#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aue n TRP 2024N 0.00 0.13 0.18 1.96 7.02 -1.26 -1.24 117.44 124.23 1aue n TRP 2024Ca 0.00 1.06 0.03 0.00 -1.02 0.00 0.00 57.50 57.57 1aue n TRP 2024Cb 0.00 -0.89 0.38 0.00 -2.42 0.00 0.00 31.31 28.38 1aue n TRP 2024CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1aue h HIS 2025N 0.00 0.06 0.00 -5.99 3.86 -2.00 -2.48 115.15 108.60 1aue h HIS 2025Ca 0.34 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.54 1aue h HIS 2025Cb 0.56 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.01 1aue h HIS 2025CO -0.72 0.35 -0.02 0.93 0.86 0.00 0.00 177.93 179.33 1aue h GLU 2026N 0.05 0.00 -0.79 2.45 3.07 -1.59 -3.02 114.58 114.75 1aue h GLU 2026Ca 0.01 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 58.90 1aue h GLU 2026Cb 0.55 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.41 1aue h GLU 2026CO 0.04 0.87 0.50 0.52 -1.40 0.00 0.00 179.01 179.54 1aue h MET 2027N -1.00 0.93 -0.32 2.33 2.86 -1.50 -1.17 114.93 117.07 1aue h MET 2027Ca -0.00 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.48 1aue h MET 2027Cb 0.88 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1aue h MET 2027CO -0.00 0.62 -0.22 -1.49 1.06 0.00 0.00 176.91 176.87 1aue h TRP 2028N 0.96 0.68 -0.51 -0.22 4.06 -1.55 -1.61 115.95 117.76 1aue h TRP 2028Ca 0.32 -0.14 -0.11 0.00 2.06 0.00 0.00 58.89 61.02 1aue h TRP 2028Cb 0.05 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.03 1aue h TRP 2028CO -0.03 0.78 -0.10 1.25 -3.56 0.00 0.00 178.44 176.77 1aue h HIS 2029N 0.54 1.10 -0.09 0.49 2.76 -1.29 -1.85 115.15 116.80 1aue h HIS 2029Ca 0.08 -0.23 -0.11 0.00 -2.20 0.00 0.00 60.37 57.91 1aue h HIS 2029Cb 0.67 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.37 1aue h HIS 2029CO 0.03 1.03 -0.38 0.93 -1.30 0.00 0.00 177.93 178.24 1aue h GLU 2030N 0.84 0.42 -0.49 5.26 5.08 -1.11 -3.19 114.58 121.40 1aue h GLU 2030Ca 0.13 -0.33 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 1aue h GLU 2030Cb 0.67 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1aue h GLU 2030CO 0.05 0.96 0.10 0.78 -1.00 0.00 0.00 179.01 179.89 1aue h GLY 2031N -0.03 0.85 0.97 -3.84 0.00 -1.31 -2.54 103.07 97.17 1aue h GLY 2031Ca -0.02 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 1aue h GLY 2031CO 0.08 0.52 0.18 -2.00 0.00 0.00 0.00 176.54 175.32 1aue h LEU 2032N 0.67 0.70 -0.36 3.11 5.85 -1.45 0.19 115.31 124.03 1aue h LEU 2032Ca 0.15 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.76 1aue h LEU 2032Cb 0.37 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.13 1aue h LEU 2032CO 0.01 0.70 -0.39 -0.08 -0.34 0.00 0.00 178.44 178.33 1aue h GLU 2033N 0.67 -0.31 -0.62 1.25 4.22 -1.57 -1.65 114.58 116.57 1aue h GLU 2033Ca 0.16 0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.59 1aue h GLU 2033Cb 0.22 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1aue h GLU 2033CO -0.01 -0.21 0.27 1.49 -2.18 0.00 0.00 179.01 178.37 1aue h GLU 2034N -0.33 0.92 -0.03 1.92 4.57 -0.88 -0.04 114.58 120.71 1aue h GLU 2034Ca 0.14 -0.16 -0.08 0.00 -1.18 0.00 0.00 59.36 58.08 1aue h GLU 2034Cb 0.57 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 1aue h GLU 2034CO -0.53 0.76 -0.37 0.00 -1.18 0.00 0.00 179.01 177.69 1aue h ALA 2035N 1.11 1.32 0.00 2.92 0.00 -0.58 -1.85 119.26 122.19 1aue h ALA 2035Ca 0.21 -0.35 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 1aue h ALA 2035Cb 0.17 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1aue h ALA 2035CO -0.02 0.50 -0.95 0.66 0.00 0.00 0.00 179.25 179.44 1aue h SER 2036N 0.06 0.00 -0.03 0.00 4.64 -0.44 -1.00 113.55 116.77 1aue h SER 2036Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1aue h SER 2036Cb 0.69 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1aue h SER 2036CO 0.05 0.87 0.01 -0.09 -0.87 0.00 0.00 176.83 176.80 1aue h ARG 2037N 0.00 0.05 -0.56 4.77 2.43 -0.52 0.14 114.38 120.68 1aue h ARG 2037Ca -0.03 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 1aue h ARG 2037Cb 1.69 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 31.18 1aue h ARG 2037CO 0.11 0.22 0.25 -0.07 -1.51 0.00 0.00 179.97 178.97 1aue h LEU 2038N -0.13 0.31 0.11 3.80 3.38 -1.34 0.69 115.31 122.13 1aue h LEU 2038Ca 0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1aue h LEU 2038Cb 0.19 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1aue h LEU 2038CO -0.00 0.20 -0.06 0.22 0.09 0.00 0.00 178.44 178.90 1aue h TYR 2039N 0.46 -0.14 -0.03 1.13 3.20 -0.98 0.10 116.97 120.72 1aue h TYR 2039Ca 0.27 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.95 1aue h TYR 2039Cb 0.25 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1aue h TYR 2039CO -0.13 -0.09 -0.77 0.74 -1.64 0.00 0.00 178.16 176.26 1aue h PHE 2040N -0.64 0.32 0.11 -3.82 0.04 -0.84 -1.75 116.94 110.35 1aue h PHE 2040Ca -0.02 -0.15 -0.34 0.00 2.80 0.00 0.00 57.97 60.26 1aue h PHE 2040Cb 0.12 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 1aue h PHE 2040CO 0.02 0.91 -1.88 0.41 -0.60 0.00 0.00 178.31 177.17 1aue n GLY 2041N 0.64 -0.60 0.53 -1.45 0.00 0.14 -4.60 105.19 99.85 1aue n GLY 2041Ca -0.03 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 45.82 1aue n GLY 2041CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1aue n GLU 2042N -3.64 1.83 -4.05 1.61 1.02 -0.62 -4.99 120.64 111.81 1aue n GLU 2042Ca -0.32 -1.64 -0.30 0.00 -0.02 0.00 0.00 57.16 54.88 1aue n GLU 2042Cb 0.99 -1.23 -0.01 0.00 -0.02 0.00 0.00 31.44 31.16 1aue n GLU 2042CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1aue n ARG 2043N 0.53 -3.63 -3.99 3.49 1.74 -0.66 -4.92 116.66 109.22 1aue n ARG 2043Ca 0.09 0.43 -0.31 0.00 -0.77 0.00 0.00 57.85 57.28 1aue n ARG 2043Cb 0.35 -4.92 -0.15 0.00 -1.02 0.00 0.00 32.46 26.73 1aue n ARG 2043CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1aue s ASN 2044N -3.79 4.74 0.05 0.55 3.04 0.27 -4.93 114.94 114.87 1aue s ASN 2044Ca 0.39 -2.29 -0.18 0.00 0.04 0.00 0.00 52.86 50.82 1aue s ASN 2044Cb -0.21 -1.65 -0.14 0.00 -1.54 0.00 0.00 41.25 37.71 1aue s ASN 2044CO 0.89 -0.37 1.32 0.58 -3.04 0.00 0.00 177.10 176.48 1aue h VAL 2045N 6.42 1.35 -0.17 -5.21 2.07 -1.90 -2.76 116.25 116.04 1aue h VAL 2045Ca -0.05 -1.52 0.05 0.00 0.82 0.00 0.00 66.70 65.99 1aue h VAL 2045Cb 1.00 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.65 1aue h VAL 2045CO 0.56 0.46 -0.14 0.50 0.02 0.00 0.00 177.57 178.96 1aue h LYS 2046N 0.12 -0.15 -0.90 1.57 3.64 -1.98 -2.35 116.57 116.53 1aue h LYS 2046Ca 0.01 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1aue h LYS 2046Cb 0.87 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.66 1aue h LYS 2046CO 0.07 -0.10 0.55 0.78 -2.27 0.00 0.00 179.45 178.47 1aue h GLY 2047N -0.16 1.39 0.64 5.01 0.00 -1.96 -1.16 103.07 106.84 1aue h GLY 2047Ca 0.11 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.10 1aue h GLY 2047CO -0.27 0.21 0.01 1.98 0.00 0.00 0.00 176.54 178.47 1aue h MET 2048N 0.94 0.09 -0.13 4.80 1.85 -1.30 -1.51 114.93 119.67 1aue h MET 2048Ca 0.42 -0.01 -0.11 0.00 -0.61 0.00 0.00 59.70 59.39 1aue h MET 2048Cb 0.30 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.30 1aue h MET 2048CO -0.22 0.06 -0.41 0.74 -0.40 0.00 0.00 176.91 176.68 1aue h PHE 2049N 0.09 0.33 -0.59 1.39 -1.00 -1.29 -2.42 116.94 113.46 1aue h PHE 2049Ca 0.12 -0.09 -0.06 0.00 2.81 0.00 0.00 57.97 60.74 1aue h PHE 2049Cb 0.14 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 39.60 1aue h PHE 2049CO -0.19 0.65 0.11 0.93 -1.61 0.00 0.00 178.31 178.20 1aue h GLU 2050N 0.24 0.93 0.15 1.51 5.08 -0.99 -0.32 114.58 121.17 1aue h GLU 2050Ca 0.02 -0.21 -0.31 0.00 -1.00 0.00 0.00 59.36 57.86 1aue h GLU 2050Cb 0.82 -0.13 0.03 0.00 0.50 0.00 0.00 28.75 29.98 1aue h GLU 2050CO 0.07 0.85 -1.30 0.28 -1.00 0.00 0.00 179.01 177.91 1aue h VAL 2051N 0.88 1.29 -0.09 3.13 2.07 -1.28 -3.39 116.25 118.87 1aue h VAL 2051Ca 0.19 -2.53 -0.13 0.00 0.82 0.00 0.00 66.70 65.04 1aue h VAL 2051Cb 0.36 2.77 0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1aue h VAL 2051CO 0.00 0.77 -0.45 -0.07 0.02 0.00 0.00 177.57 177.84 1aue h LEU 2052N 0.24 0.54 -0.66 2.57 4.07 -1.43 -3.39 115.31 117.26 1aue h LEU 2052Ca -0.20 -0.65 0.03 0.00 0.08 0.00 0.00 57.88 57.14 1aue h LEU 2052Cb 1.97 -0.16 -0.04 0.00 1.08 0.00 0.00 40.66 43.51 1aue h LEU 2052CO 0.25 1.11 0.42 -0.08 -1.08 0.00 0.00 178.44 179.05 1aue h GLU 2053N 0.02 0.79 -0.34 1.13 4.81 -1.24 -1.44 114.58 118.30 1aue h GLU 2053Ca -0.03 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.22 1aue h GLU 2053Cb 1.10 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 1aue h GLU 2053CO 0.09 0.53 0.24 -1.00 -0.73 0.00 0.00 179.01 178.14 1aue h PRO 2054N 0.82 0.13 -0.00 0.92 0.13 -1.78 -0.28 132.00 131.94 1aue h PRO 2054Ca 0.26 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 65.25 1aue h PRO 2054Cb 0.01 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.09 1aue h PRO 2054CO -0.10 0.09 -0.66 -0.07 -0.23 0.00 0.00 178.00 177.03 1aue h LEU 2055N 0.13 0.02 -0.34 1.56 3.38 -1.48 -1.91 115.31 116.69 1aue h LEU 2055Ca 0.16 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 1aue h LEU 2055Cb 0.45 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1aue h LEU 2055CO -0.02 0.67 -0.83 0.45 0.09 0.00 0.00 178.44 178.80 1aue h HIS 2056N 0.01 0.33 0.01 1.13 3.86 -0.32 -3.29 115.15 116.88 1aue h HIS 2056Ca -0.01 -0.17 -0.00 0.00 -1.16 0.00 0.00 60.37 59.03 1aue h HIS 2056Cb 1.16 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.59 1aue h HIS 2056CO 0.00 0.96 -0.00 0.00 0.86 0.00 0.00 177.93 179.75 1aue h ALA 2057N 0.99 -0.01 -0.20 2.45 0.00 -0.72 -3.02 119.26 118.74 1aue h ALA 2057Ca -0.04 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1aue h ALA 2057Cb 1.44 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1aue h ALA 2057CO 0.13 -0.43 0.41 0.00 0.00 0.00 0.00 179.25 179.36 1aue h MET 2058N -0.17 0.00 -0.11 0.00 -0.00 -1.43 0.11 114.93 113.33 1aue h MET 2058Ca -0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 59.70 59.54 1aue h MET 2058Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.76 1aue h MET 2058CO 0.00 0.00 -0.63 0.52 -0.00 0.00 0.00 176.91 176.81 1aue h MET 2059N 0.00 0.40 -0.87 -0.10 2.86 -1.65 -3.28 114.93 112.29 1aue h MET 2059Ca 0.09 -0.28 0.17 0.00 -2.06 0.00 0.00 59.70 57.62 1aue h MET 2059Cb 0.90 0.04 -0.07 0.00 0.06 0.00 0.00 31.60 32.54 1aue h MET 2059CO -0.00 0.89 0.57 0.93 1.06 0.00 0.00 176.91 180.36 1aue h GLU 2060N 0.29 0.50 -0.71 1.72 5.08 -0.81 0.30 114.58 120.95 1aue h GLU 2060Ca -0.01 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1aue h GLU 2060Cb 1.16 -0.11 -0.12 0.00 0.50 0.00 0.00 28.75 30.18 1aue h GLU 2060CO 0.11 0.33 -0.44 -0.09 -1.00 0.00 0.00 179.01 177.92 1aue h ARG 2061N 0.51 -0.15 0.00 2.33 2.43 -1.72 -3.48 114.38 114.30 1aue h ARG 2061Ca 0.44 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 1aue h ARG 2061Cb 0.94 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1aue h ARG 2061CO -0.18 -0.10 0.00 0.41 -1.51 0.00 0.00 179.97 178.59 1aue n GLY 2062N -1.40 2.79 0.16 2.80 0.00 0.11 -4.99 105.19 104.66 1aue n GLY 2062Ca 0.04 -1.98 -0.05 0.00 0.00 0.00 0.00 46.02 44.02 1aue n GLY 2062CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aue h PRO 2063N 0.00 -0.24 0.00 1.61 0.13 -1.84 -3.47 132.00 128.20 1aue h PRO 2063Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1aue h PRO 2063Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1aue h PRO 2063CO 0.00 -0.16 0.00 1.04 -0.23 0.00 0.00 178.00 178.65 1aue n GLN 2064N -3.46 0.00 -4.46 0.86 6.02 -1.26 -4.42 117.38 110.67 1aue n GLN 2064Ca -0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.74 1aue n GLN 2064Cb 0.14 -2.80 -0.11 0.00 1.02 0.00 0.00 30.24 28.50 1aue n GLN 2064CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1aue s THR 2065N 0.00 1.44 0.17 5.09 -4.23 -1.26 -5.00 115.64 111.84 1aue s THR 2065Ca 0.00 -2.05 -0.17 0.00 -1.18 0.00 0.00 61.69 58.29 1aue s THR 2065Cb 0.00 -2.67 0.11 0.00 1.34 0.00 0.00 72.50 71.28 1aue s THR 2065CO 0.00 -0.13 1.66 -0.07 -0.54 0.00 0.00 174.62 175.54 1aue h LEU 2066N 2.15 -0.45 -0.24 4.79 4.07 -1.99 0.54 115.31 124.18 1aue h LEU 2066Ca -0.41 0.13 -0.21 0.00 0.08 0.00 0.00 57.88 57.47 1aue h LEU 2066Cb 1.24 0.28 0.00 0.00 1.08 0.00 0.00 40.66 43.26 1aue h LEU 2066CO 0.70 -0.16 -0.84 0.11 -1.08 0.00 0.00 178.44 177.17 1aue h LYS 2067N -0.02 0.51 0.00 1.13 1.57 -1.97 -1.64 116.57 116.15 1aue h LYS 2067Ca 0.20 -0.47 -0.05 0.00 -1.87 0.00 0.00 60.65 58.46 1aue h LYS 2067Cb 0.34 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1aue h LYS 2067CO -0.45 1.10 -0.24 0.93 -0.57 0.00 0.00 179.45 180.23 1aue h GLU 2068N 0.33 0.00 -0.02 3.15 5.08 -1.71 -0.03 114.58 121.37 1aue h GLU 2068Ca -0.06 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1aue h GLU 2068Cb 1.45 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.70 1aue h GLU 2068CO 0.15 0.24 -0.29 1.15 -1.00 0.00 0.00 179.01 179.26 1aue h THR 2069N 0.00 1.49 -0.18 1.13 2.02 -0.60 -1.23 112.91 115.54 1aue h THR 2069Ca -0.00 -1.86 -0.11 0.00 0.77 0.00 0.00 66.41 65.21 1aue h THR 2069Cb 0.57 2.59 -0.01 0.00 -1.74 0.00 0.00 68.15 69.55 1aue h THR 2069CO 0.03 0.52 -0.38 0.77 0.37 0.00 0.00 175.52 176.83 1aue h SER 2070N -0.35 0.42 -0.02 4.18 4.64 -1.23 -2.13 113.55 119.06 1aue h SER 2070Ca -0.03 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1aue h SER 2070Cb 1.00 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1aue h SER 2070CO 0.06 0.77 -0.01 0.15 -0.87 0.00 0.00 176.83 176.93 1aue h PHE 2071N 0.34 -0.01 -0.27 4.77 3.04 -0.91 -2.38 116.94 121.52 1aue h PHE 2071Ca 0.03 0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.02 1aue h PHE 2071Cb 0.82 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.31 1aue h PHE 2071CO 0.02 -0.01 0.06 -0.97 -2.02 0.00 0.00 178.31 175.39 1aue h ASN 2072N -0.00 0.03 -0.51 0.41 -0.73 -1.19 -0.39 115.58 113.20 1aue h ASN 2072Ca 0.01 0.04 0.06 0.00 1.87 0.00 0.00 56.30 58.27 1aue h ASN 2072Cb 0.02 0.05 -0.05 0.00 0.27 0.00 0.00 38.32 38.60 1aue h ASN 2072CO -0.02 0.05 0.23 -0.61 -0.37 0.00 0.00 177.43 176.71 1aue h GLN 2073N 0.16 0.43 0.24 6.67 4.15 -1.15 0.38 115.11 125.99 1aue h GLN 2073Ca 0.12 -0.03 -0.34 0.00 0.77 0.00 0.00 58.65 59.17 1aue h GLN 2073Cb 0.12 -0.10 0.03 0.00 0.21 0.00 0.00 27.48 27.74 1aue h GLN 2073CO -0.15 0.28 -1.55 0.00 -1.93 0.00 0.00 178.83 175.48 1aue h ALA 2074N 1.31 -0.09 -0.01 3.38 0.00 -1.21 -3.41 119.26 119.23 1aue h ALA 2074Ca 0.24 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1aue h ALA 2074Cb 0.20 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1aue h ALA 2074CO -0.20 0.78 -0.19 0.66 0.00 0.00 0.00 179.25 180.30 1aue n TYR 2075N -3.69 0.00 0.51 0.00 4.01 -0.18 -4.69 117.16 113.13 1aue n TYR 2075Ca -0.19 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.35 1aue n TYR 2075Cb 1.10 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 40.03 1aue n TYR 2075CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1aue h GLY 2076N 1.82 -1.37 0.54 2.72 0.00 -0.33 0.10 103.07 106.55 1aue h GLY 2076Ca 0.00 0.51 0.15 0.00 0.00 0.00 0.00 47.33 47.99 1aue h GLY 2076CO 0.00 -0.50 0.56 0.07 0.00 0.00 0.00 176.54 176.67 1aue h ARG 2077N -1.35 0.58 -0.25 4.80 0.11 -1.86 -0.83 114.38 115.59 1aue h ARG 2077Ca -0.13 -0.04 -0.10 0.00 0.10 0.00 0.00 59.98 59.81 1aue h ARG 2077Cb 1.00 -0.13 -0.00 0.00 1.11 0.00 0.00 29.97 31.95 1aue h ARG 2077CO 0.22 0.39 -0.22 -0.44 0.10 0.00 0.00 179.97 180.01 1aue h ASP 2078N 0.60 0.63 0.46 0.08 5.19 -1.77 -1.90 116.42 119.70 1aue h ASP 2078Ca 0.43 -0.46 -0.22 0.00 -0.62 0.00 0.00 57.03 56.16 1aue h ASP 2078Cb 0.79 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 40.13 1aue h ASP 2078CO -0.19 0.96 -0.94 -0.07 -3.12 0.00 0.00 179.24 175.89 1aue h LEU 2079N 0.30 0.41 -0.53 1.55 3.38 -0.43 -1.70 115.31 118.30 1aue h LEU 2079Ca 0.04 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1aue h LEU 2079Cb 0.77 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1aue h LEU 2079CO 0.06 1.15 0.34 0.24 0.09 0.00 0.00 178.44 180.31 1aue h MET 2080N 0.17 0.66 -0.42 1.13 2.86 -1.20 -2.06 114.93 116.07 1aue h MET 2080Ca -0.07 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.43 1aue h MET 2080Cb 1.58 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 33.08 1aue h MET 2080CO 0.15 0.44 -0.15 1.49 1.06 0.00 0.00 176.91 179.90 1aue h GLU 2081N 0.68 0.79 0.05 1.72 4.81 -1.20 -2.39 114.58 119.04 1aue h GLU 2081Ca 0.20 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1aue h GLU 2081Cb -0.04 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1aue h GLU 2081CO -0.06 0.89 -0.02 0.00 -0.73 0.00 0.00 179.01 179.09 1aue h ALA 2082N 1.12 -0.06 -0.89 2.92 0.00 -1.17 -2.25 119.26 118.93 1aue h ALA 2082Ca 0.11 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1aue h ALA 2082Cb 0.65 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1aue h ALA 2082CO 0.05 -0.52 0.58 0.37 0.00 0.00 0.00 179.25 179.73 1aue h GLN 2083N -0.10 0.97 -0.09 0.00 4.15 -1.31 -1.25 115.11 117.48 1aue h GLN 2083Ca -0.01 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.27 1aue h GLN 2083Cb 0.08 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 1aue h GLN 2083CO 0.01 0.64 -0.33 1.49 -1.93 0.00 0.00 178.83 178.72 1aue h GLU 2084N 1.00 0.18 -0.23 1.69 4.22 -0.91 0.12 114.58 120.65 1aue h GLU 2084Ca 0.38 -0.07 -0.13 0.00 0.08 0.00 0.00 59.36 59.62 1aue h GLU 2084Cb 0.21 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1aue h GLU 2084CO -0.14 0.49 -0.42 -1.49 -2.18 0.00 0.00 179.01 175.26 1aue h TRP 2085N 0.16 0.65 -0.84 0.92 4.06 -0.70 0.34 115.95 120.54 1aue h TRP 2085Ca 0.02 -0.19 -0.00 0.00 2.06 0.00 0.00 58.89 60.78 1aue h TRP 2085Cb 0.66 -0.14 -0.04 0.00 -1.00 0.00 0.00 29.16 28.64 1aue h TRP 2085CO 0.01 0.88 0.52 0.00 -3.56 0.00 0.00 178.44 176.28 1aue h ARG 2087N 1.15 0.00 -0.43 0.00 -0.00 -0.74 -3.03 114.38 111.33 1aue h ARG 2087Ca 0.30 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.65 1aue h ARG 2087Cb -0.08 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 29.88 1aue h ARG 2087CO -0.06 0.46 -0.27 0.87 0.00 0.00 0.00 179.97 180.97 1aue h LYS 2088N 0.00 0.91 -0.42 0.04 1.57 0.00 -3.14 116.57 115.54 1aue h LYS 2088Ca -0.02 -0.41 0.08 0.00 -1.87 0.00 0.00 60.65 58.43 1aue h LYS 2088Cb 1.38 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.60 1aue h LYS 2088CO 0.06 1.06 -0.00 -0.92 -0.57 0.00 0.00 179.45 179.08 1aue h TYR 2089N 0.78 -0.03 0.00 -1.35 3.20 -0.99 -1.62 116.97 116.97 1aue h TYR 2089Ca 0.09 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1aue h TYR 2089Cb 0.83 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 1aue h TYR 2089CO 0.05 -0.09 -0.04 0.52 -1.64 0.00 0.00 178.16 176.96 1aue h MET 2090N 0.11 0.00 0.00 1.82 2.86 -1.48 0.29 114.93 118.53 1aue h MET 2090Ca 0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1aue h MET 2090Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 1aue h MET 2090CO -0.34 0.04 -1.02 1.63 1.06 0.00 0.00 176.91 178.28 1aue n LYS 2091N -3.65 0.49 -0.00 1.72 4.76 -1.00 -4.60 118.16 115.89 1aue n LYS 2091Ca -0.02 0.07 0.03 0.00 -2.87 0.00 0.00 58.31 55.51 1aue n LYS 2091Cb 0.14 -1.73 -0.04 0.00 -1.84 0.00 0.00 35.03 31.56 1aue n LYS 2091CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1aue n SER 2092N -2.41 2.20 -2.05 4.39 3.41 -0.27 -5.01 113.62 113.88 1aue n SER 2092Ca 0.01 -0.27 -0.17 0.00 -0.26 0.00 0.00 58.87 58.17 1aue n SER 2092Cb 0.51 1.17 -0.04 0.00 -0.26 0.00 0.00 64.21 65.59 1aue n SER 2092CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aue n GLY 2093N 1.73 0.37 3.07 5.00 0.00 0.87 -4.94 105.19 111.29 1aue n GLY 2093Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1aue n GLY 2093CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1aue s ASN 2094N -2.22 4.16 0.58 1.61 2.47 -1.26 -5.01 114.94 115.27 1aue s ASN 2094Ca 0.00 -1.24 0.30 0.00 0.42 0.00 0.00 52.86 52.33 1aue s ASN 2094Cb 0.00 -1.51 1.45 0.00 -1.45 0.00 0.00 41.25 39.73 1aue s ASN 2094CO 0.00 -0.16 1.85 0.58 -3.72 0.00 0.00 177.10 175.66 1aue h VAL 2095N 6.61 0.39 -1.11 -5.21 2.07 -1.95 -0.54 116.25 116.51 1aue h VAL 2095Ca -0.24 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.59 1aue h VAL 2095Cb 1.06 0.55 -0.10 0.00 -1.52 0.00 0.00 31.29 31.28 1aue h VAL 2095CO 0.49 0.00 0.71 0.11 0.02 0.00 0.00 177.57 178.90 1aue h LYS 2096N 0.00 0.30 -0.62 1.57 6.56 -1.99 0.20 116.57 122.60 1aue h LYS 2096Ca 0.30 -0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 59.80 1aue h LYS 2096Cb 1.47 -0.07 -0.03 0.00 -0.57 0.00 0.00 32.23 33.03 1aue h LYS 2096CO -0.00 0.20 0.11 -0.44 -2.06 0.00 0.00 179.45 177.26 1aue h ASP 2097N 0.31 0.94 0.83 0.86 3.32 -1.41 -1.55 116.42 119.72 1aue h ASP 2097Ca 0.66 -0.21 -0.16 0.00 0.02 0.00 0.00 57.03 57.34 1aue h ASP 2097Cb 1.79 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 41.07 1aue h ASP 2097CO -0.34 0.94 -0.77 -0.07 -1.72 0.00 0.00 179.24 177.27 1aue h LEU 2098N 0.94 0.00 -1.01 1.55 4.07 -0.86 -1.82 115.31 118.18 1aue h LEU 2098Ca 0.19 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 58.06 1aue h LEU 2098Cb 0.39 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 1aue h LEU 2098CO 0.01 0.77 -0.28 0.74 -1.08 0.00 0.00 178.44 178.61 1aue h THR 2099N 0.00 1.26 -0.24 0.22 2.02 -0.58 -1.59 112.91 113.99 1aue h THR 2099Ca -0.01 -1.26 -0.20 0.00 0.77 0.00 0.00 66.41 65.72 1aue h THR 2099Cb 1.40 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 1aue h THR 2099CO 0.10 0.39 -0.62 1.56 0.37 0.00 0.00 175.52 177.33 1aue h GLN 2100N 0.33 0.83 -0.52 6.66 1.08 -0.97 -2.90 115.11 119.63 1aue h GLN 2100Ca 0.05 -0.57 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 1aue h GLN 2100Cb 0.66 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 28.15 1aue h GLN 2100CO 0.05 1.19 0.33 0.00 -0.95 0.00 0.00 178.83 179.45 1aue h ALA 2101N 0.68 0.66 0.00 3.87 0.00 -0.98 -2.68 119.26 120.80 1aue h ALA 2101Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1aue h ALA 2101Cb 1.23 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1aue h ALA 2101CO 0.13 0.12 -0.08 -1.49 0.00 0.00 0.00 179.25 177.94 1aue h TRP 2102N 0.70 0.00 -0.37 0.00 4.06 -1.28 -0.05 115.95 119.01 1aue h TRP 2102Ca 0.19 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.07 1aue h TRP 2102Cb -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.10 1aue h TRP 2102CO -0.03 0.08 -0.03 -0.44 -3.56 0.00 0.00 178.44 174.46 1aue h ASP 2103N 0.00 0.66 -0.15 -3.49 3.32 -1.26 -0.60 116.42 114.90 1aue h ASP 2103Ca -0.00 -0.33 -0.13 0.00 0.02 0.00 0.00 57.03 56.59 1aue h ASP 2103Cb 0.60 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1aue h ASP 2103CO 0.01 0.83 -0.35 -0.07 -1.72 0.00 0.00 179.24 177.94 1aue h LEU 2104N 0.47 0.69 -0.11 1.55 3.38 -1.48 -1.23 115.31 118.59 1aue h LEU 2104Ca 0.10 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1aue h LEU 2104Cb 0.51 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1aue h LEU 2104CO 0.02 0.98 -0.09 1.88 0.09 0.00 0.00 178.44 181.32 1aue h TYR 2105N 0.55 0.31 -0.05 1.13 0.05 -0.57 -2.12 116.97 116.27 1aue h TYR 2105Ca 0.06 -0.09 -0.09 0.00 0.05 0.00 0.00 58.73 58.66 1aue h TYR 2105Cb 0.86 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.53 1aue h TYR 2105CO 0.04 0.66 -0.36 -0.92 -1.05 0.00 0.00 178.16 176.52 1aue h TYR 2106N -0.13 0.12 -0.74 4.88 3.20 -1.16 -1.73 116.97 121.42 1aue h TYR 2106Ca 0.02 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 1aue h TYR 2106Cb 0.60 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 1aue h TYR 2106CO 0.08 0.46 0.28 1.25 -1.64 0.00 0.00 178.16 178.59 1aue h HIS 2107N 0.09 1.14 -0.01 -3.82 2.76 -0.85 -1.33 115.15 113.13 1aue h HIS 2107Ca 0.01 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.08 1aue h HIS 2107Cb 0.69 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.31 1aue h HIS 2107CO 0.01 0.88 0.00 0.28 -1.30 0.00 0.00 177.93 177.80 1aue h VAL 2108N 1.07 1.20 -0.84 5.26 2.07 -0.98 -3.11 116.25 120.92 1aue h VAL 2108Ca 0.24 -0.61 0.13 0.00 0.82 0.00 0.00 66.70 67.29 1aue h VAL 2108Cb 0.24 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 31.52 1aue h VAL 2108CO -0.02 0.16 0.44 0.15 0.02 0.00 0.00 177.57 178.33 1aue h PHE 2109N -0.24 0.79 -0.11 1.57 3.57 -1.19 0.18 116.94 121.51 1aue h PHE 2109Ca 0.00 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1aue h PHE 2109Cb 0.26 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1aue h PHE 2109CO 0.01 0.22 -0.03 0.00 -2.23 0.00 0.00 178.31 176.28 1aue h ARG 2110N 0.66 -0.01 -0.45 1.11 3.08 -1.28 -2.91 114.38 114.58 1aue h ARG 2110Ca 0.45 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.41 1aue h ARG 2110Cb 0.59 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 1aue h ARG 2110CO -0.34 -0.01 -0.07 0.00 -1.07 0.00 0.00 179.97 178.49 1aue h ARG 2111N -0.01 0.79 -0.03 0.04 3.08 -1.28 -2.41 114.38 114.56 1aue h ARG 2111Ca 0.06 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1aue h ARG 2111Cb 0.09 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1aue h ARG 2111CO -0.12 0.84 0.00 -0.89 -1.07 0.00 0.00 179.97 178.73 1aue n ILE 2112N -4.18 0.00 -1.83 2.04 5.41 0.56 -2.84 119.36 118.52 1aue n ILE 2112Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.78 1aue n ILE 2112Cb 0.34 -0.20 0.02 0.00 -0.71 0.00 0.00 39.64 39.09 1aue n ILE 2112CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1aue n SER 2113N -0.46 0.28 0.00 4.38 7.64 -0.91 -5.02 113.62 119.53 1aue n SER 2113Ca 0.00 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.80 1aue n SER 2113Cb 0.01 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1aue n SER 2113CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20