#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i4h n THR 1679N 0.00 0.00 -3.65 3.15 -2.24 -1.26 -5.00 114.28 105.28 2i4h n THR 1679Ca 0.00 -0.27 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 2i4h n THR 1679Cb 0.00 0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 68.56 2i4h n THR 1679CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2i4h s SER 1680N -3.13 -0.25 -0.43 3.42 1.04 -1.26 -4.20 113.70 108.90 2i4h s SER 1680Ca -0.03 -0.21 0.05 0.00 0.48 0.00 0.00 55.95 56.25 2i4h s SER 1680Cb 0.08 0.45 0.19 0.00 0.10 0.00 0.00 66.02 66.85 2i4h s SER 1680CO 0.50 -0.78 0.47 0.00 0.98 0.00 0.00 173.24 174.40 2i4h s PRO 1682N 0.01 4.62 -0.09 0.00 0.02 -1.26 -4.61 135.00 133.69 2i4h s PRO 1682Ca 0.33 1.80 0.01 0.00 0.02 0.00 0.00 61.00 63.16 2i4h s PRO 1682Cb 0.07 -3.17 0.02 0.00 0.02 0.00 0.00 34.50 31.44 2i4h s PRO 1682CO -0.16 0.20 -0.10 0.42 -0.33 0.00 0.00 177.00 177.03 2i4h s ILE 1683N -1.18 1.07 0.27 2.83 -1.09 -0.01 -4.93 121.20 118.17 2i4h s ILE 1683Ca 0.45 -0.37 -0.31 0.00 -2.23 0.00 0.00 60.65 58.20 2i4h s ILE 1683Cb -0.32 -1.04 -0.12 0.00 -1.58 0.00 0.00 42.46 39.40 2i4h s ILE 1683CO 0.41 0.36 1.61 0.29 -1.23 0.00 0.00 174.94 176.38 2i4h n LYS 1684N 4.47 2.66 -0.19 2.79 4.76 -1.26 -0.92 118.16 130.47 2i4h n LYS 1684Ca -0.17 0.95 0.08 0.00 -2.87 0.00 0.00 58.31 56.30 2i4h n LYS 1684Cb 0.51 -2.73 0.37 0.00 -1.84 0.00 0.00 35.03 31.33 2i4h n LYS 1684CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 2i4h h ILE 1685N 3.41 0.98 0.00 -0.18 3.07 -1.65 0.89 117.51 124.02 2i4h h ILE 1685Ca -0.46 -0.24 0.00 0.00 1.55 0.00 0.00 64.86 65.70 2i4h h ILE 1685Cb 1.22 0.20 0.00 0.00 -0.27 0.00 0.00 36.82 37.98 2i4h h ILE 1685CO 0.82 0.13 0.00 -0.46 -1.05 0.00 0.00 178.15 177.59 2i4h n ASN 1686N -4.49 0.00 -0.07 2.16 6.94 -1.26 -2.41 115.26 116.12 2i4h n ASN 1686Ca 0.12 0.15 0.09 0.00 -0.02 0.00 0.00 54.58 54.92 2i4h n ASN 1686Cb 0.28 -0.37 -0.09 0.00 -2.36 0.00 0.00 39.78 37.24 2i4h n ASN 1686CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2i4h n GLN 1687N -1.37 0.77 -0.11 -3.83 6.02 0.22 -4.71 117.38 114.37 2i4h n GLN 1687Ca 0.09 -0.15 -0.06 0.00 -0.01 0.00 0.00 57.00 56.87 2i4h n GLN 1687Cb 0.23 -1.41 0.02 0.00 1.02 0.00 0.00 30.24 30.10 2i4h n GLN 1687CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2i4h h PHE 1688N 0.36 0.23 -0.51 1.08 3.57 -0.95 -1.92 116.94 118.80 2i4h h PHE 1688Ca 0.00 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.62 2i4h h PHE 1688Cb 0.49 -0.05 -0.10 0.00 2.79 0.00 0.00 35.95 39.08 2i4h h PHE 1688CO 0.00 0.10 -0.29 1.49 -2.23 0.00 0.00 178.31 177.37 2i4h h GLU 1689N 0.28 -0.17 -0.63 1.11 4.57 -1.84 -1.40 114.58 116.50 2i4h h GLU 1689Ca 0.16 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 2i4h h GLU 1689Cb 0.14 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2i4h h GLU 1689CO -0.17 -0.11 0.10 0.78 -1.18 0.00 0.00 179.01 178.43 2i4h h GLY 1690N -0.17 1.10 1.00 1.92 0.00 -1.82 -2.43 103.07 102.67 2i4h h GLY 1690Ca 0.22 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 2i4h h GLY 1690CO -0.61 0.67 0.31 0.84 0.00 0.00 0.00 176.54 177.74 2i4h h HIS 1691N 0.96 0.90 -0.56 5.60 -0.00 -0.88 -1.87 115.15 119.30 2i4h h HIS 1691Ca 0.19 -0.04 -0.07 0.00 -0.00 0.00 0.00 60.37 60.45 2i4h h HIS 1691Cb 0.42 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.53 2i4h h HIS 1691CO 0.03 0.68 0.09 0.35 -0.00 0.00 0.00 177.93 179.08 2i4h h PHE 1692N 0.86 0.99 -0.42 5.26 3.57 -1.20 -1.05 116.94 124.96 2i4h h PHE 1692Ca 0.22 -0.14 0.09 0.00 3.53 0.00 0.00 57.97 61.66 2i4h h PHE 1692Cb 0.11 -0.27 -0.08 0.00 2.79 0.00 0.00 35.95 38.50 2i4h h PHE 1692CO 0.00 0.87 -0.12 0.52 -2.23 0.00 0.00 178.31 177.35 2i4h h MET 1693N 0.83 -0.03 -0.57 1.11 2.86 -1.17 -1.81 114.93 116.15 2i4h h MET 1693Ca 0.17 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.76 2i4h h MET 1693Cb 0.41 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 2i4h h MET 1693CO 0.01 -0.02 0.16 -0.22 1.06 0.00 0.00 176.91 177.91 2i4h h LYS 1694N -0.03 0.90 -0.88 1.72 3.64 -1.15 -1.42 116.57 119.36 2i4h h LYS 1694Ca 0.20 -0.20 0.12 0.00 -1.27 0.00 0.00 60.65 59.50 2i4h h LYS 1694Cb 0.34 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 31.96 2i4h h LYS 1694CO -0.45 0.82 0.57 -0.07 -2.27 0.00 0.00 179.45 178.05 2i4h h LEU 1695N 0.82 0.71 0.00 5.20 3.38 -0.95 -2.85 115.31 121.61 2i4h h LEU 1695Ca 0.18 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2i4h h LEU 1695Cb 0.31 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2i4h h LEU 1695CO -0.00 0.39 -0.27 1.56 0.09 0.00 0.00 178.44 180.21 2i4h h GLN 1696N 0.77 0.00 -6.92 1.13 4.20 -0.69 -1.39 115.11 112.20 2i4h h GLN 1696Ca 0.43 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.58 2i4h h GLN 1696Cb 0.58 0.00 0.18 0.00 0.30 0.00 0.00 27.48 28.53 2i4h h GLN 1696CO -0.19 0.00 0.07 0.00 -0.67 0.00 0.00 178.83 178.04 2i4h n ALA 1697N -1.98 -0.29 -3.84 3.87 0.00 -0.59 -1.28 120.51 116.39 2i4h n ALA 1697Ca 0.04 -0.17 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 2i4h n ALA 1697Cb 0.49 -2.10 0.01 0.00 0.00 0.00 0.00 19.45 17.86 2i4h n ALA 1697CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2i4h n ASP 1698N -1.49 -2.91 -3.60 0.00 9.92 -1.26 -2.53 116.55 114.68 2i4h n ASP 1698Ca 0.13 -1.04 -0.20 0.00 -0.53 0.00 0.00 54.79 53.15 2i4h n ASP 1698Cb 0.49 -3.07 0.05 0.00 -0.64 0.00 0.00 41.12 37.95 2i4h n ASP 1698CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2i4h n SER 1699N -2.77 -1.70 -2.20 -2.24 7.64 -1.23 -2.87 113.62 108.26 2i4h n SER 1699Ca -0.19 -0.76 -0.18 0.00 1.01 0.00 0.00 58.87 58.75 2i4h n SER 1699Cb 0.63 -4.42 0.01 0.00 -1.01 0.00 0.00 64.21 59.42 2i4h n SER 1699CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2i4h n ASN 1700N -3.08 -5.19 0.39 6.43 4.13 -0.40 -4.90 115.26 112.63 2i4h n ASN 1700Ca -0.29 -0.11 -0.18 0.00 1.68 0.00 0.00 54.58 55.68 2i4h n ASN 1700Cb 0.67 -4.18 -0.09 0.00 -1.54 0.00 0.00 39.78 34.64 2i4h n ASN 1700CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 2i4h h TYR 1701N -0.47 -0.98 -0.40 3.10 3.20 -1.35 0.29 116.97 120.37 2i4h h TYR 1701Ca -0.42 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.31 2i4h h TYR 1701Cb 1.30 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.89 2i4h h TYR 1701CO 0.45 -0.59 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.09 2i4h h LEU 1702N -0.99 0.82 -0.14 2.82 3.38 -1.79 -2.31 115.31 117.10 2i4h h LEU 1702Ca -0.09 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.60 2i4h h LEU 1702Cb 0.78 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2i4h h LEU 1702CO 0.13 1.01 0.01 0.25 0.09 0.00 0.00 178.44 179.94 2i4h h LEU 1703N 0.70 -0.02 -1.25 1.67 6.46 -1.13 -0.46 115.31 121.27 2i4h h LEU 1703Ca 0.10 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2i4h h LEU 1703Cb 0.74 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.68 2i4h h LEU 1703CO 0.06 0.01 0.31 0.28 -0.62 0.00 0.00 178.44 178.48 2i4h h SER 1704N 0.07 0.74 -0.01 1.25 0.02 -0.39 -0.47 113.55 114.76 2i4h h SER 1704Ca 0.06 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2i4h h SER 1704Cb 0.06 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.42 2i4h h SER 1704CO -0.09 0.61 0.00 0.50 -1.14 0.00 0.00 176.83 176.70 2i4h h LYS 1705N 0.83 0.02 -0.15 3.45 3.64 -1.27 -1.13 116.57 121.96 2i4h h LYS 1705Ca 0.21 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.63 2i4h h LYS 1705Cb 0.04 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 2i4h h LYS 1705CO -0.03 0.30 -0.11 1.49 -2.27 0.00 0.00 179.45 178.83 2i4h h GLU 1706N -0.27 -0.11 -0.67 1.90 4.81 -0.98 -2.63 114.58 116.63 2i4h h GLU 1706Ca 0.00 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 2i4h h GLU 1706Cb 0.29 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.60 2i4h h GLU 1706CO 0.00 -0.07 0.19 -0.92 -0.73 0.00 0.00 179.01 177.48 2i4h h TYR 1707N -0.12 0.31 -0.70 0.92 3.20 -1.01 -2.35 116.97 117.23 2i4h h TYR 1707Ca 0.09 0.04 0.03 0.00 3.14 0.00 0.00 58.73 62.03 2i4h h TYR 1707Cb 0.25 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2i4h h TYR 1707CO -0.24 -0.01 0.46 0.93 -1.64 0.00 0.00 178.16 177.66 2i4h h GLU 1708N 0.32 0.83 -0.01 1.82 3.07 -1.08 -2.10 114.58 117.43 2i4h h GLU 1708Ca 0.36 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 2i4h h GLU 1708Cb 0.56 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.28 2i4h h GLU 1708CO -0.42 0.55 0.08 0.93 -1.40 0.00 0.00 179.01 178.75 2i4h h GLU 1709N 0.85 0.00 0.00 2.33 5.08 -1.04 -0.78 114.58 121.03 2i4h h GLU 1709Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2i4h h GLU 1709Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2i4h h GLU 1709CO -0.08 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.21 2i4h n LEU 1710N -3.08 0.47 -0.23 1.33 4.77 -0.79 -4.48 117.00 115.00 2i4h n LEU 1710Ca -0.03 0.55 0.02 0.00 -0.03 0.00 0.00 56.01 56.53 2i4h n LEU 1710Cb 0.15 -0.42 0.12 0.00 -2.33 0.00 0.00 43.42 40.94 2i4h n LEU 1710CO 0.19 -0.16 0.82 0.50 -1.33 0.00 0.00 177.39 177.41 2i4h h LYS 1711N 0.00 0.10 -0.16 3.23 3.64 -1.28 -2.04 116.57 120.06 2i4h h LYS 1711Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2i4h h LYS 1711Cb 0.59 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 2i4h h LYS 1711CO 0.00 0.06 0.00 -0.25 -2.27 0.00 0.00 179.45 176.99 2i4h n ASP 1712N -5.32 3.00 -4.73 4.20 8.00 -1.26 -4.95 116.55 115.48 2i4h n ASP 1712Ca 0.11 -1.92 -0.42 0.00 0.71 0.00 0.00 54.79 53.27 2i4h n ASP 1712Cb 0.40 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.38 2i4h n ASP 1712CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2i4h s VAL 1713N -1.64 2.14 0.00 2.53 1.01 -0.77 -1.87 120.40 121.80 2i4h s VAL 1713Ca 0.29 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2i4h s VAL 1713Cb 0.19 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2i4h s VAL 1713CO 0.28 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2i4h n GLY 1714N 3.07 2.95 0.01 4.51 0.00 -1.26 -4.50 105.19 109.96 2i4h n GLY 1714Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2i4h n GLY 1714CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i4h n ARG 1715N -2.00 0.01 0.00 1.61 1.74 -0.78 -3.10 116.66 114.14 2i4h n ARG 1715Ca 0.00 0.07 0.01 0.00 -0.77 0.00 0.00 57.85 57.16 2i4h n ARG 1715Cb 0.00 -1.52 0.04 0.00 -1.02 0.00 0.00 32.46 29.97 2i4h n ARG 1715CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2i4h n ASN 1716N -1.54 0.00 -4.50 0.55 2.85 -1.26 -4.79 115.26 106.57 2i4h n ASN 1716Ca 0.06 -0.58 -0.30 0.00 -0.11 0.00 0.00 54.58 53.65 2i4h n ASN 1716Cb 0.30 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.21 2i4h n ASN 1716CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2i4h s GLN 1717N -2.00 1.92 0.36 1.20 -0.21 -1.18 -5.09 119.66 114.65 2i4h s GLN 1717Ca 0.02 -1.10 -0.27 0.00 0.02 0.00 0.00 55.36 54.03 2i4h s GLN 1717Cb 0.01 -2.17 -0.09 0.00 1.00 0.00 0.00 33.01 31.75 2i4h s GLN 1717CO 0.02 0.50 1.26 -1.54 -2.12 0.00 0.00 175.29 173.40 2i4h s SER 1718N -1.99 6.67 -0.33 5.90 1.04 -1.26 -4.96 113.70 118.77 2i4h s SER 1718Ca 0.18 2.57 0.07 0.00 0.48 0.00 0.00 55.95 59.25 2i4h s SER 1718Cb -0.11 -2.64 0.54 0.00 0.10 0.00 0.00 66.02 63.92 2i4h s SER 1718CO 0.10 -0.59 1.57 0.00 0.98 0.00 0.00 173.24 175.30 2i4h h ASP 1720N 1.02 0.81 -0.24 0.00 3.32 -1.94 -2.53 116.42 116.86 2i4h h ASP 1720Ca 0.32 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 2i4h h ASP 1720Cb 1.93 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 41.25 2i4h h ASP 1720CO 0.57 0.93 -0.15 0.40 -1.72 0.00 0.00 179.24 179.27 2i4h h ILE 1721N 0.74 1.31 -0.23 0.35 1.08 -1.92 -2.88 117.51 115.96 2i4h h ILE 1721Ca 0.13 -1.26 0.07 0.00 -0.39 0.00 0.00 64.86 63.40 2i4h h ILE 1721Cb 0.59 1.61 -0.01 0.00 -3.07 0.00 0.00 36.82 35.94 2i4h h ILE 1721CO 0.04 0.39 0.29 0.00 -0.69 0.00 0.00 178.15 178.18 2i4h h ALA 1722N 0.70 1.83 0.00 1.87 0.00 -1.79 -2.07 119.26 119.80 2i4h h ALA 1722Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2i4h h ALA 1722Cb 0.67 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2i4h h ALA 1722CO 0.04 -0.41 -0.59 1.28 0.00 0.00 0.00 179.25 179.57 2i4h n LEU 1723N -3.65 0.57 -4.67 0.00 4.77 -0.97 -4.63 117.00 108.41 2i4h n LEU 1723Ca 0.03 -0.01 -0.44 0.00 -0.03 0.00 0.00 56.01 55.55 2i4h n LEU 1723Cb 0.42 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2i4h n LEU 1723CO 0.26 0.11 0.97 0.18 -1.33 0.00 0.00 177.39 177.57 2i4h n LEU 1724N -1.60 3.15 -0.33 2.23 4.77 -0.78 -4.87 117.00 119.57 2i4h n LEU 1724Ca 0.05 1.16 0.23 0.00 -0.03 0.00 0.00 56.01 57.42 2i4h n LEU 1724Cb 0.35 -1.44 0.45 0.00 -2.33 0.00 0.00 43.42 40.45 2i4h n LEU 1724CO 0.36 -0.53 0.96 -0.65 -1.33 0.00 0.00 177.39 176.20 2i4h h PRO 1725N 3.73 0.04 0.00 3.23 0.11 -1.91 -1.08 132.00 136.13 2i4h h PRO 1725Ca -0.45 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 2i4h h PRO 1725Cb 1.28 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2i4h h PRO 1725CO 0.72 0.03 -0.13 0.93 -0.21 0.00 0.00 178.00 179.34 2i4h h GLU 1726N 0.05 0.00 -0.02 1.05 3.07 -1.95 -3.02 114.58 113.75 2i4h h GLU 1726Ca 0.72 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.58 2i4h h GLU 1726Cb 1.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.65 2i4h h GLU 1726CO -0.81 0.13 -0.40 0.09 -1.40 0.00 0.00 179.01 176.63 2i4h n ASN 1727N -3.62 2.06 -0.17 1.42 3.02 -0.41 -4.48 115.26 113.08 2i4h n ASN 1727Ca -0.02 -1.52 -0.02 0.00 -0.03 0.00 0.00 54.58 52.99 2i4h n ASN 1727Cb 0.26 0.39 0.07 0.00 -0.61 0.00 0.00 39.78 39.89 2i4h n ASN 1727CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2i4h h ARG 1728N 2.60 0.33 0.00 3.52 2.43 -1.48 0.45 114.38 122.23 2i4h h ARG 1728Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2i4h h ARG 1728Cb 0.76 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 2i4h h ARG 1728CO 0.00 0.22 0.00 0.78 -1.51 0.00 0.00 179.97 179.46 2i4h h GLY 1729N 0.34 0.00 0.28 2.80 0.00 -1.81 -2.81 103.07 101.87 2i4h h GLY 1729Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2i4h h GLY 1729CO -0.27 0.00 -0.21 0.28 0.00 0.00 0.00 176.54 176.34 2i4h n LYS 1730N -2.57 0.89 -3.98 4.80 5.02 0.14 -4.82 118.16 117.64 2i4h n LYS 1730Ca -0.01 -0.49 -0.35 0.00 -2.02 0.00 0.00 58.31 55.44 2i4h n LYS 1730Cb 0.13 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.53 2i4h n LYS 1730CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2i4h s ASN 1731N -2.45 5.20 0.16 4.39 0.01 -1.06 -4.42 114.94 116.76 2i4h s ASN 1731Ca 0.26 -0.10 -0.10 0.00 -0.71 0.00 0.00 52.86 52.21 2i4h s ASN 1731Cb 0.19 -1.90 0.02 0.00 0.41 0.00 0.00 41.25 39.97 2i4h s ASN 1731CO 0.50 0.08 1.57 -0.09 -1.51 0.00 0.00 177.10 177.64 2i4h h ARG 1732N 7.42 1.02 -5.38 -0.60 2.43 -1.87 -3.43 114.38 113.97 2i4h h ARG 1732Ca -0.36 -0.41 -0.57 0.00 -0.81 0.00 0.00 59.98 57.83 2i4h h ARG 1732Cb 1.18 -0.05 -0.31 0.00 -0.42 0.00 0.00 29.97 30.37 2i4h h ARG 1732CO 0.63 1.10 -0.84 0.71 -1.51 0.00 0.00 179.97 180.06 2i4h s TYR 1733N -4.75 1.74 0.47 2.20 2.02 -1.26 -5.03 117.35 112.74 2i4h s TYR 1733Ca -0.11 -0.48 0.21 0.00 -0.37 0.00 0.00 57.07 56.31 2i4h s TYR 1733Cb 0.12 -1.16 1.30 0.00 -0.40 0.00 0.00 41.96 41.82 2i4h s TYR 1733CO 0.87 -0.15 2.08 -2.95 -1.57 0.00 0.00 175.55 173.82 2i4h h ASN 1734N 6.18 0.00 0.01 2.29 7.08 -1.96 -2.89 115.58 126.30 2i4h h ASN 1734Ca -0.33 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.89 2i4h h ASN 1734Cb 1.17 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.41 2i4h h ASN 1734CO 0.48 0.11 -0.06 -0.46 -2.08 0.00 0.00 177.43 175.42 2i4h n ASN 1735N -4.09 1.89 -3.97 6.14 6.94 -1.26 -4.79 115.26 116.13 2i4h n ASN 1735Ca -0.02 -1.56 -0.30 0.00 -0.02 0.00 0.00 54.58 52.67 2i4h n ASN 1735Cb 0.20 0.05 -0.14 0.00 -2.36 0.00 0.00 39.78 37.52 2i4h n ASN 1735CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2i4h s ILE 1736N -2.10 2.33 -0.01 1.53 -1.09 -1.09 -5.07 121.20 115.71 2i4h s ILE 1736Ca 0.32 -2.76 0.02 0.00 -2.23 0.00 0.00 60.65 56.01 2i4h s ILE 1736Cb 0.20 -2.67 -0.00 0.00 -1.58 0.00 0.00 42.46 38.40 2i4h s ILE 1736CO 0.36 -0.70 -0.08 -0.76 -1.23 0.00 0.00 174.94 172.53 2i4h s LEU 1737N 0.37 1.98 0.51 2.97 1.43 -1.26 -4.68 118.68 120.01 2i4h s LEU 1737Ca 0.14 -0.15 -0.19 0.00 -1.03 0.00 0.00 54.13 52.90 2i4h s LEU 1737Cb -0.22 -0.42 -0.07 0.00 0.03 0.00 0.00 46.19 45.51 2i4h s LEU 1737CO -0.05 0.09 1.05 -2.16 0.23 0.00 0.00 176.35 175.51 2i4h s PRO 1738N -0.13 3.67 0.24 1.29 0.04 -1.26 -4.66 135.00 134.18 2i4h s PRO 1738Ca 0.02 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.09 2i4h s PRO 1738Cb -0.04 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 2i4h s PRO 1738CO -0.00 -0.54 1.27 0.71 0.04 0.00 0.00 177.00 178.48 2i4h s TYR 1739N -2.10 3.27 0.26 0.56 2.02 -1.26 -4.58 117.35 115.52 2i4h s TYR 1739Ca 0.66 1.35 -0.08 0.00 -0.37 0.00 0.00 57.07 58.63 2i4h s TYR 1739Cb -0.16 -3.56 0.44 0.00 -0.40 0.00 0.00 41.96 38.28 2i4h s TYR 1739CO 0.24 -1.64 1.60 -0.44 -1.57 0.00 0.00 175.55 173.74 2i4h h ASP 1740N 4.70 -0.64 0.57 2.29 3.32 -1.50 -1.27 116.42 123.90 2i4h h ASP 1740Ca -0.46 0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 2i4h h ASP 1740Cb 1.22 0.48 -0.00 0.00 0.22 0.00 0.00 39.33 41.24 2i4h h ASP 1740CO 0.73 -0.27 -0.13 0.00 -1.72 0.00 0.00 179.24 177.86 2i4h h ALA 1741N 1.84 1.15 -0.05 3.45 0.00 -1.93 -3.27 119.26 120.45 2i4h h ALA 1741Ca 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2i4h h ALA 1741Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2i4h h ALA 1741CO -0.83 0.16 0.00 0.25 0.00 0.00 0.00 179.25 178.83 2i4h n THR 1742N -3.46 0.58 -2.29 0.00 -2.24 -0.91 -5.06 114.28 100.89 2i4h n THR 1742Ca -0.01 -0.79 -0.37 0.00 -2.27 0.00 0.00 64.05 60.61 2i4h n THR 1742Cb 0.29 0.73 -0.02 0.00 -2.10 0.00 0.00 70.33 69.23 2i4h n THR 1742CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i4h s ARG 1743N -0.67 3.90 0.07 -0.78 1.70 -0.53 -0.56 118.95 122.08 2i4h s ARG 1743Ca 0.04 1.79 -0.29 0.00 -0.47 0.00 0.00 55.73 56.79 2i4h s ARG 1743Cb 0.02 -2.52 -0.05 0.00 -0.57 0.00 0.00 34.95 31.84 2i4h s ARG 1743CO 0.03 -0.44 0.95 0.08 -1.08 0.00 0.00 175.30 174.84 2i4h s VAL 1744N -1.50 4.64 -0.10 4.99 1.01 -0.51 -4.78 120.40 124.15 2i4h s VAL 1744Ca 0.61 2.02 -0.04 0.00 0.00 0.00 0.00 61.98 64.57 2i4h s VAL 1744Cb -0.29 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.75 2i4h s VAL 1744CO 0.36 0.27 0.04 -0.54 0.00 0.00 0.00 175.10 175.24 2i4h s LYS 1745N 0.30 3.16 0.34 2.72 1.02 -1.26 -4.11 119.74 121.91 2i4h s LYS 1745Ca 0.48 -0.32 -0.26 0.00 0.02 0.00 0.00 55.97 55.89 2i4h s LYS 1745Cb -0.22 -2.93 -0.10 0.00 -0.52 0.00 0.00 37.83 34.06 2i4h s LYS 1745CO 0.29 0.71 0.97 -0.51 -0.92 0.00 0.00 175.35 175.89 2i4h s LEU 1746N -0.87 4.30 -0.97 3.17 1.43 -0.05 -5.04 118.68 120.66 2i4h s LEU 1746Ca 0.13 1.89 -0.01 0.00 -1.03 0.00 0.00 54.13 55.12 2i4h s LEU 1746Cb -0.12 -4.04 0.30 0.00 0.03 0.00 0.00 46.19 42.37 2i4h s LEU 1746CO 0.03 -0.16 1.40 -0.24 0.23 0.00 0.00 176.35 177.61 2i4h n SER 1747N 0.45 6.08 -3.96 2.29 2.88 -1.26 -4.55 113.62 115.55 2i4h n SER 1747Ca 0.02 -3.50 -0.14 0.00 -1.33 0.00 0.00 58.87 53.92 2i4h n SER 1747Cb 0.50 -1.11 -0.05 0.00 -0.75 0.00 0.00 64.21 62.80 2i4h n SER 1747CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i4h h SER 1755N 8.99 0.00 -0.01 0.00 0.02 -1.99 -2.97 113.55 117.60 2i4h h SER 1755Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2i4h h SER 1755Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2i4h h SER 1755CO 1.11 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.90 2i4h n ASP 1756N -2.80 0.05 -4.71 3.07 5.68 -1.26 -4.83 116.55 111.75 2i4h n ASP 1756Ca 0.00 -1.45 -0.41 0.00 -0.50 0.00 0.00 54.79 52.44 2i4h n ASP 1756Cb 0.23 -0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.16 2i4h n ASP 1756CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2i4h s TYR 1757N -1.99 3.58 0.00 2.11 5.04 -1.12 -0.87 117.35 124.10 2i4h s TYR 1757Ca 0.27 1.38 0.01 0.00 -2.44 0.00 0.00 57.07 56.29 2i4h s TYR 1757Cb 0.12 -2.92 -0.01 0.00 0.35 0.00 0.00 41.96 39.51 2i4h s TYR 1757CO 0.21 0.02 -0.03 -1.50 -1.34 0.00 0.00 175.55 172.91 2i4h s ILE 1758N 1.01 0.24 -0.92 3.14 2.07 -1.26 -4.89 121.20 120.59 2i4h s ILE 1758Ca 0.42 -0.25 -0.24 0.00 -1.41 0.00 0.00 60.65 59.16 2i4h s ILE 1758Cb -0.19 -0.23 0.03 0.00 0.13 0.00 0.00 42.46 42.20 2i4h s ILE 1758CO 0.20 -0.01 1.51 0.21 -1.91 0.00 0.00 174.94 174.94 2i4h s ASN 1759N -0.28 6.15 -0.28 4.50 3.84 -1.26 -4.59 114.94 123.01 2i4h s ASN 1759Ca -0.01 -1.01 -0.23 0.00 0.21 0.00 0.00 52.86 51.82 2i4h s ASN 1759Cb -0.02 -2.56 0.13 0.00 -0.55 0.00 0.00 41.25 38.24 2i4h s ASN 1759CO -0.00 -1.82 1.04 0.00 -2.79 0.00 0.00 177.10 173.53 2i4h s ALA 1760N 6.16 -2.04 -0.02 1.71 0.00 -1.26 -3.04 121.76 123.27 2i4h s ALA 1760Ca 0.48 1.93 0.03 0.00 0.00 0.00 0.00 51.96 54.40 2i4h s ALA 1760Cb -0.04 -1.51 -0.00 0.00 0.00 0.00 0.00 23.12 21.57 2i4h s ALA 1760CO -0.01 -0.25 -0.12 -1.12 0.00 0.00 0.00 175.76 174.26 2i4h s SER 1761N 0.42 1.47 0.24 0.00 0.01 0.05 -1.42 113.70 114.47 2i4h s SER 1761Ca 0.01 -0.23 -0.30 0.00 1.31 0.00 0.00 55.95 56.75 2i4h s SER 1761Cb -0.05 -0.30 -0.09 0.00 0.21 0.00 0.00 66.02 65.80 2i4h s SER 1761CO -0.08 0.12 1.05 -0.31 0.41 0.00 0.00 173.24 174.43 2i4h s TYR 1762N -0.04 3.69 -0.24 2.43 2.02 0.27 -0.69 117.35 124.80 2i4h s TYR 1762Ca 0.00 1.73 -0.01 0.00 -0.37 0.00 0.00 57.07 58.42 2i4h s TYR 1762Cb -0.07 -3.20 0.02 0.00 -0.40 0.00 0.00 41.96 38.31 2i4h s TYR 1762CO 0.00 -0.28 -0.08 0.42 -1.57 0.00 0.00 175.55 174.04 2i4h s ILE 1763N -0.90 2.77 0.70 2.71 -1.09 -0.14 -4.93 121.20 120.33 2i4h s ILE 1763Ca 0.45 -0.98 -0.13 0.00 -2.23 0.00 0.00 60.65 57.76 2i4h s ILE 1763Cb -0.30 -2.37 0.02 0.00 -1.58 0.00 0.00 42.46 38.23 2i4h s ILE 1763CO 0.37 0.26 1.09 -2.16 -1.23 0.00 0.00 174.94 173.27 2i4h s PRO 1764N 1.33 2.67 0.52 2.79 0.04 -1.26 -0.14 135.00 140.94 2i4h s PRO 1764Ca 0.01 1.20 0.09 0.00 0.04 0.00 0.00 61.00 62.34 2i4h s PRO 1764Cb -0.16 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.49 2i4h s PRO 1764CO -0.06 -1.33 0.68 0.20 0.04 0.00 0.00 177.00 176.53 2i4h s GLY 1765N -3.14 1.86 0.59 0.56 0.00 -0.56 -4.59 107.32 102.05 2i4h s GLY 1765Ca 0.63 -1.93 0.29 0.00 0.00 0.00 0.00 44.72 43.71 2i4h s GLY 1765CO 0.49 -1.65 2.21 3.43 0.00 0.00 0.00 173.10 177.58 2i4h h ASN 1766N 0.40 0.00 0.00 1.64 2.35 -1.99 -3.31 115.58 114.67 2i4h h ASN 1766Ca -0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 2i4h h ASN 1766Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 2i4h h ASN 1766CO 0.44 0.00 -0.62 0.59 -1.65 0.00 0.00 177.43 176.19 2i4h n ASN 1767N -3.83 1.36 -3.54 5.81 3.02 -1.26 -5.08 115.26 111.74 2i4h n ASN 1767Ca -0.02 -0.43 -0.07 0.00 -0.03 0.00 0.00 54.58 54.03 2i4h n ASN 1767Cb 0.15 1.10 -0.02 0.00 -0.61 0.00 0.00 39.78 40.40 2i4h n ASN 1767CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2i4h s PHE 1768N -1.86 -0.28 0.96 3.10 5.36 -1.25 -5.16 117.98 118.85 2i4h s PHE 1768Ca 0.01 0.22 -0.12 0.00 -0.96 0.00 0.00 56.93 56.08 2i4h s PHE 1768Cb 0.04 0.52 0.17 0.00 -0.34 0.00 0.00 43.02 43.41 2i4h s PHE 1768CO 0.26 -0.41 1.09 -0.98 -1.46 0.00 0.00 175.22 173.71 2i4h s ARG 1769N -2.67 0.70 -1.33 10.12 1.70 -1.26 -1.49 118.95 124.72 2i4h s ARG 1769Ca 0.06 0.73 -0.01 0.00 -0.47 0.00 0.00 55.73 56.04 2i4h s ARG 1769Cb -0.01 -1.75 0.01 0.00 -0.57 0.00 0.00 34.95 32.63 2i4h s ARG 1769CO -0.07 -2.60 0.71 0.54 -1.08 0.00 0.00 175.30 172.80 2i4h n ARG 1770N -4.12 -4.90 -0.20 3.89 1.74 -1.23 -4.60 116.66 107.24 2i4h n ARG 1770Ca 0.06 0.61 -0.08 0.00 -0.77 0.00 0.00 57.85 57.67 2i4h n ARG 1770Cb 0.56 -5.17 0.02 0.00 -1.02 0.00 0.00 32.46 26.85 2i4h n ARG 1770CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2i4h h GLU 1771N -1.89 0.86 -5.84 5.56 4.81 -0.71 -3.35 114.58 114.02 2i4h h GLU 1771Ca -0.61 -0.16 -0.50 0.00 -0.13 0.00 0.00 59.36 57.96 2i4h h GLU 1771Cb 1.36 -0.14 -0.18 0.00 0.63 0.00 0.00 28.75 30.42 2i4h h GLU 1771CO 0.57 0.75 -0.78 0.71 -0.73 0.00 0.00 179.01 179.53 2i4h s TYR 1772N -5.54 1.73 -0.17 0.92 1.51 -0.88 -1.86 117.35 113.06 2i4h s TYR 1772Ca -0.13 -0.48 -0.02 0.00 -1.01 0.00 0.00 57.07 55.43 2i4h s TYR 1772Cb 0.13 -0.88 -0.01 0.00 -0.11 0.00 0.00 41.96 41.09 2i4h s TYR 1772CO 0.79 0.28 -0.10 0.42 -1.11 0.00 0.00 175.55 175.83 2i4h s ILE 1773N -1.98 3.15 -0.09 2.71 1.01 -0.16 -0.96 121.20 124.88 2i4h s ILE 1773Ca 0.13 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 2i4h s ILE 1773Cb -0.06 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 2i4h s ILE 1773CO 0.06 0.49 -0.02 -0.69 0.00 0.00 0.00 174.94 174.78 2i4h s VAL 1774N 0.80 4.14 0.13 2.92 1.01 0.13 -1.36 120.40 128.17 2i4h s VAL 1774Ca -0.04 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.52 2i4h s VAL 1774Cb -0.15 -2.74 0.01 0.00 0.00 0.00 0.00 36.38 33.50 2i4h s VAL 1774CO 0.01 0.59 0.31 0.28 0.00 0.00 0.00 175.10 176.30 2i4h s THR 1775N -0.75 0.09 0.71 3.92 -1.32 -0.96 -0.77 115.64 116.57 2i4h s THR 1775Ca 0.12 -1.01 -0.11 0.00 -1.21 0.00 0.00 61.69 59.47 2i4h s THR 1775Cb -0.11 -1.44 0.01 0.00 -1.51 0.00 0.00 72.50 69.45 2i4h s THR 1775CO 0.02 -0.41 1.09 0.00 -2.21 0.00 0.00 174.62 173.11 2i4h s GLN 1776N -3.87 2.85 0.08 7.08 -2.07 -1.17 -3.85 119.66 118.71 2i4h s GLN 1776Ca 0.08 0.56 -0.32 0.00 -1.82 0.00 0.00 55.36 53.86 2i4h s GLN 1776Cb 0.03 -2.01 -0.11 0.00 -1.09 0.00 0.00 33.01 29.83 2i4h s GLN 1776CO -0.08 -1.07 1.83 0.41 -1.32 0.00 0.00 175.29 175.07 2i4h n GLY 1777N -2.76 1.59 3.65 2.60 0.00 0.04 -4.84 105.19 105.48 2i4h n GLY 1777Ca 0.07 0.75 -0.36 0.00 0.00 0.00 0.00 46.02 46.47 2i4h n GLY 1777CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2i4h n PRO 1778N 5.75 0.74 -3.62 1.61 -0.02 -1.26 -4.71 135.00 133.48 2i4h n PRO 1778Ca 0.19 0.31 -0.20 0.00 -2.02 0.00 0.00 63.50 61.78 2i4h n PRO 1778Cb 0.35 -2.30 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 2i4h n PRO 1778CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i4h s LEU 1779N -3.34 3.94 0.52 2.45 1.43 -1.26 -1.22 118.68 121.20 2i4h s LEU 1779Ca 0.77 -0.22 0.26 0.00 -1.03 0.00 0.00 54.13 53.91 2i4h s LEU 1779Cb -0.37 -2.65 1.39 0.00 0.03 0.00 0.00 46.19 44.59 2i4h s LEU 1779CO 0.47 -0.36 1.96 -0.65 0.23 0.00 0.00 176.35 178.00 2i4h h PRO 1780N 1.02 0.04 -0.65 1.29 0.11 -1.98 -0.93 132.00 130.90 2i4h h PRO 1780Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2i4h h PRO 1780Cb 1.25 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2i4h h PRO 1780CO 0.55 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 178.78 2i4h n GLY 1781N -1.65 2.35 0.00 -0.55 0.00 -1.26 -4.11 105.19 99.97 2i4h n GLY 1781Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2i4h n GLY 1781CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i4h n THR 1782N 1.59 0.12 0.09 2.61 -2.24 -0.48 -4.81 114.28 111.15 2i4h n THR 1782Ca 0.23 -0.29 0.04 0.00 -2.27 0.00 0.00 64.05 61.76 2i4h n THR 1782Cb 0.61 1.34 0.46 0.00 -2.10 0.00 0.00 70.33 70.64 2i4h n THR 1782CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2i4h h LYS 1783N 0.00 0.33 -0.14 -0.78 2.10 -1.38 -1.67 116.57 115.03 2i4h h LYS 1783Ca 0.00 -0.04 -0.13 0.00 -2.00 0.00 0.00 60.65 58.48 2i4h h LYS 1783Cb 0.40 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.66 2i4h h LYS 1783CO 0.00 0.29 -0.48 -0.44 -2.00 0.00 0.00 179.45 176.82 2i4h h ASP 1784N 0.33 0.40 -0.67 7.07 3.32 -1.87 -2.90 116.42 122.11 2i4h h ASP 1784Ca 0.08 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.86 2i4h h ASP 1784Cb 0.10 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2i4h h ASP 1784CO -0.01 0.82 0.13 0.44 -1.72 0.00 0.00 179.24 178.90 2i4h h ASP 1785N 0.30 1.05 0.10 6.45 3.32 -1.72 0.99 116.42 126.92 2i4h h ASP 1785Ca 0.02 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 56.84 2i4h h ASP 1785Cb 0.96 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 2i4h h ASP 1785CO 0.08 1.03 -0.18 0.15 -1.72 0.00 0.00 179.24 178.61 2i4h h PHE 1786N 1.04 -0.47 -0.36 4.55 3.57 -1.29 0.13 116.94 124.11 2i4h h PHE 1786Ca 0.21 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.57 2i4h h PHE 1786Cb 0.42 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 2i4h h PHE 1786CO 0.03 -0.26 -0.35 -1.49 -2.23 0.00 0.00 178.31 174.01 2i4h h TRP 1787N -0.34 0.96 -0.39 0.41 4.06 -1.41 0.02 115.95 119.26 2i4h h TRP 1787Ca 0.02 -0.27 0.08 0.00 2.06 0.00 0.00 58.89 60.79 2i4h h TRP 1787Cb 0.36 -0.21 -0.08 0.00 -1.00 0.00 0.00 29.16 28.23 2i4h h TRP 1787CO -0.18 1.04 -0.16 -0.22 -3.56 0.00 0.00 178.44 175.36 2i4h h LYS 1788N 0.68 -0.08 -0.08 0.49 3.64 -0.66 0.64 116.57 121.20 2i4h h LYS 1788Ca 0.07 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2i4h h LYS 1788Cb 0.90 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.72 2i4h h LYS 1788CO 0.08 -0.05 -0.07 1.98 -2.27 0.00 0.00 179.45 179.12 2i4h h MET 1789N -0.08 -0.07 -0.70 1.90 4.05 -0.45 0.12 114.93 119.69 2i4h h MET 1789Ca 0.19 0.01 0.14 0.00 -0.28 0.00 0.00 59.70 59.76 2i4h h MET 1789Cb 0.38 0.02 -0.13 0.00 -0.80 0.00 0.00 31.60 31.06 2i4h h MET 1789CO -0.45 -0.05 -0.22 0.28 0.23 0.00 0.00 176.91 176.70 2i4h h VAL 1790N -0.08 0.24 0.05 -5.77 2.07 -0.78 0.08 116.25 112.06 2i4h h VAL 1790Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 2i4h h VAL 1790Cb 0.16 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2i4h h VAL 1790CO -0.13 0.00 -0.02 -0.25 0.02 0.00 0.00 177.57 177.19 2i4h h TRP 1791N -0.04 -0.06 -0.24 1.57 2.91 -0.32 -1.57 115.95 118.20 2i4h h TRP 1791Ca 0.32 -0.00 -0.09 0.00 1.13 0.00 0.00 58.89 60.25 2i4h h TRP 1791Cb 0.54 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 29.19 2i4h h TRP 1791CO -0.60 0.19 -0.23 0.93 -1.03 0.00 0.00 178.44 177.69 2i4h h GLU 1792N -0.30 0.45 -0.26 2.65 5.08 -0.52 -2.53 114.58 119.15 2i4h h GLU 1792Ca -0.01 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2i4h h GLU 1792Cb 0.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2i4h h GLU 1792CO 0.01 0.66 0.00 1.04 -1.00 0.00 0.00 179.01 179.72 2i4h n GLN 1793N -4.14 2.11 -2.99 2.33 1.13 -0.01 -4.94 117.38 110.87 2i4h n GLN 1793Ca -0.00 -1.67 -0.20 0.00 -1.94 0.00 0.00 57.00 53.19 2i4h n GLN 1793Cb 0.39 -1.45 0.04 0.00 0.11 0.00 0.00 30.24 29.32 2i4h n GLN 1793CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2i4h n ASN 1794N 0.90 -5.70 -4.73 1.08 3.02 -0.95 -4.30 115.26 104.57 2i4h n ASN 1794Ca 0.17 -0.28 -0.41 0.00 -0.03 0.00 0.00 54.58 54.03 2i4h n ASN 1794Cb 0.47 -4.51 -0.03 0.00 -0.61 0.00 0.00 39.78 35.10 2i4h n ASN 1794CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2i4h s VAL 1795N -3.13 3.39 0.00 2.41 1.01 -0.62 -0.21 120.40 123.25 2i4h s VAL 1795Ca 0.30 1.12 0.00 0.00 0.00 0.00 0.00 61.98 63.40 2i4h s VAL 1795Cb -0.13 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.53 2i4h s VAL 1795CO 0.37 0.15 0.00 1.41 0.00 0.00 0.00 175.10 177.03 2i4h n HIS 1796N 2.85 0.00 -4.72 5.22 8.25 -1.26 -4.86 115.22 120.70 2i4h n HIS 1796Ca 0.06 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.24 2i4h n HIS 1796Cb 0.44 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.38 2i4h n HIS 1796CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2i4h s ASN 1797N -1.25 2.49 -0.14 0.41 -0.87 -1.26 -0.24 114.94 114.08 2i4h s ASN 1797Ca 0.00 -0.44 0.02 0.00 -1.57 0.00 0.00 52.86 50.86 2i4h s ASN 1797Cb 0.00 -1.13 0.00 0.00 -0.02 0.00 0.00 41.25 40.10 2i4h s ASN 1797CO 0.00 0.06 -0.19 -0.63 -2.57 0.00 0.00 177.10 173.78 2i4h s ILE 1798N 0.71 2.41 -0.13 0.60 1.01 0.17 -1.36 121.20 124.61 2i4h s ILE 1798Ca -0.12 -0.87 -0.04 0.00 0.00 0.00 0.00 60.65 59.61 2i4h s ILE 1798Cb -0.16 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 2i4h s ILE 1798CO 0.03 0.54 0.01 -0.69 0.00 0.00 0.00 174.94 174.82 2i4h s VAL 1799N 0.65 4.37 -0.15 2.92 1.01 0.20 0.16 120.40 129.55 2i4h s VAL 1799Ca -0.10 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2i4h s VAL 1799Cb -0.16 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.34 2i4h s VAL 1799CO 0.02 0.53 -0.15 -0.32 0.00 0.00 0.00 175.10 175.18 2i4h s MET 1800N -0.17 2.42 -0.33 2.72 0.00 0.57 -1.27 119.30 123.24 2i4h s MET 1800Ca 0.05 -0.61 0.06 0.00 0.00 0.00 0.00 55.69 55.20 2i4h s MET 1800Cb -0.12 -2.18 0.46 0.00 0.00 0.00 0.00 34.83 32.98 2i4h s MET 1800CO 0.02 -0.23 1.31 1.33 0.00 0.00 0.00 175.02 177.45 2i4h n VAL 1801N 4.72 2.64 -4.09 10.11 0.24 -0.15 -0.56 118.33 131.24 2i4h n VAL 1801Ca -0.18 -3.92 -0.08 0.00 -2.04 0.00 0.00 64.34 58.13 2i4h n VAL 1801Cb 0.50 -1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 31.74 2i4h n VAL 1801CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2i4h s THR 1802N -4.45 0.28 0.25 3.34 -1.32 -1.26 -4.79 115.64 107.70 2i4h s THR 1802Ca 0.51 -1.77 0.02 0.00 -1.21 0.00 0.00 61.69 59.25 2i4h s THR 1802Cb 0.42 -1.46 -0.03 0.00 -1.51 0.00 0.00 72.50 69.92 2i4h s THR 1802CO 0.02 -0.95 0.41 -1.10 -2.21 0.00 0.00 174.62 170.80 2i4h s GLN 1803N -3.74 3.47 0.17 7.08 -0.21 -1.26 -4.84 119.66 120.33 2i4h s GLN 1803Ca 0.06 -0.54 -0.05 0.00 0.02 0.00 0.00 55.36 54.85 2i4h s GLN 1803Cb 0.06 -2.82 0.05 0.00 1.00 0.00 0.00 33.01 31.30 2i4h s GLN 1803CO -0.09 0.35 1.47 0.00 -2.12 0.00 0.00 175.29 174.90 2i4h s VAL 1805N -3.99 1.62 -0.04 0.00 1.01 -1.26 0.10 120.40 117.84 2i4h s VAL 1805Ca -0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 2i4h s VAL 1805Cb 0.11 -1.40 0.03 0.00 0.00 0.00 0.00 36.38 35.12 2i4h s VAL 1805CO 0.86 0.46 0.07 -1.61 0.00 0.00 0.00 175.10 174.88 2i4h s GLU 1806N 0.18 -0.01 -1.40 2.72 2.02 0.04 -4.88 118.70 117.36 2i4h s GLU 1806Ca -0.09 0.30 -0.05 0.00 0.02 0.00 0.00 54.97 55.16 2i4h s GLU 1806Cb -0.14 -0.29 0.03 0.00 0.10 0.00 0.00 34.13 33.83 2i4h s GLU 1806CO 0.04 -0.22 0.74 1.63 0.02 0.00 0.00 175.26 177.47 2i4h n LYS 1807N 4.54 -4.77 -1.03 1.61 4.01 -1.26 -1.66 118.16 119.60 2i4h n LYS 1807Ca -0.20 0.57 -0.01 0.00 -0.51 0.00 0.00 58.31 58.16 2i4h n LYS 1807Cb 0.50 -5.16 -0.00 0.00 -0.51 0.00 0.00 35.03 29.86 2i4h n LYS 1807CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2i4h n GLY 1808N -1.67 0.41 3.18 0.72 0.00 -1.26 -5.01 105.19 101.56 2i4h n GLY 1808Ca -0.19 -0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 2i4h n GLY 1808CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i4h s ARG 1809N -0.96 1.33 -0.01 1.61 1.81 -0.67 -5.12 118.95 116.95 2i4h s ARG 1809Ca 0.00 -0.69 -0.30 0.00 -1.72 0.00 0.00 55.73 53.02 2i4h s ARG 1809Cb 0.00 -1.32 -0.05 0.00 -0.45 0.00 0.00 34.95 33.13 2i4h s ARG 1809CO 0.00 0.35 1.32 0.08 -0.68 0.00 0.00 175.30 176.37 2i4h s VAL 1810N -0.53 3.89 -0.02 3.52 1.01 -1.26 -0.78 120.40 126.23 2i4h s VAL 1810Ca 0.06 1.27 0.10 0.00 0.00 0.00 0.00 61.98 63.42 2i4h s VAL 1810Cb -0.07 -3.82 -0.16 0.00 0.00 0.00 0.00 36.38 32.33 2i4h s VAL 1810CO 0.00 0.01 0.21 0.29 0.00 0.00 0.00 175.10 175.61 2i4h n LYS 1811N 5.14 0.54 -3.64 2.72 4.76 0.28 -4.93 118.16 123.03 2i4h n LYS 1811Ca 0.12 -0.09 -0.07 0.00 -2.87 0.00 0.00 58.31 55.40 2i4h n LYS 1811Cb 0.45 -1.25 -0.07 0.00 -1.84 0.00 0.00 35.03 32.32 2i4h n LYS 1811CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i4h s ASP 1813N 0.59 6.50 -1.11 0.00 -1.08 -0.35 -4.50 116.67 116.71 2i4h s ASP 1813Ca -0.01 2.31 -0.22 0.00 -0.52 0.00 0.00 52.55 54.11 2i4h s ASP 1813Cb -0.05 -2.61 -0.03 0.00 -1.46 0.00 0.00 42.92 38.78 2i4h s ASP 1813CO -0.09 -0.69 1.83 -2.28 0.52 0.00 0.00 175.17 174.46 2i4h s HIS 1814N -1.46 2.16 -2.34 -5.34 5.65 -1.26 -4.79 115.29 107.92 2i4h s HIS 1814Ca 0.58 -0.10 0.29 0.00 0.25 0.00 0.00 55.06 56.08 2i4h s HIS 1814Cb -0.29 -4.27 1.30 0.00 -1.18 0.00 0.00 32.58 28.14 2i4h s HIS 1814CO 0.37 -1.58 1.88 2.48 -0.65 0.00 0.00 174.74 177.24 2i4h n TYR 1815N 12.28 0.01 -4.19 3.88 0.18 -1.26 -4.82 117.16 123.23 2i4h n TYR 1815Ca 0.43 -0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.97 2i4h n TYR 1815Cb 0.47 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.36 2i4h n TYR 1815CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2i4h s TRP 1816N -1.99 2.65 0.26 -3.48 -2.14 -1.26 -5.03 118.94 107.94 2i4h s TRP 1816Ca 0.41 -0.40 -0.31 0.00 2.66 0.00 0.00 56.10 58.46 2i4h s TRP 1816Cb 0.21 -1.58 -0.12 0.00 -3.10 0.00 0.00 33.47 28.88 2i4h s TRP 1816CO 0.34 0.39 1.64 -2.30 -2.66 0.00 0.00 176.95 174.37 2i4h n PRO 1817N -1.08 2.71 0.00 3.25 -0.02 -1.26 -4.91 135.00 133.69 2i4h n PRO 1817Ca -0.03 0.97 0.15 0.00 -2.02 0.00 0.00 63.50 62.56 2i4h n PRO 1817Cb 0.62 -2.77 0.82 0.00 -0.02 0.00 0.00 33.50 32.14 2i4h n PRO 1817CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i4h n ALA 1818N 2.88 2.54 -3.00 3.55 0.00 -1.26 -4.90 120.51 120.33 2i4h n ALA 1818Ca 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2i4h n ALA 1818Cb 0.36 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2i4h n ALA 1818CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i4h n ASP 1819N -1.14 0.00 -0.10 0.00 3.85 -1.26 -5.07 116.55 112.82 2i4h n ASP 1819Ca 0.18 -0.12 0.11 0.00 -0.71 0.00 0.00 54.79 54.25 2i4h n ASP 1819Cb 0.17 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 39.92 2i4h n ASP 1819CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2i4h n GLN 1820N 0.00 0.26 -2.29 0.11 6.02 -1.26 -4.31 117.38 115.91 2i4h n GLN 1820Ca 0.00 -0.21 -0.42 0.00 -0.01 0.00 0.00 57.00 56.37 2i4h n GLN 1820Cb 0.00 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.73 2i4h n GLN 1820CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2i4h s ASP 1821N -2.88 6.97 0.71 1.08 1.01 -1.26 -4.42 116.67 117.87 2i4h s ASP 1821Ca 0.11 2.24 -0.15 0.00 0.71 0.00 0.00 52.55 55.46 2i4h s ASP 1821Cb 0.17 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 41.53 2i4h s ASP 1821CO 0.77 -0.52 1.18 -0.94 0.21 0.00 0.00 175.17 175.88 2i4h s SER 1822N 0.72 4.46 -0.14 0.27 1.04 -1.26 -4.76 113.70 114.02 2i4h s SER 1822Ca 0.59 2.27 -0.13 0.00 0.48 0.00 0.00 55.95 59.16 2i4h s SER 1822Cb -0.34 -2.58 0.04 0.00 0.10 0.00 0.00 66.02 63.24 2i4h s SER 1822CO 0.33 -2.08 0.38 -0.22 0.98 0.00 0.00 173.24 172.63 2i4h s LEU 1823N -5.03 0.53 0.03 2.42 2.96 -0.50 -4.99 118.68 114.09 2i4h s LEU 1823Ca 0.73 0.77 -0.23 0.00 -0.22 0.00 0.00 54.13 55.18 2i4h s LEU 1823Cb -0.27 1.31 -0.06 0.00 0.50 0.00 0.00 46.19 47.67 2i4h s LEU 1823CO 0.44 -0.13 0.68 -0.31 -1.32 0.00 0.00 176.35 175.70 2i4h s TYR 1824N 0.23 3.72 -0.55 5.38 1.51 -1.26 -0.83 117.35 125.54 2i4h s TYR 1824Ca -0.00 1.34 -0.00 0.00 -1.01 0.00 0.00 57.07 57.40 2i4h s TYR 1824Cb -0.03 -2.70 0.14 0.00 -0.11 0.00 0.00 41.96 39.27 2i4h s TYR 1824CO 0.00 0.34 0.34 0.71 -1.11 0.00 0.00 175.55 175.83 2i4h s TYR 1825N -0.24 3.39 0.00 2.71 2.02 0.12 -4.96 117.35 120.38 2i4h s TYR 1825Ca 0.34 -2.83 0.00 0.00 -0.37 0.00 0.00 57.07 54.21 2i4h s TYR 1825Cb -0.19 -3.08 0.00 0.00 -0.40 0.00 0.00 41.96 38.29 2i4h s TYR 1825CO 0.20 -0.83 0.00 0.41 -1.57 0.00 0.00 175.55 173.76 2i4h n GLY 1826N 3.54 1.13 0.09 0.71 0.00 -1.26 -1.89 105.19 107.51 2i4h n GLY 1826Ca 0.06 0.43 0.04 0.00 0.00 0.00 0.00 46.02 46.55 2i4h n GLY 1826CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2i4h n ASP 1827N 11.18 0.64 -4.80 1.61 2.03 -1.26 -4.93 116.55 121.01 2i4h n ASP 1827Ca 0.00 0.27 -0.34 0.00 0.52 0.00 0.00 54.79 55.24 2i4h n ASP 1827Cb 0.00 0.62 -0.07 0.00 -0.72 0.00 0.00 41.12 40.96 2i4h n ASP 1827CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2i4h s LEU 1828N -5.42 4.00 -0.22 -2.67 1.43 -0.79 -5.05 118.68 109.95 2i4h s LEU 1828Ca -0.04 0.22 -0.09 0.00 -1.03 0.00 0.00 54.13 53.19 2i4h s LEU 1828Cb 0.10 -2.24 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 2i4h s LEU 1828CO 0.82 0.30 0.12 -0.63 0.23 0.00 0.00 176.35 177.19 2i4h s ILE 1829N -1.15 5.08 -0.10 -0.59 1.01 -0.65 0.10 121.20 124.91 2i4h s ILE 1829Ca 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 60.65 60.92 2i4h s ILE 1829Cb -0.12 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 2i4h s ILE 1829CO 0.12 0.39 0.00 -0.76 0.00 0.00 0.00 174.94 174.69 2i4h s LEU 1830N 0.86 3.58 -0.05 2.97 1.02 -0.01 -2.22 118.68 124.82 2i4h s LEU 1830Ca 0.06 0.13 -0.02 0.00 0.02 0.00 0.00 54.13 54.32 2i4h s LEU 1830Cb -0.13 -1.83 0.04 0.00 0.02 0.00 0.00 46.19 44.29 2i4h s LEU 1830CO 0.03 0.35 0.09 -1.58 0.02 0.00 0.00 176.35 175.26 2i4h s GLN 1831N -0.73 -0.00 -0.27 1.70 0.74 -0.05 -1.41 119.66 119.62 2i4h s GLN 1831Ca 0.12 0.36 -0.29 0.00 0.05 0.00 0.00 55.36 55.60 2i4h s GLN 1831Cb -0.12 -0.30 0.01 0.00 1.10 0.00 0.00 33.01 33.70 2i4h s GLN 1831CO 0.02 -0.24 1.17 1.41 -0.55 0.00 0.00 175.29 177.11 2i4h s MET 1832N 1.63 4.07 -0.03 1.67 -2.45 -1.26 -1.02 119.30 121.91 2i4h s MET 1832Ca -0.03 1.27 0.10 0.00 -1.25 0.00 0.00 55.69 55.78 2i4h s MET 1832Cb -0.12 -3.77 -0.23 0.00 1.25 0.00 0.00 34.83 31.95 2i4h s MET 1832CO -0.04 -0.90 0.71 -0.07 1.05 0.00 0.00 175.02 175.77 2i4h h LEU 1833N 10.18 0.04 -7.05 4.11 3.38 -0.90 -3.43 115.31 121.64 2i4h h LEU 1833Ca -0.23 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.62 2i4h h LEU 1833Cb 1.08 -0.01 -0.16 0.00 0.09 0.00 0.00 40.66 41.66 2i4h h LEU 1833CO 1.02 1.06 0.16 -0.94 0.09 0.00 0.00 178.44 179.83 2i4h s SER 1834N -6.23 -0.57 -0.12 -0.43 1.04 -1.16 -4.98 113.70 101.25 2i4h s SER 1834Ca -0.05 0.33 -0.03 0.00 0.48 0.00 0.00 55.95 56.67 2i4h s SER 1834Cb 0.08 0.55 0.05 0.00 0.10 0.00 0.00 66.02 66.80 2i4h s SER 1834CO 0.82 -0.76 0.06 -0.70 0.98 0.00 0.00 173.24 173.64 2i4h s GLU 1835N -2.41 0.16 -0.31 4.02 2.12 -1.26 -1.46 118.70 119.55 2i4h s GLU 1835Ca -0.05 0.06 0.01 0.00 0.36 0.00 0.00 54.97 55.35 2i4h s GLU 1835Cb -0.01 -1.31 0.08 0.00 0.26 0.00 0.00 34.13 33.15 2i4h s GLU 1835CO -0.01 -0.50 0.01 -1.12 -0.54 0.00 0.00 175.26 173.09 2i4h s SER 1836N 2.09 4.76 -0.25 -1.70 0.01 0.16 -4.97 113.70 113.80 2i4h s SER 1836Ca 0.03 -1.68 -0.24 0.00 1.31 0.00 0.00 55.95 55.37 2i4h s SER 1836Cb -0.14 -1.65 -0.00 0.00 0.21 0.00 0.00 66.02 64.43 2i4h s SER 1836CO -0.06 -0.31 0.82 -0.69 0.41 0.00 0.00 173.24 173.40 2i4h s VAL 1837N 1.08 4.83 0.45 3.43 1.01 -1.26 -0.93 120.40 129.02 2i4h s VAL 1837Ca 0.00 1.50 0.07 0.00 0.00 0.00 0.00 61.98 63.55 2i4h s VAL 1837Cb -0.20 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 2i4h s VAL 1837CO -0.05 -0.10 0.37 -0.76 0.00 0.00 0.00 175.10 174.56 2i4h s LEU 1838N 2.86 3.16 0.31 3.92 1.43 0.33 -5.00 118.68 125.69 2i4h s LEU 1838Ca 0.34 -0.93 0.05 0.00 -1.03 0.00 0.00 54.13 52.56 2i4h s LEU 1838Cb -0.15 -1.72 0.69 0.00 0.03 0.00 0.00 46.19 45.04 2i4h s LEU 1838CO 0.08 -0.78 1.82 -0.65 0.23 0.00 0.00 176.35 177.06 2i4h h PRO 1839N 0.99 0.81 0.00 1.29 0.11 -2.03 -3.27 132.00 129.90 2i4h h PRO 1839Ca -0.40 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2i4h h PRO 1839Cb 1.27 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2i4h h PRO 1839CO 0.59 0.54 0.00 0.39 -0.21 0.00 0.00 178.00 179.31 2i4h n GLU 1840N -4.65 -0.49 -3.48 1.05 1.02 -1.26 -5.02 120.64 107.81 2i4h n GLU 1840Ca 0.20 -0.50 -0.15 0.00 -0.02 0.00 0.00 57.16 56.68 2i4h n GLU 1840Cb 0.46 -0.91 -0.04 0.00 -0.02 0.00 0.00 31.44 30.93 2i4h n GLU 1840CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 2i4h s TRP 1841N -0.08 -0.60 -0.06 -0.32 -2.14 -1.24 -2.04 118.94 112.47 2i4h s TRP 1841Ca 0.00 0.75 0.05 0.00 2.66 0.00 0.00 56.10 59.56 2i4h s TRP 1841Cb 0.00 0.47 -0.01 0.00 -3.10 0.00 0.00 33.47 30.83 2i4h s TRP 1841CO 0.00 -0.72 -0.22 0.99 -2.66 0.00 0.00 176.95 174.35 2i4h s THR 1842N -2.36 2.35 -0.23 0.66 2.01 -0.11 -0.51 115.64 117.44 2i4h s THR 1842Ca -0.06 -0.96 -0.05 0.00 0.31 0.00 0.00 61.69 60.93 2i4h s THR 1842Cb -0.00 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 2i4h s THR 1842CO -0.01 0.57 0.01 -0.63 -0.69 0.00 0.00 174.62 173.87 2i4h s ILE 1843N -0.22 3.82 0.08 1.82 1.01 -0.10 -0.69 121.20 126.92 2i4h s ILE 1843Ca -0.01 -0.34 0.07 0.00 0.00 0.00 0.00 60.65 60.37 2i4h s ILE 1843Cb -0.13 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.54 2i4h s ILE 1843CO 0.03 0.39 -0.13 -0.13 0.00 0.00 0.00 174.94 175.09 2i4h s ARG 1844N 1.49 2.08 -0.06 2.79 0.52 -0.26 0.39 118.95 125.89 2i4h s ARG 1844Ca 0.06 -1.02 0.05 0.00 -0.52 0.00 0.00 55.73 54.29 2i4h s ARG 1844Cb -0.15 -2.25 -0.00 0.00 0.52 0.00 0.00 34.95 33.07 2i4h s ARG 1844CO 0.00 0.52 -0.21 -2.00 0.02 0.00 0.00 175.30 173.63 2i4h s GLU 1845N -1.92 2.28 0.02 3.54 2.12 -0.54 -0.56 118.70 123.65 2i4h s GLU 1845Ca 0.18 -0.74 0.07 0.00 0.36 0.00 0.00 54.97 54.84 2i4h s GLU 1845Cb -0.11 -1.89 -0.02 0.00 0.26 0.00 0.00 34.13 32.37 2i4h s GLU 1845CO 0.10 0.25 -0.21 -0.06 -0.54 0.00 0.00 175.26 174.80 2i4h s PHE 1846N 0.10 1.84 0.06 5.30 0.40 -0.53 -0.16 117.98 124.99 2i4h s PHE 1846Ca -0.08 -0.37 -0.21 0.00 -0.60 0.00 0.00 56.93 55.67 2i4h s PHE 1846Cb -0.14 -1.13 -0.06 0.00 0.51 0.00 0.00 43.02 42.20 2i4h s PHE 1846CO 0.04 0.05 0.64 0.21 0.70 0.00 0.00 175.22 176.86 2i4h s LYS 1847N -0.94 4.34 0.11 0.44 2.20 -0.19 -0.77 119.74 124.93 2i4h s LYS 1847Ca 0.08 0.85 0.09 0.00 -0.36 0.00 0.00 55.97 56.62 2i4h s LYS 1847Cb -0.09 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 2i4h s LYS 1847CO 0.01 0.48 -0.22 0.42 -0.36 0.00 0.00 175.35 175.69 2i4h s ILE 1848N -0.64 1.78 0.28 5.43 1.09 -0.24 -0.87 121.20 128.03 2i4h s ILE 1848Ca 0.32 -1.57 -0.21 0.00 -1.10 0.00 0.00 60.65 58.10 2i4h s ILE 1848Cb -0.20 -1.61 0.03 0.00 -1.06 0.00 0.00 42.46 39.62 2i4h s ILE 1848CO 0.20 -0.04 0.75 0.00 -0.10 0.00 0.00 174.94 175.75 2i4h s HIS 1857N -3.63 0.02 0.14 0.00 0.00 -1.26 -1.63 115.29 108.93 2i4h s HIS 1857Ca 0.12 0.11 0.00 0.00 -3.00 0.00 0.00 55.06 52.29 2i4h s HIS 1857Cb -0.06 -0.20 -0.04 0.00 -4.00 0.00 0.00 32.58 28.28 2i4h s HIS 1857CO 0.07 -0.07 0.03 1.03 -1.00 0.00 0.00 174.74 174.79 2i4h s ARG 1858N 0.90 0.97 -0.10 -0.38 0.52 0.07 -5.16 118.95 115.77 2i4h s ARG 1858Ca -0.07 -1.46 0.00 0.00 -0.52 0.00 0.00 55.73 53.68 2i4h s ARG 1858Cb -0.11 0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.37 2i4h s ARG 1858CO -0.02 -0.19 -0.09 -0.51 0.02 0.00 0.00 175.30 174.50 2i4h s LEU 1859N -3.09 3.01 -0.06 2.53 1.43 -1.26 -1.07 118.68 120.16 2i4h s LEU 1859Ca 0.22 -0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 2i4h s LEU 1859Cb 0.07 -1.67 -0.00 0.00 0.03 0.00 0.00 46.19 44.62 2i4h s LEU 1859CO 0.01 0.27 -0.20 -0.63 0.23 0.00 0.00 176.35 176.04 2i4h s ILE 1860N -0.29 1.72 -0.11 -0.59 -1.09 0.05 -4.73 121.20 116.16 2i4h s ILE 1860Ca 0.03 -0.86 -0.05 0.00 -2.23 0.00 0.00 60.65 57.55 2i4h s ILE 1860Cb -0.13 -1.48 -0.04 0.00 -1.58 0.00 0.00 42.46 39.24 2i4h s ILE 1860CO 0.03 0.49 0.06 -0.13 -1.23 0.00 0.00 174.94 174.15 2i4h s ARG 1861N 0.14 3.30 -0.13 2.79 0.52 0.67 -1.46 118.95 124.78 2i4h s ARG 1861Ca -0.09 -0.30 0.00 0.00 -0.52 0.00 0.00 55.73 54.82 2i4h s ARG 1861Cb -0.14 -3.00 0.02 0.00 0.52 0.00 0.00 34.95 32.35 2i4h s ARG 1861CO 0.04 0.66 -0.12 -1.58 0.02 0.00 0.00 175.30 174.32 2i4h s HIS 1862N -0.73 1.90 -0.40 -0.53 5.65 0.27 -0.65 115.29 120.80 2i4h s HIS 1862Ca 0.12 -1.02 -0.06 0.00 0.25 0.00 0.00 55.06 54.36 2i4h s HIS 1862Cb -0.12 -1.45 0.09 0.00 -1.18 0.00 0.00 32.58 29.93 2i4h s HIS 1862CO 0.03 -0.59 0.21 -0.06 -0.65 0.00 0.00 174.74 173.67 2i4h s PHE 1863N 1.50 3.43 -0.41 3.88 0.40 0.12 -1.11 117.98 125.80 2i4h s PHE 1863Ca 0.04 -1.95 -0.11 0.00 -0.60 0.00 0.00 56.93 54.30 2i4h s PHE 1863Cb -0.13 -2.98 0.06 0.00 0.51 0.00 0.00 43.02 40.48 2i4h s PHE 1863CO -0.09 -0.90 0.27 -1.58 0.70 0.00 0.00 175.22 173.62 2i4h s HIS 1864N 1.28 3.28 -0.21 0.36 2.46 0.13 -0.32 115.29 122.28 2i4h s HIS 1864Ca 0.04 -1.19 -0.24 0.00 0.47 0.00 0.00 55.06 54.14 2i4h s HIS 1864Cb -0.23 -2.81 -0.01 0.00 -0.13 0.00 0.00 32.58 29.40 2i4h s HIS 1864CO -0.01 -0.76 0.77 -0.47 -2.47 0.00 0.00 174.74 171.79 2i4h s TYR 1865N 1.52 3.35 -0.97 3.88 5.04 0.28 -0.93 117.35 129.52 2i4h s TYR 1865Ca 0.03 1.10 0.20 0.00 -2.44 0.00 0.00 57.07 55.96 2i4h s TYR 1865Cb -0.22 -2.97 -0.23 0.00 0.35 0.00 0.00 41.96 38.90 2i4h s TYR 1865CO 0.05 -0.30 0.87 0.25 -1.34 0.00 0.00 175.55 175.09 2i4h n THR 1866N 4.97 0.00 -3.29 4.34 -2.24 -0.86 -4.24 114.28 112.96 2i4h n THR 1866Ca 0.03 -0.02 -0.27 0.00 -2.27 0.00 0.00 64.05 61.53 2i4h n THR 1866Cb 0.48 0.99 -0.07 0.00 -2.10 0.00 0.00 70.33 69.64 2i4h n THR 1866CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2i4h n VAL 1867N -1.49 2.49 -3.69 2.28 0.31 -1.26 -4.87 118.33 112.10 2i4h n VAL 1867Ca 0.04 -5.30 -0.29 0.00 -0.01 0.00 0.00 64.34 58.78 2i4h n VAL 1867Cb 0.32 -1.90 -0.15 0.00 -0.91 0.00 0.00 33.84 31.20 2i4h n VAL 1867CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 2i4h s TRP 1868N -2.72 1.34 0.31 3.52 -0.11 -1.26 -4.50 118.94 115.51 2i4h s TRP 1868Ca 0.42 -1.46 -0.30 0.00 1.22 0.00 0.00 56.10 55.99 2i4h s TRP 1868Cb 0.19 -1.46 -0.11 0.00 -1.50 0.00 0.00 33.47 30.58 2i4h s TRP 1868CO -0.05 -0.84 1.55 -2.14 -4.62 0.00 0.00 176.95 170.85 2i4h s PRO 1869N 1.75 4.14 0.35 5.86 0.02 -1.26 -4.79 135.00 141.06 2i4h s PRO 1869Ca 0.08 2.54 -0.28 0.00 0.02 0.00 0.00 61.00 63.36 2i4h s PRO 1869Cb -0.17 -3.02 -0.12 0.00 0.02 0.00 0.00 34.50 31.21 2i4h s PRO 1869CO -0.26 -0.58 1.37 -3.47 -0.33 0.00 0.00 177.00 173.73 2i4h n ASP 1870N 1.81 3.13 0.00 2.53 4.64 -1.26 -1.72 116.55 125.68 2i4h n ASP 1870Ca 0.06 1.21 0.00 0.00 -1.38 0.00 0.00 54.79 54.68 2i4h n ASP 1870Cb 0.38 -1.53 0.00 0.00 -1.04 0.00 0.00 41.12 38.93 2i4h n ASP 1870CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 2i4h n HIS 1871N 0.52 0.00 -1.62 -0.67 8.25 -1.26 -4.90 115.22 115.54 2i4h n HIS 1871Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2i4h n HIS 1871Cb 0.37 -0.78 0.00 0.00 1.12 0.00 0.00 29.99 30.70 2i4h n HIS 1871CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2i4h n GLY 1872N -2.00 5.11 3.08 -1.41 0.00 -0.70 -4.80 105.19 104.47 2i4h n GLY 1872Ca 0.00 -1.72 -0.08 0.00 0.00 0.00 0.00 46.02 44.23 2i4h n GLY 1872CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i4h s VAL 1873N 2.29 0.18 0.96 1.61 -7.23 -1.26 -4.81 120.40 112.15 2i4h s VAL 1873Ca 0.00 -1.49 -0.11 0.00 -1.81 0.00 0.00 61.98 58.57 2i4h s VAL 1873Cb 0.00 -1.16 0.17 0.00 0.56 0.00 0.00 36.38 35.95 2i4h s VAL 1873CO 0.00 -0.82 1.09 -2.84 -0.31 0.00 0.00 175.10 172.22 2i4h s PRO 1874N -3.23 0.70 0.35 4.82 0.02 -1.26 -4.50 135.00 131.90 2i4h s PRO 1874Ca 0.00 1.08 0.14 0.00 0.02 0.00 0.00 61.00 62.25 2i4h s PRO 1874Cb 0.03 -1.72 0.65 0.00 0.02 0.00 0.00 34.50 33.47 2i4h s PRO 1874CO -0.07 -2.70 1.76 1.49 -0.33 0.00 0.00 177.00 177.14 2i4h h GLU 1875N -1.90 0.00 -4.63 5.54 4.81 -2.02 -3.43 114.58 112.95 2i4h h GLU 1875Ca -0.50 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.50 2i4h h GLU 1875Cb 1.29 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.51 2i4h h GLU 1875CO 0.49 0.43 -0.70 0.95 -0.73 0.00 0.00 179.01 179.45 2i4h s THR 1876N -3.90 0.66 0.07 0.32 -4.23 -1.26 -5.04 115.64 102.26 2i4h s THR 1876Ca -0.02 -1.80 -0.22 0.00 -1.18 0.00 0.00 61.69 58.48 2i4h s THR 1876Cb 0.13 -1.51 -0.13 0.00 1.34 0.00 0.00 72.50 72.33 2i4h s THR 1876CO 0.72 -0.80 1.58 0.71 -0.54 0.00 0.00 174.62 176.29 2i4h h THR 1877N 3.22 1.17 -0.92 3.99 1.35 -1.95 -3.31 112.91 116.45 2i4h h THR 1877Ca -0.35 -0.50 0.22 0.00 -0.55 0.00 0.00 66.41 65.22 2i4h h THR 1877Cb 1.17 1.32 -0.17 0.00 -1.73 0.00 0.00 68.15 68.74 2i4h h THR 1877CO 0.61 0.15 -0.08 1.56 -0.25 0.00 0.00 175.52 177.51 2i4h h GLN 1878N -0.02 0.02 0.06 4.72 4.20 -1.97 -1.49 115.11 120.63 2i4h h GLN 1878Ca 0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2i4h h GLN 1878Cb 0.20 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2i4h h GLN 1878CO -0.00 0.02 -0.05 1.03 -0.67 0.00 0.00 178.83 179.15 2i4h h SER 1879N 0.02 -0.14 0.50 1.46 0.87 -1.99 -0.89 113.55 113.39 2i4h h SER 1879Ca 0.51 0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.88 2i4h h SER 1879Cb 0.93 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 2i4h h SER 1879CO -0.89 -0.08 -0.88 0.25 -0.53 0.00 0.00 176.83 174.70 2i4h h LEU 1880N -0.12 0.34 -0.98 2.23 5.85 -1.61 -1.35 115.31 119.66 2i4h h LEU 1880Ca 0.00 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.51 2i4h h LEU 1880Cb 0.12 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 2i4h h LEU 1880CO -0.01 1.06 0.63 0.40 -0.34 0.00 0.00 178.44 180.18 2i4h h ILE 1881N 0.15 1.10 -0.23 4.05 2.04 -1.19 -0.81 117.51 122.62 2i4h h ILE 1881Ca -0.05 -0.40 -0.18 0.00 1.00 0.00 0.00 64.86 65.22 2i4h h ILE 1881Cb 1.50 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2i4h h ILE 1881CO 0.14 0.21 -0.58 -0.61 0.00 0.00 0.00 178.15 177.31 2i4h h GLN 1882N 1.16 0.80 -0.08 2.37 5.75 -0.80 -1.39 115.11 122.92 2i4h h GLN 1882Ca 0.42 -0.55 -0.00 0.00 -0.15 0.00 0.00 58.65 58.36 2i4h h GLN 1882Cb 0.13 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.76 2i4h h GLN 1882CO -0.16 1.17 0.04 0.35 -2.65 0.00 0.00 178.83 177.59 2i4h h PHE 1883N 0.54 0.12 -0.23 3.99 3.57 -1.17 -0.34 116.94 123.42 2i4h h PHE 1883Ca -0.01 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2i4h h PHE 1883Cb 1.20 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.87 2i4h h PHE 1883CO 0.08 0.17 0.07 0.28 -2.23 0.00 0.00 178.31 176.68 2i4h h VAL 1884N 0.03 0.93 -0.52 1.41 2.07 -1.12 0.84 116.25 119.89 2i4h h VAL 1884Ca 0.03 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2i4h h VAL 1884Cb 0.09 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2i4h h VAL 1884CO -0.00 0.03 0.33 0.03 0.02 0.00 0.00 177.57 177.97 2i4h h ARG 1885N 0.18 0.70 -0.08 1.57 3.08 -1.16 -1.63 114.38 117.03 2i4h h ARG 1885Ca 0.10 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2i4h h ARG 1885Cb 0.07 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 2i4h h ARG 1885CO -0.11 0.48 0.00 1.15 -1.07 0.00 0.00 179.97 180.42 2i4h h THR 1886N 0.71 1.24 -0.58 2.04 2.02 0.01 -1.89 112.91 116.46 2i4h h THR 1886Ca 0.19 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 2i4h h THR 1886Cb -0.05 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 2i4h h THR 1886CO -0.04 0.21 0.27 0.58 0.37 0.00 0.00 175.52 176.92 2i4h h VAL 1887N -0.13 1.21 -0.62 3.16 2.07 -0.57 -2.38 116.25 118.99 2i4h h VAL 1887Ca 0.02 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 2i4h h VAL 1887Cb 0.33 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2i4h h VAL 1887CO 0.00 0.24 0.33 -0.09 0.02 0.00 0.00 177.57 178.08 2i4h h ARG 1888N 0.79 0.85 -0.19 1.57 9.65 -1.27 0.18 114.38 125.96 2i4h h ARG 1888Ca 0.20 -0.09 -0.03 0.00 -1.10 0.00 0.00 59.98 58.96 2i4h h ARG 1888Cb 0.13 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 2i4h h ARG 1888CO -0.02 0.63 -0.00 -0.44 2.80 0.00 0.00 179.97 182.93 2i4h h ASP 1889N 0.86 0.34 -0.25 -3.80 3.45 -0.86 -0.06 116.42 116.10 2i4h h ASP 1889Ca 0.22 -0.32 0.04 0.00 0.43 0.00 0.00 57.03 57.41 2i4h h ASP 1889Cb 0.03 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 2i4h h ASP 1889CO -0.04 0.57 -0.02 1.88 -1.57 0.00 0.00 179.24 180.07 2i4h h TYR 1890N 0.10 -0.05 0.03 4.55 -1.99 -1.08 -2.84 116.97 115.69 2i4h h TYR 1890Ca 0.05 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.83 2i4h h TYR 1890Cb 0.40 0.06 -0.04 0.00 2.00 0.00 0.00 36.73 39.15 2i4h h TYR 1890CO 0.04 -0.06 -0.29 0.82 -0.00 0.00 0.00 178.16 178.66 2i4h h ILE 1891N 0.05 0.36 0.00 -2.88 2.04 -0.47 -2.19 117.51 114.41 2i4h h ILE 1891Ca 0.12 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.98 2i4h h ILE 1891Cb 0.16 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2i4h h ILE 1891CO -0.22 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.52 2i4h n ASN 1892N -5.40 0.00 -0.68 1.72 3.02 -0.05 -0.83 115.26 113.04 2i4h n ASN 1892Ca -0.05 0.41 0.06 0.00 -0.03 0.00 0.00 54.58 54.97 2i4h n ASN 1892Cb 0.31 -0.41 0.17 0.00 -0.61 0.00 0.00 39.78 39.24 2i4h n ASN 1892CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2i4h n ARG 1893N -1.41 2.89 -3.75 3.52 1.74 -0.84 -4.89 116.66 113.91 2i4h n ARG 1893Ca 0.00 -2.16 -0.33 0.00 -0.77 0.00 0.00 57.85 54.59 2i4h n ARG 1893Cb 0.00 -1.34 -0.09 0.00 -1.02 0.00 0.00 32.46 30.01 2i4h n ARG 1893CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2i4h s SER 1894N -1.11 5.44 0.03 0.55 0.15 -0.01 -5.04 113.70 113.72 2i4h s SER 1894Ca 0.26 -3.68 -0.30 0.00 0.70 0.00 0.00 55.95 52.93 2i4h s SER 1894Cb 0.15 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.63 2i4h s SER 1894CO 0.15 -0.16 0.99 -2.16 1.20 0.00 0.00 173.24 173.26 2i4h s PRO 1895N -1.25 4.58 -0.84 5.44 0.05 -1.26 -3.15 135.00 138.57 2i4h s PRO 1895Ca 0.25 1.45 0.00 0.00 0.05 0.00 0.00 61.00 62.75 2i4h s PRO 1895Cb -0.08 -3.43 0.00 0.00 0.05 0.00 0.00 34.50 31.04 2i4h s PRO 1895CO -0.13 -0.00 0.00 0.41 0.05 0.00 0.00 177.00 177.33 2i4h n GLY 1896N 2.76 0.07 3.75 0.56 0.00 -1.26 -5.03 105.19 106.04 2i4h n GLY 1896Ca 0.05 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.22 2i4h n GLY 1896CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i4h s ALA 1897N -2.47 2.62 0.62 4.61 0.00 -1.19 -5.08 121.76 120.88 2i4h s ALA 1897Ca 0.00 1.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.98 2i4h s ALA 1897Cb 0.00 -3.47 0.07 0.00 0.00 0.00 0.00 23.12 19.72 2i4h s ALA 1897CO 0.00 -1.17 0.16 0.41 0.00 0.00 0.00 175.76 175.16 2i4h n GLY 1898N 0.57 -1.50 3.55 0.00 0.00 0.71 -5.00 105.19 103.52 2i4h n GLY 1898Ca 0.13 -0.49 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 2i4h n GLY 1898CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2i4h n PRO 1899N -0.64 0.31 -2.99 1.61 -0.02 -1.26 -4.77 135.00 127.24 2i4h n PRO 1899Ca 0.02 0.16 -0.40 0.00 -2.02 0.00 0.00 63.50 61.26 2i4h n PRO 1899Cb 0.11 -2.08 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 2i4h n PRO 1899CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2i4h s THR 1900N -1.95 4.99 0.00 3.45 2.01 -0.78 -4.43 115.64 118.93 2i4h s THR 1900Ca 0.69 1.51 -0.27 0.00 0.31 0.00 0.00 61.69 63.93 2i4h s THR 1900Cb -0.33 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 2i4h s THR 1900CO 0.55 0.17 0.86 -0.69 -0.69 0.00 0.00 174.62 174.82 2i4h s VAL 1901N 1.31 4.86 -0.07 3.82 1.01 -0.46 -0.99 120.40 129.88 2i4h s VAL 1901Ca 0.38 1.82 0.03 0.00 0.00 0.00 0.00 61.98 64.21 2i4h s VAL 1901Cb -0.17 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.00 2i4h s VAL 1901CO 0.16 0.24 -0.16 -0.69 0.00 0.00 0.00 175.10 174.65 2i4h s VAL 1902N 0.67 1.44 0.06 2.92 1.01 -0.47 0.58 120.40 126.61 2i4h s VAL 1902Ca 0.45 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 2i4h s VAL 1902Cb -0.20 -1.27 -0.00 0.00 0.00 0.00 0.00 36.38 34.91 2i4h s VAL 1902CO 0.25 0.42 0.17 -1.38 0.00 0.00 0.00 175.10 174.56 2i4h s HIS 1903N 0.42 0.14 0.00 5.22 -3.43 -0.40 -2.25 115.29 114.99 2i4h s HIS 1903Ca -0.13 -0.49 0.00 0.00 -0.80 0.00 0.00 55.06 53.64 2i4h s HIS 1903Cb -0.15 -0.07 0.00 0.00 -1.43 0.00 0.00 32.58 30.93 2i4h s HIS 1903CO 0.05 -0.48 0.00 0.00 -2.00 0.00 0.00 174.74 172.31 2i4h n SER 1905N 0.00 1.88 0.10 0.00 2.88 -1.26 -2.09 113.62 115.13 2i4h n SER 1905Ca 0.00 0.46 0.12 0.00 -1.33 0.00 0.00 58.87 58.12 2i4h n SER 1905Cb 0.00 -0.80 0.15 0.00 -0.75 0.00 0.00 64.21 62.82 2i4h n SER 1905CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2i4h h ALA 1906N -1.00 0.67 -1.18 -1.46 0.00 -1.89 0.16 119.26 114.56 2i4h h ALA 1906Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2i4h h ALA 1906Cb 0.79 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.59 2i4h h ALA 1906CO 0.00 0.00 -0.10 0.41 0.00 0.00 0.00 179.25 179.56 2i4h n GLY 1907N 1.26 0.49 1.81 0.00 0.00 -1.25 -4.14 105.19 103.35 2i4h n GLY 1907Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2i4h n GLY 1907CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2i4h n VAL 1908N -3.41 0.03 0.02 1.61 0.24 -1.26 -4.65 118.33 110.90 2i4h n VAL 1908Ca -0.02 0.01 -0.01 0.00 -2.04 0.00 0.00 64.34 62.28 2i4h n VAL 1908Cb 0.52 -0.70 -0.00 0.00 -1.47 0.00 0.00 33.84 32.19 2i4h n VAL 1908CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2i4h h GLY 1909N 0.00 -0.05 1.14 7.63 0.00 -1.93 0.48 103.07 110.34 2i4h h GLY 1909Ca 0.00 0.02 -0.18 0.00 0.00 0.00 0.00 47.33 47.17 2i4h h GLY 1909CO 0.00 -0.02 -0.48 3.21 0.00 0.00 0.00 176.54 179.25 2i4h h ARG 1910N -0.13 0.91 -0.30 4.80 3.08 -1.91 -0.21 114.38 120.62 2i4h h ARG 1910Ca -0.01 -0.54 0.01 0.00 0.07 0.00 0.00 59.98 59.52 2i4h h ARG 1910Cb 0.04 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2i4h h ARG 1910CO 0.01 1.18 0.18 1.15 -1.07 0.00 0.00 179.97 181.41 2i4h h THR 1911N 0.72 1.04 -0.78 2.04 2.02 -1.88 -1.00 112.91 115.07 2i4h h THR 1911Ca 0.03 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 2i4h h THR 1911Cb 1.08 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.10 2i4h h THR 1911CO 0.11 0.07 0.44 1.23 0.37 0.00 0.00 175.52 177.74 2i4h h GLY 1912N 0.36 1.15 1.10 2.16 0.00 -0.77 -1.97 103.07 105.10 2i4h h GLY 1912Ca 0.12 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.81 2i4h h GLY 1912CO -0.05 0.49 -0.22 -0.84 0.00 0.00 0.00 176.54 175.92 2i4h h THR 1913N 1.07 1.27 0.12 4.70 2.02 -0.79 0.89 112.91 122.19 2i4h h THR 1913Ca 0.28 -1.38 0.01 0.00 0.77 0.00 0.00 66.41 66.09 2i4h h THR 1913Cb 0.01 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2i4h h THR 1913CO -0.05 0.48 -0.22 0.15 0.37 0.00 0.00 175.52 176.25 2i4h h PHE 1914N 0.83 -0.59 -0.27 3.16 3.57 -1.05 -0.25 116.94 122.35 2i4h h PHE 1914Ca 0.11 0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.44 2i4h h PHE 1914Cb 0.80 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 2i4h h PHE 1914CO 0.05 -0.32 -0.54 0.82 -2.23 0.00 0.00 178.31 176.10 2i4h h ILE 1915N -0.42 1.29 -1.01 1.41 2.04 -1.28 -1.00 117.51 118.55 2i4h h ILE 1915Ca 0.03 -1.74 0.08 0.00 1.00 0.00 0.00 64.86 64.23 2i4h h ILE 1915Cb 0.44 1.65 -0.07 0.00 -0.74 0.00 0.00 36.82 38.09 2i4h h ILE 1915CO -0.12 0.56 0.64 0.00 0.00 0.00 0.00 178.15 179.24 2i4h h ALA 1916N 0.78 1.43 -0.33 1.87 0.00 -0.73 -2.10 119.26 120.18 2i4h h ALA 1916Ca 0.02 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2i4h h ALA 1916Cb 1.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2i4h h ALA 1916CO 0.12 0.38 -0.32 1.25 0.00 0.00 0.00 179.25 180.67 2i4h h LEU 1917N 1.12 0.85 -0.44 0.00 5.85 -0.67 0.39 115.31 122.42 2i4h h LEU 1917Ca 0.45 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.79 2i4h h LEU 1917Cb 0.27 -0.24 -0.10 0.00 0.37 0.00 0.00 40.66 40.96 2i4h h LEU 1917CO -0.20 1.14 -0.35 -0.78 -0.34 0.00 0.00 178.44 177.91 2i4h h ASP 1918N 0.57 -1.18 -0.26 1.25 3.58 -0.99 0.73 116.42 120.12 2i4h h ASP 1918Ca 0.05 0.20 -0.01 0.00 0.42 0.00 0.00 57.03 57.70 2i4h h ASP 1918Cb 0.90 0.55 -0.01 0.00 1.72 0.00 0.00 39.33 42.48 2i4h h ASP 1918CO 0.08 -0.33 0.12 0.03 -2.88 0.00 0.00 179.24 176.26 2i4h h ARG 1919N -0.25 0.37 -0.69 0.28 2.47 -1.05 -2.64 114.38 112.86 2i4h h ARG 1919Ca 0.18 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.81 2i4h h ARG 1919Cb 0.55 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.77 2i4h h ARG 1919CO -0.57 0.37 0.31 0.82 0.56 0.00 0.00 179.97 181.46 2i4h h ILE 1920N 0.28 1.24 -0.44 2.04 2.04 -0.69 -1.44 117.51 120.54 2i4h h ILE 1920Ca 0.09 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.21 2i4h h ILE 1920Cb 0.13 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 2i4h h ILE 1920CO -0.01 0.29 0.13 -0.07 0.00 0.00 0.00 178.15 178.48 2i4h h LEU 1921N 0.98 0.60 -0.32 1.44 3.38 -0.77 -1.76 115.31 118.86 2i4h h LEU 1921Ca 0.23 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 57.99 2i4h h LEU 1921Cb 0.16 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2i4h h LEU 1921CO -0.02 0.58 -0.32 1.56 0.09 0.00 0.00 178.44 180.33 2i4h h GLN 1922N 0.64 0.79 -0.75 1.13 4.20 -1.16 -2.84 115.11 117.13 2i4h h GLN 1922Ca 0.15 -0.42 0.14 0.00 0.06 0.00 0.00 58.65 58.58 2i4h h GLN 1922Cb 0.21 0.02 -0.09 0.00 0.30 0.00 0.00 27.48 27.91 2i4h h GLN 1922CO -0.01 1.05 0.29 1.96 -0.67 0.00 0.00 178.83 181.45 2i4h h GLN 1923N 0.56 0.43 0.00 1.46 4.20 -0.92 -2.07 115.11 118.77 2i4h h GLN 1923Ca 0.05 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 2i4h h GLN 1923Cb 0.90 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 2i4h h GLN 1923CO 0.08 0.28 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.36 2i4h h LEU 1924N 0.44 0.00 -0.46 1.46 3.38 -1.18 0.27 115.31 119.21 2i4h h LEU 1924Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 2i4h h LEU 1924Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2i4h h LEU 1924CO -0.40 0.09 -0.32 0.47 0.09 0.00 0.00 178.44 178.37 2i4h n ASP 1925N -3.34 1.04 -0.02 -0.43 8.00 -0.82 -4.46 116.55 116.53 2i4h n ASP 1925Ca -0.01 -0.86 -0.02 0.00 0.71 0.00 0.00 54.79 54.61 2i4h n ASP 1925Cb 0.28 0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.55 2i4h n ASP 1925CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2i4h n SER 1926N -0.72 4.01 -4.44 -2.24 7.64 -0.82 -5.10 113.62 111.96 2i4h n SER 1926Ca 0.11 -0.01 -0.21 0.00 1.01 0.00 0.00 58.87 59.76 2i4h n SER 1926Cb 0.36 0.26 -0.10 0.00 -1.01 0.00 0.00 64.21 63.71 2i4h n SER 1926CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2i4h s LYS 1927N -2.07 1.58 -0.25 1.43 1.02 0.88 -5.03 119.74 117.30 2i4h s LYS 1927Ca -0.03 -1.81 0.13 0.00 0.02 0.00 0.00 55.97 54.28 2i4h s LYS 1927Cb 0.01 -1.14 0.76 0.00 -0.52 0.00 0.00 37.83 36.94 2i4h s LYS 1927CO 0.10 0.01 1.72 -0.40 -0.92 0.00 0.00 175.35 175.86 2i4h n ASP 1928N -0.61 5.19 -4.01 2.83 3.85 -1.26 -4.68 116.55 117.86 2i4h n ASP 1928Ca -0.05 -3.04 -0.11 0.00 -0.71 0.00 0.00 54.79 50.87 2i4h n ASP 1928Cb 0.64 -0.68 -0.11 0.00 -1.35 0.00 0.00 41.12 39.61 2i4h n ASP 1928CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 2i4h s SER 1929N -1.06 0.52 -0.02 -1.12 0.01 -1.26 -1.62 113.70 109.16 2i4h s SER 1929Ca 0.53 -0.49 0.05 0.00 1.31 0.00 0.00 55.95 57.35 2i4h s SER 1929Cb 0.41 0.06 -0.01 0.00 0.21 0.00 0.00 66.02 66.69 2i4h s SER 1929CO 0.14 -0.24 -0.17 0.54 0.41 0.00 0.00 173.24 173.92 2i4h s VAL 1930N -1.34 1.36 -0.47 3.43 0.11 -0.10 -4.77 120.40 118.62 2i4h s VAL 1930Ca -0.12 -0.73 0.06 0.00 -2.93 0.00 0.00 61.98 58.26 2i4h s VAL 1930Cb -0.09 -1.13 0.22 0.00 -1.53 0.00 0.00 36.38 33.84 2i4h s VAL 1930CO -0.00 0.39 0.49 -0.67 -3.33 0.00 0.00 175.10 171.98 2i4h n ASP 1931N 2.69 0.83 -0.13 3.54 2.03 -1.26 -0.83 116.55 123.42 2i4h n ASP 1931Ca -0.15 -2.76 -0.05 0.00 0.52 0.00 0.00 54.79 52.35 2i4h n ASP 1931Cb 0.54 -0.63 0.04 0.00 -0.72 0.00 0.00 41.12 40.35 2i4h n ASP 1931CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2i4h h ILE 1932N 3.28 0.87 -0.02 5.18 2.04 -1.99 -1.39 117.51 125.49 2i4h h ILE 1932Ca 0.16 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.93 2i4h h ILE 1932Cb 0.84 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2i4h h ILE 1932CO 0.52 0.06 -0.11 0.22 0.00 0.00 0.00 178.15 178.83 2i4h h TYR 1933N 0.33 -0.29 -0.96 1.37 3.20 -1.92 -1.69 116.97 117.01 2i4h h TYR 1933Ca 0.20 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.09 2i4h h TYR 1933Cb 0.18 0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.54 2i4h h TYR 1933CO -0.15 -0.17 0.62 0.78 -1.64 0.00 0.00 178.16 177.60 2i4h h GLY 1934N -0.18 1.35 0.78 1.82 0.00 -1.70 0.63 103.07 105.77 2i4h h GLY 1934Ca 0.05 -0.52 0.01 0.00 0.00 0.00 0.00 47.33 46.88 2i4h h GLY 1934CO -0.13 0.50 -0.09 0.00 0.00 0.00 0.00 176.54 176.82 2i4h h ALA 1935N 1.39 -0.12 -0.70 3.60 0.00 -1.04 -1.02 119.26 121.37 2i4h h ALA 1935Ca 0.35 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 2i4h h ALA 1935Cb -0.13 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2i4h h ALA 1935CO -0.07 -0.59 0.37 0.28 0.00 0.00 0.00 179.25 179.23 2i4h h VAL 1936N -0.17 1.22 -0.53 0.00 2.07 -1.16 -2.57 116.25 115.10 2i4h h VAL 1936Ca 0.03 -0.57 0.08 0.00 0.82 0.00 0.00 66.70 67.06 2i4h h VAL 1936Cb 0.21 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 2i4h h VAL 1936CO -0.08 0.25 0.15 -0.74 0.02 0.00 0.00 177.57 177.17 2i4h h HIS 1937N 0.97 0.26 -0.44 1.57 6.17 -0.81 -1.48 115.15 121.38 2i4h h HIS 1937Ca 0.24 0.03 -0.05 0.00 0.71 0.00 0.00 60.37 61.31 2i4h h HIS 1937Cb 0.06 -0.04 -0.02 0.00 2.52 0.00 0.00 27.41 29.93 2i4h h HIS 1937CO -0.00 0.05 0.08 0.22 0.71 0.00 0.00 177.93 178.98 2i4h h ASP 1938N 0.31 0.63 -0.26 3.26 3.58 -0.99 -2.35 116.42 120.61 2i4h h ASP 1938Ca 0.26 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 2i4h h ASP 1938Cb 0.33 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 2i4h h ASP 1938CO -0.30 0.65 0.09 -0.07 -2.88 0.00 0.00 179.24 176.73 2i4h h LEU 1939N 0.65 0.38 -1.45 2.28 3.38 -1.08 -3.12 115.31 116.36 2i4h h LEU 1939Ca 0.14 -0.20 0.12 0.00 0.09 0.00 0.00 57.88 58.04 2i4h h LEU 1939Cb 0.30 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 2i4h h LEU 1939CO 0.00 0.48 0.51 0.03 0.09 0.00 0.00 178.44 179.55 2i4h h ARG 1940N 0.27 0.57 -0.14 1.13 2.47 -1.06 -1.50 114.38 116.10 2i4h h ARG 1940Ca 0.09 -0.03 0.04 0.00 -1.26 0.00 0.00 59.98 58.81 2i4h h ARG 1940Cb 0.23 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 2i4h h ARG 1940CO -0.00 0.37 0.24 -0.07 0.56 0.00 0.00 179.97 181.07 2i4h h LEU 1941N 0.58 0.00 0.00 3.04 3.38 -1.35 -3.13 115.31 117.83 2i4h h LEU 1941Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2i4h h LEU 1941Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2i4h h LEU 1941CO -0.14 0.00 -1.39 1.41 0.09 0.00 0.00 178.44 178.42 2i4h n HIS 1942N -3.48 0.00 -3.68 1.13 8.25 -0.61 -4.72 115.22 112.11 2i4h n HIS 1942Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.34 2i4h n HIS 1942Cb 0.34 -0.19 -0.09 0.00 1.12 0.00 0.00 29.99 31.17 2i4h n HIS 1942CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 2i4h s ARG 1943N -2.59 0.63 0.34 -0.41 3.52 -0.94 -4.62 118.95 114.87 2i4h s ARG 1943Ca -0.03 0.80 -0.26 0.00 -0.13 0.00 0.00 55.73 56.11 2i4h s ARG 1943Cb 0.05 0.27 -0.13 0.00 -1.56 0.00 0.00 34.95 33.58 2i4h s ARG 1943CO 0.36 -0.09 0.78 1.55 -0.81 0.00 0.00 175.30 177.09 2i4h n VAL 1944N 3.02 1.98 -1.09 7.11 3.14 -1.26 -3.86 118.33 127.37 2i4h n VAL 1944Ca -0.15 -0.50 -0.03 0.00 -2.96 0.00 0.00 64.34 60.70 2i4h n VAL 1944Cb 0.56 -0.72 -0.01 0.00 -1.06 0.00 0.00 33.84 32.61 2i4h n VAL 1944CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 2i4h n HIS 1945N -0.28 0.00 -1.72 1.45 8.25 -1.26 -4.83 115.22 116.82 2i4h n HIS 1945Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.15 2i4h n HIS 1945Cb 0.35 -1.82 -0.03 0.00 1.12 0.00 0.00 29.99 29.60 2i4h n HIS 1945CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2i4h s MET 1946N -1.93 4.14 -0.19 -0.41 1.00 -1.25 -2.76 119.30 117.90 2i4h s MET 1946Ca 0.00 2.58 -0.03 0.00 0.00 0.00 0.00 55.69 58.24 2i4h s MET 1946Cb 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 34.83 31.13 2i4h s MET 1946CO 0.00 -0.86 0.11 0.28 0.00 0.00 0.00 175.02 174.55 2i4h n VAL 1947N 4.89 -7.33 0.03 -6.03 0.31 -0.90 -4.77 118.33 104.52 2i4h n VAL 1947Ca 0.18 0.85 0.11 0.00 -0.01 0.00 0.00 64.34 65.46 2i4h n VAL 1947Cb 0.39 -5.67 -0.11 0.00 -0.91 0.00 0.00 33.84 27.54 2i4h n VAL 1947CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2i4h n GLN 1948N 0.13 0.64 -4.30 5.55 0.00 -1.11 -4.88 117.38 113.40 2i4h n GLN 1948Ca 0.02 -0.08 -0.16 0.00 -0.00 0.00 0.00 57.00 56.78 2i4h n GLN 1948Cb 0.08 -1.63 -0.10 0.00 0.00 0.00 0.00 30.24 28.59 2i4h n GLN 1948CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2i4h s THR 1949N -3.45 1.27 0.25 1.69 -4.23 -1.26 -5.03 115.64 104.88 2i4h s THR 1949Ca -0.05 -2.09 -0.02 0.00 -1.18 0.00 0.00 61.69 58.35 2i4h s THR 1949Cb 0.12 -2.07 0.11 0.00 1.34 0.00 0.00 72.50 72.00 2i4h s THR 1949CO 0.87 -0.56 1.75 -0.08 -0.54 0.00 0.00 174.62 176.05 2i4h h GLU 1950N 2.61 0.81 0.00 3.99 4.81 -1.93 -1.85 114.58 123.03 2i4h h GLU 1950Ca -0.38 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 58.63 2i4h h GLU 1950Cb 1.21 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.50 2i4h h GLU 1950CO 0.64 0.82 -0.04 0.00 -0.73 0.00 0.00 179.01 179.69 2i4h h GLN 1952N 0.00 0.42 -0.38 0.00 4.20 -1.65 -1.05 115.11 116.65 2i4h h GLN 1952Ca -0.00 -0.72 0.04 0.00 0.06 0.00 0.00 58.65 58.03 2i4h h GLN 1952Cb 0.19 0.27 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 2i4h h GLN 1952CO 0.01 1.34 0.14 -0.92 -0.67 0.00 0.00 178.83 178.73 2i4h h TYR 1953N 0.12 0.25 -0.72 2.96 3.20 -1.05 -1.63 116.97 120.10 2i4h h TYR 1953Ca -0.21 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.73 2i4h h TYR 1953Cb 2.09 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 40.25 2i4h h TYR 1953CO 0.10 0.11 0.43 0.28 -1.64 0.00 0.00 178.16 177.44 2i4h h VAL 1954N 0.30 1.04 -0.82 1.81 2.07 -1.04 -2.92 116.25 116.68 2i4h h VAL 1954Ca 0.17 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.47 2i4h h VAL 1954Cb 0.14 0.15 -0.06 0.00 -1.52 0.00 0.00 31.29 30.01 2i4h h VAL 1954CO -0.17 0.15 0.50 0.22 0.02 0.00 0.00 177.57 178.29 2i4h h TYR 1955N 0.81 0.93 -0.99 1.57 3.20 -0.86 -0.23 116.97 121.41 2i4h h TYR 1955Ca 0.31 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.21 2i4h h TYR 1955Cb 0.11 -0.30 -0.05 0.00 1.54 0.00 0.00 36.73 38.03 2i4h h TYR 1955CO -0.05 0.48 0.66 -0.07 -1.64 0.00 0.00 178.16 177.53 2i4h h LEU 1956N 0.93 1.14 -0.88 2.82 3.38 -1.14 0.99 115.31 122.55 2i4h h LEU 1956Ca 0.35 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.21 2i4h h LEU 1956Cb 0.15 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2i4h h LEU 1956CO -0.16 0.82 -0.13 0.45 0.09 0.00 0.00 178.44 179.51 2i4h h HIS 1957N 1.34 0.76 -0.25 1.13 3.86 -1.22 -1.85 115.15 118.93 2i4h h HIS 1957Ca 0.36 -0.14 -0.18 0.00 -1.16 0.00 0.00 60.37 59.26 2i4h h HIS 1957Cb -0.16 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.12 2i4h h HIS 1957CO -0.00 0.79 -0.55 1.96 0.86 0.00 0.00 177.93 180.98 2i4h h GLN 1958N 0.63 0.74 0.13 2.45 4.20 -0.56 0.29 115.11 122.99 2i4h h GLN 1958Ca 0.11 -0.47 0.02 0.00 0.06 0.00 0.00 58.65 58.36 2i4h h GLN 1958Cb 0.58 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.38 2i4h h GLN 1958CO 0.04 1.10 -0.25 0.00 -0.67 0.00 0.00 178.83 179.04 2i4h h VAL 1960N -0.46 0.78 -0.69 0.00 2.07 -1.21 -1.35 116.25 115.39 2i4h h VAL 1960Ca 0.03 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.47 2i4h h VAL 1960Cb 0.48 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 2i4h h VAL 1960CO -0.14 0.07 0.41 -0.09 0.02 0.00 0.00 177.57 177.84 2i4h h ARG 1961N 0.37 0.74 -0.19 1.57 2.43 -0.75 -1.19 114.38 117.36 2i4h h ARG 1961Ca 0.28 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 59.23 2i4h h ARG 1961Cb 0.33 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2i4h h ARG 1961CO -0.29 0.49 -0.55 -0.44 -1.51 0.00 0.00 179.97 177.67 2i4h h ASP 1962N 0.76 0.82 -0.18 -3.80 3.32 -0.42 -1.85 116.42 115.07 2i4h h ASP 1962Ca 0.30 -0.58 0.04 0.00 0.02 0.00 0.00 57.03 56.80 2i4h h ASP 1962Cb 0.13 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 2i4h h ASP 1962CO -0.16 1.26 -0.06 0.58 -1.72 0.00 0.00 179.24 179.14 2i4h h VAL 1963N 0.42 0.78 -0.25 -1.35 2.07 -0.96 -2.55 116.25 114.41 2i4h h VAL 1963Ca -0.01 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 2i4h h VAL 1963Cb 1.17 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2i4h h VAL 1963CO 0.12 0.00 -0.29 -0.07 0.02 0.00 0.00 177.57 177.35 2i4h h LEU 1964N -0.02 0.51 0.24 2.57 3.38 -1.18 -2.23 115.31 118.57 2i4h h LEU 1964Ca 0.09 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2i4h h LEU 1964Cb 0.16 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2i4h h LEU 1964CO -0.20 0.78 -0.24 0.03 0.09 0.00 0.00 178.44 178.90 2i4h h ARG 1965N 0.43 -0.49 -0.16 1.13 3.08 -1.25 -2.00 114.38 115.12 2i4h h ARG 1965Ca 0.06 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.19 2i4h h ARG 1965Cb 0.72 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.83 2i4h h ARG 1965CO 0.06 -0.33 -0.18 0.00 -1.07 0.00 0.00 179.97 178.44 2i4h h ALA 1966N 0.17 -0.10 -0.28 0.04 0.00 -1.25 -2.95 119.26 114.89 2i4h h ALA 1966Ca -0.00 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2i4h h ALA 1966Cb 0.48 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2i4h h ALA 1966CO -0.06 -0.63 0.16 0.00 0.00 0.00 0.00 179.25 178.72 2i4h h ARG 1967N -0.22 0.38 -0.86 0.00 3.08 -1.36 -3.26 114.38 112.13 2i4h h ARG 1967Ca 0.11 -0.03 0.21 0.00 0.07 0.00 0.00 59.98 60.34 2i4h h ARG 1967Cb 0.38 -0.08 -0.16 0.00 0.08 0.00 0.00 29.97 30.18 2i4h h ARG 1967CO -0.29 0.28 -0.09 1.63 -1.07 0.00 0.00 179.97 180.42 2i4h n LYS 1968N -4.47 -0.07 -0.23 0.04 4.76 -0.76 -4.70 118.16 112.73 2i4h n LYS 1968Ca 0.01 1.32 0.07 0.00 -2.87 0.00 0.00 58.31 56.84 2i4h n LYS 1968Cb 0.09 -2.04 0.19 0.00 -1.84 0.00 0.00 35.03 31.44 2i4h n LYS 1968CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2i4h n LEU 1969N -5.33 3.19 -0.82 -0.35 7.99 -1.23 -5.13 117.00 115.32 2i4h n LEU 1969Ca 0.17 -2.04 0.10 0.00 -0.01 0.00 0.00 56.01 54.24 2i4h n LEU 1969Cb 0.56 -0.30 0.09 0.00 -0.11 0.00 0.00 43.42 43.65 2i4h n LEU 1969CO -0.08 0.78 0.57 0.54 -1.51 0.00 0.00 177.39 177.69