#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2was s VAL 1769N 0.00 0.02 0.01 1.61 0.11 -1.26 -0.70 120.40 120.19 2was s VAL 1769Ca 0.00 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.89 2was s VAL 1769Cb 0.00 -0.07 -0.01 0.00 -1.53 0.00 0.00 36.38 34.77 2was s VAL 1769CO 0.00 -0.09 -0.03 -0.83 -3.33 0.00 0.00 175.10 170.82 2was s GLY 1770N -0.26 0.19 0.00 6.54 0.00 0.56 -3.98 107.32 110.37 2was s GLY 1770Ca -0.03 -0.26 0.03 0.00 0.00 0.00 0.00 44.72 44.46 2was s GLY 1770CO -0.00 -0.26 -0.10 0.54 0.00 0.00 0.00 173.10 173.27 2was s VAL 1771N -0.42 0.80 -0.05 1.40 0.11 -1.26 0.11 120.40 121.08 2was s VAL 1771Ca -0.03 -0.55 -0.03 0.00 -2.93 0.00 0.00 61.98 58.44 2was s VAL 1771Cb -0.03 -0.69 0.02 0.00 -1.53 0.00 0.00 36.38 34.15 2was s VAL 1771CO -0.00 0.14 0.12 -0.62 -3.33 0.00 0.00 175.10 171.40 2was s ASP 1772N -0.47 -0.10 -0.06 3.54 2.15 -0.32 -4.65 116.67 116.76 2was s ASP 1772Ca 0.02 0.24 0.04 0.00 0.43 0.00 0.00 52.55 53.28 2was s ASP 1772Cb -0.05 0.19 0.00 0.00 -0.30 0.00 0.00 42.92 42.77 2was s ASP 1772CO -0.00 -0.09 -0.17 0.54 -0.17 0.00 0.00 175.17 175.28 2was s VAL 1773N 0.55 1.48 0.03 1.11 0.11 -1.26 -0.55 120.40 121.86 2was s VAL 1773Ca -0.04 -0.71 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 2was s VAL 1773Cb -0.06 -1.29 -0.02 0.00 -1.53 0.00 0.00 36.38 33.49 2was s VAL 1773CO -0.02 0.43 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.45 2was s GLU 1774N 0.25 0.75 0.38 1.54 0.41 -0.24 -4.97 118.70 116.83 2was s GLU 1774Ca -0.09 -0.65 -0.25 0.00 -0.41 0.00 0.00 54.97 53.57 2was s GLU 1774Cb -0.14 -0.70 -0.09 0.00 -1.78 0.00 0.00 34.13 31.43 2was s GLU 1774CO 0.04 0.17 1.07 -1.17 -0.49 0.00 0.00 175.26 174.87 2was s LEU 1775N -1.04 4.20 0.49 1.80 2.96 -1.26 -0.63 118.68 125.19 2was s LEU 1775Ca -0.01 2.10 0.16 0.00 -0.22 0.00 0.00 54.13 56.16 2was s LEU 1775Cb -0.07 -4.10 1.16 0.00 0.50 0.00 0.00 46.19 43.68 2was s LEU 1775CO 0.01 -0.47 2.08 0.40 -1.32 0.00 0.00 176.35 177.05 2was h ILE 1776N 2.32 1.04 -0.06 6.68 1.08 -1.85 -1.80 117.51 124.92 2was h ILE 1776Ca -0.48 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 2was h ILE 1776Cb 1.22 1.16 0.00 0.00 -3.07 0.00 0.00 36.82 36.12 2was h ILE 1776CO 0.63 0.08 0.00 0.35 -0.69 0.00 0.00 178.15 178.52 2was n THR 1777N -4.42 0.07 0.41 -0.27 -2.24 -1.26 -3.21 114.28 103.37 2was n THR 1777Ca -0.03 -0.17 0.13 0.00 -2.27 0.00 0.00 64.05 61.72 2was n THR 1777Cb 0.16 0.06 0.48 0.00 -2.10 0.00 0.00 70.33 68.93 2was n THR 1777CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2was h SER 1778N 1.22 0.00 -3.65 3.42 4.64 -1.70 -3.40 113.55 114.08 2was h SER 1778Ca 0.00 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.63 2was h SER 1778Cb 0.27 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.15 2was h SER 1778CO 0.00 0.00 -0.48 -0.63 -0.87 0.00 0.00 176.83 174.85 2was s ILE 1779N -3.33 5.09 -0.44 0.95 -1.09 -1.20 -5.04 121.20 116.15 2was s ILE 1779Ca 0.05 -0.41 -0.22 0.00 -2.23 0.00 0.00 60.65 57.84 2was s ILE 1779Cb 0.10 -3.68 0.02 0.00 -1.58 0.00 0.00 42.46 37.32 2was s ILE 1779CO 0.50 -0.08 0.71 0.21 -1.23 0.00 0.00 174.94 175.05 2was s ASN 1780N 1.68 6.38 0.25 3.58 2.47 -1.26 -4.94 114.94 123.10 2was s ASN 1780Ca 0.05 -0.17 0.09 0.00 0.42 0.00 0.00 52.86 53.25 2was s ASN 1780Cb -0.18 -2.35 0.28 0.00 -1.45 0.00 0.00 41.25 37.55 2was s ASN 1780CO 0.09 -0.83 1.57 0.58 -3.72 0.00 0.00 177.10 174.79 2was h VAL 1781N 5.91 1.47 -0.05 -5.21 2.07 -1.97 -2.86 116.25 115.61 2was h VAL 1781Ca -0.25 -2.25 -0.02 0.00 0.82 0.00 0.00 66.70 65.00 2was h VAL 1781Cb 1.09 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 2was h VAL 1781CO 0.92 0.64 -0.09 -0.33 0.02 0.00 0.00 177.57 178.74 2was h GLU 1782N 0.02 0.07 -5.49 1.57 3.07 -2.05 -3.38 114.58 108.39 2was h GLU 1782Ca -0.01 -0.01 -0.29 0.00 -0.50 0.00 0.00 59.36 58.56 2was h GLU 1782Cb 1.17 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 29.03 2was h GLU 1782CO 0.09 0.16 0.88 1.21 -1.40 0.00 0.00 179.01 179.95 2was s ASN 1783N -6.99 4.88 0.39 1.42 3.84 -1.08 -4.75 114.94 112.64 2was s ASN 1783Ca -0.05 -1.35 0.08 0.00 0.21 0.00 0.00 52.86 51.76 2was s ASN 1783Cb 0.16 -2.58 0.84 0.00 -0.55 0.00 0.00 41.25 39.12 2was s ASN 1783CO 0.70 -3.19 1.99 0.44 -2.79 0.00 0.00 177.10 174.24 2was h ASP 1784N 10.31 0.55 -0.03 -4.21 3.32 -1.86 -2.47 116.42 122.03 2was h ASP 1784Ca 0.17 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 2was h ASP 1784Cb 0.96 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.39 2was h ASP 1784CO 1.20 0.36 0.01 0.74 -1.72 0.00 0.00 179.24 179.83 2was h THR 1785N 0.63 1.13 -0.11 0.35 2.02 -1.96 -1.35 112.91 113.62 2was h THR 1785Ca 0.27 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 2was h THR 1785Cb 0.26 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2was h THR 1785CO -0.08 0.10 0.00 0.15 0.37 0.00 0.00 175.52 176.07 2was h PHE 1786N -0.10 0.21 0.06 3.16 3.57 -1.92 -1.31 116.94 120.61 2was h PHE 1786Ca 0.01 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.50 2was h PHE 1786Cb 0.16 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2was h PHE 1786CO -0.02 0.43 -0.29 0.82 -2.23 0.00 0.00 178.31 177.01 2was h ILE 1787N -0.08 0.36 -0.44 1.41 1.08 -1.44 -1.90 117.51 116.50 2was h ILE 1787Ca 0.03 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 2was h ILE 1787Cb 0.34 0.36 -0.02 0.00 -3.07 0.00 0.00 36.82 34.43 2was h ILE 1787CO 0.00 0.00 0.19 -0.08 -0.69 0.00 0.00 178.15 177.58 2was h GLU 1788N -0.48 0.62 -0.10 2.37 4.81 -1.26 0.37 114.58 120.92 2was h GLU 1788Ca 0.05 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.12 2was h GLU 1788Cb 0.53 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2was h GLU 1788CO -0.21 0.50 -0.30 -0.09 -0.73 0.00 0.00 179.01 178.18 2was h ARG 1789N 0.62 0.18 0.00 1.92 2.43 -0.81 -3.36 114.38 115.36 2was h ARG 1789Ca 0.15 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2was h ARG 1789Cb 0.10 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2was h ARG 1789CO -0.02 0.47 -0.36 0.09 -1.51 0.00 0.00 179.97 178.64 2was n ASN 1790N -4.13 0.63 -4.26 -3.80 3.02 -0.75 -4.36 115.26 101.61 2was n ASN 1790Ca -0.01 -0.56 -0.30 0.00 -0.03 0.00 0.00 54.58 53.68 2was n ASN 1790Cb 0.39 1.03 -0.16 0.00 -0.61 0.00 0.00 39.78 40.42 2was n ASN 1790CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2was s PHE 1791N -1.60 2.17 0.70 3.10 0.08 0.08 -3.66 117.98 118.85 2was s PHE 1791Ca 0.02 -0.47 -0.14 0.00 0.12 0.00 0.00 56.93 56.45 2was s PHE 1791Cb 0.04 -1.40 0.02 0.00 -0.57 0.00 0.00 43.02 41.11 2was s PHE 1791CO 0.22 -0.08 1.12 0.95 -0.10 0.00 0.00 175.22 177.33 2was s THR 1792N -0.44 3.08 0.46 0.64 -4.23 -1.26 -4.65 115.64 109.23 2was s THR 1792Ca 0.06 0.47 0.22 0.00 -1.18 0.00 0.00 61.69 61.25 2was s THR 1792Cb -0.10 -2.97 0.41 0.00 1.34 0.00 0.00 72.50 71.18 2was s THR 1792CO 0.00 -0.34 1.87 -0.65 -0.54 0.00 0.00 174.62 174.96 2was h PRO 1793N -0.31 0.26 0.08 3.99 0.11 -1.97 -0.86 132.00 133.31 2was h PRO 1793Ca -0.46 -0.02 -0.27 0.00 0.11 0.00 0.00 66.00 65.37 2was h PRO 1793Cb 1.25 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.31 2was h PRO 1793CO 0.52 0.17 -1.14 -0.56 -0.21 0.00 0.00 178.00 176.79 2was h GLN 1794N 0.27 0.42 0.16 1.05 -0.00 -1.98 -2.34 115.11 112.69 2was h GLN 1794Ca 0.44 -0.57 0.01 0.00 -0.00 0.00 0.00 58.65 58.53 2was h GLN 1794Cb 1.30 0.19 -0.02 0.00 -0.00 0.00 0.00 27.48 28.95 2was h GLN 1794CO -0.12 1.23 -0.18 0.93 -0.00 0.00 0.00 178.83 180.68 2was h GLU 1795N 0.19 -0.37 -0.94 0.06 5.08 -1.57 -0.62 114.58 116.41 2was h GLU 1795Ca -0.13 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.36 2was h GLU 1795Cb 1.82 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 31.07 2was h GLU 1795CO 0.20 -0.25 0.57 0.82 -1.00 0.00 0.00 179.01 179.35 2was h ILE 1796N -0.39 0.92 -0.29 3.13 2.04 -1.25 -1.44 117.51 120.22 2was h ILE 1796Ca 0.01 -0.32 -0.14 0.00 1.00 0.00 0.00 64.86 65.41 2was h ILE 1796Cb 0.38 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 2was h ILE 1796CO -0.06 0.17 -0.38 -0.08 0.00 0.00 0.00 178.15 177.80 2was h GLU 1797N 0.92 0.69 0.33 2.37 4.81 -1.16 -2.22 114.58 120.32 2was h GLU 1797Ca 0.46 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2was h GLU 1797Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2was h GLU 1797CO -0.26 0.95 -0.16 -0.92 -0.73 0.00 0.00 179.01 177.89 2was h TYR 1798N 0.57 -0.42 -0.80 0.92 3.20 -0.25 -2.89 116.97 117.31 2was h TYR 1798Ca 0.05 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2was h TYR 1798Cb 0.91 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.28 2was h TYR 1798CO 0.04 -0.18 0.52 0.00 -1.64 0.00 0.00 178.16 176.90 2was h SER 1800N 1.09 0.00 -0.23 0.00 0.02 -1.41 -1.70 113.55 111.32 2was h SER 1800Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2was h SER 1800Cb -0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.44 2was h SER 1800CO -0.06 0.04 0.00 0.00 -1.14 0.00 0.00 176.83 175.67 2was n ALA 1801N -2.39 2.50 -2.65 3.77 0.00 -0.66 -4.91 120.51 116.17 2was n ALA 1801Ca -0.03 -0.57 -0.26 0.00 0.00 0.00 0.00 53.44 52.58 2was n ALA 1801Cb 0.13 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 2was n ALA 1801CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2was s GLN 1802N -1.71 3.54 0.26 0.00 -1.52 -0.64 -5.00 119.66 114.60 2was s GLN 1802Ca 0.31 -0.23 -0.02 0.00 -1.95 0.00 0.00 55.36 53.46 2was s GLN 1802Cb 0.16 -2.71 0.44 0.00 -0.22 0.00 0.00 33.01 30.68 2was s GLN 1802CO 0.24 0.24 1.86 -1.35 -0.25 0.00 0.00 175.29 176.03 2was h PRO 1803N 1.39 1.02 -4.69 2.91 0.11 -1.91 -3.32 132.00 127.51 2was h PRO 1803Ca -0.49 -0.06 -0.66 0.00 0.11 0.00 0.00 66.00 64.90 2was h PRO 1803Cb 1.20 -0.23 -0.39 0.00 0.11 0.00 0.00 31.00 31.69 2was h PRO 1803CO 0.65 0.68 -0.74 0.45 -0.21 0.00 0.00 178.00 178.82 2was s SER 1804N -5.79 4.64 0.14 -2.05 0.15 -1.26 -5.01 113.70 104.53 2was s SER 1804Ca -0.12 -1.93 -0.13 0.00 0.70 0.00 0.00 55.95 54.47 2was s SER 1804Cb 0.20 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.94 2was s SER 1804CO 0.81 -0.33 1.58 0.58 1.20 0.00 0.00 173.24 177.08 2was h VAL 1805N 6.65 1.27 -0.50 4.45 2.07 -1.77 -1.95 116.25 126.47 2was h VAL 1805Ca -0.08 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 2was h VAL 1805Cb 1.03 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2was h VAL 1805CO 0.50 0.38 0.16 -0.61 0.02 0.00 0.00 177.57 178.02 2was h GLN 1806N 0.68 0.78 -0.95 1.57 4.15 -1.92 -1.22 115.11 118.20 2was h GLN 1806Ca 0.13 -0.17 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 2was h GLN 1806Cb 0.54 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.08 2was h GLN 1806CO 0.03 0.72 0.56 0.77 -1.93 0.00 0.00 178.83 178.98 2was h SER 1807N 0.68 1.14 -0.35 -0.69 0.02 -1.82 -0.47 113.55 112.07 2was h SER 1807Ca 0.16 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 2was h SER 1807Cb 0.27 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2was h SER 1807CO -0.01 0.88 0.04 -1.28 -1.14 0.00 0.00 176.83 175.33 2was h SER 1808N 1.31 0.57 -0.61 3.07 0.87 -0.99 -0.67 113.55 117.09 2was h SER 1808Ca 0.34 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 2was h SER 1808Cb -0.04 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.74 2was h SER 1808CO -0.06 0.70 0.24 -0.26 -0.53 0.00 0.00 176.83 176.92 2was h PHE 1809N 0.42 0.94 -0.86 2.24 0.04 -1.04 -1.11 116.94 117.56 2was h PHE 1809Ca 0.10 -0.07 0.02 0.00 2.80 0.00 0.00 57.97 60.82 2was h PHE 1809Cb 0.38 -0.28 -0.05 0.00 2.20 0.00 0.00 35.95 38.21 2was h PHE 1809CO 0.03 0.75 0.57 0.00 -0.60 0.00 0.00 178.31 179.05 2was h ALA 1810N 1.09 1.42 -0.16 2.45 0.00 -0.81 0.96 119.26 124.22 2was h ALA 1810Ca 0.20 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2was h ALA 1810Cb 0.21 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 2was h ALA 1810CO -0.02 0.51 -0.19 0.78 0.00 0.00 0.00 179.25 180.34 2was h GLY 1811N 1.12 0.45 1.49 0.00 0.00 -0.85 -1.98 103.07 103.30 2was h GLY 1811Ca 0.33 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.14 2was h GLY 1811CO -0.08 0.43 0.11 -0.84 0.00 0.00 0.00 176.54 176.15 2was h THR 1812N 0.05 1.19 -0.46 4.70 2.02 -0.98 -1.89 112.91 117.54 2was h THR 1812Ca 0.02 -0.68 -0.05 0.00 0.77 0.00 0.00 66.41 66.47 2was h THR 1812Cb 0.73 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2was h THR 1812CO 0.05 0.25 0.09 -0.25 0.37 0.00 0.00 175.52 176.02 2was h TRP 1813N 0.63 0.79 -0.60 3.16 2.91 -0.75 -1.82 115.95 120.28 2was h TRP 1813Ca 0.15 -0.11 -0.00 0.00 1.13 0.00 0.00 58.89 60.06 2was h TRP 1813Cb 0.23 -0.22 -0.03 0.00 -0.51 0.00 0.00 29.16 28.63 2was h TRP 1813CO 0.01 0.74 0.36 0.77 -1.03 0.00 0.00 178.44 179.29 2was h SER 1814N 0.62 0.72 -0.09 2.65 0.02 -1.08 -2.25 113.55 114.14 2was h SER 1814Ca 0.14 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2was h SER 1814Cb 0.37 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 2was h SER 1814CO 0.01 0.55 0.02 0.00 -1.14 0.00 0.00 176.83 176.27 2was h ALA 1815N 1.57 0.11 -0.13 3.77 0.00 -1.05 0.39 119.26 123.93 2was h ALA 1815Ca 0.22 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2was h ALA 1815Cb -0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2was h ALA 1815CO -0.04 -0.26 -0.10 0.87 0.00 0.00 0.00 179.25 179.71 2was h LYS 1816N -0.07 -0.12 -0.27 0.00 1.57 -1.14 0.13 116.57 116.68 2was h LYS 1816Ca 0.03 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2was h LYS 1816Cb 0.24 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 2was h LYS 1816CO 0.00 -0.08 0.06 0.93 -0.57 0.00 0.00 179.45 179.79 2was h GLU 1817N -0.12 0.15 -0.36 3.15 4.39 -1.34 -1.08 114.58 119.37 2was h GLU 1817Ca 0.08 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.81 2was h GLU 1817Cb 0.24 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 2was h GLU 1817CO -0.20 0.10 0.15 0.00 -1.16 0.00 0.00 179.01 177.90 2was h ALA 1818N 1.20 0.42 0.29 3.43 0.00 -0.67 -2.27 119.26 121.65 2was h ALA 1818Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2was h ALA 1818Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2was h ALA 1818CO -0.16 -0.24 -0.15 0.28 0.00 0.00 0.00 179.25 178.98 2was h VAL 1819N 0.31 0.69 -0.96 0.00 2.07 -0.53 -2.30 116.25 115.53 2was h VAL 1819Ca 0.16 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.90 2was h VAL 1819Cb 0.11 0.69 -0.12 0.00 -1.52 0.00 0.00 31.29 30.45 2was h VAL 1819CO -0.14 0.00 0.52 0.15 0.02 0.00 0.00 177.57 178.12 2was h PHE 1820N -0.40 0.90 0.00 1.57 3.57 -1.14 -1.72 116.94 119.71 2was h PHE 1820Ca -0.04 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.40 2was h PHE 1820Cb 0.32 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2was h PHE 1820CO -0.07 0.07 -0.50 0.87 -2.23 0.00 0.00 178.31 176.45 2was h LYS 1821N 0.56 0.00 0.00 1.11 1.57 -1.03 -2.65 116.57 116.13 2was h LYS 1821Ca 0.60 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 2was h LYS 1821Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.39 2was h LYS 1821CO -0.47 0.50 0.00 0.66 -0.57 0.00 0.00 179.45 179.57 2was h SER 1822N 0.00 0.00 0.00 0.86 4.64 -0.77 -3.43 113.55 114.85 2was h SER 1822Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2was h SER 1822Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2was h SER 1822CO 0.07 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.21 2was n LEU 1823N -2.77 0.61 -0.45 5.97 4.77 -1.00 -4.22 117.00 119.91 2was n LEU 1823Ca 0.03 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2was n LEU 1823Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2was n LEU 1823CO 0.29 0.00 0.24 0.18 -1.33 0.00 0.00 177.39 176.77 2was n LEU 1834N -0.13 0.00 0.28 2.23 4.77 -1.26 -5.07 117.00 117.82 2was n LEU 1834Ca 0.00 -0.92 0.17 0.00 -0.03 0.00 0.00 56.01 55.24 2was n LEU 1834Cb 0.00 0.00 0.70 0.00 -2.33 0.00 0.00 43.42 41.79 2was n LEU 1834CO 0.00 0.46 0.99 0.50 -1.33 0.00 0.00 177.39 178.02 2was h LYS 1835N 0.00 0.00 -0.82 3.23 3.64 -1.76 -2.70 116.57 118.16 2was h LYS 1835Ca 0.00 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 2was h LYS 1835Cb 1.24 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.98 2was h LYS 1835CO 0.00 0.01 0.45 -0.44 -2.27 0.00 0.00 179.45 177.20 2was h ASP 1836N 0.00 0.60 -3.26 4.20 3.32 -1.89 -3.38 116.42 116.02 2was h ASP 1836Ca -0.00 0.07 -0.66 0.00 0.02 0.00 0.00 57.03 56.45 2was h ASP 1836Cb 0.50 -0.04 -0.16 0.00 0.22 0.00 0.00 39.33 39.85 2was h ASP 1836CO 0.00 0.31 0.20 -0.63 -1.72 0.00 0.00 179.24 177.40 2was s ILE 1837N -6.01 4.74 -0.14 0.35 1.01 -1.02 -1.73 121.20 118.40 2was s ILE 1837Ca -0.12 -0.24 -0.05 0.00 0.00 0.00 0.00 60.65 60.23 2was s ILE 1837Cb 0.20 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 2was s ILE 1837CO 0.78 -0.88 0.04 -0.70 0.00 0.00 0.00 174.94 174.17 2was s GLU 1838N 3.01 3.56 -0.20 2.79 2.12 -0.80 -4.87 118.70 124.32 2was s GLU 1838Ca 0.20 -0.37 -0.07 0.00 0.36 0.00 0.00 54.97 55.09 2was s GLU 1838Cb -0.17 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 2was s GLU 1838CO 0.14 0.46 0.06 0.42 -0.54 0.00 0.00 175.26 175.80 2was s ILE 1839N -0.18 4.59 -0.19 -3.70 -1.09 -1.26 -0.87 121.20 118.50 2was s ILE 1839Ca 0.06 -0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.38 2was s ILE 1839Cb -0.12 -3.09 0.01 0.00 -1.58 0.00 0.00 42.46 37.68 2was s ILE 1839CO 0.02 0.43 -0.13 0.68 -1.23 0.00 0.00 174.94 174.70 2was s VAL 1840N 0.69 2.62 0.03 2.92 -7.23 0.80 -4.72 120.40 115.50 2was s VAL 1840Ca 0.03 -0.75 -0.02 0.00 -1.81 0.00 0.00 61.98 59.43 2was s VAL 1840Cb -0.13 -2.14 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 2was s VAL 1840CO 0.02 0.49 0.01 -0.13 -0.31 0.00 0.00 175.10 175.18 2was s ARG 1841N 1.32 0.43 0.00 4.82 0.52 -1.26 0.07 118.95 124.85 2was s ARG 1841Ca 0.04 -0.74 0.00 0.00 -0.52 0.00 0.00 55.73 54.52 2was s ARG 1841Cb -0.14 0.16 0.00 0.00 0.52 0.00 0.00 34.95 35.49 2was s ARG 1841CO -0.08 -0.08 0.00 0.25 0.02 0.00 0.00 175.30 175.40 2was n THR 1842N 1.15 0.00 -0.47 0.02 -2.24 -1.26 -5.03 114.28 106.45 2was n THR 1842Ca -0.21 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2was n THR 1842Cb 0.57 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 2was n THR 1842CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2was n ALA 1846N -1.62 0.00 -2.89 6.98 0.00 -1.26 -5.21 120.51 116.51 2was n ALA 1846Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2was n ALA 1846Cb 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.46 2was n ALA 1846CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2was s PRO 1847N -1.24 3.45 0.06 0.00 0.02 -1.26 -4.94 135.00 131.09 2was s PRO 1847Ca 0.00 -0.23 0.09 0.00 0.02 0.00 0.00 61.00 60.88 2was s PRO 1847Cb 0.00 -3.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.35 2was s PRO 1847CO 0.00 0.72 -0.23 0.00 -0.33 0.00 0.00 177.00 177.16 2was s ALA 1848N -1.19 2.44 -0.16 -1.55 0.00 0.11 -4.65 121.76 116.76 2was s ALA 1848Ca 0.22 -1.27 -0.11 0.00 0.00 0.00 0.00 51.96 50.80 2was s ALA 1848Cb -0.12 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.37 2was s ALA 1848CO 0.12 0.55 0.19 0.08 0.00 0.00 0.00 175.76 176.70 2was s VAL 1849N -0.91 5.39 -0.15 0.00 1.01 -1.26 -0.14 120.40 124.33 2was s VAL 1849Ca 0.14 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 2was s VAL 1849Cb -0.10 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.81 2was s VAL 1849CO 0.04 0.48 -0.01 -1.61 0.00 0.00 0.00 175.10 174.00 2was s GLU 1850N -0.01 0.99 0.25 2.72 2.02 -0.05 -4.93 118.70 119.70 2was s GLU 1850Ca 0.13 -0.31 -0.08 0.00 0.02 0.00 0.00 54.97 54.72 2was s GLU 1850Cb -0.12 -1.74 -0.07 0.00 0.10 0.00 0.00 34.13 32.30 2was s GLU 1850CO 0.02 -0.45 0.56 -0.51 0.02 0.00 0.00 175.26 174.89 2was s LEU 1851N 1.79 4.13 0.16 1.80 1.43 -1.26 -1.90 118.68 124.83 2was s LEU 1851Ca 0.02 0.87 -0.02 0.00 -1.03 0.00 0.00 54.13 53.97 2was s LEU 1851Cb -0.15 -3.66 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 2was s LEU 1851CO -0.07 -0.12 0.12 -1.00 0.23 0.00 0.00 176.35 175.51 2was s HIS 1852N -1.90 0.86 0.00 0.29 3.76 -0.70 -4.70 115.29 112.89 2was s HIS 1852Ca 0.47 -1.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.18 2was s HIS 1852Cb -0.11 -0.42 0.00 0.00 1.11 0.00 0.00 32.58 33.16 2was s HIS 1852CO 0.24 -0.59 0.00 0.41 -0.85 0.00 0.00 174.74 173.94 2was n GLY 1853N -0.17 2.65 0.28 -2.22 0.00 -1.26 -1.67 105.19 102.81 2was n GLY 1853Ca -0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 2was n GLY 1853CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2was h ASN 1854N 4.44 0.71 -0.73 1.61 2.35 -1.99 -2.16 115.58 119.81 2was h ASN 1854Ca 0.00 0.00 0.17 0.00 -0.55 0.00 0.00 56.30 55.92 2was h ASN 1854Cb 0.00 -0.15 -0.12 0.00 0.05 0.00 0.00 38.32 38.10 2was h ASN 1854CO 0.00 0.49 0.06 0.00 -1.65 0.00 0.00 177.43 176.33 2was h ALA 1855N 1.31 0.82 -0.26 -0.83 0.00 -1.76 -0.63 119.26 117.91 2was h ALA 1855Ca 0.29 0.21 -0.07 0.00 0.00 0.00 0.00 54.91 55.34 2was h ALA 1855Cb 0.05 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2was h ALA 1855CO -0.12 -0.40 -0.13 -0.22 0.00 0.00 0.00 179.25 178.38 2was h LYS 1856N 0.15 0.55 0.42 0.00 3.64 -0.67 -2.50 116.57 118.16 2was h LYS 1856Ca 0.41 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2was h LYS 1856Cb 0.71 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 2was h LYS 1856CO -0.60 0.80 -0.20 0.87 -2.27 0.00 0.00 179.45 178.04 2was h LYS 1857N 0.28 -0.55 -0.01 1.90 1.57 -1.09 -1.67 116.57 117.01 2was h LYS 1857Ca 0.06 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2was h LYS 1857Cb 0.64 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 2was h LYS 1857CO 0.04 -0.32 0.01 0.00 -0.57 0.00 0.00 179.45 178.60 2was h ALA 1858N -0.09 1.41 0.01 3.86 0.00 -1.20 0.64 119.26 123.88 2was h ALA 1858Ca -0.06 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2was h ALA 1858Cb 0.48 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2was h ALA 1858CO 0.10 -0.01 -0.28 0.00 0.00 0.00 0.00 179.25 179.05 2was h ALA 1859N 1.99 0.02 -0.44 0.00 0.00 -1.09 -2.54 119.26 117.20 2was h ALA 1859Ca 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.34 2was h ALA 1859Cb 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2was h ALA 1859CO -0.00 0.11 -0.06 0.93 0.00 0.00 0.00 179.25 180.23 2was h GLU 1860N -0.52 0.75 0.00 0.00 5.08 -0.69 0.88 114.58 120.07 2was h GLU 1860Ca -0.04 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2was h GLU 1860Cb 1.06 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2was h GLU 1860CO 0.05 0.80 0.00 -1.91 -1.00 0.00 0.00 179.01 176.95 2was n GLU 1861N -4.19 0.08 0.00 2.33 2.13 0.22 -1.25 120.64 119.95 2was n GLU 1861Ca 0.02 0.22 0.04 0.00 0.66 0.00 0.00 57.16 58.10 2was n GLU 1861Cb 0.33 -1.50 -0.01 0.00 0.27 0.00 0.00 31.44 30.53 2was n GLU 1861CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2was n ALA 1862N -1.42 2.80 -0.71 4.31 0.00 -0.85 -4.98 120.51 119.67 2was n ALA 1862Ca 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.09 2was n ALA 1862Cb 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.28 2was n ALA 1862CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2was n GLY 1863N 0.88 0.60 3.64 0.00 0.00 -0.38 -5.02 105.19 104.91 2was n GLY 1863Ca 0.03 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 2was n GLY 1863CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2was s VAL 1864N -2.00 4.10 -0.17 1.61 1.01 0.25 -4.25 120.40 120.95 2was s VAL 1864Ca 0.00 1.26 0.22 0.00 0.00 0.00 0.00 61.98 63.46 2was s VAL 1864Cb 0.00 -4.05 -0.29 0.00 0.00 0.00 0.00 36.38 32.04 2was s VAL 1864CO 0.00 -0.38 0.60 0.35 0.00 0.00 0.00 175.10 175.67 2was n THR 1865N 6.06 0.07 -3.59 3.92 -2.24 0.18 -4.47 114.28 114.20 2was n THR 1865Ca 0.15 -0.45 -0.13 0.00 -2.27 0.00 0.00 64.05 61.36 2was n THR 1865Cb 0.46 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.70 2was n THR 1865CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2was s ASP 1866N -4.43 -0.53 -0.07 3.42 2.15 -1.22 -4.98 116.67 111.00 2was s ASP 1866Ca -0.05 0.79 0.02 0.00 0.43 0.00 0.00 52.55 53.74 2was s ASP 1866Cb 0.14 0.72 0.01 0.00 -0.30 0.00 0.00 42.92 43.49 2was s ASP 1866CO 0.89 -0.34 -0.13 -0.69 -0.17 0.00 0.00 175.17 174.73 2was s VAL 1867N -0.50 1.26 0.10 1.11 1.01 -1.26 -0.54 120.40 121.57 2was s VAL 1867Ca -0.02 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 61.49 2was s VAL 1867Cb -0.02 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2was s VAL 1867CO 0.01 0.38 -0.14 -0.54 0.00 0.00 0.00 175.10 174.82 2was s LYS 1868N 0.71 2.01 -0.01 2.72 -0.14 -0.71 -4.33 119.74 120.00 2was s LYS 1868Ca -0.13 -1.06 -0.02 0.00 -1.36 0.00 0.00 55.97 53.39 2was s LYS 1868Cb -0.16 -2.23 -0.00 0.00 -1.68 0.00 0.00 37.83 33.76 2was s LYS 1868CO 0.03 0.51 0.05 0.54 -0.76 0.00 0.00 175.35 175.72 2was s VAL 1869N -1.14 0.05 0.09 3.17 0.11 -1.26 -1.74 120.40 119.67 2was s VAL 1869Ca 0.19 -0.40 0.07 0.00 -2.93 0.00 0.00 61.98 58.91 2was s VAL 1869Cb -0.11 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.51 2was s VAL 1869CO 0.11 -0.22 -0.18 -0.55 -3.33 0.00 0.00 175.10 170.93 2was s SER 1870N -0.67 2.12 0.04 3.54 0.15 -0.43 -4.60 113.70 113.83 2was s SER 1870Ca -0.07 -0.65 0.04 0.00 0.70 0.00 0.00 55.95 55.96 2was s SER 1870Cb -0.05 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.15 2was s SER 1870CO 0.00 -0.01 -0.11 -0.63 1.20 0.00 0.00 173.24 173.69 2was s ILE 1871N -1.21 0.88 0.08 6.45 1.01 -1.26 -1.69 121.20 125.47 2was s ILE 1871Ca 0.02 -0.92 -0.19 0.00 0.00 0.00 0.00 60.65 59.56 2was s ILE 1871Cb -0.10 -0.83 0.04 0.00 0.01 0.00 0.00 42.46 41.59 2was s ILE 1871CO 0.03 -0.08 0.46 -0.55 0.00 0.00 0.00 174.94 174.80 2was s SER 1872N -1.13 -0.34 0.12 3.58 0.15 -0.12 -5.01 113.70 110.96 2was s SER 1872Ca -0.01 -0.06 -0.13 0.00 0.70 0.00 0.00 55.95 56.45 2was s SER 1872Cb -0.08 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.73 2was s SER 1872CO 0.01 -0.77 0.33 -1.38 1.20 0.00 0.00 173.24 172.62 2was s HIS 1873N -3.05 -0.02 0.00 3.44 -3.43 -1.26 0.19 115.29 111.15 2was s HIS 1873Ca -0.02 -0.34 0.00 0.00 -0.80 0.00 0.00 55.06 53.90 2was s HIS 1873Cb 0.00 0.13 0.00 0.00 -1.43 0.00 0.00 32.58 31.29 2was s HIS 1873CO -0.07 -0.67 0.00 -0.40 -2.00 0.00 0.00 174.74 171.60 2was n ASP 1874N -0.18 0.58 0.23 7.38 5.68 -0.46 -4.99 116.55 124.79 2was n ASP 1874Ca -0.14 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.24 2was n ASP 1874Cb 0.63 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.14 2was n ASP 1874CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2was h ASP 1875N 0.00 0.00 0.06 -1.12 3.32 -2.03 -3.33 116.42 113.32 2was h ASP 1875Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 2was h ASP 1875Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 2was h ASP 1875CO 0.00 0.24 -2.24 0.18 -1.72 0.00 0.00 179.24 175.70 2was n LEU 1876N -3.65 2.81 -3.59 1.55 4.77 -1.26 -4.81 117.00 112.82 2was n LEU 1876Ca -0.01 0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 2was n LEU 1876Cb 0.36 -1.02 -0.02 0.00 -2.33 0.00 0.00 43.42 40.42 2was n LEU 1876CO 0.34 0.90 0.51 0.00 -1.33 0.00 0.00 177.39 177.80 2was s GLN 1877N -2.54 1.31 0.12 3.23 -2.07 -1.25 -2.98 119.66 115.48 2was s GLN 1877Ca -0.29 -0.59 0.08 0.00 -1.82 0.00 0.00 55.36 52.74 2was s GLN 1877Cb 0.08 0.53 -0.04 0.00 -1.09 0.00 0.00 33.01 32.49 2was s GLN 1877CO 0.68 -0.59 -0.13 0.00 -1.32 0.00 0.00 175.29 173.94 2was s ALA 1878N -3.62 2.86 0.02 2.60 0.00 0.20 -1.35 121.76 122.47 2was s ALA 1878Ca 0.06 -1.31 0.02 0.00 0.00 0.00 0.00 51.96 50.73 2was s ALA 1878Cb -0.02 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.29 2was s ALA 1878CO -0.05 0.60 -0.08 0.08 0.00 0.00 0.00 175.76 176.31 2was s VAL 1879N -1.26 0.60 0.01 0.00 1.01 0.13 -1.08 120.40 119.81 2was s VAL 1879Ca 0.21 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.55 2was s VAL 1879Cb -0.11 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 2was s VAL 1879CO 0.13 -0.05 -0.02 0.00 0.00 0.00 0.00 175.10 175.15 2was s ALA 1880N -0.65 0.17 -0.04 5.51 0.00 0.28 -0.94 121.76 126.08 2was s ALA 1880Ca -0.02 -0.26 0.04 0.00 0.00 0.00 0.00 51.96 51.72 2was s ALA 1880Cb -0.06 0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 2was s ALA 1880CO 0.00 -0.02 -0.16 0.08 0.00 0.00 0.00 175.76 175.66 2was s VAL 1881N -0.51 1.33 0.03 0.00 1.01 -0.68 -1.17 120.40 120.40 2was s VAL 1881Ca -0.05 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.34 2was s VAL 1881Cb -0.04 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 2was s VAL 1881CO -0.00 0.39 -0.19 0.00 0.00 0.00 0.00 175.10 175.30 2was s ALA 1882N 0.11 1.57 -0.06 5.51 0.00 0.12 -1.32 121.76 127.69 2was s ALA 1882Ca -0.05 -0.94 0.05 0.00 0.00 0.00 0.00 51.96 51.02 2was s ALA 1882Cb -0.11 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.68 2was s ALA 1882CO 0.02 0.35 -0.20 0.14 0.00 0.00 0.00 175.76 176.08 2was s VAL 1883N -0.71 1.66 0.10 0.00 -7.23 -0.71 -0.32 120.40 113.18 2was s VAL 1883Ca 0.06 -0.83 0.06 0.00 -1.81 0.00 0.00 61.98 59.46 2was s VAL 1883Cb -0.08 -1.43 -0.04 0.00 0.56 0.00 0.00 36.38 35.39 2was s VAL 1883CO 0.01 0.47 -0.04 -0.94 -0.31 0.00 0.00 175.10 174.29 2was s SER 1884N 0.10 4.78 0.18 4.85 1.04 0.12 -1.74 113.70 123.03 2was s SER 1884Ca -0.07 -0.27 0.10 0.00 0.48 0.00 0.00 55.95 56.19 2was s SER 1884Cb -0.14 -1.05 -0.04 0.00 0.10 0.00 0.00 66.02 64.89 2was s SER 1884CO 0.04 0.17 -0.16 -0.89 0.98 0.00 0.00 173.24 173.38 2was s THR 1885N -1.29 2.81 0.00 2.02 2.01 0.30 -2.99 115.64 118.49 2was s THR 1885Ca 0.24 -1.79 0.00 0.00 0.31 0.00 0.00 61.69 60.45 2was s THR 1885Cb -0.11 -2.37 0.00 0.00 0.01 0.00 0.00 72.50 70.03 2was s THR 1885CO 0.17 -0.09 0.00 0.29 -0.69 0.00 0.00 174.62 174.30