0.00 0.00 51.96 53.29 2i5x s ALA 1760Cb 0.01 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.54 2i5x s ALA 1760CO -0.02 -0.54 -0.02 -1.12 0.00 0.00 0.00 175.76 174.06 2i5x s SER 1761N -1.95 0.19 0.15 0.00 0.01 0.32 -1.44 113.70 110.97 2i5x s SER 1761Ca -0.05 -0.14 -0.30 0.00 1.31 0.00 0.00 55.95 56.77 2i5x s SER 1761Cb -0.01 0.01 -0.07 0.00 0.21 0.00 0.00 66.02 66.17 2i5x s SER 1761CO -0.01 -0.06 0.94 -0.31 0.41 0.00 0.00 173.24 174.21 2i5x s TYR 1762N -0.37 3.86 -0.08 2.43 2.02 -0.40 -0.81 117.35 124.01 2i5x s TYR 1762Ca -0.03 1.82 0.01 0.00 -0.37 0.00 0.00 57.07 58.50 2i5x s TYR 1762Cb -0.03 -3.01 0.02 0.00 -0.40 0.00 0.00 41.96 38.53 2i5x s TYR 1762CO -0.00 0.29 -0.11 0.42 -1.57 0.00 0.00 175.55 174.58 2i5x s ILE 1763N -0.38 1.12 0.64 2.71 -1.09 -0.22 -4.89 121.20 119.10 2i5x s ILE 1763Ca 0.44 -0.43 -0.17 0.00 -2.23 0.00 0.00 60.65 58.26 2i5x s ILE 1763Cb -0.24 -1.05 -0.01 0.00 -1.58 0.00 0.00 42.46 39.58 2i5x s ILE 1763CO 0.30 0.36 1.17 -2.84 -1.23 0.00 0.00 174.94 172.70 2i5x s PRO 1764N 0.96 2.77 0.00 2.79 0.02 -1.00 -1.61 135.00 138.93 2i5x s PRO 1764Ca -0.09 1.66 0.00 0.00 0.02 0.00 0.00 61.00 62.59 2i5x s PRO 1764Cb -0.15 -1.92 0.00 0.00 0.02 0.00 0.00 34.50 32.45 2i5x s PRO 1764CO 0.00 -1.33 0.00 0.41 -0.33 0.00 0.00 177.00 175.76 2i5x n GLY 1765N 0.16 6.92 0.28 0.52 0.00 -0.61 -4.82 105.19 107.64 2i5x n GLY 1765Ca 0.12 -1.87 0.14 0.00 0.00 0.00 0.00 46.02 44.42 2i5x n GLY 1765CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2i5x h ASN 1766N 0.00 0.00 0.00 1.61 4.21 -1.96 -3.36 115.58 116.08 2i5x h ASN 1766Ca 0.00 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.44 2i5x h ASN 1766Cb 0.00 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.19 2i5x h ASN 1766CO 0.00 0.09 -1.27 0.59 -1.29 0.00 0.00 177.43 175.54 2i5x n ASN 1767N -3.56 3.71 -3.87 5.81 3.02 -1.26 -5.08 115.26 114.03 2i5x n ASN 1767Ca -0.02 -0.02 -0.09 0.00 -0.03 0.00 0.00 54.58 54.42 2i5x n ASN 1767Cb 0.21 0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.40 2i5x n ASN 1767CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2i5x s PHE 1768N -2.10 0.06 -0.12 3.10 -0.71 -1.26 -5.08 117.98 111.87 2i5x s PHE 1768Ca -0.06 -0.44 0.16 0.00 -1.04 0.00 0.00 56.93 55.56 2i5x s PHE 1768Cb 0.02 0.38 0.20 0.00 -1.21 0.00 0.00 43.02 42.40 2i5x s PHE 1768CO 0.12 -1.02 1.51 0.00 -1.34 0.00 0.00 175.22 174.49 2i5x h ARG 1769N 2.18 0.00 -1.84 1.99 3.08 -1.90 -1.61 114.38 116.28 2i5x h ARG 1769Ca -0.25 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.15 2i5x h ARG 1769Cb 1.25 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.93 2i5x h ARG 1769CO 0.33 0.44 -0.16 0.54 -1.07 0.00 0.00 179.97 180.06 2i5x n ARG 1770N -3.26 3.42 0.10 0.04 1.74 -1.26 -2.37 116.66 115.07 2i5x n ARG 1770Ca 0.02 -4.37 -0.05 0.00 -0.77 0.00 0.00 57.85 52.67 2i5x n ARG 1770Cb 0.68 -2.27 0.02 0.00 -1.02 0.00 0.00 32.46 29.87 2i5x n ARG 1770CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2i5x h GLU 1771N 2.89 0.06 -5.21 5.56 4.81 -1.47 -3.37 114.58 117.87 2i5x h GLU 1771Ca 0.35 -0.07 -0.39 0.00 -0.13 0.00 0.00 59.36 59.13 2i5x h GLU 1771Cb 0.59 0.02 -0.21 0.00 0.63 0.00 0.00 28.75 29.78 2i5x h GLU 1771CO 1.00 0.84 -0.77 0.71 -0.73 0.00 0.00 179.01 180.07 2i5x s TYR 1772N -3.20 1.13 -0.18 0.92 2.02 -0.63 -1.49 117.35 115.91 2i5x s TYR 1772Ca -0.01 -0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 56.17 2i5x s TYR 1772Cb 0.11 -0.64 -0.02 0.00 -0.40 0.00 0.00 41.96 41.02 2i5x s TYR 1772CO 0.80 0.04 -0.05 0.42 -1.57 0.00 0.00 175.55 175.19 2i5x s ILE 1773N -1.41 3.53 -0.05 2.71 1.01 -0.14 -1.05 121.20 125.79 2i5x s ILE 1773Ca -0.02 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 2i5x s ILE 1773Cb -0.09 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 2i5x s ILE 1773CO 0.02 0.46 0.02 0.68 0.00 0.00 0.00 174.94 176.12 2i5x s VAL 1774N 0.90 4.36 0.14 2.92 -7.23 0.01 -0.78 120.40 120.73 2i5x s VAL 1774Ca -0.01 -0.35 -0.09 0.00 -1.81 0.00 0.00 61.98 59.72 2i5x s VAL 1774Cb -0.15 -2.89 -0.00 0.00 0.56 0.00 0.00 36.38 33.90 2i5x s VAL 1774CO 0.01 0.51 0.27 0.28 -0.31 0.00 0.00 175.10 175.86 2i5x s THR 1775N -0.98 0.09 0.82 5.32 -1.32 -1.00 -0.52 115.64 118.04 2i5x s THR 1775Ca 0.16 -1.29 -0.11 0.00 -1.21 0.00 0.00 61.69 59.24 2i5x s THR 1775Cb -0.11 -1.68 0.09 0.00 -1.51 0.00 0.00 72.50 69.29 2i5x s THR 1775CO 0.06 -0.39 1.09 0.00 -2.21 0.00 0.00 174.62 173.17 2i5x s GLN 1776N -3.93 1.85 0.05 7.08 -2.07 -1.13 -3.76 119.66 117.75 2i5x s GLN 1776Ca 0.13 0.80 -0.30 0.00 -1.82 0.00 0.00 55.36 54.17 2i5x s GLN 1776Cb 0.04 -1.88 -0.09 0.00 -1.09 0.00 0.00 33.01 29.99 2i5x s GLN 1776CO -0.03 -1.82 1.89 0.20 -1.32 0.00 0.00 175.29 174.20 2i5x s GLY 1777N -3.65 1.44 0.37 2.60 0.00 0.08 -4.83 107.32 103.33 2i5x s GLY 1777Ca 0.62 1.31 -0.26 0.00 0.00 0.00 0.00 44.72 46.39 2i5x s GLY 1777CO 0.56 3.32 0.95 -1.05 0.00 0.00 0.00 173.10 176.88 2i5x n PRO 1778N 6.94 1.26 -3.13 2.90 -0.02 -1.26 -4.64 135.00 137.05 2i5x n PRO 1778Ca 0.19 0.45 -0.24 0.00 -2.02 0.00 0.00 63.50 61.87 2i5x n PRO 1778Cb 0.40 -1.90 -0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2i5x n PRO 1778CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i5x s LEU 1779N 0.15 3.85 0.30 2.45 1.43 -1.26 -1.39 118.68 124.21 2i5x s LEU 1779Ca 0.61 0.53 0.05 0.00 -1.03 0.00 0.00 54.13 54.29 2i5x s LEU 1779Cb -0.62 -3.41 0.76 0.00 0.03 0.00 0.00 46.19 42.94 2i5x s LEU 1779CO 0.58 -0.44 1.71 -0.65 0.23 0.00 0.00 176.35 177.78 2i5x h PRO 1780N 0.56 0.44 -0.01 1.29 0.11 -1.96 -0.33 132.00 132.10 2i5x h PRO 1780Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2i5x h PRO 1780Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2i5x h PRO 1780CO 0.61 0.29 -0.06 0.41 -0.21 0.00 0.00 178.00 179.04 2i5x n GLY 1781N -1.33 -0.37 0.04 -0.55 0.00 -1.26 -3.90 105.19 97.82 2i5x n GLY 1781Ca 0.23 -0.38 0.01 0.00 0.00 0.00 0.00 46.02 45.88 2i5x n GLY 1781CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i5x n THR 1782N -0.28 0.00 0.22 2.61 -2.24 -0.28 -4.74 114.28 109.58 2i5x n THR 1782Ca 0.18 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.54 2i5x n THR 1782Cb 0.31 1.02 0.52 0.00 -2.10 0.00 0.00 70.33 70.08 2i5x n THR 1782CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2i5x h LYS 1783N 0.20 0.00 -0.64 -0.78 2.10 -1.28 -0.56 116.57 115.61 2i5x h LYS 1783Ca 0.00 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.57 2i5x h LYS 1783Cb 0.04 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.35 2i5x h LYS 1783CO 0.00 0.24 0.07 -0.44 -2.00 0.00 0.00 179.45 177.32 2i5x h ASP 1784N 0.00 1.04 -0.64 7.07 3.32 -1.85 -1.44 116.42 123.93 2i5x h ASP 1784Ca -0.00 -0.26 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 2i5x h ASP 1784Cb 0.51 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2i5x h ASP 1784CO 0.03 1.05 0.38 0.44 -1.72 0.00 0.00 179.24 179.42 2i5x h ASP 1785N 1.00 0.77 -0.00 6.45 3.32 -1.60 -0.91 116.42 125.44 2i5x h ASP 1785Ca 0.19 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.19 2i5x h ASP 1785Cb 0.48 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2i5x h ASP 1785CO 0.02 0.61 -0.08 0.15 -1.72 0.00 0.00 179.24 178.22 2i5x h PHE 1786N 0.86 -0.20 -0.29 4.55 3.57 -0.88 -0.12 116.94 124.44 2i5x h PHE 1786Ca 0.23 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.64 2i5x h PHE 1786Cb -0.01 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2i5x h PHE 1786CO -0.02 -0.12 -0.23 -1.49 -2.23 0.00 0.00 178.31 174.22 2i5x h TRP 1787N -0.14 0.62 -0.38 0.41 4.06 -1.14 -1.10 115.95 118.27 2i5x h TRP 1787Ca 0.03 -0.13 0.03 0.00 2.06 0.00 0.00 58.89 60.88 2i5x h TRP 1787Cb 0.18 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.15 2i5x h TRP 1787CO -0.15 0.74 0.19 -0.22 -3.56 0.00 0.00 178.44 175.45 2i5x h LYS 1788N 0.49 0.38 -0.38 0.49 3.64 -0.90 -0.52 116.57 119.78 2i5x h LYS 1788Ca 0.07 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2i5x h LYS 1788Cb 0.66 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.35 2i5x h LYS 1788CO 0.05 0.25 0.14 1.98 -2.27 0.00 0.00 179.45 179.60 2i5x h MET 1789N 0.40 0.29 -0.51 1.90 4.05 -0.59 0.30 114.93 120.76 2i5x h MET 1789Ca 0.16 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.63 2i5x h MET 1789Cb 0.06 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 30.74 2i5x h MET 1789CO -0.11 0.19 0.20 0.28 0.23 0.00 0.00 176.91 177.70 2i5x h VAL 1790N 0.29 0.86 0.45 -5.77 2.07 -0.87 -0.35 116.25 112.93 2i5x h VAL 1790Ca 0.17 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2i5x h VAL 1790Cb 0.14 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 2i5x h VAL 1790CO -0.17 0.07 -0.22 -0.25 0.02 0.00 0.00 177.57 177.02 2i5x h TRP 1791N 0.39 -0.56 -0.00 1.57 2.91 -0.75 -1.89 115.95 117.62 2i5x h TRP 1791Ca 0.24 -0.01 -0.07 0.00 1.13 0.00 0.00 58.89 60.18 2i5x h TRP 1791Cb 0.23 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.06 2i5x h TRP 1791CO -0.15 -0.31 -0.31 0.93 -1.03 0.00 0.00 178.44 177.58 2i5x h GLU 1792N -0.69 0.00 -0.27 2.65 5.08 -0.76 -2.54 114.58 118.06 2i5x h GLU 1792Ca -0.06 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2i5x h GLU 1792Cb 0.51 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2i5x h GLU 1792CO 0.10 0.32 0.00 1.04 -1.00 0.00 0.00 179.01 179.47 2i5x n GLN 1793N -4.17 1.97 -3.31 2.33 1.13 -0.16 -4.94 117.38 110.23 2i5x n GLN 1793Ca -0.02 -1.47 -0.24 0.00 -1.94 0.00 0.00 57.00 53.33 2i5x n GLN 1793Cb 0.36 -1.41 0.04 0.00 0.11 0.00 0.00 30.24 29.33 2i5x n GLN 1793CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2i5x n ASN 1794N 0.69 -5.73 -4.73 1.08 3.02 -0.96 -4.10 115.26 104.54 2i5x n ASN 1794Ca 0.17 -0.42 -0.42 0.00 -0.03 0.00 0.00 54.58 53.88 2i5x n ASN 1794Cb 0.40 -4.60 -0.03 0.00 -0.61 0.00 0.00 39.78 34.95 2i5x n ASN 1794CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2i5x s VAL 1795N -3.19 3.48 -0.08 2.41 1.01 -0.73 -0.37 120.40 122.92 2i5x s VAL 1795Ca 0.43 1.14 0.11 0.00 0.00 0.00 0.00 61.98 63.65 2i5x s VAL 1795Cb -0.20 -3.73 -0.16 0.00 0.00 0.00 0.00 36.38 32.30 2i5x s VAL 1795CO 0.53 0.13 0.26 1.41 0.00 0.00 0.00 175.10 177.43 2i5x n HIS 1796N 3.29 0.00 -4.23 5.22 8.25 -1.26 -4.87 115.22 121.63 2i5x n HIS 1796Ca 0.08 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.32 2i5x n HIS 1796Cb 0.44 -0.21 -0.17 0.00 1.12 0.00 0.00 29.99 31.17 2i5x n HIS 1796CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2i5x s ASN 1797N -3.05 1.34 -0.09 0.41 -0.87 -1.26 -0.64 114.94 110.78 2i5x s ASN 1797Ca -0.03 -0.19 0.04 0.00 -1.57 0.00 0.00 52.86 51.11 2i5x s ASN 1797Cb 0.07 -0.59 0.00 0.00 -0.02 0.00 0.00 41.25 40.71 2i5x s ASN 1797CO 0.44 -0.05 -0.21 -0.63 -2.57 0.00 0.00 177.10 174.08 2i5x s ILE 1798N 1.00 1.82 -0.17 0.60 1.01 0.14 -1.70 121.20 123.89 2i5x s ILE 1798Ca -0.09 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 2i5x s ILE 1798Cb -0.14 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 2i5x s ILE 1798CO -0.00 0.51 -0.11 -0.69 0.00 0.00 0.00 174.94 174.65 2i5x s VAL 1799N 0.37 3.08 -0.18 2.92 1.01 0.12 -0.13 120.40 127.57 2i5x s VAL 1799Ca -0.16 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.20 2i5x s VAL 1799Cb -0.17 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.90 2i5x s VAL 1799CO 0.07 0.49 -0.18 -0.32 0.00 0.00 0.00 175.10 175.16 2i5x s MET 1800N 0.81 2.79 -0.19 2.72 0.00 0.10 -0.51 119.30 125.03 2i5x s MET 1800Ca -0.04 -0.83 0.14 0.00 0.00 0.00 0.00 55.69 54.97 2i5x s MET 1800Cb -0.15 -2.52 0.39 0.00 0.00 0.00 0.00 34.83 32.55 2i5x s MET 1800CO 0.01 -0.25 1.24 1.33 0.00 0.00 0.00 175.02 177.35 2i5x n VAL 1801N 4.63 2.13 -4.43 10.11 0.24 -0.20 -0.75 118.33 130.07 2i5x n VAL 1801Ca -0.20 -2.69 -0.22 0.00 -2.04 0.00 0.00 64.34 59.20 2i5x n VAL 1801Cb 0.49 -0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 32.51 2i5x n VAL 1801CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2i5x s THR 1802N -3.06 2.16 0.46 3.34 -1.32 -1.26 -4.69 115.64 111.26 2i5x s THR 1802Ca 0.37 -2.31 -0.04 0.00 -1.21 0.00 0.00 61.69 58.49 2i5x s THR 1802Cb 0.34 -2.23 -0.04 0.00 -1.51 0.00 0.00 72.50 69.06 2i5x s THR 1802CO -0.01 -0.46 0.74 -1.10 -2.21 0.00 0.00 174.62 171.59 2i5x s GLN 1803N -3.57 3.54 0.21 7.08 -0.21 -1.26 -4.86 119.66 120.59 2i5x s GLN 1803Ca 0.27 0.11 -0.05 0.00 0.02 0.00 0.00 55.36 55.71 2i5x s GLN 1803Cb -0.03 -2.43 0.18 0.00 1.00 0.00 0.00 33.01 31.74 2i5x s GLN 1803CO 0.12 -0.14 1.66 0.00 -2.12 0.00 0.00 175.29 174.81 2i5x s VAL 1805N -4.78 1.19 -0.07 0.00 1.01 -1.26 0.36 120.40 116.86 2i5x s VAL 1805Ca -0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 2i5x s VAL 1805Cb 0.13 -1.03 0.03 0.00 0.00 0.00 0.00 36.38 35.50 2i5x s VAL 1805CO 0.84 0.35 -0.03 -1.61 0.00 0.00 0.00 175.10 174.65 2i5x s GLU 1806N 0.12 0.80 -1.62 2.72 2.02 -0.24 -4.78 118.70 117.72 2i5x s GLU 1806Ca -0.04 -0.02 -0.11 0.00 0.02 0.00 0.00 54.97 54.82 2i5x s GLU 1806Cb -0.11 -0.99 0.10 0.00 0.10 0.00 0.00 34.13 33.23 2i5x s GLU 1806CO 0.02 -0.21 0.54 1.63 0.02 0.00 0.00 175.26 177.25 2i5x n LYS 1807N 4.70 -2.56 -0.50 1.61 5.02 -1.26 -1.54 118.16 123.63 2i5x n LYS 1807Ca -0.14 0.31 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 2i5x n LYS 1807Cb 0.50 -4.66 0.00 0.00 -0.02 0.00 0.00 35.03 30.85 2i5x n LYS 1807CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i5x n GLY 1808N -1.71 1.78 3.69 0.72 0.00 -1.26 -5.00 105.19 103.40 2i5x n GLY 1808Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 2i5x n GLY 1808CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i5x s ARG 1809N -0.08 3.78 0.11 1.61 0.52 -0.59 -5.07 118.95 119.23 2i5x s ARG 1809Ca 0.00 -0.31 -0.31 0.00 -0.52 0.00 0.00 55.73 54.60 2i5x s ARG 1809Cb 0.00 -3.17 -0.07 0.00 0.52 0.00 0.00 34.95 32.22 2i5x s ARG 1809CO 0.00 0.42 1.34 0.08 0.02 0.00 0.00 175.30 177.15 2i5x s VAL 1810N -0.03 3.47 -0.03 3.52 1.01 -1.26 -1.08 120.40 126.01 2i5x s VAL 1810Ca 0.07 1.07 0.03 0.00 0.00 0.00 0.00 61.98 63.15 2i5x s VAL 1810Cb -0.12 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 2i5x s VAL 1810CO 0.01 0.09 0.03 0.29 0.00 0.00 0.00 175.10 175.52 2i5x n LYS 1811N 3.82 2.53 -3.62 2.72 4.76 0.16 -4.94 118.16 123.58 2i5x n LYS 1811Ca 0.10 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 2i5x n LYS 1811Cb 0.43 -1.09 -0.07 0.00 -1.84 0.00 0.00 35.03 32.47 2i5x n LYS 1811CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i5x s ASP 1813N 0.26 5.57 -0.53 0.00 2.15 -0.48 -4.55 116.67 119.08 2i5x s ASP 1813Ca -0.00 2.17 -0.29 0.00 0.43 0.00 0.00 52.55 54.87 2i5x s ASP 1813Cb -0.05 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 40.02 2i5x s ASP 1813CO 0.00 -1.32 1.21 -2.28 -0.17 0.00 0.00 175.17 172.61 2i5x s HIS 1814N -1.84 2.64 -0.26 -5.34 5.65 -1.26 -4.79 115.29 110.09 2i5x s HIS 1814Ca 0.72 0.55 0.13 0.00 0.25 0.00 0.00 55.06 56.71 2i5x s HIS 1814Cb -0.24 -4.47 0.31 0.00 -1.18 0.00 0.00 32.58 27.00 2i5x s HIS 1814CO 0.30 -1.53 1.22 2.48 -0.65 0.00 0.00 174.74 176.56 2i5x n TYR 1815N 8.34 0.37 -4.28 3.88 0.18 -1.26 -4.99 117.16 119.40 2i5x n TYR 1815Ca 0.11 -0.77 -0.17 0.00 1.88 0.00 0.00 57.90 58.95 2i5x n TYR 1815Cb 0.49 -0.16 -0.10 0.00 -0.38 0.00 0.00 39.34 39.19 2i5x n TYR 1815CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2i5x s TRP 1816N -2.15 1.45 0.19 -3.48 -2.14 -1.26 -5.06 118.94 106.49 2i5x s TRP 1816Ca 0.27 -0.65 -0.30 0.00 2.66 0.00 0.00 56.10 58.09 2i5x s TRP 1816Cb 0.21 -0.72 -0.08 0.00 -3.10 0.00 0.00 33.47 29.79 2i5x s TRP 1816CO 0.06 0.19 1.12 -1.25 -2.66 0.00 0.00 176.95 174.42 2i5x s PRO 1817N -3.47 4.58 0.00 3.25 0.04 -1.26 -4.95 135.00 133.19 2i5x s PRO 1817Ca 0.17 1.76 0.18 0.00 0.04 0.00 0.00 61.00 63.15 2i5x s PRO 1817Cb -0.00 -3.26 -0.09 0.00 0.04 0.00 0.00 34.50 31.18 2i5x s PRO 1817CO 0.03 0.06 0.86 0.00 0.04 0.00 0.00 177.00 178.00 2i5x n ALA 1818N 2.25 3.81 -2.91 8.56 0.00 -1.26 -4.61 120.51 126.34 2i5x n ALA 1818Ca 0.03 -0.55 -0.11 0.00 0.00 0.00 0.00 53.44 52.80 2i5x n ALA 1818Cb 0.46 -0.66 -0.01 0.00 0.00 0.00 0.00 19.45 19.24 2i5x n ALA 1818CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i5x n ASP 1819N -0.71 -2.36 -1.97 0.00 5.68 -1.26 -4.95 116.55 110.98 2i5x n ASP 1819Ca 0.06 -2.92 -0.15 0.00 -0.50 0.00 0.00 54.79 51.28 2i5x n ASP 1819Cb 0.34 1.11 -0.03 0.00 -1.14 0.00 0.00 41.12 41.39 2i5x n ASP 1819CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2i5x n GLN 1820N 2.35 -1.71 -1.59 0.11 1.13 -1.26 -4.89 117.38 111.51 2i5x n GLN 1820Ca 0.18 0.82 0.00 0.00 -1.94 0.00 0.00 57.00 56.05 2i5x n GLN 1820Cb 0.56 -5.28 0.00 0.00 0.11 0.00 0.00 30.24 25.63 2i5x n GLN 1820CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 2i5x n ASP 1821N -1.36 1.68 -4.07 1.08 5.75 -1.26 -4.76 116.55 113.62 2i5x n ASP 1821Ca -0.17 -0.86 -0.13 0.00 -0.01 0.00 0.00 54.79 53.62 2i5x n ASP 1821Cb 0.58 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.55 2i5x n ASP 1821CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2i5x s SER 1822N -0.77 0.90 -0.03 -1.12 1.04 -1.26 -1.63 113.70 110.84 2i5x s SER 1822Ca 0.00 -0.55 -0.13 0.00 0.48 0.00 0.00 55.95 55.75 2i5x s SER 1822Cb 0.00 0.03 0.02 0.00 0.10 0.00 0.00 66.02 66.17 2i5x s SER 1822CO 0.00 -0.19 0.29 -0.76 0.98 0.00 0.00 173.24 173.56 2i5x s LEU 1823N -1.57 0.94 0.24 2.42 1.43 -0.52 -5.00 118.68 116.61 2i5x s LEU 1823Ca -0.09 0.12 -0.28 0.00 -1.03 0.00 0.00 54.13 52.84 2i5x s LEU 1823Cb -0.10 1.17 -0.09 0.00 0.03 0.00 0.00 46.19 47.20 2i5x s LEU 1823CO 0.01 -0.39 0.91 -0.31 0.23 0.00 0.00 176.35 176.79 2i5x s TYR 1824N -1.14 3.92 -0.29 0.29 2.02 -1.26 -1.06 117.35 119.83 2i5x s TYR 1824Ca -0.12 1.84 -0.01 0.00 -0.37 0.00 0.00 57.07 58.41 2i5x s TYR 1824Cb -0.05 -2.93 0.09 0.00 -0.40 0.00 0.00 41.96 38.67 2i5x s TYR 1824CO 0.03 0.43 0.07 0.71 -1.57 0.00 0.00 175.55 175.22 2i5x s TYR 1825N -1.25 1.86 0.00 2.71 2.02 0.21 -4.95 117.35 117.95 2i5x s TYR 1825Ca 0.42 -1.73 0.00 0.00 -0.37 0.00 0.00 57.07 55.39 2i5x s TYR 1825Cb -0.24 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.61 2i5x s TYR 1825CO 0.30 -0.84 0.00 0.41 -1.57 0.00 0.00 175.55 173.85 2i5x n GLY 1826N 4.81 3.78 0.52 0.71 0.00 -1.26 -1.55 105.19 112.20 2i5x n GLY 1826Ca -0.03 0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.16 2i5x n GLY 1826CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i5x n ASP 1827N 6.34 1.56 -4.73 1.61 8.00 -1.26 -4.88 116.55 123.19 2i5x n ASP 1827Ca 0.00 -1.70 -0.28 0.00 0.71 0.00 0.00 54.79 53.52 2i5x n ASP 1827Cb 0.00 -0.10 -0.07 0.00 -0.02 0.00 0.00 41.12 40.93 2i5x n ASP 1827CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2i5x s LEU 1828N -1.54 3.57 -0.07 0.64 1.43 -0.60 -4.76 118.68 117.36 2i5x s LEU 1828Ca 0.31 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 2i5x s LEU 1828Cb 0.17 -2.23 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 2i5x s LEU 1828CO 0.25 0.12 -0.18 -0.51 0.23 0.00 0.00 176.35 176.26 2i5x s ILE 1829N -1.57 2.67 -0.06 -0.59 2.07 -0.70 -0.62 121.20 122.39 2i5x s ILE 1829Ca 0.28 -0.84 0.04 0.00 -1.41 0.00 0.00 60.65 58.72 2i5x s ILE 1829Cb -0.11 -2.04 -0.02 0.00 0.13 0.00 0.00 42.46 40.42 2i5x s ILE 1829CO 0.20 0.57 -0.17 -0.76 -1.91 0.00 0.00 174.94 172.87 2i5x s LEU 1830N -0.27 2.57 -0.06 8.50 2.01 -0.23 -1.12 118.68 130.09 2i5x s LEU 1830Ca 0.01 -0.29 0.01 0.00 0.01 0.00 0.00 54.13 53.88 2i5x s LEU 1830Cb -0.13 -1.51 0.02 0.00 0.01 0.00 0.00 46.19 44.57 2i5x s LEU 1830CO 0.03 0.30 -0.08 -1.58 1.01 0.00 0.00 176.35 176.04 2i5x s GLN 1831N -0.49 1.23 0.02 1.70 0.74 -0.38 -1.44 119.66 121.04 2i5x s GLN 1831Ca 0.06 -0.23 -0.30 0.00 0.05 0.00 0.00 55.36 54.94 2i5x s GLN 1831Cb -0.12 -1.14 -0.05 0.00 1.10 0.00 0.00 33.01 32.81 2i5x s GLN 1831CO 0.01 -0.06 1.16 1.41 -0.55 0.00 0.00 175.29 177.26 2i5x s MET 1832N 0.92 4.43 -0.21 1.67 -2.45 -0.64 -1.12 119.30 121.89 2i5x s MET 1832Ca -0.11 1.68 0.06 0.00 -1.25 0.00 0.00 55.69 56.08 2i5x s MET 1832Cb -0.15 -3.43 -0.21 0.00 1.25 0.00 0.00 34.83 32.30 2i5x s MET 1832CO 0.01 -0.28 -0.02 1.28 1.05 0.00 0.00 175.02 177.06 2i5x n LEU 1833N 4.28 2.01 -3.44 4.11 4.77 0.14 -4.32 117.00 124.55 2i5x n LEU 1833Ca 0.09 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.93 2i5x n LEU 1833Cb 0.47 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2i5x n LEU 1833CO 0.55 0.78 0.41 -0.94 -1.33 0.00 0.00 177.39 176.86 2i5x s SER 1834N -6.29 -0.55 -0.13 -1.43 1.04 -1.05 -4.97 113.70 100.32 2i5x s SER 1834Ca -0.25 -0.02 -0.06 0.00 0.48 0.00 0.00 55.95 56.10 2i5x s SER 1834Cb 0.08 0.60 0.06 0.00 0.10 0.00 0.00 66.02 66.86 2i5x s SER 1834CO 0.70 -0.98 0.29 -0.70 0.98 0.00 0.00 173.24 173.53 2i5x s GLU 1835N -3.74 0.21 -0.25 4.02 2.12 -1.26 -1.38 118.70 118.42 2i5x s GLU 1835Ca 0.02 0.73 0.01 0.00 0.36 0.00 0.00 54.97 56.09 2i5x s GLU 1835Cb -0.01 -0.01 0.05 0.00 0.26 0.00 0.00 34.13 34.41 2i5x s GLU 1835CO -0.12 -0.23 -0.10 0.45 -0.54 0.00 0.00 175.26 174.72 2i5x s SER 1836N 2.01 4.33 -0.23 -1.70 0.15 0.56 -4.99 113.70 113.83 2i5x s SER 1836Ca -0.03 -1.22 -0.17 0.00 0.70 0.00 0.00 55.95 55.23 2i5x s SER 1836Cb -0.11 -1.58 -0.03 0.00 -1.71 0.00 0.00 66.02 62.59 2i5x s SER 1836CO -0.09 -0.17 0.45 -0.69 1.20 0.00 0.00 173.24 173.93 2i5x s VAL 1837N 1.17 5.14 0.41 4.45 1.01 -1.26 -0.88 120.40 130.44 2i5x s VAL 1837Ca -0.06 0.77 0.07 0.00 0.00 0.00 0.00 61.98 62.76 2i5x s VAL 1837Cb -0.19 -3.77 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 2i5x s VAL 1837CO -0.05 0.17 0.11 -0.76 0.00 0.00 0.00 175.10 174.56 2i5x s LEU 1838N 1.82 3.02 0.40 3.92 1.43 0.33 -5.01 118.68 124.59 2i5x s LEU 1838Ca 0.20 -1.19 0.08 0.00 -1.03 0.00 0.00 54.13 52.19 2i5x s LEU 1838Cb -0.15 -1.22 0.87 0.00 0.03 0.00 0.00 46.19 45.71 2i5x s LEU 1838CO 0.09 -0.50 2.01 -0.65 0.23 0.00 0.00 176.35 177.53 2i5x h PRO 1839N 1.58 0.56 0.00 1.29 0.11 -2.02 -3.22 132.00 130.29 2i5x h PRO 1839Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2i5x h PRO 1839Cb 1.25 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2i5x h PRO 1839CO 0.74 0.37 -0.20 0.39 -0.21 0.00 0.00 178.00 179.10 2i5x n GLU 1840N -4.47 5.68 -3.71 1.05 1.02 -1.26 -4.95 120.64 114.00 2i5x n GLU 1840Ca 0.07 -0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.11 2i5x n GLU 1840Cb 0.19 -0.65 -0.05 0.00 -0.02 0.00 0.00 31.44 30.91 2i5x n GLU 1840CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 2i5x s TRP 1841N -1.31 -0.08 -0.04 -0.32 -2.14 -1.22 -1.59 118.94 112.24 2i5x s TRP 1841Ca 0.01 -0.26 0.04 0.00 2.66 0.00 0.00 56.10 58.55 2i5x s TRP 1841Cb 0.02 0.22 -0.00 0.00 -3.10 0.00 0.00 33.47 30.60 2i5x s TRP 1841CO 0.10 -0.73 -0.16 0.99 -2.66 0.00 0.00 176.95 174.49 2i5x s THR 1842N -3.84 1.35 -0.17 0.66 2.01 0.10 -0.52 115.64 115.22 2i5x s THR 1842Ca 0.06 -0.68 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 2i5x s THR 1842Cb 0.02 -1.16 -0.00 0.00 0.01 0.00 0.00 72.50 71.37 2i5x s THR 1842CO -0.09 0.39 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.48 2i5x s ILE 1843N 0.02 2.88 0.11 1.82 1.01 -0.06 -0.69 121.20 126.29 2i5x s ILE 1843Ca -0.03 -0.69 0.10 0.00 0.00 0.00 0.00 60.65 60.03 2i5x s ILE 1843Cb -0.11 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2i5x s ILE 1843CO 0.02 0.49 -0.22 -0.13 0.00 0.00 0.00 174.94 175.10 2i5x s ARG 1844N 0.98 1.65 -0.07 2.79 0.52 -0.27 -0.33 118.95 124.23 2i5x s ARG 1844Ca -0.02 -1.23 0.05 0.00 -0.52 0.00 0.00 55.73 54.01 2i5x s ARG 1844Cb -0.15 -2.02 -0.00 0.00 0.52 0.00 0.00 34.95 33.30 2i5x s ARG 1844CO -0.02 0.47 -0.22 -2.00 0.02 0.00 0.00 175.30 173.56 2i5x s GLU 1845N -2.01 2.46 0.14 3.54 2.12 -0.48 -0.59 118.70 123.87 2i5x s GLU 1845Ca 0.16 -0.78 0.09 0.00 0.36 0.00 0.00 54.97 54.80 2i5x s GLU 1845Cb -0.10 -2.00 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 2i5x s GLU 1845CO 0.08 0.25 -0.22 -0.06 -0.54 0.00 0.00 175.26 174.76 2i5x s PHE 1846N 0.12 2.01 -0.13 5.30 0.08 0.12 0.24 117.98 125.73 2i5x s PHE 1846Ca -0.10 -0.41 -0.05 0.00 0.12 0.00 0.00 56.93 56.49 2i5x s PHE 1846Cb -0.15 -1.06 -0.04 0.00 -0.57 0.00 0.00 43.02 41.21 2i5x s PHE 1846CO 0.05 0.31 0.06 0.21 -0.10 0.00 0.00 175.22 175.76 2i5x s LYS 1847N -2.25 3.45 -0.05 0.44 2.20 -0.28 -0.22 119.74 123.02 2i5x s LYS 1847Ca 0.13 -0.30 0.06 0.00 -0.36 0.00 0.00 55.97 55.49 2i5x s LYS 1847Cb -0.09 -3.05 -0.01 0.00 -1.51 0.00 0.00 37.83 33.17 2i5x s LYS 1847CO 0.06 0.59 -0.24 -1.50 -0.36 0.00 0.00 175.35 173.89 2i5x s ILE 1848N -0.52 2.13 -0.08 5.43 2.07 -0.22 -1.25 121.20 128.77 2i5x s ILE 1848Ca 0.10 -1.04 0.04 0.00 -1.41 0.00 0.00 60.65 58.34 2i5x s ILE 1848Cb -0.12 -1.77 0.00 0.00 0.13 0.00 0.00 42.46 40.70 2i5x s ILE 1848CO 0.02 0.57 -0.19 0.00 -1.91 0.00 0.00 174.94 173.44 2i5x n GLY 1850N 3.53 0.00 2.94 0.00 0.00 -1.26 -1.73 105.19 108.68 2i5x n GLY 1850Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 2i5x n GLY 1850CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2i5x s HIS 1857N -1.73 3.16 0.28 1.61 0.09 -1.22 -5.02 115.29 112.45 2i5x s HIS 1857Ca 0.00 -3.15 -0.08 0.00 -0.00 0.00 0.00 55.06 51.83 2i5x s HIS 1857Cb 0.00 -2.79 -0.06 0.00 -0.00 0.00 0.00 32.58 29.72 2i5x s HIS 1857CO 0.00 -0.75 0.58 0.50 -0.00 0.00 0.00 174.74 175.07 2i5x s ARG 1858N -0.25 3.73 -0.18 1.40 3.52 -0.81 -4.90 118.95 121.47 2i5x s ARG 1858Ca 0.17 0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.84 2i5x s ARG 1858Cb -0.26 -2.61 -0.05 0.00 -1.56 0.00 0.00 34.95 30.47 2i5x s ARG 1858CO -0.00 0.23 0.20 -1.17 -0.81 0.00 0.00 175.30 173.74 2i5x s LEU 1859N -3.27 4.24 -0.09 -0.88 1.98 -1.26 -1.06 118.68 118.34 2i5x s LEU 1859Ca 0.46 0.37 0.03 0.00 -2.89 0.00 0.00 54.13 52.10 2i5x s LEU 1859Cb -0.11 -2.21 -0.01 0.00 0.66 0.00 0.00 46.19 44.52 2i5x s LEU 1859CO 0.26 0.17 -0.18 -0.63 -1.89 0.00 0.00 176.35 174.07 2i5x s ILE 1860N 0.29 2.60 -0.11 6.68 -1.09 0.69 -4.78 121.20 125.48 2i5x s ILE 1860Ca 0.12 -0.85 -0.05 0.00 -2.23 0.00 0.00 60.65 57.64 2i5x s ILE 1860Cb -0.12 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.69 2i5x s ILE 1860CO 0.01 0.55 0.08 -0.60 -1.23 0.00 0.00 174.94 173.75 2i5x s ARG 1861N 0.05 3.31 -0.14 2.79 3.52 0.19 -0.70 118.95 127.96 2i5x s ARG 1861Ca -0.07 -0.26 0.01 0.00 -0.13 0.00 0.00 55.73 55.27 2i5x s ARG 1861Cb -0.15 -3.03 0.02 0.00 -1.56 0.00 0.00 34.95 30.23 2i5x s ARG 1861CO 0.05 0.70 -0.15 -1.58 -0.81 0.00 0.00 175.30 173.51 2i5x s HIS 1862N -0.84 2.18 -0.34 5.12 5.65 0.24 -0.68 115.29 126.62 2i5x s HIS 1862Ca 0.13 -1.17 -0.04 0.00 0.25 0.00 0.00 55.06 54.23 2i5x s HIS 1862Cb -0.12 -1.58 0.06 0.00 -1.18 0.00 0.00 32.58 29.76 2i5x s HIS 1862CO 0.03 -0.62 0.09 -0.06 -0.65 0.00 0.00 174.74 173.53 2i5x s PHE 1863N 1.30 3.33 -0.39 3.88 0.08 0.81 -1.12 117.98 125.87 2i5x s PHE 1863Ca 0.01 -1.80 -0.04 0.00 0.12 0.00 0.00 56.93 55.22 2i5x s PHE 1863Cb -0.14 -2.45 0.09 0.00 -0.57 0.00 0.00 43.02 39.96 2i5x s PHE 1863CO -0.08 -0.81 0.18 -1.58 -0.10 0.00 0.00 175.22 172.83 2i5x s HIS 1864N 1.29 3.47 -0.24 0.36 2.46 0.13 -0.72 115.29 122.04 2i5x s HIS 1864Ca -0.01 -2.10 -0.23 0.00 0.47 0.00 0.00 55.06 53.19 2i5x s HIS 1864Cb -0.20 -2.96 -0.01 0.00 -0.13 0.00 0.00 32.58 29.27 2i5x s HIS 1864CO -0.00 -0.91 0.77 -0.47 -2.47 0.00 0.00 174.74 171.65 2i5x s TYR 1865N 1.23 3.31 -1.29 3.88 5.04 0.07 -0.72 117.35 128.88 2i5x s TYR 1865Ca 0.04 1.05 0.12 0.00 -2.44 0.00 0.00 57.07 55.84 2i5x s TYR 1865Cb -0.22 -2.98 0.24 0.00 0.35 0.00 0.00 41.96 39.34 2i5x s TYR 1865CO -0.02 -0.36 1.11 0.25 -1.34 0.00 0.00 175.55 175.19 2i5x n THR 1866N 5.18 0.55 -2.04 4.34 -2.24 -0.62 -4.14 114.28 115.32 2i5x n THR 1866Ca 0.04 -0.78 -0.03 0.00 -2.27 0.00 0.00 64.05 61.01 2i5x n THR 1866Cb 0.48 0.84 0.10 0.00 -2.10 0.00 0.00 70.33 69.66 2i5x n THR 1866CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2i5x n VAL 1867N 0.68 1.75 -3.80 2.28 0.24 -1.26 -4.84 118.33 113.37 2i5x n VAL 1867Ca 0.11 -3.03 -0.36 0.00 -2.04 0.00 0.00 64.34 59.02 2i5x n VAL 1867Cb 0.39 -0.04 -0.12 0.00 -1.47 0.00 0.00 33.84 32.59 2i5x n VAL 1867CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2i5x s TRP 1868N -2.78 3.55 0.32 6.34 -0.11 -1.26 -4.62 118.94 120.38 2i5x s TRP 1868Ca 0.39 -2.34 -0.29 0.00 1.22 0.00 0.00 56.10 55.08 2i5x s TRP 1868Cb 0.38 -3.04 -0.11 0.00 -1.50 0.00 0.00 33.47 29.21 2i5x s TRP 1868CO -0.06 -0.94 1.43 -1.25 -4.62 0.00 0.00 176.95 171.51 2i5x s PRO 1869N 1.15 4.23 0.31 5.86 0.04 -1.26 -4.79 135.00 140.54 2i5x s PRO 1869Ca 0.06 2.39 -0.28 0.00 0.04 0.00 0.00 61.00 63.21 2i5x s PRO 1869Cb -0.22 -3.04 -0.13 0.00 0.04 0.00 0.00 34.50 31.14 2i5x s PRO 1869CO -0.04 -0.41 1.17 -3.47 0.04 0.00 0.00 177.00 174.30 2i5x n ASP 1870N 1.28 2.07 -0.17 6.66 -0.08 -1.26 -1.54 116.55 123.51 2i5x n ASP 1870Ca 0.03 1.19 -0.02 0.00 -1.51 0.00 0.00 54.79 54.48 2i5x n ASP 1870Cb 0.40 -1.39 -0.01 0.00 2.34 0.00 0.00 41.12 42.46 2i5x n ASP 1870CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2i5x n HIS 1871N 0.42 0.00 -2.72 -0.67 8.25 -1.26 -4.90 115.22 114.34 2i5x n HIS 1871Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2i5x n HIS 1871Cb 0.34 -2.07 0.00 0.00 1.12 0.00 0.00 29.99 29.37 2i5x n HIS 1871CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2i5x n GLY 1872N 0.66 6.24 3.16 -1.41 0.00 -0.59 -4.87 105.19 108.38 2i5x n GLY 1872Ca -0.02 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.22 2i5x n GLY 1872CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i5x s VAL 1873N 0.49 0.61 0.96 1.61 -7.23 -1.26 -4.78 120.40 110.80 2i5x s VAL 1873Ca 0.00 -1.91 -0.11 0.00 -1.81 0.00 0.00 61.98 58.15 2i5x s VAL 1873Cb 0.00 -1.66 0.17 0.00 0.56 0.00 0.00 36.38 35.45 2i5x s VAL 1873CO 0.00 -0.89 1.10 -2.84 -0.31 0.00 0.00 175.10 172.16 2i5x s PRO 1874N -3.85 0.67 0.41 4.82 0.02 -1.26 -4.48 135.00 131.33 2i5x s PRO 1874Ca 0.11 1.24 0.18 0.00 0.02 0.00 0.00 61.00 62.55 2i5x s PRO 1874Cb 0.06 -1.71 0.90 0.00 0.02 0.00 0.00 34.50 33.77 2i5x s PRO 1874CO -0.06 -2.77 1.87 1.49 -0.33 0.00 0.00 177.00 177.21 2i5x h GLU 1875N -1.96 0.00 -4.69 5.54 4.81 -2.02 -3.44 114.58 112.82 2i5x h GLU 1875Ca -0.49 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.48 2i5x h GLU 1875Cb 1.28 0.00 -0.18 0.00 0.63 0.00 0.00 28.75 30.48 2i5x h GLU 1875CO 0.46 0.30 -0.72 0.95 -0.73 0.00 0.00 179.01 179.28 2i5x s THR 1876N -4.09 0.69 0.19 0.32 -4.23 -1.26 -5.03 115.64 102.22 2i5x s THR 1876Ca -0.02 -1.53 -0.09 0.00 -1.18 0.00 0.00 61.69 58.88 2i5x s THR 1876Cb 0.13 -1.18 0.06 0.00 1.34 0.00 0.00 72.50 72.85 2i5x s THR 1876CO 0.68 -0.60 1.64 0.71 -0.54 0.00 0.00 174.62 176.51 2i5x h THR 1877N 3.71 1.27 -0.87 3.99 1.35 -1.95 -3.29 112.91 117.12 2i5x h THR 1877Ca -0.36 -1.18 0.17 0.00 -0.55 0.00 0.00 66.41 64.48 2i5x h THR 1877Cb 1.18 0.84 -0.10 0.00 -1.73 0.00 0.00 68.15 68.34 2i5x h THR 1877CO 0.52 0.43 0.44 -0.61 -0.25 0.00 0.00 175.52 176.05 2i5x h GLN 1878N 0.95 0.56 0.16 4.72 4.15 -1.97 -1.32 115.11 122.37 2i5x h GLN 1878Ca 0.16 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2i5x h GLN 1878Cb 0.59 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.15 2i5x h GLN 1878CO 0.04 0.37 -0.08 1.03 -1.93 0.00 0.00 178.83 178.26 2i5x h SER 1879N 0.58 -0.18 0.13 -0.69 0.87 -1.99 -1.29 113.55 110.99 2i5x h SER 1879Ca 0.49 -0.14 -0.17 0.00 -1.23 0.00 0.00 61.79 60.73 2i5x h SER 1879Cb 0.76 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2i5x h SER 1879CO -0.40 0.04 -0.65 0.25 -0.53 0.00 0.00 176.83 175.54 2i5x h LEU 1880N -0.40 0.56 -0.59 2.23 5.85 -1.66 -1.72 115.31 119.59 2i5x h LEU 1880Ca -0.02 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.43 2i5x h LEU 1880Cb 0.31 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 2i5x h LEU 1880CO 0.04 1.06 0.27 0.40 -0.34 0.00 0.00 178.44 179.87 2i5x h ILE 1881N 0.35 0.89 -0.45 4.05 2.04 -1.14 0.17 117.51 123.41 2i5x h ILE 1881Ca -0.01 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 2i5x h ILE 1881Cb 1.21 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2i5x h ILE 1881CO 0.12 0.09 0.05 -0.61 0.00 0.00 0.00 178.15 177.80 2i5x h GLN 1882N 0.51 0.77 -0.03 2.37 4.15 -1.06 -1.07 115.11 120.74 2i5x h GLN 1882Ca 0.28 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2i5x h GLN 1882Cb 0.24 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 2i5x h GLN 1882CO -0.22 0.80 0.02 0.35 -1.93 0.00 0.00 178.83 177.85 2i5x h PHE 1883N 0.62 0.04 -0.50 3.99 3.57 -0.80 -0.89 116.94 122.98 2i5x h PHE 1883Ca 0.14 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.68 2i5x h PHE 1883Cb 0.42 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 2i5x h PHE 1883CO 0.03 0.03 0.25 0.28 -2.23 0.00 0.00 178.31 176.68 2i5x h VAL 1884N 0.04 0.96 -0.74 1.41 2.07 -0.57 -0.64 116.25 118.77 2i5x h VAL 1884Ca 0.01 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 2i5x h VAL 1884Cb 0.00 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 2i5x h VAL 1884CO -0.00 0.09 0.37 0.03 0.02 0.00 0.00 177.57 178.08 2i5x h ARG 1885N 0.49 1.05 0.27 1.57 3.08 -0.97 -0.01 114.38 119.87 2i5x h ARG 1885Ca 0.22 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2i5x h ARG 1885Cb 0.13 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2i5x h ARG 1885CO -0.16 0.80 -0.13 1.15 -1.07 0.00 0.00 179.97 180.56 2i5x h THR 1886N 1.05 0.77 -0.58 2.04 2.02 -0.71 -1.02 112.91 116.48 2i5x h THR 1886Ca 0.26 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 67.25 2i5x h THR 1886Cb 0.08 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 2i5x h THR 1886CO -0.04 0.05 0.27 0.58 0.37 0.00 0.00 175.52 176.76 2i5x h VAL 1887N -0.49 0.90 -0.73 3.16 2.07 -0.91 -2.22 116.25 118.03 2i5x h VAL 1887Ca -0.04 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2i5x h VAL 1887Cb 0.36 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2i5x h VAL 1887CO 0.06 0.09 0.40 -0.09 0.02 0.00 0.00 177.57 178.06 2i5x h ARG 1888N 0.51 1.01 -0.17 1.57 9.65 -0.89 0.11 114.38 126.17 2i5x h ARG 1888Ca 0.27 -0.11 0.01 0.00 -1.10 0.00 0.00 59.98 59.05 2i5x h ARG 1888Cb 0.23 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 2i5x h ARG 1888CO -0.21 0.74 0.08 0.22 2.80 0.00 0.00 179.97 183.59 2i5x h ASP 1889N 1.02 0.12 -0.56 -3.80 1.82 -0.67 -0.34 116.42 114.01 2i5x h ASP 1889Ca 0.26 0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.89 2i5x h ASP 1889Cb 0.02 -0.02 -0.03 0.00 0.68 0.00 0.00 39.33 39.99 2i5x h ASP 1889CO -0.04 0.09 0.28 1.88 -1.61 0.00 0.00 179.24 179.84 2i5x h TYR 1890N 0.18 0.79 -0.38 0.28 0.05 -0.81 -2.13 116.97 114.95 2i5x h TYR 1890Ca 0.07 -0.03 0.05 0.00 0.05 0.00 0.00 58.73 58.86 2i5x h TYR 1890Cb 0.01 -0.25 -0.04 0.00 1.01 0.00 0.00 36.73 37.46 2i5x h TYR 1890CO -0.09 0.60 0.12 0.82 -1.05 0.00 0.00 178.16 178.56 2i5x h ILE 1891N 0.75 0.87 0.00 -2.88 2.04 -0.58 -1.10 117.51 116.61 2i5x h ILE 1891Ca 0.19 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 2i5x h ILE 1891Cb 0.09 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2i5x h ILE 1891CO -0.03 0.05 -0.02 0.78 0.00 0.00 0.00 178.15 178.93 2i5x h ASN 1892N 0.26 0.00 -0.40 1.72 2.35 -0.84 -1.25 115.58 117.42 2i5x h ASN 1892Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2i5x h ASN 1892Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2i5x h ASN 1892CO -0.19 0.02 0.00 0.54 -1.65 0.00 0.00 177.43 176.15 2i5x n ARG 1893N -4.04 3.40 -3.46 0.81 1.74 -0.45 -4.66 116.66 110.01 2i5x n ARG 1893Ca -0.03 -2.06 -0.30 0.00 -0.77 0.00 0.00 57.85 54.69 2i5x n ARG 1893Cb 0.11 -1.92 -0.07 0.00 -1.02 0.00 0.00 32.46 29.56 2i5x n ARG 1893CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2i5x n SER 1894N 0.50 4.03 -4.72 0.55 7.64 -0.47 -5.03 113.62 116.12 2i5x n SER 1894Ca 0.18 -3.39 -0.42 0.00 1.01 0.00 0.00 58.87 56.26 2i5x n SER 1894Cb 0.81 -0.78 -0.03 0.00 -1.01 0.00 0.00 64.21 63.20 2i5x n SER 1894CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2i5x s PRO 1895N -2.30 4.15 0.00 1.43 0.04 -1.26 -2.17 135.00 134.89 2i5x s PRO 1895Ca 0.36 2.54 0.00 0.00 0.04 0.00 0.00 61.00 63.93 2i5x s PRO 1895Cb 0.09 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.55 2i5x s PRO 1895CO -0.03 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 176.73 2i5x n GLY 1896N 3.59 0.90 3.77 0.56 0.00 -1.26 -5.03 105.19 107.72 2i5x n GLY 1896Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2i5x n GLY 1896CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i5x s ALA 1897N -2.80 3.32 1.00 4.61 0.00 -0.92 -5.02 121.76 121.95 2i5x s ALA 1897Ca 0.00 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2i5x s ALA 1897Cb 0.00 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.60 2i5x s ALA 1897CO 0.00 -0.89 0.00 0.41 0.00 0.00 0.00 175.76 175.28 2i5x n GLY 1898N 0.65 -1.23 3.72 0.00 0.00 0.50 -5.00 105.19 103.82 2i5x n GLY 1898Ca 0.03 -1.44 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 2i5x n GLY 1898CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2i5x s PRO 1899N 0.00 2.13 -0.10 1.61 0.02 -1.26 -4.76 135.00 132.64 2i5x s PRO 1899Ca 0.00 1.89 -0.27 0.00 0.02 0.00 0.00 61.00 62.65 2i5x s PRO 1899Cb 0.00 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 32.68 2i5x s PRO 1899CO 0.00 -1.87 0.86 0.99 -0.33 0.00 0.00 177.00 176.65 2i5x s THR 1900N -1.79 4.90 0.06 0.99 2.01 -0.56 -4.48 115.64 116.78 2i5x s THR 1900Ca 0.78 1.75 -0.28 0.00 0.31 0.00 0.00 61.69 64.24 2i5x s THR 1900Cb -0.33 -4.18 -0.05 0.00 0.01 0.00 0.00 72.50 67.95 2i5x s THR 1900CO 0.45 0.10 0.90 -0.69 -0.69 0.00 0.00 174.62 174.68 2i5x s VAL 1901N 1.62 4.67 -0.06 3.82 1.01 -0.69 -0.97 120.40 129.80 2i5x s VAL 1901Ca 0.42 1.91 0.02 0.00 0.00 0.00 0.00 61.98 64.34 2i5x s VAL 1901Cb -0.18 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 31.96 2i5x s VAL 1901CO 0.17 0.29 -0.12 -0.69 0.00 0.00 0.00 175.10 174.76 2i5x s VAL 1902N 0.23 1.07 0.07 2.92 1.01 0.04 0.10 120.40 125.85 2i5x s VAL 1902Ca 0.45 -0.45 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 2i5x s VAL 1902Cb -0.22 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.18 2i5x s VAL 1902CO 0.27 0.34 0.17 -1.38 0.00 0.00 0.00 175.10 174.50 2i5x s HIS 1903N 0.61 0.15 0.00 5.22 -3.43 0.33 -2.39 115.29 115.79 2i5x s HIS 1903Ca -0.13 -0.53 0.00 0.00 -0.80 0.00 0.00 55.06 53.60 2i5x s HIS 1903Cb -0.15 -0.08 0.00 0.00 -1.43 0.00 0.00 32.58 30.92 2i5x s HIS 1903CO 0.03 -0.49 0.00 0.00 -2.00 0.00 0.00 174.74 172.28 2i5x n SER 1905N 0.00 1.63 0.07 0.00 2.88 -1.26 -2.24 113.62 114.69 2i5x n SER 1905Ca 0.00 0.60 0.12 0.00 -1.33 0.00 0.00 58.87 58.27 2i5x n SER 1905Cb 0.00 -0.84 0.24 0.00 -0.75 0.00 0.00 64.21 62.86 2i5x n SER 1905CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i5x n ALA 1906N -3.49 2.78 -2.65 -1.46 0.00 -1.26 -0.74 120.51 113.69 2i5x n ALA 1906Ca -0.06 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.08 2i5x n ALA 1906Cb 0.24 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.46 2i5x n ALA 1906CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i5x n GLY 1907N 1.34 0.19 1.66 0.00 0.00 -1.25 -4.28 105.19 102.85 2i5x n GLY 1907Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2i5x n GLY 1907CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2i5x n VAL 1908N -3.75 0.13 -0.00 1.61 0.24 -1.26 -4.66 118.33 110.64 2i5x n VAL 1908Ca -0.04 0.04 -0.01 0.00 -2.04 0.00 0.00 64.34 62.30 2i5x n VAL 1908Cb 0.55 -0.86 -0.00 0.00 -1.47 0.00 0.00 33.84 32.06 2i5x n VAL 1908CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2i5x h GLY 1909N 0.00 -0.04 1.08 7.63 0.00 -1.93 -1.51 103.07 108.30 2i5x h GLY 1909Ca 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 47.33 47.19 2i5x h GLY 1909CO 0.00 -0.01 -0.38 3.21 0.00 0.00 0.00 176.54 179.36 2i5x h ARG 1910N -0.41 0.85 -0.41 4.80 3.08 -1.93 -1.39 114.38 118.96 2i5x h ARG 1910Ca -0.00 -0.47 0.06 0.00 0.07 0.00 0.00 59.98 59.64 2i5x h ARG 1910Cb 0.03 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 2i5x h ARG 1910CO 0.01 1.11 0.12 1.15 -1.07 0.00 0.00 179.97 181.28 2i5x h THR 1911N 0.64 0.83 -0.58 2.04 2.02 -1.88 -0.52 112.91 115.47 2i5x h THR 1911Ca 0.05 -0.09 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 2i5x h THR 1911Cb 0.97 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 2i5x h THR 1911CO 0.09 0.05 0.10 1.23 0.37 0.00 0.00 175.52 177.36 2i5x h GLY 1912N 0.27 1.02 1.01 2.16 0.00 -1.11 -1.54 103.07 104.87 2i5x h GLY 1912Ca 0.20 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 2i5x h GLY 1912CO -0.22 0.63 0.29 -0.84 0.00 0.00 0.00 176.54 176.39 2i5x h THR 1913N 0.85 1.23 -0.09 4.70 2.02 -1.04 -0.14 112.91 120.43 2i5x h THR 1913Ca 0.18 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.70 2i5x h THR 1913Cb 0.41 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 2i5x h THR 1913CO 0.01 0.28 -0.13 0.15 0.37 0.00 0.00 175.52 176.20 2i5x h PHE 1914N 0.91 -0.32 -0.40 3.16 3.57 -0.79 -1.00 116.94 122.08 2i5x h PHE 1914Ca 0.22 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.70 2i5x h PHE 1914Cb 0.16 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2i5x h PHE 1914CO 0.01 -0.19 0.09 0.82 -2.23 0.00 0.00 178.31 176.80 2i5x h ILE 1915N -0.17 1.23 -0.46 1.41 2.04 -1.07 -0.20 117.51 120.30 2i5x h ILE 1915Ca 0.08 -0.81 0.05 0.00 1.00 0.00 0.00 64.86 65.18 2i5x h ILE 1915Cb 0.28 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 2i5x h ILE 1915CO -0.19 0.28 0.18 0.00 0.00 0.00 0.00 178.15 178.42 2i5x h ALA 1916N 0.94 0.56 -0.61 1.87 0.00 -0.92 -0.75 119.26 120.35 2i5x h ALA 1916Ca 0.12 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2i5x h ALA 1916Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2i5x h ALA 1916CO 0.00 -0.20 0.13 1.25 0.00 0.00 0.00 179.25 180.44 2i5x h LEU 1917N 0.37 0.95 -0.57 0.00 5.85 -0.85 -0.06 115.31 120.99 2i5x h LEU 1917Ca 0.21 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2i5x h LEU 1917Cb 0.18 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 2i5x h LEU 1917CO -0.19 0.95 0.32 -0.78 -0.34 0.00 0.00 178.44 178.39 2i5x h ASP 1918N 0.90 0.49 -0.18 1.25 3.58 -0.60 -0.64 116.42 121.22 2i5x h ASP 1918Ca 0.19 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.63 2i5x h ASP 1918Cb 0.38 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 2i5x h ASP 1918CO 0.01 0.33 -0.02 0.03 -2.88 0.00 0.00 179.24 176.71 2i5x h ARG 1919N 0.62 0.33 -0.13 0.28 3.08 -0.73 -2.94 114.38 114.88 2i5x h ARG 1919Ca 0.25 -0.11 -0.15 0.00 0.07 0.00 0.00 59.98 60.03 2i5x h ARG 1919Cb 0.11 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2i5x h ARG 1919CO -0.14 0.56 -0.56 -0.84 -1.07 0.00 0.00 179.97 177.92 2i5x h ILE 1920N 0.07 1.34 -0.57 2.04 3.07 -0.78 -1.98 117.51 120.70 2i5x h ILE 1920Ca 0.05 -1.84 -0.03 0.00 1.55 0.00 0.00 64.86 64.59 2i5x h ILE 1920Cb 0.42 1.85 -0.03 0.00 -0.27 0.00 0.00 36.82 38.79 2i5x h ILE 1920CO 0.01 0.56 0.23 -0.07 -1.05 0.00 0.00 178.15 177.83 2i5x h LEU 1921N 0.31 0.75 -0.46 0.16 3.38 -1.17 -0.53 115.31 117.76 2i5x h LEU 1921Ca 0.00 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2i5x h LEU 1921Cb 1.07 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2i5x h LEU 1921CO 0.10 0.68 0.06 1.56 0.09 0.00 0.00 178.44 180.92 2i5x h GLN 1922N 0.82 0.77 -1.01 1.13 4.20 -1.29 -2.58 115.11 117.15 2i5x h GLN 1922Ca 0.19 -0.21 0.10 0.00 0.06 0.00 0.00 58.65 58.79 2i5x h GLN 1922Cb 0.16 -0.09 -0.08 0.00 0.30 0.00 0.00 27.48 27.78 2i5x h GLN 1922CO -0.02 0.79 0.64 1.96 -0.67 0.00 0.00 178.83 181.54 2i5x h GLN 1923N 0.63 1.03 -0.33 1.46 4.20 -0.75 -1.65 115.11 119.69 2i5x h GLN 1923Ca 0.14 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 2i5x h GLN 1923Cb 0.41 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2i5x h GLN 1923CO 0.01 0.68 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.78 2i5x h LEU 1924N 1.06 0.48 0.00 1.46 3.38 -0.83 0.67 115.31 121.52 2i5x h LEU 1924Ca 0.48 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2i5x h LEU 1924Cb 0.39 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2i5x h LEU 1924CO -0.24 0.56 -0.02 0.44 0.09 0.00 0.00 178.44 179.27 2i5x h ASP 1925N 0.49 0.00 0.00 -0.43 3.32 -0.92 -3.38 116.42 115.50 2i5x h ASP 1925Ca 0.11 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2i5x h ASP 1925Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2i5x h ASP 1925CO 0.01 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.99 2i5x n SER 1926N -2.65 0.06 -4.27 6.45 3.41 -0.97 -5.11 113.62 110.53 2i5x n SER 1926Ca 0.05 -0.31 -0.14 0.00 -0.26 0.00 0.00 58.87 58.21 2i5x n SER 1926Cb 0.48 0.27 -0.10 0.00 -0.26 0.00 0.00 64.21 64.60 2i5x n SER 1926CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2i5x s LYS 1927N -0.27 1.20 0.00 4.33 1.02 0.20 -5.04 119.74 121.18 2i5x s LYS 1927Ca 0.00 -1.60 0.26 0.00 0.02 0.00 0.00 55.97 54.65 2i5x s LYS 1927Cb 0.00 -0.30 0.77 0.00 -0.52 0.00 0.00 37.83 37.78 2i5x s LYS 1927CO 0.00 -0.16 1.57 -0.25 -0.92 0.00 0.00 175.35 175.59 2i5x n ASP 1928N -0.31 1.04 -4.04 2.83 10.43 -1.26 -4.74 116.55 120.50 2i5x n ASP 1928Ca -0.05 -0.91 -0.10 0.00 2.57 0.00 0.00 54.79 56.30 2i5x n ASP 1928Cb 0.64 0.13 -0.08 0.00 1.84 0.00 0.00 41.12 43.65 2i5x n ASP 1928CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2i5x s SER 1929N -2.48 0.07 -0.00 -2.24 1.04 -1.26 -1.81 113.70 107.01 2i5x s SER 1929Ca 0.25 -1.04 0.02 0.00 0.48 0.00 0.00 55.95 55.67 2i5x s SER 1929Cb 0.19 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.75 2i5x s SER 1929CO 0.51 -0.92 -0.07 0.54 0.98 0.00 0.00 173.24 174.28 2i5x s VAL 1930N -4.03 0.58 -0.55 5.02 0.11 -0.46 -4.66 120.40 116.41 2i5x s VAL 1930Ca 0.24 -0.36 0.05 0.00 -2.93 0.00 0.00 61.98 58.98 2i5x s VAL 1930Cb 0.04 -0.50 0.20 0.00 -1.53 0.00 0.00 36.38 34.59 2i5x s VAL 1930CO 0.05 0.13 0.50 -0.67 -3.33 0.00 0.00 175.10 171.78 2i5x n ASP 1931N 2.80 1.60 -0.05 3.54 2.03 -1.26 -0.81 116.55 124.40 2i5x n ASP 1931Ca -0.14 -2.91 -0.11 0.00 0.52 0.00 0.00 54.79 52.15 2i5x n ASP 1931Cb 0.57 -0.66 -0.05 0.00 -0.72 0.00 0.00 41.12 40.27 2i5x n ASP 1931CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2i5x h ILE 1932N 3.78 1.15 -0.37 5.18 2.04 -1.98 -1.73 117.51 125.58 2i5x h ILE 1932Ca 0.18 -0.46 0.06 0.00 1.00 0.00 0.00 64.86 65.64 2i5x h ILE 1932Cb 0.80 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 2i5x h ILE 1932CO 0.59 0.15 0.05 0.22 0.00 0.00 0.00 178.15 179.16 2i5x h TYR 1933N 0.15 0.07 -0.87 1.37 5.03 -1.92 -1.51 116.97 119.30 2i5x h TYR 1933Ca 0.06 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.39 2i5x h TYR 1933Cb 0.16 0.02 -0.04 0.00 1.55 0.00 0.00 36.73 38.42 2i5x h TYR 1933CO -0.02 -0.01 0.50 0.78 -1.32 0.00 0.00 178.16 178.09 2i5x h GLY 1934N 0.16 1.27 0.90 1.82 0.00 -1.72 0.21 103.07 105.71 2i5x h GLY 1934Ca 0.18 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 2i5x h GLY 1934CO -0.26 0.52 0.02 0.00 0.00 0.00 0.00 176.54 176.83 2i5x h ALA 1935N 1.35 0.06 -0.52 3.60 0.00 -0.85 -0.88 119.26 122.02 2i5x h ALA 1935Ca 0.31 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 2i5x h ALA 1935Cb -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2i5x h ALA 1935CO -0.05 -0.38 -0.13 0.28 0.00 0.00 0.00 179.25 178.96 2i5x h VAL 1936N -0.04 1.27 -0.41 0.00 2.07 -0.98 -1.16 116.25 117.00 2i5x h VAL 1936Ca 0.02 -1.29 0.09 0.00 0.82 0.00 0.00 66.70 66.34 2i5x h VAL 1936Cb 0.11 1.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.79 2i5x h VAL 1936CO -0.00 0.45 -0.17 -0.74 0.02 0.00 0.00 177.57 177.12 2i5x h HIS 1937N 0.89 -0.43 -0.64 1.57 6.17 -0.50 -0.60 115.15 121.61 2i5x h HIS 1937Ca 0.13 0.04 -0.09 0.00 0.71 0.00 0.00 60.37 61.17 2i5x h HIS 1937Cb 0.70 0.25 -0.02 0.00 2.52 0.00 0.00 27.41 30.85 2i5x h HIS 1937CO 0.05 -0.26 0.05 0.22 0.71 0.00 0.00 177.93 178.70 2i5x h ASP 1938N -0.09 1.06 -0.32 3.26 3.58 -0.71 -1.45 116.42 121.74 2i5x h ASP 1938Ca 0.20 -0.29 0.04 0.00 0.42 0.00 0.00 57.03 57.40 2i5x h ASP 1938Cb 0.40 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 41.13 2i5x h ASP 1938CO -0.47 1.08 0.11 -0.07 -2.88 0.00 0.00 179.24 177.00 2i5x h LEU 1939N 1.00 0.11 -1.57 2.28 3.38 -0.93 -2.78 115.31 116.80 2i5x h LEU 1939Ca 0.19 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2i5x h LEU 1939Cb 0.51 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2i5x h LEU 1939CO 0.02 0.10 -0.11 0.03 0.09 0.00 0.00 178.44 178.57 2i5x h ARG 1940N 0.24 0.13 -0.01 1.13 2.47 -0.56 -0.49 114.38 117.29 2i5x h ARG 1940Ca 0.15 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.84 2i5x h ARG 1940Cb 0.12 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 2i5x h ARG 1940CO -0.16 0.25 0.01 -0.07 0.56 0.00 0.00 179.97 180.57 2i5x h LEU 1941N 0.13 0.00 0.00 3.04 3.38 -0.99 -3.24 115.31 117.63 2i5x h LEU 1941Ca 0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2i5x h LEU 1941Cb 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2i5x h LEU 1941CO 0.02 0.00 -2.02 1.41 0.09 0.00 0.00 178.44 177.94 2i5x n HIS 1942N -4.34 0.00 -3.60 1.13 8.25 -0.29 -4.84 115.22 111.53 2i5x n HIS 1942Ca -0.03 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.27 2i5x n HIS 1942Cb 0.10 -0.61 -0.07 0.00 1.12 0.00 0.00 29.99 30.53 2i5x n HIS 1942CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2i5x s ARG 1943N -3.04 0.90 0.56 -0.41 3.52 -0.60 -4.61 118.95 115.28 2i5x s ARG 1943Ca -0.08 0.39 -0.20 0.00 -0.13 0.00 0.00 55.73 55.72 2i5x s ARG 1943Cb 0.10 0.42 -0.04 0.00 -1.56 0.00 0.00 34.95 33.87 2i5x s ARG 1943CO 0.79 -0.23 1.22 0.54 -0.81 0.00 0.00 175.30 176.81 2i5x s VAL 1944N -0.72 2.63 -0.00 7.11 0.11 -1.26 -3.84 120.40 124.43 2i5x s VAL 1944Ca -0.08 0.42 0.00 0.00 -2.93 0.00 0.00 61.98 59.39 2i5x s VAL 1944Cb -0.02 -3.18 0.00 0.00 -1.53 0.00 0.00 36.38 31.65 2i5x s VAL 1944CO 0.06 -0.06 0.00 1.41 -3.33 0.00 0.00 175.10 173.18 2i5x n HIS 1945N -1.32 0.00 -1.70 1.54 8.25 -1.26 -4.83 115.22 115.90 2i5x n HIS 1945Ca 0.12 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.16 2i5x n HIS 1945Cb 0.49 -1.44 -0.03 0.00 1.12 0.00 0.00 29.99 30.13 2i5x n HIS 1945CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2i5x n MET 1946N -0.13 2.73 -2.57 -0.41 0.00 -1.25 -2.91 117.12 112.58 2i5x n MET 1946Ca -0.00 0.99 -0.01 0.00 0.00 0.00 0.00 57.70 58.68 2i5x n MET 1946Cb 0.36 -2.85 0.00 0.00 0.00 0.00 0.00 33.22 30.73 2i5x n MET 1946CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 2i5x n VAL 1947N 4.22-10.70 0.52 2.03 0.31 -0.72 -4.80 118.33 109.19 2i5x n VAL 1947Ca 0.17 1.53 0.11 0.00 -0.01 0.00 0.00 64.34 66.14 2i5x n VAL 1947Cb 0.35 -6.61 -0.04 0.00 -0.91 0.00 0.00 33.84 26.63 2i5x n VAL 1947CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2i5x n GLN 1948N 0.51 0.32 -4.23 5.55 0.00 -1.15 -4.86 117.38 113.53 2i5x n GLN 1948Ca 0.01 -0.04 -0.18 0.00 -0.00 0.00 0.00 57.00 56.79 2i5x n GLN 1948Cb 0.05 -1.57 -0.11 0.00 0.00 0.00 0.00 30.24 28.60 2i5x n GLN 1948CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2i5x s THR 1949N -3.23 1.30 0.35 1.69 -4.23 -1.26 -5.04 115.64 105.22 2i5x s THR 1949Ca 0.02 -1.64 0.02 0.00 -1.18 0.00 0.00 61.69 58.92 2i5x s THR 1949Cb 0.14 -1.45 0.26 0.00 1.34 0.00 0.00 72.50 72.80 2i5x s THR 1949CO 0.84 -0.37 2.01 -0.08 -0.54 0.00 0.00 174.62 176.47 2i5x h GLU 1950N 3.68 0.82 -0.07 3.99 4.81 -1.95 -1.90 114.58 123.95 2i5x h GLU 1950Ca -0.40 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.73 2i5x h GLU 1950Cb 1.19 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 2i5x h GLU 1950CO 0.48 0.55 -0.15 0.00 -0.73 0.00 0.00 179.01 179.16 2i5x h GLN 1952N 0.10 1.00 -0.43 0.00 4.20 -1.65 -0.22 115.11 118.11 2i5x h GLN 1952Ca 0.02 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.43 2i5x h GLN 1952Cb 0.33 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 2i5x h GLN 1952CO 0.02 0.93 0.12 -0.92 -0.67 0.00 0.00 178.83 178.31 2i5x h TYR 1953N 0.91 0.71 -0.43 2.96 3.20 -1.01 -1.75 116.97 121.57 2i5x h TYR 1953Ca 0.19 -0.08 0.06 0.00 3.14 0.00 0.00 58.73 62.04 2i5x h TYR 1953Cb 0.41 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 2i5x h TYR 1953CO 0.03 0.65 0.14 0.28 -1.64 0.00 0.00 178.16 177.62 2i5x h VAL 1954N 0.56 0.85 -0.98 1.81 2.07 -0.94 -2.92 116.25 116.69 2i5x h VAL 1954Ca 0.14 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.61 2i5x h VAL 1954Cb 0.29 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.52 2i5x h VAL 1954CO -0.00 0.05 0.63 0.22 0.02 0.00 0.00 177.57 178.49 2i5x h TYR 1955N 0.29 1.18 -0.69 1.57 3.20 -0.59 -0.04 116.97 121.90 2i5x h TYR 1955Ca 0.20 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.16 2i5x h TYR 1955Cb 0.21 -0.39 -0.06 0.00 1.54 0.00 0.00 36.73 38.03 2i5x h TYR 1955CO -0.16 0.64 0.38 -0.07 -1.64 0.00 0.00 178.16 177.31 2i5x h LEU 1956N 1.18 0.57 -0.54 2.82 3.38 -1.15 0.63 115.31 122.20 2i5x h LEU 1956Ca 0.40 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.35 2i5x h LEU 1956Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2i5x h LEU 1956CO -0.15 0.36 0.14 0.45 0.09 0.00 0.00 178.44 179.33 2i5x h HIS 1957N 0.70 0.90 -0.66 1.13 3.86 -1.00 -2.45 115.15 117.63 2i5x h HIS 1957Ca 0.31 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.38 2i5x h HIS 1957Cb 0.20 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 2i5x h HIS 1957CO -0.08 0.79 0.29 1.96 0.86 0.00 0.00 177.93 181.75 2i5x h GLN 1958N 0.76 0.95 -0.04 2.45 4.20 -0.50 -0.24 115.11 122.70 2i5x h GLN 1958Ca 0.17 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2i5x h GLN 1958Cb 0.33 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2i5x h GLN 1958CO 0.00 0.76 0.02 0.00 -0.67 0.00 0.00 178.83 178.94 2i5x h VAL 1960N -0.00 1.24 -0.60 0.00 2.07 -1.22 -0.96 116.25 116.78 2i5x h VAL 1960Ca 0.01 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.77 2i5x h VAL 1960Cb 0.05 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2i5x h VAL 1960CO -0.00 0.30 0.39 -0.09 0.02 0.00 0.00 177.57 178.19 2i5x h ARG 1961N 0.87 0.80 -0.34 1.57 2.43 -0.85 -1.44 114.38 117.42 2i5x h ARG 1961Ca 0.20 -0.05 -0.16 0.00 -0.81 0.00 0.00 59.98 59.16 2i5x h ARG 1961Cb 0.23 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2i5x h ARG 1961CO -0.01 0.54 -0.40 -0.44 -1.51 0.00 0.00 179.97 178.14 2i5x h ASP 1962N 0.82 0.90 -0.71 -3.80 3.32 -0.62 -0.37 116.42 115.97 2i5x h ASP 1962Ca 0.22 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 2i5x h ASP 1962Cb -0.08 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.18 2i5x h ASP 1962CO -0.05 1.19 0.42 0.58 -1.72 0.00 0.00 179.24 179.67 2i5x h VAL 1963N 0.68 1.20 -0.14 -1.35 2.07 -1.03 -2.47 116.25 115.23 2i5x h VAL 1963Ca 0.05 -0.45 -0.16 0.00 0.82 0.00 0.00 66.70 66.96 2i5x h VAL 1963Cb 0.98 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2i5x h VAL 1963CO 0.09 0.21 -0.59 -0.07 0.02 0.00 0.00 177.57 177.23 2i5x h LEU 1964N 0.96 0.51 -0.84 2.57 3.38 -1.01 -2.13 115.31 118.75 2i5x h LEU 1964Ca 0.25 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2i5x h LEU 1964Cb -0.03 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 2i5x h LEU 1964CO -0.05 0.98 0.40 0.03 0.09 0.00 0.00 178.44 179.90 2i5x h ARG 1965N 0.34 1.21 -0.05 1.13 3.08 -0.99 -2.85 114.38 116.24 2i5x h ARG 1965Ca -0.00 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 59.75 2i5x h ARG 1965Cb 1.13 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 2i5x h ARG 1965CO 0.10 0.93 -0.52 0.00 -1.07 0.00 0.00 179.97 179.41 2i5x h ALA 1966N 1.22 1.05 0.00 0.04 0.00 -1.21 -3.51 119.26 116.84 2i5x h ALA 1966Ca 0.29 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2i5x h ALA 1966Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2i5x h ALA 1966CO -0.04 0.66 0.00 0.54 0.00 0.00 0.00 179.25 180.41