#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s14 n PRO 2018N 0.00 0.04 -0.09 3.49 -0.04 -1.26 -3.69 135.00 133.44 1s14 n PRO 2018Ca 0.00 0.02 -0.13 0.00 -0.04 0.00 0.00 63.50 63.35 1s14 n PRO 2018Cb 0.00 -1.54 -0.04 0.00 -0.04 0.00 0.00 33.50 31.88 1s14 n PRO 2018CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1s14 h VAL 2019N 0.00 1.30 0.00 0.52 2.07 -1.97 -2.61 116.25 115.56 1s14 h VAL 2019Ca 0.00 -1.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 1s14 h VAL 2019Cb 0.53 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1s14 h VAL 2019CO 0.00 0.45 -0.06 0.03 0.02 0.00 0.00 177.57 178.01 1s14 h ARG 2020N 0.41 0.00 -0.23 1.57 3.08 -1.85 0.10 114.38 117.47 1s14 h ARG 2020Ca 0.05 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.95 1s14 h ARG 2020Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1s14 h ARG 2020CO 0.07 0.06 -0.41 -0.09 -1.07 0.00 0.00 179.97 178.53 1s14 h ARG 2021N 0.00 0.68 -1.93 0.04 9.65 -1.58 -3.38 114.38 117.86 1s14 h ARG 2021Ca -0.00 -0.43 -0.54 0.00 -1.10 0.00 0.00 59.98 57.91 1s14 h ARG 2021Cb 0.34 0.05 -0.38 0.00 -1.39 0.00 0.00 29.97 28.59 1s14 h ARG 2021CO 0.01 1.05 -1.10 2.89 2.80 0.00 0.00 179.97 185.62 1s14 n ARG 2022N -4.20 0.75 -0.32 0.20 0.00 -1.01 -4.99 116.66 107.09 1s14 n ARG 2022Ca -0.05 -3.19 0.13 0.00 -0.00 0.00 0.00 57.85 54.74 1s14 n ARG 2022Cb 0.55 -1.28 0.31 0.00 -0.00 0.00 0.00 32.46 32.04 1s14 n ARG 2022CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1s14 h PRO 2023N 3.87 0.49 0.00 2.89 0.13 -1.18 0.26 132.00 138.47 1s14 h PRO 2023Ca 0.07 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1s14 h PRO 2023Cb 0.90 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1s14 h PRO 2023CO 0.46 0.33 0.21 0.41 -0.23 0.00 0.00 178.00 179.18 1s14 n GLY 2024N -1.33 -0.45 0.07 1.56 0.00 -1.26 0.53 105.19 104.31 1s14 n GLY 2024Ca 0.22 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.41 1s14 n GLY 2024CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1s14 h MET 2025N 0.00 0.00 0.00 1.61 2.86 -1.29 -3.37 114.93 114.74 1s14 h MET 2025Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1s14 h MET 2025Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1s14 h MET 2025CO 0.00 0.00 -0.24 0.66 1.06 0.00 0.00 176.91 178.39 1s14 n TYR 2026N -2.18 0.00 -3.88 -0.22 4.01 0.19 -5.08 117.16 109.99 1s14 n TYR 2026Ca 0.03 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.69 1s14 n TYR 2026Cb 0.45 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.46 1s14 n TYR 2026CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1s14 s THR 2027N -1.31 0.00 -0.33 -0.72 -1.32 -0.63 -5.06 115.64 106.27 1s14 s THR 2027Ca 0.00 -1.10 -0.25 0.00 -1.21 0.00 0.00 61.69 59.14 1s14 s THR 2027Cb 0.01 -2.27 0.01 0.00 -1.51 0.00 0.00 72.50 68.74 1s14 s THR 2027CO 0.06 0.00 0.88 -0.62 -2.21 0.00 0.00 174.62 172.74 1s14 s ASP 2028N -2.99 6.71 0.00 8.08 -1.08 -1.26 -4.24 116.67 121.90 1s14 s ASP 2028Ca 0.15 0.69 0.31 0.00 -0.52 0.00 0.00 52.55 53.18 1s14 s ASP 2028Cb -0.05 -2.45 1.75 0.00 -1.46 0.00 0.00 42.92 40.71 1s14 s ASP 2028CO 0.09 -0.75 2.16 0.35 0.52 0.00 0.00 175.17 177.54 1s14 n THR 2029N 5.74 0.00 -0.31 1.71 -2.24 -1.26 -3.73 114.28 114.20 1s14 n THR 2029Ca 0.06 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.83 1s14 n THR 2029Cb 0.48 -0.50 0.11 0.00 -2.10 0.00 0.00 70.33 68.32 1s14 n THR 2029CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1s14 h THR 2030N 0.00 1.13 -2.48 4.28 2.02 -1.91 0.16 112.91 116.11 1s14 h THR 2030Ca 0.00 -0.36 0.13 0.00 0.77 0.00 0.00 66.41 66.95 1s14 h THR 2030Cb 0.12 -0.02 -0.10 0.00 -1.74 0.00 0.00 68.15 66.41 1s14 h THR 2030CO 0.00 0.19 0.43 0.00 0.37 0.00 0.00 175.52 176.51 1s14 s ARG 2031N -6.10 1.20 0.00 6.66 1.70 -1.24 -2.54 118.95 118.63 1s14 s ARG 2031Ca -0.13 -0.61 0.15 0.00 -0.47 0.00 0.00 55.73 54.67 1s14 s ARG 2031Cb 0.17 0.45 0.90 0.00 -0.57 0.00 0.00 34.95 35.90 1s14 s ARG 2031CO 0.79 -0.54 1.33 -0.35 -1.08 0.00 0.00 175.30 175.44 1s14 n PRO 2032N -0.41 0.57 -0.19 3.89 -0.04 -1.26 -4.17 135.00 133.39 1s14 n PRO 2032Ca -0.07 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1s14 n PRO 2032Cb 0.61 -1.41 0.10 0.00 -0.04 0.00 0.00 33.50 32.76 1s14 n PRO 2032CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1s14 h ASN 2033N 0.00 0.03 -0.46 3.54 2.35 -1.88 -1.04 115.58 118.11 1s14 h ASN 2033Ca 0.00 0.10 0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1s14 h ASN 2033Cb 0.00 0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 1s14 h ASN 2033CO 0.00 0.03 0.30 -0.74 -1.65 0.00 0.00 177.43 175.37 1s14 h HIS 2034N 0.27 0.55 -0.00 1.19 2.76 -1.86 -0.04 115.15 118.02 1s14 h HIS 2034Ca 0.30 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.48 1s14 h HIS 2034Cb 0.42 -0.19 -0.00 0.00 1.55 0.00 0.00 27.41 29.20 1s14 h HIS 2034CO -0.23 0.34 0.00 -0.07 -1.30 0.00 0.00 177.93 176.67 1s14 h LEU 2035N 0.59 0.00 -1.10 0.26 4.07 -1.51 -2.31 115.31 115.32 1s14 h LEU 2035Ca 0.17 -0.19 0.07 0.00 0.08 0.00 0.00 57.88 58.01 1s14 h LEU 2035Cb -0.03 -0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.65 1s14 h LEU 2035CO -0.04 0.19 0.61 1.23 -1.08 0.00 0.00 178.44 179.35 1s14 h GLY 2036N -0.18 1.40 2.00 0.83 0.00 -0.59 -1.96 103.07 104.56 1s14 h GLY 2036Ca 0.00 -0.44 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1s14 h GLY 2036CO -0.00 0.31 -0.35 1.46 0.00 0.00 0.00 176.54 177.96 1s14 h GLN 2037N 1.08 0.00 -0.40 4.80 1.08 -0.81 0.57 115.11 121.44 1s14 h GLN 2037Ca 0.41 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.50 1s14 h GLN 2037Cb 0.19 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 1s14 h GLN 2037CO -0.16 0.35 -0.17 0.93 -0.95 0.00 0.00 178.83 178.84 1s14 h GLU 2038N 0.00 0.82 -0.38 1.46 5.08 -0.80 0.30 114.58 121.06 1s14 h GLU 2038Ca -0.00 -0.35 -0.09 0.00 -1.00 0.00 0.00 59.36 57.92 1s14 h GLU 2038Cb 0.62 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1s14 h GLU 2038CO 0.05 0.97 -0.12 0.28 -1.00 0.00 0.00 179.01 179.19 1s14 h VAL 2039N 0.62 1.28 -0.89 3.13 2.07 -1.11 -2.79 116.25 118.56 1s14 h VAL 2039Ca 0.09 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.42 1s14 h VAL 2039Cb 0.72 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.71 1s14 h VAL 2039CO 0.05 0.41 0.58 0.40 0.02 0.00 0.00 177.57 179.03 1s14 h ILE 2040N 0.56 1.17 -0.61 4.57 2.04 -0.76 -2.36 117.51 122.11 1s14 h ILE 2040Ca 0.09 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1s14 h ILE 2040Cb 0.65 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1s14 h ILE 2040CO 0.04 0.21 0.31 0.44 0.00 0.00 0.00 178.15 179.15 1s14 h ASP 2041N 1.14 0.77 -0.36 1.72 3.32 -0.73 -1.44 116.42 120.84 1s14 h ASP 2041Ca 0.35 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.30 1s14 h ASP 2041Cb -0.03 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1s14 h ASP 2041CO -0.11 0.65 0.13 0.78 -1.72 0.00 0.00 179.24 178.97 1s14 h ASN 2042N 0.86 0.56 0.04 6.45 2.35 -1.17 -1.29 115.58 123.38 1s14 h ASN 2042Ca 0.22 -0.07 -0.19 0.00 -0.55 0.00 0.00 56.30 55.71 1s14 h ASN 2042Cb 0.07 -0.14 0.02 0.00 0.05 0.00 0.00 38.32 38.31 1s14 h ASN 2042CO -0.03 0.54 -0.77 0.28 -1.65 0.00 0.00 177.43 175.80 1s14 h SER 2043N 0.60 0.60 0.42 5.81 0.02 -1.25 -3.22 113.55 116.53 1s14 h SER 2043Ca 0.14 -0.80 -0.02 0.00 -0.84 0.00 0.00 61.79 60.27 1s14 h SER 2043Cb 0.18 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1s14 h SER 2043CO -0.01 1.34 -0.10 0.58 -1.14 0.00 0.00 176.83 177.49 1s14 h VAL 2044N -0.06 0.47 -0.57 2.27 2.07 -1.11 -0.88 116.25 118.44 1s14 h VAL 2044Ca -0.11 -0.51 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 1s14 h VAL 2044Cb 1.49 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1s14 h VAL 2044CO 0.15 0.10 0.05 0.44 0.02 0.00 0.00 177.57 178.34 1s14 h ASP 2045N 0.00 0.90 -0.65 0.57 3.32 -1.25 0.43 116.42 119.74 1s14 h ASP 2045Ca -0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 1s14 h ASP 2045Cb 0.34 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1s14 h ASP 2045CO 0.01 0.92 0.09 -0.33 -1.72 0.00 0.00 179.24 178.22 1s14 h GLU 2046N 0.88 1.09 -0.12 3.56 4.39 -1.20 0.04 114.58 123.22 1s14 h GLU 2046Ca 0.17 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.56 1s14 h GLU 2046Cb 0.44 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1s14 h GLU 2046CO 0.02 1.01 0.00 0.00 -1.16 0.00 0.00 179.01 178.88 1s14 h ALA 2047N 1.07 0.16 -1.00 3.43 0.00 -1.07 0.23 119.26 122.09 1s14 h ALA 2047Ca 0.20 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1s14 h ALA 2047Cb 0.46 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1s14 h ALA 2047CO 0.02 -0.15 0.65 -0.07 0.00 0.00 0.00 179.25 179.69 1s14 h LEU 2048N -0.05 1.05 0.00 0.00 3.38 0.02 0.15 115.31 119.87 1s14 h LEU 2048Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1s14 h LEU 2048Cb 0.35 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1s14 h LEU 2048CO 0.01 0.69 0.00 0.00 0.09 0.00 0.00 178.44 179.23 1s14 n ALA 2049N -2.37 2.35 -1.73 1.53 0.00 -0.02 -4.87 120.51 115.41 1s14 n ALA 2049Ca 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1s14 n ALA 2049Cb 0.15 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.22 1s14 n ALA 2049CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s14 n GLY 2050N 0.46 0.37 0.05 0.00 0.00 0.53 -4.95 105.19 101.64 1s14 n GLY 2050Ca 0.17 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 45.24 1s14 n GLY 2050CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1s14 n HIS 2051N -3.69 0.00 -4.24 1.61 8.25 0.76 -5.00 115.22 112.90 1s14 n HIS 2051Ca -0.01 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.13 1s14 n HIS 2051Cb 0.37 -0.47 -0.09 0.00 1.12 0.00 0.00 29.99 30.93 1s14 n HIS 2051CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s14 s ALA 2052N -2.23 3.27 -0.02 -1.41 0.00 -1.00 -4.43 121.76 115.93 1s14 s ALA 2052Ca -0.06 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1s14 s ALA 2052Cb 0.03 -1.28 -0.02 0.00 0.00 0.00 0.00 23.12 21.85 1s14 s ALA 2052CO 0.37 0.66 0.04 1.63 0.00 0.00 0.00 175.76 178.47 1s14 n LYS 2053N 1.12 2.64 -3.81 0.00 5.02 -1.26 -4.19 118.16 117.68 1s14 n LYS 2053Ca -0.13 -0.01 -0.14 0.00 -2.02 0.00 0.00 58.31 56.01 1s14 n LYS 2053Cb 0.52 -0.84 -0.15 0.00 -0.02 0.00 0.00 35.03 34.54 1s14 n LYS 2053CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1s14 s ARG 2054N -1.70 -0.01 -0.15 1.97 3.52 -1.26 -0.59 118.95 120.73 1s14 s ARG 2054Ca -0.00 0.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.72 1s14 s ARG 2054Cb 0.01 -0.13 0.03 0.00 -1.56 0.00 0.00 34.95 33.29 1s14 s ARG 2054CO 0.05 -0.09 -0.11 0.08 -0.81 0.00 0.00 175.30 174.42 1s14 s VAL 2055N 0.61 1.39 -0.11 7.11 1.01 -0.48 -2.75 120.40 127.18 1s14 s VAL 2055Ca -0.05 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1s14 s VAL 2055Cb -0.07 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1s14 s VAL 2055CO -0.02 0.37 -0.05 -1.81 0.00 0.00 0.00 175.10 173.59 1s14 s ASP 2056N 1.55 4.75 -0.10 3.32 -0.00 0.21 -1.86 116.67 124.55 1s14 s ASP 2056Ca 0.04 -0.07 0.03 0.00 -0.00 0.00 0.00 52.55 52.55 1s14 s ASP 2056Cb -0.13 -1.51 0.01 0.00 -0.00 0.00 0.00 42.92 41.28 1s14 s ASP 2056CO -0.09 0.27 -0.20 -0.69 -0.00 0.00 0.00 175.17 174.46 1s14 s VAL 2057N -0.23 1.75 -0.09 -1.27 1.01 -0.20 0.36 120.40 121.72 1s14 s VAL 2057Ca 0.04 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1s14 s VAL 2057Cb -0.13 -1.54 0.01 0.00 0.00 0.00 0.00 36.38 34.73 1s14 s VAL 2057CO 0.02 0.49 -0.14 -0.63 0.00 0.00 0.00 175.10 174.85 1s14 s ILE 2058N 0.58 1.34 -0.53 2.22 1.01 0.40 -0.73 121.20 125.49 1s14 s ILE 2058Ca -0.15 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.79 1s14 s ILE 2058Cb -0.17 -1.24 0.13 0.00 0.01 0.00 0.00 42.46 41.19 1s14 s ILE 2058CO 0.05 0.41 0.48 -0.22 0.00 0.00 0.00 174.94 175.65 1s14 s LEU 2059N 0.93 6.10 0.79 2.97 2.96 -0.18 -0.81 118.68 131.45 1s14 s LEU 2059Ca -0.08 -1.78 -0.12 0.00 -0.22 0.00 0.00 54.13 51.93 1s14 s LEU 2059Cb -0.15 -2.19 0.07 0.00 0.50 0.00 0.00 46.19 44.42 1s14 s LEU 2059CO -0.00 -0.83 1.12 -1.00 -1.32 0.00 0.00 176.35 174.32 1s14 s HIS 2060N 1.58 2.26 0.54 5.38 3.76 -0.37 -1.11 115.29 127.33 1s14 s HIS 2060Ca 0.03 1.63 0.27 0.00 -0.15 0.00 0.00 55.06 56.84 1s14 s HIS 2060Cb -0.29 -3.19 1.43 0.00 1.11 0.00 0.00 32.58 31.64 1s14 s HIS 2060CO 0.03 -2.15 1.98 0.00 -0.85 0.00 0.00 174.74 173.75 1s14 h ALA 2061N -1.07 2.47 -0.37 -1.40 0.00 -1.87 -1.27 119.26 115.75 1s14 h ALA 2061Ca -0.44 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1s14 h ALA 2061Cb 1.25 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1s14 h ALA 2061CO 0.49 -0.70 0.01 -0.40 0.00 0.00 0.00 179.25 178.65 1s14 n ASP 2062N -4.25 3.98 -1.21 0.00 5.68 -1.26 -4.88 116.55 114.61 1s14 n ASP 2062Ca 0.10 -2.60 -0.13 0.00 -0.50 0.00 0.00 54.79 51.66 1s14 n ASP 2062Cb 0.64 -0.62 -0.03 0.00 -1.14 0.00 0.00 41.12 39.97 1s14 n ASP 2062CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s14 n GLN 2063N 0.37 -0.96 -3.47 0.11 1.13 -0.48 -5.02 117.38 109.05 1s14 n GLN 2063Ca 0.18 0.82 -0.24 0.00 -1.94 0.00 0.00 57.00 55.82 1s14 n GLN 2063Cb 0.86 -4.94 -0.02 0.00 0.11 0.00 0.00 30.24 26.25 1s14 n GLN 2063CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1s14 s SER 2064N -2.67 6.31 -0.07 1.08 1.04 -1.25 -4.69 113.70 113.46 1s14 s SER 2064Ca 0.00 0.42 0.04 0.00 0.48 0.00 0.00 55.95 56.88 1s14 s SER 2064Cb 0.00 -2.02 0.00 0.00 0.10 0.00 0.00 66.02 64.11 1s14 s SER 2064CO 0.00 -0.24 -0.19 -0.22 0.98 0.00 0.00 173.24 173.57 1s14 s LEU 2065N -4.14 1.92 -0.08 2.42 2.96 -0.47 -1.24 118.68 120.05 1s14 s LEU 2065Ca 0.39 -0.44 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1s14 s LEU 2065Cb -0.10 -1.14 -0.01 0.00 0.50 0.00 0.00 46.19 45.43 1s14 s LEU 2065CO 0.34 0.13 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.61 1s14 s GLU 2066N 0.33 2.78 -0.17 1.98 2.12 0.01 -1.36 118.70 124.39 1s14 s GLU 2066Ca -0.13 -0.80 0.01 0.00 0.36 0.00 0.00 54.97 54.40 1s14 s GLU 2066Cb -0.16 -2.34 0.03 0.00 0.26 0.00 0.00 34.13 31.93 1s14 s GLU 2066CO 0.06 0.38 -0.12 0.08 -0.54 0.00 0.00 175.26 175.12 1s14 s VAL 2067N -0.14 1.59 -0.05 3.70 1.01 0.74 -0.45 120.40 126.79 1s14 s VAL 2067Ca -0.03 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.20 1s14 s VAL 2067Cb -0.14 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1s14 s VAL 2067CO 0.04 0.31 -0.21 -0.63 0.00 0.00 0.00 175.10 174.61 1s14 s ILE 2068N 1.45 2.47 0.16 2.22 1.01 0.16 -0.94 121.20 127.72 1s14 s ILE 2068Ca 0.02 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.77 1s14 s ILE 2068Cb -0.14 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.36 1s14 s ILE 2068CO -0.09 0.58 -0.04 1.51 0.00 0.00 0.00 174.94 176.89 1s14 s ASP 2069N -0.41 1.43 -0.46 3.58 1.47 -0.28 0.67 116.67 122.66 1s14 s ASP 2069Ca 0.04 -1.10 0.03 0.00 1.18 0.00 0.00 52.55 52.70 1s14 s ASP 2069Cb -0.12 0.07 0.47 0.00 -0.34 0.00 0.00 42.92 42.99 1s14 s ASP 2069CO 0.02 -0.48 1.60 -0.90 0.68 0.00 0.00 175.17 176.09 1s14 n ASP 2070N -0.21 5.88 -3.21 2.11 5.75 -1.11 -2.37 116.55 123.39 1s14 n ASP 2070Ca -0.09 -3.77 0.00 0.00 -0.01 0.00 0.00 54.79 50.93 1s14 n ASP 2070Cb 0.62 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 1s14 n ASP 2070CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s14 n GLY 2071N -0.85 -0.08 0.21 6.12 0.00 -1.23 -4.37 105.19 104.98 1s14 n GLY 2071Ca 0.52 -1.37 0.10 0.00 0.00 0.00 0.00 46.02 45.27 1s14 n GLY 2071CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1s14 h ARG 2072N 0.00 0.00 -0.23 1.61 3.08 -1.84 -3.05 114.38 113.95 1s14 h ARG 2072Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1s14 h ARG 2072Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1s14 h ARG 2072CO 0.00 0.09 0.00 0.41 -1.07 0.00 0.00 179.97 179.40 1s14 n GLY 2073N 1.12 -1.24 3.67 0.04 0.00 -1.26 -4.39 105.19 103.13 1s14 n GLY 2073Ca 0.04 -1.08 -0.49 0.00 0.00 0.00 0.00 46.02 44.49 1s14 n GLY 2073CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s14 n MET 2074N 1.16 2.03 -1.51 1.61 0.00 -1.26 -4.86 117.12 114.29 1s14 n MET 2074Ca 0.00 0.74 -0.48 0.00 0.00 0.00 0.00 57.70 57.96 1s14 n MET 2074Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 33.22 30.59 1s14 n MET 2074CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1s14 n PRO 2075N 6.66 0.72 0.00 0.03 -0.02 -1.26 -4.75 135.00 136.39 1s14 n PRO 2075Ca 0.24 0.26 0.01 0.00 -2.02 0.00 0.00 63.50 61.99 1s14 n PRO 2075Cb 0.28 -1.54 -0.01 0.00 -0.02 0.00 0.00 33.50 32.21 1s14 n PRO 2075CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1s14 n VAL 2076N 0.58 0.00 -1.32 -1.45 0.24 -1.26 -1.11 118.33 114.01 1s14 n VAL 2076Ca 0.15 -0.44 -0.33 0.00 -2.04 0.00 0.00 64.34 61.68 1s14 n VAL 2076Cb 0.26 1.01 0.10 0.00 -1.47 0.00 0.00 33.84 33.74 1s14 n VAL 2076CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1s14 s ASP 2077N -1.14 4.06 0.26 -1.34 -4.77 -1.26 -4.11 116.67 108.37 1s14 s ASP 2077Ca 0.02 2.27 -0.30 0.00 -3.30 0.00 0.00 52.55 51.24 1s14 s ASP 2077Cb 0.02 -2.58 -0.09 0.00 -1.09 0.00 0.00 42.92 39.18 1s14 s ASP 2077CO 0.11 -2.35 1.06 -0.63 0.70 0.00 0.00 175.17 174.07 1s14 s ILE 2078N -2.18 3.65 -0.03 2.11 -1.09 -1.26 -1.40 121.20 121.00 1s14 s ILE 2078Ca 0.72 1.65 -0.23 0.00 -2.23 0.00 0.00 60.65 60.56 1s14 s ILE 2078Cb -0.27 -4.05 -0.04 0.00 -1.58 0.00 0.00 42.46 36.52 1s14 s ILE 2078CO 0.48 0.39 0.67 -2.28 -1.23 0.00 0.00 174.94 172.97 1s14 s HIS 2079N -1.10 3.63 0.00 3.97 5.65 -1.14 -4.91 115.29 121.39 1s14 s HIS 2079Ca 0.44 1.26 0.00 0.00 0.25 0.00 0.00 55.06 57.01 1s14 s HIS 2079Cb -0.30 -2.74 0.00 0.00 -1.18 0.00 0.00 32.58 28.36 1s14 s HIS 2079CO 0.38 0.20 0.99 -0.35 -0.65 0.00 0.00 174.74 175.31 1s14 n PRO 2080N 3.31 0.00 0.26 2.88 -0.04 -1.26 -1.05 135.00 139.10 1s14 n PRO 2080Ca -0.03 0.93 -0.10 0.00 -0.04 0.00 0.00 63.50 64.25 1s14 n PRO 2080Cb 0.51 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 1s14 n PRO 2080CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1s14 h GLU 2081N 0.00 -0.65 -0.29 0.54 5.08 -1.99 -3.34 114.58 113.92 1s14 h GLU 2081Ca 0.00 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1s14 h GLU 2081Cb 0.00 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1s14 h GLU 2081CO 0.00 -0.43 -0.17 0.39 -1.00 0.00 0.00 179.01 177.79 1s14 n GLU 2082N -4.04 -0.13 0.00 2.33 -0.58 -1.22 -4.88 120.64 112.12 1s14 n GLU 2082Ca -0.08 1.08 0.00 0.00 -0.42 0.00 0.00 57.16 57.73 1s14 n GLU 2082Cb 0.27 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 1s14 n GLU 2082CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s14 n GLY 2083N -1.07 2.00 3.96 0.62 0.00 -0.22 -5.01 105.19 105.48 1s14 n GLY 2083Ca 0.01 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 1s14 n GLY 2083CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1s14 s VAL 2084N -1.43 4.80 0.46 1.61 -7.23 -1.26 -4.66 120.40 112.69 1s14 s VAL 2084Ca 0.00 -0.78 -0.25 0.00 -1.81 0.00 0.00 61.98 59.14 1s14 s VAL 2084Cb 0.00 -3.71 -0.08 0.00 0.56 0.00 0.00 36.38 33.15 1s14 s VAL 2084CO 0.00 -0.35 1.43 -2.16 -0.31 0.00 0.00 175.10 173.70 1s14 s PRO 2085N -4.19 3.63 0.45 4.82 0.04 -1.26 -2.88 135.00 135.60 1s14 s PRO 2085Ca 0.40 2.41 0.22 0.00 0.04 0.00 0.00 61.00 64.07 1s14 s PRO 2085Cb -0.09 -2.62 1.20 0.00 0.04 0.00 0.00 34.50 33.03 1s14 s PRO 2085CO 0.33 -0.86 1.86 0.00 0.04 0.00 0.00 177.00 178.36 1s14 h ALA 2086N 2.23 2.39 -0.25 8.56 0.00 -1.38 0.57 119.26 131.38 1s14 h ALA 2086Ca -0.51 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 1s14 h ALA 2086Cb 1.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1s14 h ALA 2086CO 0.61 -0.68 -0.38 -0.24 0.00 0.00 0.00 179.25 178.55 1s14 h VAL 2087N 0.29 1.30 -0.22 0.00 3.04 -1.40 -2.55 116.25 116.71 1s14 h VAL 2087Ca 0.47 -1.53 -0.12 0.00 -1.01 0.00 0.00 66.70 64.51 1s14 h VAL 2087Cb 1.36 1.52 -0.01 0.00 -2.01 0.00 0.00 31.29 32.15 1s14 h VAL 2087CO -0.14 0.48 -0.38 -0.08 -1.01 0.00 0.00 177.57 176.45 1s14 h GLU 2088N 0.47 0.48 -0.03 4.17 4.81 -1.21 -2.44 114.58 120.83 1s14 h GLU 2088Ca 0.04 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.04 1s14 h GLU 2088Cb 0.88 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.25 1s14 h GLU 2088CO 0.08 0.79 0.01 1.25 -0.73 0.00 0.00 179.01 180.40 1s14 h LEU 2089N 0.40 0.04 -0.74 1.64 5.85 -1.20 -1.66 115.31 119.64 1s14 h LEU 2089Ca 0.04 -0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.63 1s14 h LEU 2089Cb 0.84 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 1s14 h LEU 2089CO 0.07 0.23 0.41 0.40 -0.34 0.00 0.00 178.44 179.21 1s14 h ILE 2090N -0.15 0.94 -0.15 4.05 2.04 -1.37 -2.07 117.51 120.79 1s14 h ILE 2090Ca 0.01 -0.25 -0.10 0.00 1.00 0.00 0.00 64.86 65.52 1s14 h ILE 2090Cb 0.21 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1s14 h ILE 2090CO -0.00 0.13 -0.35 -0.07 0.00 0.00 0.00 178.15 177.87 1s14 h LEU 2091N 0.73 0.32 -1.75 1.44 3.38 -1.30 -3.07 115.31 115.06 1s14 h LEU 2091Ca 0.34 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1s14 h LEU 2091Cb 0.27 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1s14 h LEU 2091CO -0.22 0.65 -0.11 0.00 0.09 0.00 0.00 178.44 178.85 1s14 n ILE 2093N -4.40 2.27 -3.31 0.00 -5.35 -1.18 -4.97 119.36 102.44 1s14 n ILE 2093Ca -0.02 -1.71 -0.38 0.00 -0.27 0.00 0.00 62.75 60.36 1s14 n ILE 2093Cb 0.19 -0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 37.84 1s14 n ILE 2093CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1s14 s SER 2117N -1.62 6.87 0.22 7.28 0.15 -0.95 -4.97 113.70 120.67 1s14 s SER 2117Ca 0.44 1.03 -0.01 0.00 0.70 0.00 0.00 55.95 58.11 1s14 s SER 2117Cb 0.34 -2.32 0.22 0.00 -1.71 0.00 0.00 66.02 62.55 1s14 s SER 2117CO 0.11 0.14 1.58 0.58 1.20 0.00 0.00 173.24 176.85 1s14 h VAL 2118N 4.14 1.31 -0.83 4.45 2.07 -1.93 -2.34 116.25 123.13 1s14 h VAL 2118Ca -0.46 -1.65 -0.02 0.00 0.82 0.00 0.00 66.70 65.40 1s14 h VAL 2118Cb 1.20 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 1s14 h VAL 2118CO 0.69 0.51 0.46 0.58 0.02 0.00 0.00 177.57 179.83 1s14 h VAL 2119N 0.41 1.24 -0.51 2.57 2.07 -1.93 -0.11 116.25 119.99 1s14 h VAL 2119Ca 0.03 -0.59 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 1s14 h VAL 2119Cb 0.95 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1s14 h VAL 2119CO 0.08 0.27 -0.01 -1.13 0.02 0.00 0.00 177.57 176.81 1s14 h ASN 2120N 1.16 0.88 -0.02 0.57 -1.24 -1.79 -2.36 115.58 112.78 1s14 h ASN 2120Ca 0.29 -0.31 -0.09 0.00 0.71 0.00 0.00 56.30 56.91 1s14 h ASN 2120Cb 0.02 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.82 1s14 h ASN 2120CO -0.05 0.98 -0.23 0.00 -1.29 0.00 0.00 177.43 176.83 1s14 h ALA 2121N 0.94 1.18 -0.64 1.57 0.00 -0.83 -3.06 119.26 118.41 1s14 h ALA 2121Ca 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1s14 h ALA 2121Cb 0.53 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1s14 h ALA 2121CO 0.03 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1s14 n LEU 2122N -4.14 3.61 -4.59 0.00 4.32 -0.12 -4.57 117.00 111.51 1s14 n LEU 2122Ca -0.00 -1.77 -0.33 0.00 -0.02 0.00 0.00 56.01 53.89 1s14 n LEU 2122Cb 0.38 -0.42 -0.11 0.00 -1.62 0.00 0.00 43.42 41.65 1s14 n LEU 2122CO 0.41 0.88 -0.38 -0.44 -1.22 0.00 0.00 177.39 176.65 1s14 s SER 2123N -1.08 4.64 0.40 -1.43 0.01 -0.90 -1.22 113.70 114.13 1s14 s SER 2123Ca 0.45 -0.07 0.17 0.00 1.31 0.00 0.00 55.95 57.80 1s14 s SER 2123Cb 0.24 -1.13 0.85 0.00 0.21 0.00 0.00 66.02 66.19 1s14 s SER 2123CO 0.31 0.33 1.85 0.11 0.41 0.00 0.00 173.24 176.25 1s14 h LYS 2124N 4.91 0.00 -2.13 12.44 1.57 -0.71 -2.63 116.57 130.02 1s14 h LYS 2124Ca -0.49 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.23 1s14 h LYS 2124Cb 1.17 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.29 1s14 h LYS 2124CO 0.53 0.32 0.12 0.50 -0.57 0.00 0.00 179.45 180.36 1s14 s ARG 2125N -4.07 0.97 -0.08 3.15 3.52 -1.23 -1.88 118.95 119.33 1s14 s ARG 2125Ca -0.02 0.33 -0.03 0.00 -0.13 0.00 0.00 55.73 55.87 1s14 s ARG 2125Cb 0.13 0.46 0.04 0.00 -1.56 0.00 0.00 34.95 34.03 1s14 s ARG 2125CO 0.69 -0.28 0.17 0.08 -0.81 0.00 0.00 175.30 175.15 1s14 s VAL 2126N -0.95 -0.17 -0.12 7.11 1.01 -0.13 -0.91 120.40 126.25 1s14 s VAL 2126Ca -0.09 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.16 1s14 s VAL 2126Cb -0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 1s14 s VAL 2126CO 0.08 0.11 -0.17 -1.61 0.00 0.00 0.00 175.10 173.51 1s14 s GLU 2127N 1.77 3.25 -0.09 2.72 2.02 0.84 -0.30 118.70 128.90 1s14 s GLU 2127Ca -0.03 -0.76 0.02 0.00 0.02 0.00 0.00 54.97 54.22 1s14 s GLU 2127Cb -0.12 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.61 1s14 s GLU 2127CO -0.06 0.17 -0.16 0.08 0.02 0.00 0.00 175.26 175.32 1s14 s VAL 2128N 0.41 1.46 -0.10 2.63 1.01 0.09 -1.27 120.40 124.63 1s14 s VAL 2128Ca -0.13 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1s14 s VAL 2128Cb -0.17 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1s14 s VAL 2128CO 0.06 0.43 -0.20 0.20 0.00 0.00 0.00 175.10 175.59 1s14 s ASN 2129N 0.73 2.73 -0.04 3.32 0.01 -0.85 -1.14 114.94 119.69 1s14 s ASN 2129Ca -0.12 -0.49 0.06 0.00 -0.71 0.00 0.00 52.86 51.59 1s14 s ASN 2129Cb -0.16 -1.25 -0.01 0.00 0.41 0.00 0.00 41.25 40.24 1s14 s ASN 2129CO 0.03 0.10 -0.23 -0.69 -1.51 0.00 0.00 177.10 174.80 1s14 s VAL 2130N 0.58 1.87 -0.41 1.60 1.01 0.14 -1.26 120.40 123.94 1s14 s VAL 2130Ca -0.14 -0.98 -0.07 0.00 0.00 0.00 0.00 61.98 60.79 1s14 s VAL 2130Cb -0.17 -1.58 0.08 0.00 0.00 0.00 0.00 36.38 34.72 1s14 s VAL 2130CO 0.04 0.53 0.23 -0.13 0.00 0.00 0.00 175.10 175.77 1s14 s ARG 2131N -0.22 2.48 -0.02 2.72 0.52 -0.10 0.24 118.95 124.57 1s14 s ARG 2131Ca -0.00 -1.52 0.02 0.00 -0.52 0.00 0.00 55.73 53.71 1s14 s ARG 2131Cb -0.12 -3.70 0.00 0.00 0.52 0.00 0.00 34.95 31.65 1s14 s ARG 2131CO 0.02 -0.95 -0.06 1.03 0.02 0.00 0.00 175.30 175.36 1s14 s ARG 2132N 1.36 0.61 -1.43 3.54 0.52 0.00 -1.99 118.95 121.56 1s14 s ARG 2132Ca 0.03 -0.20 -0.07 0.00 -0.52 0.00 0.00 55.73 54.98 1s14 s ARG 2132Cb -0.23 -0.60 0.01 0.00 0.52 0.00 0.00 34.95 34.65 1s14 s ARG 2132CO 0.01 0.08 0.12 -3.47 0.02 0.00 0.00 175.30 172.06 1s14 n ASP 2133N 3.22 0.01 0.00 0.23 4.64 -1.26 -0.23 116.55 123.16 1s14 n ASP 2133Ca -0.17 -1.24 0.00 0.00 -1.38 0.00 0.00 54.79 52.01 1s14 n ASP 2133Cb 0.56 -1.53 0.00 0.00 -1.04 0.00 0.00 41.12 39.11 1s14 n ASP 2133CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1s14 n GLY 2134N -2.44 0.38 3.31 0.27 0.00 -1.26 -4.98 105.19 100.46 1s14 n GLY 2134Ca -0.28 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 1s14 n GLY 2134CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s14 s GLN 2135N -0.63 1.18 -0.25 1.61 -1.52 0.68 -1.76 119.66 118.98 1s14 s GLN 2135Ca 0.00 -1.23 -0.03 0.00 -1.95 0.00 0.00 55.36 52.15 1s14 s GLN 2135Cb 0.00 -1.43 0.01 0.00 -0.22 0.00 0.00 33.01 31.37 1s14 s GLN 2135CO 0.00 0.33 -0.04 0.08 -0.25 0.00 0.00 175.29 175.41 1s14 s VAL 2136N -1.33 3.15 -0.04 1.09 1.01 -0.01 -0.82 120.40 123.44 1s14 s VAL 2136Ca 0.09 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1s14 s VAL 2136Cb -0.09 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1s14 s VAL 2136CO 0.05 0.24 0.03 -0.31 0.00 0.00 0.00 175.10 175.12 1s14 s TYR 2137N 1.39 3.20 0.04 5.22 1.51 0.14 -0.60 117.35 128.25 1s14 s TYR 2137Ca 0.02 0.19 0.06 0.00 -1.01 0.00 0.00 57.07 56.33 1s14 s TYR 2137Cb -0.16 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.92 1s14 s TYR 2137CO -0.03 0.51 -0.17 1.21 -1.11 0.00 0.00 175.55 175.96 1s14 s ASN 2138N -1.35 2.02 -0.06 2.29 3.84 -0.34 0.26 114.94 121.60 1s14 s ASN 2138Ca 0.18 -0.50 -0.21 0.00 0.21 0.00 0.00 52.86 52.54 1s14 s ASN 2138Cb -0.12 -0.14 0.05 0.00 -0.55 0.00 0.00 41.25 40.48 1s14 s ASN 2138CO 0.08 0.08 0.48 -0.51 -2.79 0.00 0.00 177.10 174.44 1s14 s ILE 2139N -0.85 0.03 -0.01 -5.21 2.07 -0.29 -1.71 121.20 115.22 1s14 s ILE 2139Ca 0.04 -0.21 -0.06 0.00 -1.41 0.00 0.00 60.65 59.01 1s14 s ILE 2139Cb -0.08 -0.77 0.00 0.00 0.13 0.00 0.00 42.46 41.74 1s14 s ILE 2139CO 0.02 -0.12 0.12 0.00 -1.91 0.00 0.00 174.94 173.05 1s14 s ALA 2140N -0.98 -0.29 0.21 1.50 0.00 -1.11 -0.73 121.76 120.37 1s14 s ALA 2140Ca -0.10 -0.08 0.07 0.00 0.00 0.00 0.00 51.96 51.85 1s14 s ALA 2140Cb -0.03 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 1s14 s ALA 2140CO 0.06 -0.18 -0.11 -0.06 0.00 0.00 0.00 175.76 175.47 1s14 s PHE 2141N -1.11 1.67 -0.21 0.00 0.40 0.59 -0.85 117.98 118.46 1s14 s PHE 2141Ca -0.12 -0.65 -0.05 0.00 -0.60 0.00 0.00 56.93 55.51 1s14 s PHE 2141Cb -0.07 -0.83 0.11 0.00 0.51 0.00 0.00 43.02 42.74 1s14 s PHE 2141CO 0.01 0.27 0.40 -1.21 0.70 0.00 0.00 175.22 175.39 1s14 s GLU 2142N -3.69 0.33 -1.19 0.44 2.02 0.80 -0.95 118.70 116.45 1s14 s GLU 2142Ca 0.23 0.81 0.00 0.00 0.02 0.00 0.00 54.97 56.03 1s14 s GLU 2142Cb 0.01 -0.02 0.00 0.00 0.10 0.00 0.00 34.13 34.22 1s14 s GLU 2142CO 0.07 -0.42 0.00 0.09 0.02 0.00 0.00 175.26 175.02 1s14 n ASN 2143N 5.38 -4.21 0.00 -0.19 3.02 -0.79 -2.47 115.26 116.00 1s14 n ASN 2143Ca -0.06 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1s14 n ASN 2143Cb 0.50 -3.13 0.00 0.00 -0.61 0.00 0.00 39.78 36.54 1s14 n ASN 2143CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s14 n GLY 2144N -1.22 0.75 3.38 7.41 0.00 -1.16 -4.94 105.19 109.41 1s14 n GLY 2144Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1s14 n GLY 2144CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s14 s GLU 2145N -0.51 2.32 0.18 1.61 2.02 -1.03 -4.89 118.70 118.40 1s14 s GLU 2145Ca 0.00 -0.82 -0.31 0.00 0.02 0.00 0.00 54.97 53.86 1s14 s GLU 2145Cb 0.00 -2.20 -0.09 0.00 0.10 0.00 0.00 34.13 31.93 1s14 s GLU 2145CO 0.00 0.58 1.43 0.21 0.02 0.00 0.00 175.26 177.49 1s14 s LYS 2146N -0.63 4.29 0.00 1.61 2.20 -1.26 -0.14 119.74 125.81 1s14 s LYS 2146Ca 0.10 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 57.91 1s14 s LYS 2146Cb -0.11 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1s14 s LYS 2146CO -0.00 -0.43 0.42 1.33 -0.36 0.00 0.00 175.35 176.31 1s14 n VAL 2147N 3.19 0.00 -3.55 4.02 0.24 -0.03 -4.88 118.33 117.33 1s14 n VAL 2147Ca 0.09 -0.45 -0.06 0.00 -2.04 0.00 0.00 64.34 61.88 1s14 n VAL 2147Cb 0.41 1.09 -0.07 0.00 -1.47 0.00 0.00 33.84 33.79 1s14 n VAL 2147CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1s14 s GLN 2148N -0.06 0.40 0.69 7.34 2.00 -1.05 -4.96 119.66 124.03 1s14 s GLN 2148Ca 0.00 1.01 -0.14 0.00 -2.00 0.00 0.00 55.36 54.23 1s14 s GLN 2148Cb 0.00 0.30 0.02 0.00 0.80 0.00 0.00 33.01 34.13 1s14 s GLN 2148CO 0.00 -0.35 1.12 -0.51 -0.50 0.00 0.00 175.29 175.05 1s14 s ASP 2149N 2.68 4.81 0.30 6.67 1.11 -1.26 -2.74 116.67 128.23 1s14 s ASP 2149Ca 0.03 2.04 -0.29 0.00 0.18 0.00 0.00 52.55 54.50 1s14 s ASP 2149Cb -0.13 -2.55 -0.13 0.00 1.07 0.00 0.00 42.92 41.18 1s14 s ASP 2149CO -0.15 -1.84 1.26 -0.11 1.18 0.00 0.00 175.17 175.51 1s14 n LEU 2150N -2.68 3.00 -3.64 1.23 7.94 -1.26 -4.66 117.00 116.94 1s14 n LEU 2150Ca 0.11 1.18 -0.14 0.00 -1.11 0.00 0.00 56.01 56.05 1s14 n LEU 2150Cb 0.52 -1.42 -0.07 0.00 0.53 0.00 0.00 43.42 42.97 1s14 n LEU 2150CO 0.49 -0.70 0.36 0.00 -1.11 0.00 0.00 177.39 176.42 1s14 s GLN 2151N -1.36 0.80 -0.10 1.96 -2.07 -0.70 -4.97 119.66 113.23 1s14 s GLN 2151Ca 0.60 0.80 -0.30 0.00 -1.82 0.00 0.00 55.36 54.64 1s14 s GLN 2151Cb -0.63 0.39 -0.02 0.00 -1.09 0.00 0.00 33.01 31.66 1s14 s GLN 2151CO 0.58 -0.13 1.22 0.08 -1.32 0.00 0.00 175.29 175.72 1s14 s VAL 2152N 0.10 4.28 -1.79 3.63 1.01 -1.26 -1.20 120.40 125.17 1s14 s VAL 2152Ca -0.02 1.59 0.15 0.00 0.00 0.00 0.00 61.98 63.70 1s14 s VAL 2152Cb -0.04 -4.02 0.11 0.00 0.00 0.00 0.00 36.38 32.43 1s14 s VAL 2152CO 0.02 -0.06 0.95 1.33 0.00 0.00 0.00 175.10 177.35 1s14 n VAL 2153N 4.91 0.00 -0.48 2.92 0.24 0.23 -4.97 118.33 121.19 1s14 n VAL 2153Ca 0.12 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 1s14 n VAL 2153Cb 0.46 1.30 0.00 0.00 -1.47 0.00 0.00 33.84 34.12 1s14 n VAL 2153CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1s14 n GLY 2154N 0.84 -2.46 3.82 7.63 0.00 -1.23 -5.00 105.19 108.79 1s14 n GLY 2154Ca 0.08 -1.26 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 1s14 n GLY 2154CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s14 s THR 2155N -2.13 2.89 0.19 2.61 -4.23 -1.26 -0.83 115.64 112.88 1s14 s THR 2155Ca 0.00 -1.48 -0.20 0.00 -1.18 0.00 0.00 61.69 58.84 1s14 s THR 2155Cb 0.00 -3.04 0.04 0.00 1.34 0.00 0.00 72.50 70.84 1s14 s THR 2155CO 0.00 -0.08 0.57 0.00 -0.54 0.00 0.00 174.62 174.57 1s14 n GLY 2157N -0.36 -0.38 0.22 0.00 0.00 -1.26 -4.33 105.19 99.08 1s14 n GLY 2157Ca -0.12 0.03 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 1s14 n GLY 2157CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s14 h LYS 2158N 1.11 0.51 -0.02 1.61 1.79 -1.94 -1.72 116.57 117.91 1s14 h LYS 2158Ca -0.46 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1s14 h LYS 2158Cb 1.35 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1s14 h LYS 2158CO 0.54 0.34 0.00 0.54 -1.08 0.00 0.00 179.45 179.79 1s14 n ARG 2159N -4.88 1.18 -3.04 3.15 1.74 -1.26 -4.21 116.66 109.34 1s14 n ARG 2159Ca 0.06 -0.27 -0.44 0.00 -0.77 0.00 0.00 57.85 56.42 1s14 n ARG 2159Cb 0.16 -1.42 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 1s14 n ARG 2159CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1s14 s ASN 2160N -1.82 6.34 0.10 0.55 3.04 -0.65 -5.01 114.94 117.49 1s14 s ASN 2160Ca 0.38 -1.60 0.08 0.00 0.04 0.00 0.00 52.86 51.76 1s14 s ASN 2160Cb 0.18 -2.34 -0.03 0.00 -1.54 0.00 0.00 41.25 37.52 1s14 s ASN 2160CO 0.30 -1.12 -0.20 0.42 -3.04 0.00 0.00 177.10 173.47 1s14 s THR 2161N 2.72 1.64 -4.61 -5.21 -4.23 -1.26 -4.60 115.64 100.10 1s14 s THR 2161Ca 0.19 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 1s14 s THR 2161Cb -0.17 -1.52 0.00 0.00 1.34 0.00 0.00 72.50 72.15 1s14 s THR 2161CO 0.02 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 1s14 n GLY 2162N 1.05 -2.57 3.05 3.99 0.00 -0.84 -3.52 105.19 106.35 1s14 n GLY 2162Ca -0.19 -1.29 -0.15 0.00 0.00 0.00 0.00 46.02 44.39 1s14 n GLY 2162CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s14 s THR 2163N -2.17 0.63 -0.16 2.61 2.01 -1.00 -0.92 115.64 116.63 1s14 s THR 2163Ca 0.00 -0.82 -0.00 0.00 0.31 0.00 0.00 61.69 61.18 1s14 s THR 2163Cb 0.00 -0.62 0.04 0.00 0.01 0.00 0.00 72.50 71.93 1s14 s THR 2163CO 0.00 -0.16 -0.06 -0.55 -0.69 0.00 0.00 174.62 173.16 1s14 s SER 2164N -1.07 2.79 -0.24 3.53 0.15 -0.39 -1.13 113.70 117.34 1s14 s SER 2164Ca -0.04 -0.63 -0.06 0.00 0.70 0.00 0.00 55.95 55.92 1s14 s SER 2164Cb -0.07 -0.94 -0.02 0.00 -1.71 0.00 0.00 66.02 63.28 1s14 s SER 2164CO 0.00 -0.17 0.02 -0.69 1.20 0.00 0.00 173.24 173.60 1s14 s VAL 2165N 1.62 3.87 -0.16 4.45 1.01 -0.12 -2.01 120.40 129.06 1s14 s VAL 2165Ca 0.01 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1s14 s VAL 2165Cb -0.15 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1s14 s VAL 2165CO -0.08 0.38 -0.16 -2.28 0.00 0.00 0.00 175.10 172.96 1s14 s HIS 2166N 1.55 2.40 0.06 5.22 5.04 -0.40 -0.19 115.29 128.98 1s14 s HIS 2166Ca 0.06 -1.39 0.03 0.00 -1.54 0.00 0.00 55.06 52.22 1s14 s HIS 2166Cb -0.15 -1.72 -0.03 0.00 0.04 0.00 0.00 32.58 30.73 1s14 s HIS 2166CO 0.00 -0.72 -0.10 -0.59 -2.34 0.00 0.00 174.74 170.99 1s14 s PHE 2167N 1.41 0.90 -0.44 3.88 -0.71 -0.47 -0.11 117.98 122.45 1s14 s PHE 2167Ca 0.05 -0.51 -0.01 0.00 -1.04 0.00 0.00 56.93 55.42 1s14 s PHE 2167Cb -0.13 -0.52 0.12 0.00 -1.21 0.00 0.00 43.02 41.28 1s14 s PHE 2167CO -0.11 -0.03 0.22 -1.58 -1.34 0.00 0.00 175.22 172.38 1s14 s TRP 2168N -1.49 3.57 0.45 3.49 0.51 -0.09 -1.37 118.94 124.01 1s14 s TRP 2168Ca -0.05 -2.62 -0.24 0.00 -2.12 0.00 0.00 56.10 51.07 1s14 s TRP 2168Cb -0.09 -3.15 -0.09 0.00 -0.81 0.00 0.00 33.47 29.33 1s14 s TRP 2168CO 0.01 -0.93 1.12 -2.30 -0.51 0.00 0.00 176.95 174.34 1s14 n PRO 2169N 4.25 1.52 -2.95 4.98 -0.02 -1.26 -0.08 135.00 141.45 1s14 n PRO 2169Ca 0.01 0.55 -0.43 0.00 -2.02 0.00 0.00 63.50 61.61 1s14 n PRO 2169Cb 0.40 -2.21 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 1s14 n PRO 2169CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1s14 s ASP 2170N -0.73 6.48 0.25 2.55 -1.08 -0.36 -4.48 116.67 119.29 1s14 s ASP 2170Ca 0.64 0.12 0.13 0.00 -0.52 0.00 0.00 52.55 52.92 1s14 s ASP 2170Cb -0.51 -2.40 0.71 0.00 -1.46 0.00 0.00 42.92 39.26 1s14 s ASP 2170CO 0.56 -0.85 1.34 -1.84 0.52 0.00 0.00 175.17 174.89 1s14 n GLU 2171N 6.63 0.09 0.21 4.34 0.00 -1.26 -1.40 120.64 129.26 1s14 n GLU 2171Ca 0.03 0.55 0.09 0.00 0.00 0.00 0.00 57.16 57.84 1s14 n GLU 2171Cb 0.48 -1.93 0.40 0.00 0.00 0.00 0.00 31.44 30.40 1s14 n GLU 2171CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.13 178.92 1s14 h THR 2172N 0.00 0.55 -0.19 3.84 1.35 -1.96 -3.06 112.91 113.44 1s14 h THR 2172Ca 0.00 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 1s14 h THR 2172Cb 0.28 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 1s14 h THR 2172CO 0.00 0.24 0.00 0.49 -0.25 0.00 0.00 175.52 176.00 1s14 n PHE 2173N -3.35 0.23 -4.33 4.73 3.72 -0.49 -4.94 117.46 113.03 1s14 n PHE 2173Ca 0.01 -0.12 -0.19 0.00 -0.05 0.00 0.00 57.45 57.10 1s14 n PHE 2173Cb 0.47 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.87 1s14 n PHE 2173CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1s14 s PHE 2174N -1.77 1.00 0.43 1.38 0.08 -1.16 -4.76 117.98 113.18 1s14 s PHE 2174Ca 0.34 -0.29 0.12 0.00 0.12 0.00 0.00 56.93 57.22 1s14 s PHE 2174Cb 0.20 -0.61 1.00 0.00 -0.57 0.00 0.00 43.02 43.04 1s14 s PHE 2174CO 0.30 -0.00 2.01 -0.44 -0.10 0.00 0.00 175.22 176.99 1s14 h ASP 2175N 5.27 0.37 -3.59 1.36 3.32 -0.75 -3.41 116.42 119.00 1s14 h ASP 2175Ca -0.35 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.52 1s14 h ASP 2175Cb 1.18 -0.08 -0.28 0.00 0.22 0.00 0.00 39.33 40.38 1s14 h ASP 2175CO 0.46 0.24 -0.47 -0.55 -1.72 0.00 0.00 179.24 177.20 1s14 s SER 2176N -6.42 -0.25 0.00 6.45 0.15 -1.05 -5.03 113.70 107.55 1s14 s SER 2176Ca -0.08 0.49 0.28 0.00 0.70 0.00 0.00 55.95 57.35 1s14 s SER 2176Cb 0.19 0.44 1.08 0.00 -1.71 0.00 0.00 66.02 66.02 1s14 s SER 2176CO 0.74 -0.12 1.80 -0.81 1.20 0.00 0.00 173.24 176.04 1s14 n PRO 2177N 3.58 0.21 -2.40 5.44 -0.04 -1.26 -4.09 135.00 136.45 1s14 n PRO 2177Ca -0.19 -0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 62.79 1s14 n PRO 2177Cb 0.56 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.49 1s14 n PRO 2177CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1s14 s ARG 2178N -2.83 4.45 0.25 0.54 0.52 -1.26 -4.69 118.95 115.94 1s14 s ARG 2178Ca 0.18 1.82 -0.30 0.00 -0.52 0.00 0.00 55.73 56.92 1s14 s ARG 2178Cb 0.19 -3.30 -0.09 0.00 0.52 0.00 0.00 34.95 32.27 1s14 s ARG 2178CO 0.55 -0.20 0.96 -0.06 0.02 0.00 0.00 175.30 176.58 1s14 s PHE 2179N 0.64 3.91 -0.45 -0.53 0.40 -1.26 -4.45 117.98 116.23 1s14 s PHE 2179Ca 0.57 1.88 -0.25 0.00 -0.60 0.00 0.00 56.93 58.53 1s14 s PHE 2179Cb -0.31 -3.02 0.03 0.00 0.51 0.00 0.00 43.02 40.23 1s14 s PHE 2179CO 0.32 0.29 0.88 0.45 0.70 0.00 0.00 175.22 177.86 1s14 s SER 2180N -1.17 6.48 0.08 1.36 0.15 -1.26 -4.93 113.70 114.41 1s14 s SER 2180Ca 0.42 0.07 -0.24 0.00 0.70 0.00 0.00 55.95 56.90 1s14 s SER 2180Cb -0.26 -2.43 -0.16 0.00 -1.71 0.00 0.00 66.02 61.46 1s14 s SER 2180CO 0.33 -0.99 1.70 0.58 1.20 0.00 0.00 173.24 176.06 1s14 h VAL 2181N 6.03 0.97 -0.63 4.45 2.07 -1.99 -0.79 116.25 126.37 1s14 h VAL 2181Ca -0.24 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.25 1s14 h VAL 2181Cb 1.08 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 1s14 h VAL 2181CO 1.00 0.02 0.38 0.77 0.02 0.00 0.00 177.57 179.76 1s14 h SER 2182N -0.09 0.62 -0.37 0.57 4.64 -1.99 -0.17 113.55 116.76 1s14 h SER 2182Ca -0.01 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1s14 h SER 2182Cb 0.07 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 1s14 h SER 2182CO 0.01 0.43 0.01 0.03 -0.87 0.00 0.00 176.83 176.44 1s14 h ARG 2183N 0.75 0.75 0.19 4.77 3.08 -1.95 -0.56 114.38 121.41 1s14 h ARG 2183Ca 0.26 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1s14 h ARG 2183Cb 0.03 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1s14 h ARG 2183CO -0.11 0.75 -0.09 -0.07 -1.07 0.00 0.00 179.97 179.38 1s14 h LEU 2184N 0.70 -0.21 -0.78 3.04 3.38 -0.14 -2.78 115.31 118.51 1s14 h LEU 2184Ca 0.14 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1s14 h LEU 2184Cb 0.42 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1s14 h LEU 2184CO 0.02 -0.06 -0.14 0.71 0.09 0.00 0.00 178.44 179.05 1s14 h THR 2185N -0.35 1.26 -0.51 0.22 1.35 -0.83 -1.26 112.91 112.79 1s14 h THR 2185Ca -0.03 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 1s14 h THR 2185Cb 0.27 1.10 -0.02 0.00 -1.73 0.00 0.00 68.15 67.77 1s14 h THR 2185CO 0.04 0.41 0.33 0.45 -0.25 0.00 0.00 175.52 176.50 1s14 h HIS 2186N 0.69 0.65 -0.35 4.73 3.86 -1.09 0.15 115.15 123.79 1s14 h HIS 2186Ca 0.11 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.23 1s14 h HIS 2186Cb 0.63 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1s14 h HIS 2186CO 0.03 0.42 -0.18 0.28 0.86 0.00 0.00 177.93 179.34 1s14 h VAL 2187N 0.68 1.29 -0.76 2.45 2.07 -1.40 -2.21 116.25 118.37 1s14 h VAL 2187Ca 0.18 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.41 1s14 h VAL 2187Cb -0.06 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1s14 h VAL 2187CO -0.04 0.43 0.50 -0.07 0.02 0.00 0.00 177.57 178.41 1s14 h LEU 2188N 0.51 0.86 -0.57 2.57 3.38 -0.92 -1.10 115.31 120.04 1s14 h LEU 2188Ca 0.08 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1s14 h LEU 2188Cb 0.72 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1s14 h LEU 2188CO 0.05 0.62 0.24 0.11 0.09 0.00 0.00 178.44 179.55 1s14 h LYS 2189N 1.01 0.84 -0.23 1.13 1.57 -0.58 -1.50 116.57 118.82 1s14 h LYS 2189Ca 0.28 -0.15 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 1s14 h LYS 2189Cb -0.09 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 1s14 h LYS 2189CO -0.07 0.72 -0.20 0.00 -0.57 0.00 0.00 179.45 179.32 1s14 h ALA 2190N 1.08 1.23 -0.23 3.86 0.00 -1.07 -1.47 119.26 122.66 1s14 h ALA 2190Ca 0.19 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1s14 h ALA 2190Cb 0.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1s14 h ALA 2190CO -0.02 0.50 -0.38 0.87 0.00 0.00 0.00 179.25 180.22 1s14 h LYS 2191N 0.38 0.51 -0.46 0.00 1.57 -0.81 -0.63 116.57 117.12 1s14 h LYS 2191Ca 0.06 -0.25 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1s14 h LYS 2191Cb 0.57 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 1s14 h LYS 2191CO 0.04 0.82 0.05 0.00 -0.57 0.00 0.00 179.45 179.79 1s14 h ALA 2192N 1.16 0.62 -0.69 3.86 0.00 -0.75 -1.54 119.26 121.91 1s14 h ALA 2192Ca 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1s14 h ALA 2192Cb 0.86 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1s14 h ALA 2192CO 0.07 0.37 0.42 0.28 0.00 0.00 0.00 179.25 180.39 1s14 h VAL 2193N 0.64 1.20 0.00 0.00 2.07 -0.98 -2.59 116.25 116.59 1s14 h VAL 2193Ca 0.14 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1s14 h VAL 2193Cb 0.42 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1s14 h VAL 2193CO 0.01 0.20 0.00 0.18 0.02 0.00 0.00 177.57 177.99 1s14 n LEU 2194N -4.56 0.00 -3.25 2.57 4.77 -0.27 -3.96 117.00 112.31 1s14 n LEU 2194Ca 0.06 0.18 -0.24 0.00 -0.03 0.00 0.00 56.01 55.98 1s14 n LEU 2194Cb 0.05 -0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 40.89 1s14 n LEU 2194CO 0.37 -0.01 -0.16 0.00 -1.33 0.00 0.00 177.39 176.25 1s14 n PRO 2196N 1.08 1.05 0.00 0.00 -0.04 -1.24 -2.19 135.00 133.66 1s14 n PRO 2196Ca 0.24 0.38 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 1s14 n PRO 2196Cb 0.50 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 1s14 n PRO 2196CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s14 n GLY 2197N 2.13 2.66 3.73 0.55 0.00 0.61 -4.89 105.19 109.98 1s14 n GLY 2197Ca 0.16 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1s14 n GLY 2197CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s14 s VAL 2198N -2.44 3.85 -0.24 1.61 0.11 -0.93 -4.91 120.40 117.45 1s14 s VAL 2198Ca 0.00 1.50 -0.14 0.00 -2.93 0.00 0.00 61.98 60.40 1s14 s VAL 2198Cb 0.00 -3.96 -0.04 0.00 -1.53 0.00 0.00 36.38 30.85 1s14 s VAL 2198CO 0.00 0.21 0.34 -0.70 -3.33 0.00 0.00 175.10 171.62 1s14 s GLU 2199N 0.09 4.07 -0.11 1.54 2.12 0.24 -4.40 118.70 122.26 1s14 s GLU 2199Ca 0.53 0.03 0.02 0.00 0.36 0.00 0.00 54.97 55.91 1s14 s GLU 2199Cb -0.30 -3.60 -0.01 0.00 0.26 0.00 0.00 34.13 30.48 1s14 s GLU 2199CO 0.34 -0.14 -0.17 0.42 -0.54 0.00 0.00 175.26 175.16 1s14 s ILE 2200N 1.65 2.69 0.14 -3.70 1.01 -0.15 -1.39 121.20 121.46 1s14 s ILE 2200Ca 0.15 -0.80 0.10 0.00 0.00 0.00 0.00 60.65 60.10 1s14 s ILE 2200Cb -0.15 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 1s14 s ILE 2200CO 0.08 0.54 -0.24 0.42 0.00 0.00 0.00 174.94 175.75 1s14 s THR 2201N 0.23 2.14 -0.07 2.92 -4.23 -0.78 -0.63 115.64 115.22 1s14 s THR 2201Ca -0.11 -1.80 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 1s14 s THR 2201Cb -0.16 -1.93 0.03 0.00 1.34 0.00 0.00 72.50 71.78 1s14 s THR 2201CO 0.06 -0.03 0.02 0.12 -0.54 0.00 0.00 174.62 174.26 1s14 s PHE 2202N -1.32 0.47 -0.18 3.99 5.36 0.09 -1.04 117.98 125.35 1s14 s PHE 2202Ca 0.14 -0.05 -0.01 0.00 -0.96 0.00 0.00 56.93 56.05 1s14 s PHE 2202Cb -0.09 -0.70 -0.00 0.00 -0.34 0.00 0.00 43.02 41.89 1s14 s PHE 2202CO 0.07 -0.29 -0.11 0.21 -1.46 0.00 0.00 175.22 173.63 1s14 s LYS 2203N 2.04 3.30 -0.37 10.12 2.20 0.09 -1.42 119.74 135.69 1s14 s LYS 2203Ca 0.05 -0.69 -0.06 0.00 -0.36 0.00 0.00 55.97 54.90 1s14 s LYS 2203Cb -0.12 -2.77 0.06 0.00 -1.51 0.00 0.00 37.83 33.48 1s14 s LYS 2203CO -0.05 -0.05 0.16 0.34 -0.36 0.00 0.00 175.35 175.39 1s14 s ASP 2204N 1.03 5.37 0.00 1.43 -1.08 0.16 -1.01 116.67 122.56 1s14 s ASP 2204Ca -0.01 -1.40 0.12 0.00 -0.52 0.00 0.00 52.55 50.74 1s14 s ASP 2204Cb -0.15 -1.89 0.43 0.00 -1.46 0.00 0.00 42.92 39.86 1s14 s ASP 2204CO -0.02 -0.42 1.32 -0.62 0.52 0.00 0.00 175.17 175.95 1s14 n GLU 2205N 4.80 1.56 -0.11 4.34 1.02 -0.27 -1.12 120.64 130.86 1s14 n GLU 2205Ca -0.10 -0.86 -0.17 0.00 -0.02 0.00 0.00 57.16 56.01 1s14 n GLU 2205Cb 0.43 -1.25 -0.10 0.00 -0.02 0.00 0.00 31.44 30.51 1s14 n GLU 2205CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1s14 n ILE 2206N 0.15 1.27 0.61 -3.67 5.41 -1.26 -4.28 119.36 117.60 1s14 n ILE 2206Ca 0.11 -0.45 0.10 0.00 1.00 0.00 0.00 62.75 63.50 1s14 n ILE 2206Cb 0.22 -1.39 0.12 0.00 -0.71 0.00 0.00 39.64 37.88 1s14 n ILE 2206CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1s14 n ASN 2207N -3.33 2.85 -3.35 4.38 4.13 -1.24 -5.01 115.26 113.69 1s14 n ASN 2207Ca -0.41 -1.86 -0.18 0.00 1.68 0.00 0.00 54.58 53.81 1s14 n ASN 2207Cb 0.90 -0.08 0.07 0.00 -1.54 0.00 0.00 39.78 39.12 1s14 n ASN 2207CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1s14 n ASN 2208N 1.15 -6.14 -4.12 6.41 3.02 -0.27 -5.04 115.26 110.28 1s14 n ASN 2208Ca 0.13 -0.77 -0.09 0.00 -0.03 0.00 0.00 54.58 53.83 1s14 n ASN 2208Cb 0.51 -4.84 -0.10 0.00 -0.61 0.00 0.00 39.78 34.74 1s14 n ASN 2208CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1s14 s THR 2209N -3.41 0.42 -0.09 3.41 -4.23 -0.72 -5.01 115.64 106.02 1s14 s THR 2209Ca 0.44 -1.81 -0.06 0.00 -1.18 0.00 0.00 61.69 59.08 1s14 s THR 2209Cb -0.08 -1.52 0.03 0.00 1.34 0.00 0.00 72.50 72.28 1s14 s THR 2209CO 0.76 -0.91 0.22 -0.70 -0.54 0.00 0.00 174.62 173.45 1s14 s GLU 2210N -3.73 0.21 0.01 3.99 2.12 -1.26 -0.67 118.70 119.36 1s14 s GLU 2210Ca 0.08 0.41 -0.07 0.00 0.36 0.00 0.00 54.97 55.75 1s14 s GLU 2210Cb 0.06 -0.03 0.00 0.00 0.26 0.00 0.00 34.13 34.42 1s14 s GLU 2210CO -0.07 -0.11 0.13 -0.65 -0.54 0.00 0.00 175.26 174.02 1s14 s GLN 2211N 0.77 0.49 0.01 4.30 -0.21 -0.51 -5.01 119.66 119.50 1s14 s GLN 2211Ca -0.05 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 54.90 1s14 s GLN 2211Cb -0.07 0.20 -0.01 0.00 1.00 0.00 0.00 33.01 34.13 1s14 s GLN 2211CO -0.05 -0.12 -0.03 1.03 -2.12 0.00 0.00 175.29 174.01 1s14 s ARG 2212N -1.47 0.23 0.01 2.91 0.52 -1.26 -0.73 118.95 119.17 1s14 s ARG 2212Ca -0.14 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 54.69 1s14 s ARG 2212Cb -0.07 -0.01 -0.01 0.00 0.52 0.00 0.00 34.95 35.38 1s14 s ARG 2212CO 0.01 -0.01 -0.01 -1.58 0.02 0.00 0.00 175.30 173.73 1s14 s TRP 2213N -0.84 0.12 -0.26 -0.53 0.51 0.20 -5.00 118.94 113.14 1s14 s TRP 2213Ca -0.08 -0.22 -0.07 0.00 -2.12 0.00 0.00 56.10 53.60 1s14 s TRP 2213Cb -0.06 -0.09 0.13 0.00 -0.81 0.00 0.00 33.47 32.64 1s14 s TRP 2213CO -0.00 -0.08 0.55 0.00 -0.51 0.00 0.00 176.95 176.90 1s14 s TYR 2215N 2.77 3.34 0.60 0.00 2.02 -1.26 -4.97 117.35 119.86 1s14 s TYR 2215Ca 0.01 -1.51 0.32 0.00 -0.37 0.00 0.00 57.07 55.53 1s14 s TYR 2215Cb -0.13 -3.18 1.87 0.00 -0.40 0.00 0.00 41.96 40.12 1s14 s TYR 2215CO -0.17 -0.89 2.22 1.96 -1.57 0.00 0.00 175.55 177.11 1s14 h GLN 2216N 8.50 0.00 0.00 -0.62 7.50 -1.92 0.17 115.11 128.75 1s14 h GLN 2216Ca -0.24 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.91 1s14 h GLN 2216Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.62 1s14 h GLN 2216CO 0.82 0.00 0.00 -0.40 -1.50 0.00 0.00 178.83 177.75