#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j83 s PRO 2028N 0.00 2.57 -0.01 -1.09 0.04 -1.26 -4.94 135.00 130.31 1j83 s PRO 2028Ca 0.00 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1j83 s PRO 2028Cb 0.00 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.62 1j83 s PRO 2028CO 0.00 -1.40 0.00 0.95 0.04 0.00 0.00 177.00 176.59 1j83 s THR 2029N -2.73 0.05 0.70 1.26 -4.23 -1.26 -4.99 115.64 104.44 1j83 s THR 2029Ca 0.62 0.03 -0.14 0.00 -1.18 0.00 0.00 61.69 61.03 1j83 s THR 2029Cb -0.18 -0.09 0.02 0.00 1.34 0.00 0.00 72.50 73.59 1j83 s THR 2029CO 0.50 0.05 1.11 0.00 -0.54 0.00 0.00 174.62 175.75 1j83 s ALA 2030N 0.34 2.36 0.59 3.99 0.00 -1.26 -0.42 121.76 127.35 1j83 s ALA 2030Ca -0.03 0.49 -0.18 0.00 0.00 0.00 0.00 51.96 52.24 1j83 s ALA 2030Cb -0.05 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1j83 s ALA 2030CO -0.01 -1.50 1.14 -1.25 0.00 0.00 0.00 175.76 174.14 1j83 s PRO 2031N -4.33 3.11 -0.09 0.00 0.04 -1.26 -4.55 135.00 127.91 1j83 s PRO 2031Ca 0.66 1.58 0.13 0.00 0.04 0.00 0.00 61.00 63.40 1j83 s PRO 2031Cb -0.20 -1.97 -0.18 0.00 0.04 0.00 0.00 34.50 32.18 1j83 s PRO 2031CO 0.46 -1.04 0.14 1.63 0.04 0.00 0.00 177.00 178.24 1j83 n LYS 2032N -1.71 1.34 -3.44 4.56 5.02 -1.26 -4.91 118.16 117.77 1j83 n LYS 2032Ca 0.12 -0.05 -0.16 0.00 -2.02 0.00 0.00 58.31 56.19 1j83 n LYS 2032Cb 0.51 -1.34 -0.11 0.00 -0.02 0.00 0.00 35.03 34.07 1j83 n LYS 2032CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1j83 s ASP 2033N -4.26 1.30 -0.15 4.39 3.68 -1.26 -4.98 116.67 115.40 1j83 s ASP 2033Ca -0.06 -0.32 0.18 0.00 2.13 0.00 0.00 52.55 54.48 1j83 s ASP 2033Cb 0.06 0.54 0.33 0.00 -1.45 0.00 0.00 42.92 42.40 1j83 s ASP 2033CO 0.56 -0.34 1.19 0.33 0.13 0.00 0.00 175.17 177.03 1j83 n PHE 2034N 5.32 0.12 0.29 -5.34 7.35 -1.26 -4.76 117.46 119.18 1j83 n PHE 2034Ca -0.04 -1.05 0.18 0.00 -0.76 0.00 0.00 57.45 55.78 1j83 n PHE 2034Cb 0.49 -0.18 0.95 0.00 0.35 0.00 0.00 39.48 41.08 1j83 n PHE 2034CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1j83 h SER 2035N 0.31 0.00 0.75 -2.13 4.64 -1.93 -1.16 113.55 114.03 1j83 h SER 2035Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1j83 h SER 2035Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1j83 h SER 2035CO 0.03 0.00 -0.09 0.77 -0.87 0.00 0.00 176.83 176.67 1j83 h SER 2036N 0.00 0.00 0.00 4.97 4.64 -2.04 -3.46 113.55 117.66 1j83 h SER 2036Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1j83 h SER 2036Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1j83 h SER 2036CO -0.00 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 1j83 n GLY 2037N -0.19 0.73 3.56 -0.77 0.00 -0.44 -5.02 105.19 103.06 1j83 n GLY 2037Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1j83 n GLY 2037CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1j83 s PHE 2038N -2.91 0.44 -0.64 1.61 -0.12 -1.26 -4.92 117.98 110.17 1j83 s PHE 2038Ca 0.00 -0.79 -0.27 0.00 -0.05 0.00 0.00 56.93 55.82 1j83 s PHE 2038Cb 0.00 0.14 0.02 0.00 -0.63 0.00 0.00 43.02 42.55 1j83 s PHE 2038CO 0.00 -0.99 1.39 -1.58 -0.05 0.00 0.00 175.22 174.00 1j83 s TRP 2039N -3.97 2.24 -1.02 3.49 0.51 -0.70 -4.77 118.94 114.73 1j83 s TRP 2039Ca 0.24 0.29 0.12 0.00 -2.12 0.00 0.00 56.10 54.63 1j83 s TRP 2039Cb -0.00 -4.46 -0.01 0.00 -0.81 0.00 0.00 33.47 28.18 1j83 s TRP 2039CO 0.10 -2.02 0.67 -0.40 -0.51 0.00 0.00 176.95 174.79 1j83 n ASP 2040N 9.78 1.26 -3.09 2.95 5.68 -1.26 -1.33 116.55 130.54 1j83 n ASP 2040Ca 0.09 -1.13 -0.15 0.00 -0.50 0.00 0.00 54.79 53.10 1j83 n ASP 2040Cb 0.49 0.51 -0.02 0.00 -1.14 0.00 0.00 41.12 40.97 1j83 n ASP 2040CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1j83 n PHE 2041N -0.30 -1.71 1.17 2.11 3.01 -1.26 -4.64 117.46 115.85 1j83 n PHE 2041Ca 0.05 0.24 0.12 0.00 1.01 0.00 0.00 57.45 58.86 1j83 n PHE 2041Cb 0.24 -1.83 0.38 0.00 -0.01 0.00 0.00 39.48 38.25 1j83 n PHE 2041CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1j83 n ASN 2042N -1.91 1.90 -1.37 4.37 3.02 -1.26 -3.73 115.26 116.29 1j83 n ASN 2042Ca 0.00 -1.71 0.11 0.00 -0.03 0.00 0.00 54.58 52.95 1j83 n ASN 2042Cb 0.51 -0.09 0.32 0.00 -0.61 0.00 0.00 39.78 39.91 1j83 n ASN 2042CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1j83 n ASP 2043N 0.48 4.07 0.00 6.41 5.68 -1.26 -4.96 116.55 126.97 1j83 n ASP 2043Ca 0.17 -2.09 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 1j83 n ASP 2043Cb 0.38 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.86 1j83 n ASP 2043CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j83 n GLY 2044N 1.50 0.49 3.74 6.12 0.00 -1.26 -4.80 105.19 110.99 1j83 n GLY 2044Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 1j83 n GLY 2044CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j83 s THR 2045N -2.13 1.93 -2.02 2.61 -4.23 -1.26 -4.76 115.64 105.78 1j83 s THR 2045Ca 0.00 -1.79 0.11 0.00 -1.18 0.00 0.00 61.69 58.83 1j83 s THR 2045Cb 0.00 -2.73 0.31 0.00 1.34 0.00 0.00 72.50 71.42 1j83 s THR 2045CO 0.00 0.00 1.28 0.35 -0.54 0.00 0.00 174.62 175.71 1j83 n THR 2046N -1.25 0.43 -4.23 3.99 -2.24 -1.22 -4.65 114.28 105.11 1j83 n THR 2046Ca -0.06 -0.44 -0.31 0.00 -2.27 0.00 0.00 64.05 60.97 1j83 n THR 2046Cb 0.66 0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 69.05 1j83 n THR 2046CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j83 n GLN 2047N 0.47 -1.81 0.00 -0.78 6.02 -1.02 -1.15 117.38 119.11 1j83 n GLN 2047Ca 0.12 0.21 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 1j83 n GLN 2047Cb 0.29 -4.13 0.00 0.00 1.02 0.00 0.00 30.24 27.41 1j83 n GLN 2047CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1j83 n GLY 2048N -2.12 3.08 3.76 1.08 0.00 0.43 -4.57 105.19 106.85 1j83 n GLY 2048Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 1j83 n GLY 2048CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j83 s PHE 2049N -2.44 3.62 0.35 1.61 0.40 -0.30 -2.00 117.98 119.22 1j83 s PHE 2049Ca 0.00 1.71 -0.16 0.00 -0.60 0.00 0.00 56.93 57.88 1j83 s PHE 2049Cb 0.00 -3.25 0.04 0.00 0.51 0.00 0.00 43.02 40.32 1j83 s PHE 2049CO 0.00 -0.46 0.74 0.20 0.70 0.00 0.00 175.22 176.41 1j83 s GLY 2050N -0.82 0.34 0.19 4.36 0.00 -0.38 -4.52 107.32 106.49 1j83 s GLY 2050Ca 0.45 -0.70 -0.30 0.00 0.00 0.00 0.00 44.72 44.16 1j83 s GLY 2050CO 0.39 -0.31 1.35 0.14 0.00 0.00 0.00 173.10 174.67 1j83 s VAL 2051N -2.79 3.13 0.29 1.40 1.01 -1.26 -0.82 120.40 121.36 1j83 s VAL 2051Ca 0.16 0.90 -0.29 0.00 0.00 0.00 0.00 61.98 62.75 1j83 s VAL 2051Cb -0.05 -3.58 -0.09 0.00 0.00 0.00 0.00 36.38 32.66 1j83 s VAL 2051CO 0.11 0.12 1.10 0.21 0.00 0.00 0.00 175.10 176.64 1j83 s ASN 2052N 0.50 7.20 0.54 3.32 2.47 0.05 -4.74 114.94 124.29 1j83 s ASN 2052Ca 0.59 2.26 0.25 0.00 0.42 0.00 0.00 52.86 56.38 1j83 s ASN 2052Cb -0.38 -2.62 1.43 0.00 -1.45 0.00 0.00 41.25 38.23 1j83 s ASN 2052CO 0.37 -0.19 2.04 -0.65 -3.72 0.00 0.00 177.10 174.95 1j83 h PRO 2053N 3.68 0.00 -0.60 0.43 0.11 -1.94 -1.27 132.00 132.41 1j83 h PRO 2053Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1j83 h PRO 2053Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1j83 h PRO 2053CO 0.66 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.20 1j83 n ASP 2054N -4.25 3.42 -4.73 -2.05 8.00 -1.26 -4.95 116.55 110.72 1j83 n ASP 2054Ca 0.06 -2.17 -0.42 0.00 0.71 0.00 0.00 54.79 52.97 1j83 n ASP 2054Cb 0.47 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 1j83 n ASP 2054CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1j83 s SER 2055N -0.90 6.77 0.34 -2.24 0.15 -0.48 -4.89 113.70 112.45 1j83 s SER 2055Ca 0.39 2.51 0.27 0.00 0.70 0.00 0.00 55.95 59.81 1j83 s SER 2055Cb 0.23 -2.61 1.06 0.00 -1.71 0.00 0.00 66.02 62.99 1j83 s SER 2055CO 0.22 -0.64 1.79 1.55 1.20 0.00 0.00 173.24 177.37 1j83 h PRO 2056N 5.60 0.00 -4.20 5.44 0.13 -1.89 -3.41 132.00 133.68 1j83 h PRO 2056Ca -0.45 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.21 1j83 h PRO 2056Cb 1.21 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.99 1j83 h PRO 2056CO 0.80 0.00 -0.79 0.42 -0.23 0.00 0.00 178.00 178.20 1j83 s ILE 2057N -3.40 0.84 -0.05 -3.56 1.01 -1.26 -5.04 121.20 109.74 1j83 s ILE 2057Ca 0.04 -0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.47 1j83 s ILE 2057Cb 0.09 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.68 1j83 s ILE 2057CO 0.46 0.31 0.08 0.35 0.00 0.00 0.00 174.94 176.14 1j83 n THR 2058N 4.39 0.00 -1.09 2.92 -2.24 -1.26 -4.58 114.28 112.42 1j83 n THR 2058Ca -0.18 -0.18 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 1j83 n THR 2058Cb 0.51 0.61 -0.12 0.00 -2.10 0.00 0.00 70.33 69.23 1j83 n THR 2058CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j83 n ALA 2059N -1.44 6.69 -2.35 6.98 0.00 -1.26 -4.85 120.51 124.28 1j83 n ALA 2059Ca -0.00 -2.40 -0.31 0.00 0.00 0.00 0.00 53.44 50.73 1j83 n ALA 2059Cb 0.07 -2.70 -0.15 0.00 0.00 0.00 0.00 19.45 16.67 1j83 n ALA 2059CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1j83 s ILE 2060N 1.48 2.28 -0.08 0.00 -1.09 -1.26 -4.94 121.20 117.59 1j83 s ILE 2060Ca 0.66 -1.12 -0.22 0.00 -2.23 0.00 0.00 60.65 57.75 1j83 s ILE 2060Cb 0.26 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 39.27 1j83 s ILE 2060CO -0.02 0.52 0.63 0.20 -1.23 0.00 0.00 174.94 175.04 1j83 s ASN 2061N -0.82 6.90 -0.21 3.58 0.02 -1.06 -4.95 114.94 118.39 1j83 s ASN 2061Ca 0.11 1.08 -0.01 0.00 -1.02 0.00 0.00 52.86 53.01 1j83 s ASN 2061Cb -0.10 -2.37 0.06 0.00 0.02 0.00 0.00 41.25 38.85 1j83 s ASN 2061CO 0.00 -0.07 -0.01 -0.69 0.02 0.00 0.00 177.10 176.35 1j83 s VAL 2062N 0.72 1.00 0.21 1.60 1.01 -1.26 -1.16 120.40 122.51 1j83 s VAL 2062Ca 0.34 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1j83 s VAL 2062Cb -0.17 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1j83 s VAL 2062CO 0.16 -0.14 0.31 -1.83 0.00 0.00 0.00 175.10 173.60 1j83 s GLU 2063N 1.64 1.32 -0.23 2.72 -1.05 -0.61 -4.78 118.70 117.72 1j83 s GLU 2063Ca -0.03 -1.35 -0.14 0.00 -0.15 0.00 0.00 54.97 53.30 1j83 s GLU 2063Cb -0.18 0.38 -0.04 0.00 -0.44 0.00 0.00 34.13 33.85 1j83 s GLU 2063CO -0.07 -0.50 0.32 1.21 0.95 0.00 0.00 175.26 177.17 1j83 s ASN 2064N -3.05 6.30 -0.07 0.83 3.84 -1.26 -0.05 114.94 121.48 1j83 s ASN 2064Ca 0.26 0.34 -0.04 0.00 0.21 0.00 0.00 52.86 53.63 1j83 s ASN 2064Cb 0.03 -2.19 0.03 0.00 -0.55 0.00 0.00 41.25 38.57 1j83 s ASN 2064CO 0.07 -0.05 0.17 0.00 -2.79 0.00 0.00 177.10 174.50 1j83 s ALA 2065N 1.39 -0.37 -1.40 1.71 0.00 -0.44 -4.88 121.76 117.76 1j83 s ALA 2065Ca 0.15 0.63 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 1j83 s ALA 2065Cb -0.15 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.58 1j83 s ALA 2065CO 0.07 -0.13 0.46 -1.71 0.00 0.00 0.00 175.76 174.45 1j83 n ASN 2066N 3.65 -0.45 -3.42 0.00 4.05 -1.26 -1.58 115.26 116.25 1j83 n ASN 2066Ca -0.20 -0.98 -0.25 0.00 0.45 0.00 0.00 54.58 53.60 1j83 n ASN 2066Cb 0.55 -3.18 0.01 0.00 1.23 0.00 0.00 39.78 38.38 1j83 n ASN 2066CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1j83 n ASN 2067N -2.99 -4.28 -4.04 1.20 3.02 -1.26 -4.95 115.26 101.95 1j83 n ASN 2067Ca -0.31 -0.45 -0.10 0.00 -0.03 0.00 0.00 54.58 53.69 1j83 n ASN 2067Cb 0.68 -3.50 -0.06 0.00 -0.61 0.00 0.00 39.78 36.29 1j83 n ASN 2067CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j83 s ALA 2068N -3.04 0.08 -0.57 5.41 0.00 -0.61 -4.34 121.76 118.68 1j83 s ALA 2068Ca 0.44 -1.06 -0.20 0.00 0.00 0.00 0.00 51.96 51.14 1j83 s ALA 2068Cb -0.22 1.14 0.08 0.00 0.00 0.00 0.00 23.12 24.11 1j83 s ALA 2068CO 0.54 -0.79 0.74 -1.17 0.00 0.00 0.00 175.76 175.08 1j83 s LEU 2069N -3.05 4.95 -0.15 0.00 2.96 0.05 -1.33 118.68 122.11 1j83 s LEU 2069Ca 0.26 -1.07 -0.23 0.00 -0.22 0.00 0.00 54.13 52.87 1j83 s LEU 2069Cb 0.01 -2.42 -0.03 0.00 0.50 0.00 0.00 46.19 44.25 1j83 s LEU 2069CO 0.10 -1.11 0.70 -0.75 -1.32 0.00 0.00 176.35 173.97 1j83 s LYS 2070N 3.03 4.30 -0.26 1.98 2.20 0.93 -0.76 119.74 131.15 1j83 s LYS 2070Ca 0.16 0.80 -0.01 0.00 -0.36 0.00 0.00 55.97 56.56 1j83 s LYS 2070Cb -0.20 -3.54 0.04 0.00 -1.51 0.00 0.00 37.83 32.61 1j83 s LYS 2070CO 0.10 -0.18 -0.06 0.42 -0.36 0.00 0.00 175.35 175.27 1j83 s ILE 2071N 1.67 2.79 0.14 5.43 1.01 -0.22 -1.57 121.20 130.45 1j83 s ILE 2071Ca 0.34 -1.18 0.06 0.00 0.00 0.00 0.00 60.65 59.86 1j83 s ILE 2071Cb -0.16 -2.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 1j83 s ILE 2071CO 0.13 0.11 0.06 -0.44 0.00 0.00 0.00 174.94 174.80 1j83 s SER 2072N 1.28 5.17 -1.37 3.58 0.01 -0.31 -2.88 113.70 119.18 1j83 s SER 2072Ca -0.02 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.02 1j83 s SER 2072Cb -0.18 -1.25 0.00 0.00 0.21 0.00 0.00 66.02 64.80 1j83 s SER 2072CO -0.04 0.11 0.00 0.59 0.41 0.00 0.00 173.24 174.31 1j83 n ASN 2073N -0.01 -4.54 -0.09 2.44 3.02 -0.14 -2.57 115.26 113.37 1j83 n ASN 2073Ca -0.09 0.17 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 1j83 n ASN 2073Cb 0.54 -3.49 -0.01 0.00 -0.61 0.00 0.00 39.78 36.21 1j83 n ASN 2073CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1j83 h LEU 2074N 0.00 0.33 -0.12 3.41 3.38 -1.80 -1.73 115.31 118.78 1j83 h LEU 2074Ca -0.31 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1j83 h LEU 2074Cb 1.08 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1j83 h LEU 2074CO 0.41 0.24 -0.08 -1.13 0.09 0.00 0.00 178.44 177.98 1j83 h ASN 2075N 0.40 0.28 -0.33 -0.43 -0.00 -1.63 0.16 115.58 114.03 1j83 h ASN 2075Ca 0.12 -0.43 0.04 0.00 -0.00 0.00 0.00 56.30 56.02 1j83 h ASN 2075Cb -0.03 -0.08 -0.02 0.00 -0.00 0.00 0.00 38.32 38.19 1j83 h ASN 2075CO -0.04 0.65 0.22 0.28 -0.00 0.00 0.00 177.43 178.55 1j83 h SER 2076N -0.10 0.23 -0.28 1.15 0.02 -1.88 -1.52 113.55 111.16 1j83 h SER 2076Ca 0.03 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1j83 h SER 2076Cb 0.55 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1j83 h SER 2076CO 0.02 0.15 0.00 0.29 -1.14 0.00 0.00 176.83 176.16 1j83 n LYS 2077N -4.48 1.92 -0.90 3.45 4.76 -0.66 -4.94 118.16 117.30 1j83 n LYS 2077Ca 0.03 -1.40 0.00 0.00 -2.87 0.00 0.00 58.31 54.08 1j83 n LYS 2077Cb 0.21 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 1j83 n LYS 2077CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j83 n GLY 2078N 1.19 0.61 2.69 0.72 0.00 -0.57 -4.94 105.19 104.89 1j83 n GLY 2078Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1j83 n GLY 2078CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j83 n SER 2079N 0.00 6.54 -0.91 1.61 2.88 0.52 -4.55 113.62 119.72 1j83 n SER 2079Ca 0.00 -3.15 0.05 0.00 -1.33 0.00 0.00 58.87 54.44 1j83 n SER 2079Cb 0.00 -1.41 0.12 0.00 -0.75 0.00 0.00 64.21 62.17 1j83 n SER 2079CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1j83 n ASN 2080N 2.70 1.37 -4.68 -3.46 0.23 -1.26 -1.72 115.26 108.44 1j83 n ASN 2080Ca 0.50 -2.97 -0.42 0.00 -0.53 0.00 0.00 54.58 51.15 1j83 n ASN 2080Cb 0.31 -0.41 -0.03 0.00 -2.08 0.00 0.00 39.78 37.57 1j83 n ASN 2080CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1j83 s ASP 2081N -2.58 7.18 -0.22 0.53 -1.08 -1.26 -4.66 116.67 114.58 1j83 s ASP 2081Ca 0.33 1.45 0.15 0.00 -0.52 0.00 0.00 52.55 53.96 1j83 s ASP 2081Cb 0.35 -2.54 0.57 0.00 -1.46 0.00 0.00 42.92 39.84 1j83 s ASP 2081CO -0.10 -0.50 1.50 0.18 0.52 0.00 0.00 175.17 176.77 1j83 n LEU 2082N 5.39 4.30 -4.93 -1.34 4.77 -1.26 -4.60 117.00 119.33 1j83 n LEU 2082Ca 0.09 -3.16 -0.25 0.00 -0.03 0.00 0.00 56.01 52.66 1j83 n LEU 2082Cb 0.48 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 41.01 1j83 n LEU 2082CO 0.52 0.78 0.49 -0.94 -1.33 0.00 0.00 177.39 176.90 1j83 s SER 2083N -1.86 5.39 0.16 -1.43 1.04 -1.26 -4.95 113.70 110.79 1j83 s SER 2083Ca 0.45 0.47 0.01 0.00 0.48 0.00 0.00 55.95 57.36 1j83 s SER 2083Cb 0.37 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 65.09 1j83 s SER 2083CO 0.08 -1.15 1.38 -0.33 0.98 0.00 0.00 173.24 174.21 1j83 h GLU 2084N -0.15 0.26 0.00 4.02 5.08 -1.96 -3.38 114.58 118.46 1j83 h GLU 2084Ca -0.45 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 57.65 1j83 h GLU 2084Cb 1.28 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1j83 h GLU 2084CO 0.59 0.97 -1.06 0.41 -1.00 0.00 0.00 179.01 178.92 1j83 n GLY 2085N 0.81 -0.51 1.78 -3.84 0.00 -1.26 -1.33 105.19 100.84 1j83 n GLY 2085Ca -0.04 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.44 1j83 n GLY 2085CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j83 n ASN 2086N -1.59 3.40 0.13 1.61 5.15 -1.26 -4.46 115.26 118.24 1j83 n ASN 2086Ca 0.01 -3.62 0.10 0.00 -0.60 0.00 0.00 54.58 50.47 1j83 n ASN 2086Cb 0.29 -0.75 0.49 0.00 -0.53 0.00 0.00 39.78 39.28 1j83 n ASN 2086CO 0.00 0.00 0.00 2.22 1.40 0.00 0.00 177.26 180.88 1j83 n PHE 2087N -1.02 0.64 0.29 1.20 1.16 -1.26 -1.51 117.46 116.96 1j83 n PHE 2087Ca 0.47 0.31 0.19 0.00 -1.87 0.00 0.00 57.45 56.55 1j83 n PHE 2087Cb 1.40 -1.00 0.98 0.00 -1.61 0.00 0.00 39.48 39.25 1j83 n PHE 2087CO 0.00 0.00 0.00 -1.49 -1.87 0.00 0.00 176.76 173.40 1j83 h TRP 2088N 0.00 0.00 0.00 2.97 4.06 -1.96 -0.28 115.95 120.73 1j83 h TRP 2088Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1j83 h TRP 2088Cb 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.26 1j83 h TRP 2088CO 0.00 0.00 -0.24 0.00 -3.56 0.00 0.00 178.44 174.64 1j83 n ALA 2089N -1.98 2.76 -2.10 1.49 0.00 -0.57 -4.85 120.51 115.26 1j83 n ALA 2089Ca -0.02 -0.18 -0.23 0.00 0.00 0.00 0.00 53.44 53.00 1j83 n ALA 2089Cb 0.08 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.24 1j83 n ALA 2089CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1j83 s ASN 2090N -3.46 5.44 0.58 0.00 0.01 -0.12 -4.82 114.94 112.59 1j83 s ASN 2090Ca 0.11 0.29 -0.20 0.00 -0.71 0.00 0.00 52.86 52.35 1j83 s ASN 2090Cb 0.17 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.52 1j83 s ASN 2090CO 0.62 -1.06 1.31 0.55 -1.51 0.00 0.00 177.10 177.01 1j83 n VAL 2091N -2.39 4.21 -5.22 1.60 3.14 -1.24 -4.42 118.33 114.01 1j83 n VAL 2091Ca 0.05 -0.50 -0.32 0.00 -2.96 0.00 0.00 64.34 60.62 1j83 n VAL 2091Cb 0.59 -1.56 -0.17 0.00 -1.06 0.00 0.00 33.84 31.63 1j83 n VAL 2091CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1j83 s ARG 2092N -3.03 2.80 0.13 1.45 0.52 -1.26 -1.32 118.95 118.23 1j83 s ARG 2092Ca 0.76 -0.88 0.08 0.00 -0.52 0.00 0.00 55.73 55.17 1j83 s ARG 2092Cb -0.41 -2.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.82 1j83 s ARG 2092CO 0.46 0.26 -0.19 0.96 0.02 0.00 0.00 175.30 176.81 1j83 s ILE 2093N 0.14 1.69 0.06 1.52 -0.00 -0.38 -0.77 121.20 123.45 1j83 s ILE 2093Ca -0.12 -1.71 -0.10 0.00 -0.00 0.00 0.00 60.65 58.72 1j83 s ILE 2093Cb -0.16 -1.65 0.01 0.00 -0.00 0.00 0.00 42.46 40.66 1j83 s ILE 2093CO 0.07 -0.21 0.23 -0.94 -0.00 0.00 0.00 174.94 174.08 1j83 s SER 2094N -2.27 0.02 -1.35 4.36 1.04 -0.00 -0.81 113.70 114.68 1j83 s SER 2094Ca 0.10 -0.43 -0.06 0.00 0.48 0.00 0.00 55.95 56.04 1j83 s SER 2094Cb -0.08 0.33 0.10 0.00 0.10 0.00 0.00 66.02 66.48 1j83 s SER 2094CO 0.05 -0.65 2.41 0.00 0.98 0.00 0.00 173.24 176.03 1j83 n ALA 2095N 0.33 6.79 0.33 5.32 0.00 -1.26 -1.24 120.51 130.78 1j83 n ALA 2095Ca -0.17 -4.05 0.11 0.00 0.00 0.00 0.00 53.44 49.33 1j83 n ALA 2095Cb 0.61 -2.85 0.49 0.00 0.00 0.00 0.00 19.45 17.70 1j83 n ALA 2095CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1j83 n ASP 2096N 2.06 0.58 -1.74 0.00 8.00 -0.85 -2.34 116.55 122.26 1j83 n ASP 2096Ca 0.63 0.68 -0.03 0.00 0.71 0.00 0.00 54.79 56.77 1j83 n ASP 2096Cb 0.25 -0.79 0.07 0.00 -0.02 0.00 0.00 41.12 40.64 1j83 n ASP 2096CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1j83 n ILE 2097N -2.18 1.45 -0.05 0.53 -5.35 -1.11 -4.83 119.36 107.83 1j83 n ILE 2097Ca 0.01 -2.79 -0.11 0.00 -0.27 0.00 0.00 62.75 59.60 1j83 n ILE 2097Cb 0.17 0.28 -0.05 0.00 -1.74 0.00 0.00 39.64 38.30 1j83 n ILE 2097CO 0.00 0.00 0.00 -0.25 -1.76 0.00 0.00 176.55 174.54 1j83 h TRP 2098N 1.69 0.27 -2.15 4.28 7.01 -1.63 -3.38 115.95 122.03 1j83 h TRP 2098Ca -0.01 -0.02 -0.38 0.00 2.11 0.00 0.00 58.89 60.59 1j83 h TRP 2098Cb 1.44 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 28.36 1j83 h TRP 2098CO 0.56 0.33 -0.44 0.41 -2.79 0.00 0.00 178.44 176.51 1j83 n GLY 2099N -0.69 0.27 3.26 2.65 0.00 -1.26 -4.38 105.19 105.03 1j83 n GLY 2099Ca -0.04 -0.10 -0.17 0.00 0.00 0.00 0.00 46.02 45.71 1j83 n GLY 2099CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j83 s GLN 2100N -4.53 1.59 0.04 1.61 -1.52 -1.26 -5.09 119.66 110.50 1j83 s GLN 2100Ca 0.00 -1.91 -0.16 0.00 -1.95 0.00 0.00 55.36 51.35 1j83 s GLN 2100Cb 0.00 0.31 0.03 0.00 -0.22 0.00 0.00 33.01 33.12 1j83 s GLN 2100CO 0.00 -0.57 0.35 -1.54 -0.25 0.00 0.00 175.29 173.28 1j83 s SER 2101N -3.31 -0.20 -0.06 5.90 1.04 -1.26 -4.72 113.70 111.09 1j83 s SER 2101Ca 0.40 -0.09 -0.00 0.00 0.48 0.00 0.00 55.95 56.74 1j83 s SER 2101Cb 0.04 0.39 0.03 0.00 0.10 0.00 0.00 66.02 66.57 1j83 s SER 2101CO 0.23 -0.63 -0.02 -0.63 0.98 0.00 0.00 173.24 173.18 1j83 s ILE 2102N -2.44 0.43 -0.39 -1.02 1.01 -0.73 -4.96 121.20 113.09 1j83 s ILE 2102Ca -0.06 0.02 -0.29 0.00 0.00 0.00 0.00 60.65 60.33 1j83 s ILE 2102Cb -0.01 -0.53 0.02 0.00 0.01 0.00 0.00 42.46 41.95 1j83 s ILE 2102CO -0.02 0.24 1.13 0.21 0.00 0.00 0.00 174.94 176.49 1j83 s ASN 2103N 1.51 6.76 -0.22 3.58 2.47 -1.26 -0.54 114.94 127.24 1j83 s ASN 2103Ca -0.02 0.79 0.14 0.00 0.42 0.00 0.00 52.86 54.19 1j83 s ASN 2103Cb -0.13 -2.55 0.59 0.00 -1.45 0.00 0.00 41.25 37.71 1j83 s ASN 2103CO -0.03 -1.08 1.52 2.30 -3.72 0.00 0.00 177.10 176.09 1j83 n ILE 2104N 6.37 2.48 -1.68 -5.21 -5.35 0.21 -4.99 119.36 111.19 1j83 n ILE 2104Ca 0.12 -1.94 -0.46 0.00 -0.27 0.00 0.00 62.75 60.21 1j83 n ILE 2104Cb 0.48 -0.28 -0.04 0.00 -1.74 0.00 0.00 39.64 38.05 1j83 n ILE 2104CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1j83 n TYR 2105N -0.46 2.39 0.00 4.28 9.36 -1.25 -1.10 117.16 130.38 1j83 n TYR 2105Ca 0.27 -0.01 0.00 0.00 3.32 0.00 0.00 57.90 61.48 1j83 n TYR 2105Cb 1.02 -2.66 0.00 0.00 -0.63 0.00 0.00 39.34 37.07 1j83 n TYR 2105CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1j83 n GLY 2106N 4.17 2.28 3.78 2.98 0.00 0.06 -5.05 105.19 113.42 1j83 n GLY 2106Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1j83 n GLY 2106CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1j83 s ASP 2107N -1.73 5.82 0.00 1.61 1.01 -0.26 -4.77 116.67 118.36 1j83 s ASP 2107Ca 0.00 2.06 0.00 0.00 0.71 0.00 0.00 52.55 55.32 1j83 s ASP 2107Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1j83 s ASP 2107CO 0.00 -1.14 0.05 0.35 0.21 0.00 0.00 175.17 174.64 1j83 n THR 2108N -1.40 0.00 -4.10 -1.27 -2.24 -0.58 -4.83 114.28 99.86 1j83 n THR 2108Ca 0.11 -0.29 -0.14 0.00 -2.27 0.00 0.00 64.05 61.46 1j83 n THR 2108Cb 0.52 1.07 -0.11 0.00 -2.10 0.00 0.00 70.33 69.71 1j83 n THR 2108CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1j83 s LYS 2109N -0.47 0.62 -0.24 -0.78 1.02 -0.84 -1.34 119.74 117.71 1j83 s LYS 2109Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.12 1j83 s LYS 2109Cb 0.00 -0.37 0.06 0.00 -0.52 0.00 0.00 37.83 37.00 1j83 s LYS 2109CO 0.00 0.06 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.29 1j83 s LEU 2110N -1.82 2.49 0.50 3.17 2.96 0.85 -0.94 118.68 125.89 1j83 s LEU 2110Ca -0.06 -1.19 0.04 0.00 -0.22 0.00 0.00 54.13 52.70 1j83 s LEU 2110Cb -0.08 -1.12 -0.01 0.00 0.50 0.00 0.00 46.19 45.48 1j83 s LEU 2110CO 0.00 -0.25 0.18 0.42 -1.32 0.00 0.00 176.35 175.37 1j83 s THR 2111N 1.43 1.59 -0.01 3.68 -4.23 0.07 -0.68 115.64 117.49 1j83 s THR 2111Ca -0.04 -1.76 0.06 0.00 -1.18 0.00 0.00 61.69 58.76 1j83 s THR 2111Cb -0.19 -2.35 -0.03 0.00 1.34 0.00 0.00 72.50 71.27 1j83 s THR 2111CO -0.07 0.00 -0.18 -1.81 -0.54 0.00 0.00 174.62 172.02 1j83 s ASP 2113N -4.02 3.74 -0.18 3.99 1.01 0.06 -0.96 116.67 120.32 1j83 s ASP 2113Ca 0.24 -0.33 0.01 0.00 0.71 0.00 0.00 52.55 53.17 1j83 s ASP 2113Cb 0.01 -0.66 0.02 0.00 1.01 0.00 0.00 42.92 43.30 1j83 s ASP 2113CO 0.14 0.31 -0.19 -0.69 0.21 0.00 0.00 175.17 174.94 1j83 s VAL 2114N -0.77 2.14 -0.01 -1.27 1.01 0.28 -1.70 120.40 120.08 1j83 s VAL 2114Ca 0.12 -0.92 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1j83 s VAL 2114Cb -0.10 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1j83 s VAL 2114CO 0.02 0.53 -0.23 -0.63 0.00 0.00 0.00 175.10 174.79 1j83 s ILE 2115N 1.22 2.30 0.07 2.22 1.01 0.51 -1.08 121.20 127.46 1j83 s ILE 2115Ca 0.03 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.48 1j83 s ILE 2115Cb -0.13 -1.84 0.02 0.00 0.01 0.00 0.00 42.46 40.51 1j83 s ILE 2115CO -0.11 0.54 0.28 0.00 0.00 0.00 0.00 174.94 175.65 1j83 s ALA 2116N -0.68 -0.57 -1.18 9.38 0.00 -0.43 0.07 121.76 128.35 1j83 s ALA 2116Ca 0.11 -0.22 0.19 0.00 0.00 0.00 0.00 51.96 52.03 1j83 s ALA 2116Cb -0.10 0.45 0.87 0.00 0.00 0.00 0.00 23.12 24.34 1j83 s ALA 2116CO 0.00 -0.49 1.60 -0.35 0.00 0.00 0.00 175.76 176.52 1j83 n PRO 2117N 0.21 0.12 -3.61 0.00 -0.04 -1.26 -0.64 135.00 129.78 1j83 n PRO 2117Ca -0.17 0.15 -0.10 0.00 -0.04 0.00 0.00 63.50 63.33 1j83 n PRO 2117Cb 0.61 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.54 1j83 n PRO 2117CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1j83 s THR 2118N -2.82 0.02 0.38 0.52 -1.32 -1.26 -4.64 115.64 106.51 1j83 s THR 2118Ca 0.13 -0.46 -0.28 0.00 -1.21 0.00 0.00 61.69 59.87 1j83 s THR 2118Cb 0.13 -1.35 -0.11 0.00 -1.51 0.00 0.00 72.50 69.66 1j83 s THR 2118CO 0.32 -0.08 1.44 -2.65 -2.21 0.00 0.00 174.62 171.44 1j83 n PRO 2119N -0.36 2.52 -3.82 7.08 -0.02 -1.26 -4.81 135.00 134.33 1j83 n PRO 2119Ca -0.13 0.88 -0.14 0.00 -2.02 0.00 0.00 63.50 62.10 1j83 n PRO 2119Cb 0.63 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 1j83 n PRO 2119CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1j83 n VAL 2120N 0.34 0.00 -4.72 -1.45 0.24 -1.26 -4.91 118.33 106.57 1j83 n VAL 2120Ca 0.02 -1.68 -0.33 0.00 -2.04 0.00 0.00 64.34 60.31 1j83 n VAL 2120Cb 0.39 1.02 -0.15 0.00 -1.47 0.00 0.00 33.84 33.63 1j83 n VAL 2120CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1j83 s ASN 2121N -3.02 3.67 0.00 -1.34 0.01 -1.26 -1.69 114.94 111.31 1j83 s ASN 2121Ca 0.27 -0.44 0.02 0.00 -0.71 0.00 0.00 52.86 52.01 1j83 s ASN 2121Cb -0.01 -1.55 -0.01 0.00 0.41 0.00 0.00 41.25 40.09 1j83 s ASN 2121CO 0.20 0.12 -0.07 -0.69 -1.51 0.00 0.00 177.10 175.15 1j83 s VAL 2122N 0.59 0.58 -0.07 1.60 1.01 -0.33 -2.44 120.40 121.33 1j83 s VAL 2122Ca -0.09 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.50 1j83 s VAL 2122Cb -0.16 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 35.73 1j83 s VAL 2122CO 0.03 0.10 -0.12 -0.55 0.00 0.00 0.00 175.10 174.56 1j83 s SER 2123N -0.34 1.77 -0.03 3.32 0.15 0.15 -1.13 113.70 117.59 1j83 s SER 2123Ca 0.02 -0.30 0.02 0.00 0.70 0.00 0.00 55.95 56.39 1j83 s SER 2123Cb -0.04 -0.83 0.01 0.00 -1.71 0.00 0.00 66.02 63.46 1j83 s SER 2123CO -0.00 0.03 -0.08 -0.63 1.20 0.00 0.00 173.24 173.76 1j83 s ILE 2124N 0.66 0.75 0.11 6.45 -1.09 -0.37 -0.65 121.20 127.05 1j83 s ILE 2124Ca -0.15 -0.31 0.10 0.00 -2.23 0.00 0.00 60.65 58.06 1j83 s ILE 2124Cb -0.16 -0.69 -0.04 0.00 -1.58 0.00 0.00 42.46 40.00 1j83 s ILE 2124CO 0.04 0.25 -0.25 0.00 -1.23 0.00 0.00 174.94 173.74 1j83 s ALA 2125N 0.40 2.18 0.01 9.38 0.00 -0.75 -0.71 121.76 132.27 1j83 s ALA 2125Ca -0.06 -1.36 0.02 0.00 0.00 0.00 0.00 51.96 50.55 1j83 s ALA 2125Cb -0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1j83 s ALA 2125CO 0.01 0.49 -0.06 0.00 0.00 0.00 0.00 175.76 176.20 1j83 s ALA 2126N -1.03 0.43 -0.47 0.00 0.00 -1.26 -0.72 121.76 118.70 1j83 s ALA 2126Ca 0.11 -0.38 0.03 0.00 0.00 0.00 0.00 51.96 51.72 1j83 s ALA 2126Cb -0.10 -0.05 0.14 0.00 0.00 0.00 0.00 23.12 23.12 1j83 s ALA 2126CO 0.05 0.05 0.29 0.42 0.00 0.00 0.00 175.76 176.57 1j83 s ILE 2127N -0.54 1.49 0.57 0.00 1.01 0.22 -4.71 121.20 119.24 1j83 s ILE 2127Ca -0.02 -2.82 -0.19 0.00 0.00 0.00 0.00 60.65 57.61 1j83 s ILE 2127Cb -0.05 -2.03 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1j83 s ILE 2127CO -0.00 -0.95 1.19 -2.84 0.00 0.00 0.00 174.94 172.34 1j83 s PRO 2128N 0.05 3.13 0.06 2.79 0.02 -1.26 -1.95 135.00 137.83 1j83 s PRO 2128Ca 0.21 1.79 0.06 0.00 0.02 0.00 0.00 61.00 63.07 1j83 s PRO 2128Cb -0.18 -1.99 -0.03 0.00 0.02 0.00 0.00 34.50 32.32 1j83 s PRO 2128CO -0.05 -1.07 -0.16 -0.65 -0.33 0.00 0.00 177.00 174.74 1j83 s GLN 2129N -3.26 1.02 0.33 5.54 -0.21 0.03 -4.57 119.66 118.53 1j83 s GLN 2129Ca 0.75 -0.91 0.03 0.00 0.02 0.00 0.00 55.36 55.25 1j83 s GLN 2129Cb -0.29 -1.09 -0.05 0.00 1.00 0.00 0.00 33.01 32.58 1j83 s GLN 2129CO 0.32 0.26 0.09 -1.54 -2.12 0.00 0.00 175.29 172.30 1j83 s SER 2130N -1.42 2.15 0.35 5.90 1.04 -0.56 0.20 113.70 121.35 1j83 s SER 2130Ca 0.03 -1.45 0.04 0.00 0.48 0.00 0.00 55.95 55.04 1j83 s SER 2130Cb -0.09 0.13 0.68 0.00 0.10 0.00 0.00 66.02 66.84 1j83 s SER 2130CO 0.02 -0.72 1.97 0.77 0.98 0.00 0.00 173.24 176.26 1j83 h SER 2131N 2.11 0.72 -0.01 7.02 4.64 -1.95 -2.83 113.55 123.24 1j83 h SER 2131Ca -0.39 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1j83 h SER 2131Cb 1.25 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1j83 h SER 2131CO 0.64 0.48 -0.43 0.35 -0.87 0.00 0.00 176.83 177.00 1j83 n THR 2132N -4.47 0.00 -3.70 2.95 -2.24 -1.26 -4.69 114.28 100.87 1j83 n THR 2132Ca 0.10 -0.29 -0.28 0.00 -2.27 0.00 0.00 64.05 61.31 1j83 n THR 2132Cb 0.17 1.18 -0.11 0.00 -2.10 0.00 0.00 70.33 69.47 1j83 n THR 2132CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1j83 n HIS 2133N -0.26 1.63 0.77 4.78 8.25 -1.07 -4.96 115.22 124.36 1j83 n HIS 2133Ca 0.07 -3.92 0.13 0.00 -0.26 0.00 0.00 57.72 53.74 1j83 n HIS 2133Cb 0.36 -0.28 0.45 0.00 1.12 0.00 0.00 29.99 31.64 1j83 n HIS 2133CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j83 n GLY 2134N 2.29 -1.59 3.57 -1.41 0.00 -1.24 -1.50 105.19 105.32 1j83 n GLY 2134Ca 0.24 -0.09 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 1j83 n GLY 2134CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1j83 s TRP 2135N -3.07 -0.68 -0.29 1.61 -0.11 -1.26 -4.88 118.94 110.26 1j83 s TRP 2135Ca 0.11 1.39 -0.15 0.00 1.22 0.00 0.00 56.10 58.68 1j83 s TRP 2135Cb 0.15 0.36 0.11 0.00 -1.50 0.00 0.00 33.47 32.59 1j83 s TRP 2135CO 0.59 -0.49 0.78 0.20 -4.62 0.00 0.00 176.95 173.40 1j83 s GLY 2136N -0.55 -0.47 0.09 5.86 0.00 -1.26 -4.86 107.32 106.13 1j83 s GLY 2136Ca -0.06 2.64 -0.31 0.00 0.00 0.00 0.00 44.72 46.99 1j83 s GLY 2136CO 0.06 2.68 1.49 -1.31 0.00 0.00 0.00 173.10 176.02 1j83 s ASN 2137N 1.94 6.73 0.48 1.64 0.01 -1.26 -4.61 114.94 119.86 1j83 s ASN 2137Ca -0.08 2.37 -0.23 0.00 -0.71 0.00 0.00 52.86 54.21 1j83 s ASN 2137Cb -0.06 -2.58 -0.07 0.00 0.41 0.00 0.00 41.25 38.95 1j83 s ASN 2137CO -0.18 -0.76 1.30 -2.84 -1.51 0.00 0.00 177.10 173.11 1j83 s PRO 2138N 1.79 3.56 0.11 -0.60 0.02 -1.26 -4.30 135.00 134.31 1j83 s PRO 2138Ca 0.68 2.10 -0.06 0.00 0.02 0.00 0.00 61.00 63.74 1j83 s PRO 2138Cb -0.38 -2.46 -0.17 0.00 0.02 0.00 0.00 34.50 31.52 1j83 s PRO 2138CO 0.30 -0.81 1.24 1.15 -0.33 0.00 0.00 177.00 178.55 1j83 h THR 2139N 1.89 1.40 -2.58 0.99 2.02 -1.07 -3.48 112.91 112.08 1j83 h THR 2139Ca -0.50 -2.57 -0.02 0.00 0.77 0.00 0.00 66.41 64.09 1j83 h THR 2139Cb 1.27 2.57 -0.15 0.00 -1.74 0.00 0.00 68.15 70.10 1j83 h THR 2139CO 0.60 0.77 0.24 0.00 0.37 0.00 0.00 175.52 177.49 1j83 s ARG 2140N -3.10 1.15 0.22 6.66 1.70 -1.17 -4.82 118.95 119.59 1j83 s ARG 2140Ca -0.06 -0.20 -0.06 0.00 -0.47 0.00 0.00 55.73 54.94 1j83 s ARG 2140Cb 0.08 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 34.94 1j83 s ARG 2140CO 0.88 -0.46 0.49 0.00 -1.08 0.00 0.00 175.30 175.13 1j83 s ALA 2141N -2.80 3.67 -0.13 7.88 0.00 -0.44 -4.77 121.76 125.17 1j83 s ALA 2141Ca -0.03 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.39 1j83 s ALA 2141Cb -0.01 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.82 1j83 s ALA 2141CO -0.05 0.46 0.02 0.42 0.00 0.00 0.00 175.76 176.61 1j83 s ILE 2142N -1.86 4.40 0.08 0.00 -1.09 0.11 -4.67 121.20 118.18 1j83 s ILE 2142Ca 0.44 -0.19 0.06 0.00 -2.23 0.00 0.00 60.65 58.73 1j83 s ILE 2142Cb -0.11 -2.92 -0.04 0.00 -1.58 0.00 0.00 42.46 37.81 1j83 s ILE 2142CO 0.26 0.53 -0.09 -0.13 -1.23 0.00 0.00 174.94 174.29 1j83 s ARG 2143N -0.19 2.25 -0.13 2.79 3.00 -1.26 -1.24 118.95 124.16 1j83 s ARG 2143Ca 0.06 -0.95 0.01 0.00 0.00 0.00 0.00 55.73 54.85 1j83 s ARG 2143Cb -0.12 -2.36 0.02 0.00 0.00 0.00 0.00 34.95 32.48 1j83 s ARG 2143CO 0.02 0.53 -0.14 0.14 0.00 0.00 0.00 175.30 175.85 1j83 s VAL 2144N -1.18 1.47 0.54 3.52 -7.23 -0.28 -5.01 120.40 112.23 1j83 s VAL 2144Ca 0.21 -0.59 0.07 0.00 -1.81 0.00 0.00 61.98 59.86 1j83 s VAL 2144Cb -0.11 -1.39 0.06 0.00 0.56 0.00 0.00 36.38 35.50 1j83 s VAL 2144CO 0.13 0.44 0.74 0.26 -0.31 0.00 0.00 175.10 176.36 1j83 s TRP 2145N 1.38 2.05 0.34 2.82 0.52 -1.26 -1.19 118.94 123.59 1j83 s TRP 2145Ca 0.02 -0.49 0.11 0.00 0.02 0.00 0.00 56.10 55.76 1j83 s TRP 2145Cb -0.13 -2.42 0.89 0.00 -1.15 0.00 0.00 33.47 30.66 1j83 s TRP 2145CO -0.08 -0.95 1.77 1.79 0.02 0.00 0.00 176.95 179.50 1j83 h THR 2146N 0.23 0.62 0.00 2.01 1.35 -1.68 0.13 112.91 115.58 1j83 h THR 2146Ca -0.35 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1j83 h THR 2146Cb 1.28 -0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1j83 h THR 2146CO 0.43 0.11 0.00 -0.46 -0.25 0.00 0.00 175.52 175.35 1j83 n ASN 2147N -4.74 0.00 -0.02 5.36 0.23 -1.26 -1.98 115.26 112.85 1j83 n ASN 2147Ca 0.24 0.41 0.12 0.00 -0.53 0.00 0.00 54.58 54.82 1j83 n ASN 2147Cb 0.69 -0.46 0.17 0.00 -2.08 0.00 0.00 39.78 38.10 1j83 n ASN 2147CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1j83 n ASN 2148N -1.46 0.66 -4.74 0.53 3.02 0.46 -4.88 115.26 108.85 1j83 n ASN 2148Ca 0.05 -0.47 -0.40 0.00 -0.03 0.00 0.00 54.58 53.73 1j83 n ASN 2148Cb 0.18 0.42 -0.05 0.00 -0.61 0.00 0.00 39.78 39.72 1j83 n ASN 2148CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1j83 s PHE 2149N -2.97 3.68 -0.10 3.10 0.40 -0.84 -4.32 117.98 116.93 1j83 s PHE 2149Ca 0.11 1.34 0.02 0.00 -0.60 0.00 0.00 56.93 57.81 1j83 s PHE 2149Cb 0.17 -2.75 -0.01 0.00 0.51 0.00 0.00 43.02 40.94 1j83 s PHE 2149CO 0.73 0.25 -0.18 0.08 0.70 0.00 0.00 175.22 176.80 1j83 s VAL 2150N 0.10 2.63 0.20 -0.44 1.01 0.19 -4.83 120.40 119.25 1j83 s VAL 2150Ca 0.36 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 1j83 s VAL 2150Cb -0.19 -2.05 -0.10 0.00 0.00 0.00 0.00 36.38 34.03 1j83 s VAL 2150CO 0.20 0.55 1.57 0.00 0.00 0.00 0.00 175.10 177.43 1j83 s ALA 2151N 0.12 3.78 0.30 5.51 0.00 -1.26 -1.11 121.76 129.09 1j83 s ALA 2151Ca -0.09 1.42 0.07 0.00 0.00 0.00 0.00 51.96 53.36 1j83 s ALA 2151Cb -0.15 -3.63 -0.03 0.00 0.00 0.00 0.00 23.12 19.31 1j83 s ALA 2151CO 0.06 -0.82 0.28 -0.65 0.00 0.00 0.00 175.76 174.62 1j83 s GLN 2152N 0.73 2.87 0.49 0.00 -1.52 0.65 -4.93 119.66 117.95 1j83 s GLN 2152Ca 0.68 -1.16 0.15 0.00 -1.95 0.00 0.00 55.36 53.09 1j83 s GLN 2152Cb -0.45 -2.56 1.17 0.00 -0.22 0.00 0.00 33.01 30.95 1j83 s GLN 2152CO 0.35 0.22 2.09 1.79 -0.25 0.00 0.00 175.29 179.49 1j83 h THR 2153N 1.30 0.98 -0.04 -0.19 1.35 -1.95 -1.55 112.91 112.81 1j83 h THR 2153Ca -0.47 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1j83 h THR 2153Cb 1.25 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1j83 h THR 2153CO 0.59 0.03 0.00 -0.90 -0.25 0.00 0.00 175.52 174.99 1j83 n ASP 2154N -4.50 0.28 0.00 5.36 5.68 -1.26 -4.88 116.55 117.24 1j83 n ASP 2154Ca 0.02 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.55 1j83 n ASP 2154Cb 0.18 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1j83 n ASP 2154CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j83 n GLY 2155N 0.70 1.38 3.98 6.12 0.00 -0.58 -5.05 105.19 111.75 1j83 n GLY 2155Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 1j83 n GLY 2155CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j83 s THR 2156N -2.47 2.18 -0.05 2.61 -4.23 -1.26 -4.81 115.64 107.61 1j83 s THR 2156Ca 0.00 -0.52 0.06 0.00 -1.18 0.00 0.00 61.69 60.05 1j83 s THR 2156Cb 0.00 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 1j83 s THR 2156CO 0.00 0.00 -0.23 -0.31 -0.54 0.00 0.00 174.62 173.54 1j83 s TYR 2157N -3.19 2.28 0.02 3.99 1.51 0.19 -0.25 117.35 121.90 1j83 s TYR 2157Ca 0.66 -0.67 0.04 0.00 -1.01 0.00 0.00 57.07 56.09 1j83 s TYR 2157Cb -0.06 -1.50 -0.02 0.00 -0.11 0.00 0.00 41.96 40.28 1j83 s TYR 2157CO 0.45 -0.20 -0.12 0.21 -1.11 0.00 0.00 175.55 174.77 1j83 s LYS 2158N -0.13 0.87 0.08 -0.62 2.20 -0.27 -1.32 119.74 120.55 1j83 s LYS 2158Ca -0.03 -0.58 0.05 0.00 -0.36 0.00 0.00 55.97 55.05 1j83 s LYS 2158Cb -0.13 -0.84 -0.03 0.00 -1.51 0.00 0.00 37.83 35.32 1j83 s LYS 2158CO 0.03 0.22 -0.14 0.00 -0.36 0.00 0.00 175.35 175.10 1j83 s ALA 2159N -0.60 1.21 -0.18 3.13 0.00 -0.24 -0.63 121.76 124.44 1j83 s ALA 2159Ca 0.02 -1.04 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 1j83 s ALA 2159Cb -0.06 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1j83 s ALA 2159CO 0.00 0.15 0.06 0.99 0.00 0.00 0.00 175.76 176.97 1j83 s THR 2160N -1.42 4.82 -0.13 0.00 2.01 -1.26 -0.56 115.64 119.10 1j83 s THR 2160Ca -0.00 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.99 1j83 s THR 2160Cb -0.09 -3.17 -0.00 0.00 0.01 0.00 0.00 72.50 69.25 1j83 s THR 2160CO 0.02 0.46 -0.19 -0.22 -0.69 0.00 0.00 174.62 174.01 1j83 s LEU 2161N 0.34 2.33 -0.10 4.42 0.20 -1.26 -4.99 118.68 119.62 1j83 s LEU 2161Ca 0.03 -0.49 0.03 0.00 0.69 0.00 0.00 54.13 54.38 1j83 s LEU 2161Cb -0.12 -1.50 0.01 0.00 -0.43 0.00 0.00 46.19 44.15 1j83 s LEU 2161CO -0.00 0.13 -0.18 -0.89 -0.29 0.00 0.00 176.35 175.12 1j83 s THR 2162N 0.56 1.63 -0.15 3.68 2.01 -1.26 -4.40 115.64 117.70 1j83 s THR 2162Ca -0.11 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 1j83 s THR 2162Cb -0.16 -1.45 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 1j83 s THR 2162CO 0.04 0.47 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.69 1j83 s ILE 2163N 0.71 3.11 0.46 1.82 1.01 0.15 -4.94 121.20 123.52 1j83 s ILE 2163Ca -0.12 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 59.98 1j83 s ILE 2163Cb -0.16 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 39.99 1j83 s ILE 2163CO 0.03 0.50 0.50 -0.94 0.00 0.00 0.00 174.94 175.03 1j83 s SER 2164N 0.62 5.19 0.30 3.58 1.04 -1.26 -0.10 113.70 123.06 1j83 s SER 2164Ca -0.06 -0.73 0.23 0.00 0.48 0.00 0.00 55.95 55.87 1j83 s SER 2164Cb -0.15 -0.34 1.10 0.00 0.10 0.00 0.00 66.02 66.73 1j83 s SER 2164CO 0.03 -0.85 1.69 0.35 0.98 0.00 0.00 173.24 175.44 1j83 n THR 2165N -1.77 0.95 0.72 2.02 -2.24 -0.45 -0.82 114.28 112.68 1j83 n THR 2165Ca 0.06 0.53 0.13 0.00 -2.27 0.00 0.00 64.05 62.50 1j83 n THR 2165Cb 0.61 -1.51 0.40 0.00 -2.10 0.00 0.00 70.33 67.74 1j83 n THR 2165CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1j83 n ASN 2166N -2.26 0.60 -0.00 3.42 5.15 -1.26 -3.50 115.26 117.41 1j83 n ASN 2166Ca -0.00 0.44 0.11 0.00 -0.60 0.00 0.00 54.58 54.53 1j83 n ASN 2166Cb 0.11 -0.52 -0.13 0.00 -0.53 0.00 0.00 39.78 38.71 1j83 n ASN 2166CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1j83 n ASP 2167N -2.03 0.45 -3.55 1.20 8.00 0.00 -4.84 116.55 115.79 1j83 n ASP 2167Ca 0.05 -0.40 -0.27 0.00 0.71 0.00 0.00 54.79 54.88 1j83 n ASP 2167Cb 0.41 1.48 -0.15 0.00 -0.02 0.00 0.00 41.12 42.83 1j83 n ASP 2167CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1j83 s SER 2168N -3.89 3.04 0.36 -2.24 0.15 -1.17 -0.43 113.70 109.52 1j83 s SER 2168Ca -0.01 -1.04 0.09 0.00 0.70 0.00 0.00 55.95 55.70 1j83 s SER 2168Cb 0.15 -0.25 0.83 0.00 -1.71 0.00 0.00 66.02 65.04 1j83 s SER 2168CO 0.88 -0.41 1.88 1.55 1.20 0.00 0.00 173.24 178.34 1j83 h PRO 2169N 8.40 0.66 -0.13 5.44 0.13 -1.75 -0.86 132.00 143.89 1j83 h PRO 2169Ca -0.18 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 64.78 1j83 h PRO 2169Cb 1.06 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1j83 h PRO 2169CO 0.39 0.44 -0.49 -0.97 -0.23 0.00 0.00 178.00 177.14 1j83 h ASN 2170N 0.68 0.38 -0.40 1.44 -1.24 -1.87 -0.31 115.58 114.25 1j83 h ASN 2170Ca 0.43 -0.18 -0.02 0.00 0.71 0.00 0.00 56.30 57.24 1j83 h ASN 2170Cb 0.70 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.62 1j83 h ASN 2170CO -0.19 0.81 0.17 0.15 -1.29 0.00 0.00 177.43 177.08 1j83 h PHE 2171N 0.28 0.60 -0.34 0.67 3.57 -1.44 -1.48 116.94 118.79 1j83 h PHE 2171Ca 0.01 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1j83 h PHE 2171Cb 0.96 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 1j83 h PHE 2171CO 0.03 0.52 0.19 -0.97 -2.23 0.00 0.00 178.31 175.84 1j83 h ASN 2172N 0.50 0.42 -0.39 0.41 -1.24 -0.92 -1.06 115.58 113.31 1j83 h ASN 2172Ca 0.13 -0.08 0.01 0.00 0.71 0.00 0.00 56.30 57.07 1j83 h ASN 2172Cb 0.16 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.08 1j83 h ASN 2172CO -0.01 0.38 0.25 0.74 -1.29 0.00 0.00 177.43 177.50 1j83 h THR 2173N 0.43 1.08 -0.29 -3.57 2.02 -0.90 -1.93 112.91 109.75 1j83 h THR 2173Ca 0.12 -0.17 -0.07 0.00 0.77 0.00 0.00 66.41 67.06 1j83 h THR 2173Cb 0.05 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 1j83 h THR 2173CO -0.02 0.09 -0.09 0.40 0.37 0.00 0.00 175.52 176.27 1j83 h ILE 2174N 0.50 1.28 0.00 3.11 2.04 -1.17 -2.27 117.51 121.00 1j83 h ILE 2174Ca 0.15 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 1j83 h ILE 2174Cb -0.04 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1j83 h ILE 2174CO -0.05 0.36 -0.05 0.00 0.00 0.00 0.00 178.15 178.42 1j83 h ALA 2175N 0.78 1.13 -0.31 1.87 0.00 -1.06 -2.72 119.26 118.95 1j83 h ALA 2175Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1j83 h ALA 2175Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1j83 h ALA 2175CO 0.03 0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.59 1j83 n THR 2176N -3.34 0.82 -3.32 0.00 -2.24 -0.74 -0.76 114.28 104.70 1j83 n THR 2176Ca -0.02 -0.91 -0.44 0.00 -2.27 0.00 0.00 64.05 60.42 1j83 n THR 2176Cb 0.20 0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 68.99 1j83 n THR 2176CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1j83 s ASP 2177N -1.00 6.18 0.32 3.42 2.15 -0.87 -4.92 116.67 121.95 1j83 s ASP 2177Ca 0.23 -0.97 0.25 0.00 0.43 0.00 0.00 52.55 52.48 1j83 s ASP 2177Cb 0.12 -2.22 1.12 0.00 -0.30 0.00 0.00 42.92 41.65 1j83 s ASP 2177CO 0.16 -0.66 1.76 0.00 -0.17 0.00 0.00 175.17 176.26 1j83 h ALA 2178N 8.79 1.00 0.00 3.66 0.00 -1.91 -2.67 119.26 128.13 1j83 h ALA 2178Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1j83 h ALA 2178Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1j83 h ALA 2178CO 0.85 0.00 -1.33 0.00 0.00 0.00 0.00 179.25 178.77 1j83 n ALA 2179N -1.82 2.70 -3.08 0.00 0.00 -1.26 -4.79 120.51 112.26 1j83 n ALA 2179Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1j83 n ALA 2179Cb 0.19 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.66 1j83 n ALA 2179CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1j83 s ASP 2180N -4.94 -1.38 -0.19 0.00 2.15 -1.02 -5.01 116.67 106.29 1j83 s ASP 2180Ca -0.03 -0.87 0.16 0.00 0.43 0.00 0.00 52.55 52.24 1j83 s ASP 2180Cb 0.11 1.77 0.44 0.00 -0.30 0.00 0.00 42.92 44.95 1j83 s ASP 2180CO 0.83 -0.13 1.33 -1.54 -0.17 0.00 0.00 175.17 175.48 1j83 n SER 2181N 4.06 2.97 -4.48 -0.34 3.41 -1.14 -4.64 113.62 113.46 1j83 n SER 2181Ca 0.12 -3.25 -0.39 0.00 -0.26 0.00 0.00 58.87 55.09 1j83 n SER 2181Cb 0.58 -0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 63.89 1j83 n SER 2181CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1j83 s VAL 2182N -2.96 4.86 -0.05 -3.33 1.01 -1.26 -0.61 120.40 118.06 1j83 s VAL 2182Ca 0.39 -0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1j83 s VAL 2182Cb 0.34 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1j83 s VAL 2182CO 0.04 0.07 1.11 -0.69 0.00 0.00 0.00 175.10 175.63 1j83 s VAL 2183N 1.66 4.48 -0.41 2.92 1.01 0.30 -4.26 120.40 126.10 1j83 s VAL 2183Ca 0.05 1.78 0.06 0.00 0.00 0.00 0.00 61.98 63.88 1j83 s VAL 2183Cb -0.17 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 1j83 s VAL 2183CO 0.08 0.04 0.36 0.35 0.00 0.00 0.00 175.10 175.93 1j83 n THR 2184N 4.40 0.00 -2.55 3.92 -2.24 0.13 -1.77 114.28 116.17 1j83 n THR 2184Ca 0.09 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1j83 n THR 2184Cb 0.48 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 1j83 n THR 2184CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1j83 n ASN 2185N -0.77 0.00 -3.70 3.42 2.85 -1.14 -4.84 115.26 111.07 1j83 n ASN 2185Ca 0.02 -0.21 -0.11 0.00 -0.11 0.00 0.00 54.58 54.16 1j83 n ASN 2185Cb 0.11 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.02 1j83 n ASN 2185CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1j83 s ILE 2187N -2.66 -0.02 -0.07 -1.44 1.01 -0.82 -0.79 121.20 116.40 1j83 s ILE 2187Ca 0.00 0.09 0.05 0.00 0.00 0.00 0.00 60.65 60.79 1j83 s ILE 2187Cb 0.00 -0.57 -0.01 0.00 0.01 0.00 0.00 42.46 41.89 1j83 s ILE 2187CO 0.00 0.04 -0.24 -0.76 0.00 0.00 0.00 174.94 173.98 1j83 s LEU 2188N 1.24 2.06 -0.27 2.97 1.43 0.00 -0.61 118.68 125.50 1j83 s LEU 2188Ca -0.08 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.39 1j83 s LEU 2188Cb -0.08 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.75 1j83 s LEU 2188CO -0.11 0.22 0.22 -0.36 0.23 0.00 0.00 176.35 176.55 1j83 s PHE 2189N -0.03 3.24 -0.16 0.29 0.40 0.10 -1.25 117.98 120.57 1j83 s PHE 2189Ca -0.07 0.19 0.01 0.00 -0.60 0.00 0.00 56.93 56.46 1j83 s PHE 2189Cb -0.15 -2.41 0.02 0.00 0.51 0.00 0.00 43.02 40.99 1j83 s PHE 2189CO 0.05 -0.15 -0.19 0.08 0.70 0.00 0.00 175.22 175.71 1j83 s VAL 2190N 1.75 1.93 0.03 -0.44 1.01 -0.43 -1.81 120.40 122.43 1j83 s VAL 2190Ca 0.09 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1j83 s VAL 2190Cb -0.16 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1j83 s VAL 2190CO 0.10 0.52 -0.19 -0.83 0.00 0.00 0.00 175.10 174.70 1j83 s GLY 2191N 1.18 1.03 0.04 4.51 0.00 0.17 -3.68 107.32 110.57 1j83 s GLY 2191Ca 0.01 -0.97 -0.27 0.00 0.00 0.00 0.00 44.72 43.49 1j83 s GLY 2191CO -0.09 -0.89 0.73 -0.45 0.00 0.00 0.00 173.10 172.40 1j83 s SER 2192N -1.00 -0.52 0.00 1.64 0.15 -0.70 0.32 113.70 113.58 1j83 s SER 2192Ca 0.07 0.22 0.19 0.00 0.70 0.00 0.00 55.95 57.12 1j83 s SER 2192Cb -0.08 0.50 0.53 0.00 -1.71 0.00 0.00 66.02 65.26 1j83 s SER 2192CO 0.01 -0.74 1.44 -0.46 1.20 0.00 0.00 173.24 174.69 1j83 n ASN 2193N 0.08 3.13 -4.36 5.45 6.94 -1.02 -3.65 115.26 121.83 1j83 n ASN 2193Ca -0.15 -1.99 -0.30 0.00 -0.02 0.00 0.00 54.58 52.12 1j83 n ASN 2193Cb 0.62 -0.37 -0.14 0.00 -2.36 0.00 0.00 39.78 37.52 1j83 n ASN 2193CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1j83 s SER 2194N -1.06 3.26 -0.01 0.53 0.15 -1.26 -4.79 113.70 110.52 1j83 s SER 2194Ca 0.39 -0.55 0.11 0.00 0.70 0.00 0.00 55.95 56.61 1j83 s SER 2194Cb 0.21 -0.35 0.33 0.00 -1.71 0.00 0.00 66.02 64.50 1j83 s SER 2194CO 0.27 0.27 1.27 0.47 1.20 0.00 0.00 173.24 176.72 1j83 n ASP 2195N 1.82 2.07 -3.30 5.45 8.00 -1.26 -3.50 116.55 125.82 1j83 n ASP 2195Ca -0.17 -2.03 -0.09 0.00 0.71 0.00 0.00 54.79 53.22 1j83 n ASP 2195Cb 0.52 -0.27 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 1j83 n ASP 2195CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1j83 s ASN 2196N -0.97 0.38 0.12 -2.24 3.04 -1.26 -0.97 114.94 113.04 1j83 s ASN 2196Ca 0.25 -0.45 -0.01 0.00 0.04 0.00 0.00 52.86 52.69 1j83 s ASN 2196Cb 0.13 1.10 -0.04 0.00 -1.54 0.00 0.00 41.25 40.90 1j83 s ASN 2196CO 0.16 -0.35 0.03 0.27 -3.04 0.00 0.00 177.10 174.18 1j83 s ILE 2197N 2.48 0.21 0.02 -5.21 -4.36 -1.14 -4.42 121.20 108.78 1j83 s ILE 2197Ca 0.10 -1.90 -0.02 0.00 -0.26 0.00 0.00 60.65 58.57 1j83 s ILE 2197Cb -0.12 -1.95 -0.02 0.00 1.25 0.00 0.00 42.46 41.62 1j83 s ILE 2197CO -0.29 -0.58 0.01 -0.44 0.24 0.00 0.00 174.94 173.89 1j83 s SER 2198N -3.04 0.22 -0.01 4.36 0.01 0.11 -1.05 113.70 114.30 1j83 s SER 2198Ca 0.21 -0.50 0.05 0.00 1.31 0.00 0.00 55.95 57.02 1j83 s SER 2198Cb 0.07 0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.42 1j83 s SER 2198CO -0.00 -0.36 -0.17 -0.76 0.41 0.00 0.00 173.24 172.36 1j83 s LEU 2199N -1.65 2.61 0.08 2.44 1.43 0.06 -0.36 118.68 123.28 1j83 s LEU 2199Ca -0.13 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.54 1j83 s LEU 2199Cb -0.07 -1.52 0.02 0.00 0.03 0.00 0.00 46.19 44.64 1j83 s LEU 2199CO -0.02 0.31 0.28 -0.62 0.23 0.00 0.00 176.35 176.54 1j83 s ASP 2200N -0.96 -0.06 -1.31 2.29 -1.08 -0.69 -0.77 116.67 114.10 1j83 s ASP 2200Ca 0.12 -0.38 -0.07 0.00 -0.52 0.00 0.00 52.55 51.70 1j83 s ASP 2200Cb -0.10 0.38 -0.00 0.00 -1.46 0.00 0.00 42.92 41.73 1j83 s ASP 2200CO 0.02 -0.71 0.57 0.59 0.52 0.00 0.00 175.17 176.17 1j83 n ASN 2201N 0.18 -2.01 -4.64 -0.34 3.02 -0.74 -0.76 115.26 109.97 1j83 n ASN 2201Ca -0.17 -0.99 -0.43 0.00 -0.03 0.00 0.00 54.58 52.96 1j83 n ASN 2201Cb 0.61 -3.27 -0.02 0.00 -0.61 0.00 0.00 39.78 36.50 1j83 n ASN 2201CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1j83 s ILE 2202N -3.76 4.39 0.07 2.41 1.01 -0.44 -4.33 121.20 120.55 1j83 s ILE 2202Ca 0.16 1.60 -0.06 0.00 0.00 0.00 0.00 60.65 62.34 1j83 s ILE 2202Cb -0.06 -4.34 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 1j83 s ILE 2202CO 0.87 -0.49 0.10 -1.59 0.00 0.00 0.00 174.94 173.83 1j83 s LYS 2203N 3.81 0.73 -0.12 2.79 -2.85 -0.13 -1.71 119.74 122.26 1j83 s LYS 2203Ca 0.49 -1.03 -0.05 0.00 -1.00 0.00 0.00 55.97 54.37 1j83 s LYS 2203Cb -0.13 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.88 1j83 s LYS 2203CO 0.18 -0.20 0.08 -0.06 0.10 0.00 0.00 175.35 175.45 1j83 s PHE 2204N -3.75 3.40 0.18 1.78 0.40 -1.26 -0.75 117.98 117.98 1j83 s PHE 2204Ca 0.05 0.36 -0.05 0.00 -0.60 0.00 0.00 56.93 56.69 1j83 s PHE 2204Cb 0.05 -1.91 -0.03 0.00 0.51 0.00 0.00 43.02 41.65 1j83 s PHE 2204CO -0.10 0.57 0.20 0.95 0.70 0.00 0.00 175.22 177.55 1j83 s THR 2205N -0.80 0.04 -2.00 0.64 -4.23 -0.12 -4.99 115.64 104.18 1j83 s THR 2205Ca 0.13 -1.73 0.20 0.00 -1.18 0.00 0.00 61.69 59.11 1j83 s THR 2205Cb -0.12 -2.16 0.56 0.00 1.34 0.00 0.00 72.50 72.12 1j83 s THR 2205CO 0.03 -0.20 1.56 0.29 -0.54 0.00 0.00 174.62 175.76