#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t70 s ARG 2102N 0.00 3.70 0.04 0.03 0.52 -1.26 -0.64 118.95 121.33 1t70 s ARG 2102Ca 0.00 -0.15 0.04 0.00 -0.52 0.00 0.00 55.73 55.09 1t70 s ARG 2102Cb 0.00 -3.77 -0.02 0.00 0.52 0.00 0.00 34.95 31.68 1t70 s ARG 2102CO 0.00 -0.54 -0.11 0.14 0.02 0.00 0.00 175.30 174.81 1t70 s VAL 2103N 2.26 0.83 -0.11 3.52 -7.23 -1.00 0.19 120.40 118.84 1t70 s VAL 2103Ca 0.17 -0.92 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 1t70 s VAL 2103Cb -0.16 -0.79 -0.01 0.00 0.56 0.00 0.00 36.38 35.99 1t70 s VAL 2103CO 0.12 -0.11 -0.20 -0.22 -0.31 0.00 0.00 175.10 174.38 1t70 s LEU 2104N -1.15 2.33 -0.19 1.32 2.96 -0.72 -0.93 118.68 122.30 1t70 s LEU 2104Ca -0.02 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.38 1t70 s LEU 2104Cb -0.08 -1.49 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 1t70 s LEU 2104CO 0.01 0.16 -0.04 0.12 -1.32 0.00 0.00 176.35 175.28 1t70 s PHE 2105N 0.35 2.98 -0.08 5.38 2.19 -0.32 -1.04 117.98 127.45 1t70 s PHE 2105Ca -0.16 -0.63 -0.03 0.00 0.33 0.00 0.00 56.93 56.44 1t70 s PHE 2105Cb -0.17 -2.05 -0.04 0.00 -1.31 0.00 0.00 43.02 39.46 1t70 s PHE 2105CO 0.08 -0.32 0.05 0.42 1.83 0.00 0.00 175.22 177.27 1t70 s ILE 2106N 1.02 4.68 0.79 3.12 1.01 0.33 -0.70 121.20 131.45 1t70 s ILE 2106Ca 0.01 -0.16 -0.10 0.00 0.00 0.00 0.00 60.65 60.40 1t70 s ILE 2106Cb -0.15 -3.02 0.10 0.00 0.01 0.00 0.00 42.46 39.41 1t70 s ILE 2106CO 0.01 0.57 1.13 -0.83 0.00 0.00 0.00 174.94 175.81 1t70 s GLY 2107N -1.06 1.68 -0.19 6.18 0.00 -0.83 -1.67 107.32 111.42 1t70 s GLY 2107Ca 0.15 -0.94 -0.17 0.00 0.00 0.00 0.00 44.72 43.76 1t70 s GLY 2107CO 0.05 -0.43 0.71 1.22 0.00 0.00 0.00 173.10 174.65 1t70 n ASP 2108N -3.21 0.35 -4.65 1.64 9.92 -1.25 -3.69 116.55 115.66 1t70 n ASP 2108Ca 0.10 0.33 -0.42 0.00 -0.53 0.00 0.00 54.79 54.27 1t70 n ASP 2108Cb 0.60 -0.33 -0.04 0.00 -0.64 0.00 0.00 41.12 40.71 1t70 n ASP 2108CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1t70 s VAL 2109N 1.78 4.86 -0.36 2.53 1.01 -0.13 0.12 120.40 130.21 1t70 s VAL 2109Ca 0.42 1.56 -0.08 0.00 0.00 0.00 0.00 61.98 63.87 1t70 s VAL 2109Cb -0.56 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 31.76 1t70 s VAL 2109CO 0.27 -0.04 0.16 0.12 0.00 0.00 0.00 175.10 175.62 1t70 s PHE 2110N 2.61 3.27 0.00 5.22 5.36 0.37 -1.24 117.98 133.57 1t70 s PHE 2110Ca 0.35 -1.29 0.00 0.00 -0.96 0.00 0.00 56.93 55.03 1t70 s PHE 2110Cb -0.16 -2.44 0.00 0.00 -0.34 0.00 0.00 43.02 40.08 1t70 s PHE 2110CO 0.09 -0.72 0.00 0.41 -1.46 0.00 0.00 175.22 173.53 1t70 n GLY 2111N 4.89 0.74 0.33 13.12 0.00 -0.16 -1.86 105.19 122.25 1t70 n GLY 2111Ca -0.12 -0.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 1t70 n GLY 2111CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1t70 h GLN 2112N 0.00 -0.63 -1.02 1.61 4.20 -1.92 -1.38 115.11 115.96 1t70 h GLN 2112Ca 0.00 0.04 0.28 0.00 0.06 0.00 0.00 58.65 59.04 1t70 h GLN 2112Cb 0.00 0.14 -0.13 0.00 0.30 0.00 0.00 27.48 27.79 1t70 h GLN 2112CO 0.00 -0.42 0.61 -1.35 -0.67 0.00 0.00 178.83 177.00 1t70 h PRO 2113N -0.65 0.44 -0.04 1.46 0.11 -1.88 0.47 132.00 131.91 1t70 h PRO 2113Ca -0.03 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.83 1t70 h PRO 2113Cb 0.58 -0.10 0.01 0.00 0.11 0.00 0.00 31.00 31.60 1t70 h PRO 2113CO -0.03 0.29 -0.89 0.78 -0.21 0.00 0.00 178.00 177.94 1t70 h GLY 2114N 0.45 0.58 1.11 -0.55 0.00 -1.12 -2.91 103.07 100.63 1t70 h GLY 2114Ca 0.68 -0.94 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 1t70 h GLY 2114CO -0.50 0.84 -0.16 3.21 0.00 0.00 0.00 176.54 179.93 1t70 h ARG 2115N 0.32 1.03 -0.01 4.80 3.08 0.43 -1.06 114.38 122.97 1t70 h ARG 2115Ca -0.07 -0.41 0.01 0.00 0.07 0.00 0.00 59.98 59.57 1t70 h ARG 2115Cb 1.52 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.51 1t70 h ARG 2115CO 0.16 1.10 -0.04 -0.09 -1.07 0.00 0.00 179.97 180.04 1t70 h ARG 2116N 0.90 -0.06 -0.30 0.04 2.43 -0.25 0.22 114.38 117.36 1t70 h ARG 2116Ca 0.13 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.16 1t70 h ARG 2116Cb 0.74 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1t70 h ARG 2116CO 0.06 -0.04 -0.37 -0.39 -1.51 0.00 0.00 179.97 177.72 1t70 h VAL 2117N -0.06 1.29 0.12 0.20 -1.51 -1.47 -2.01 116.25 112.81 1t70 h VAL 2117Ca 0.02 -1.54 -0.01 0.00 -1.23 0.00 0.00 66.70 63.95 1t70 h VAL 2117Cb 0.08 1.46 0.00 0.00 -2.13 0.00 0.00 31.29 30.70 1t70 h VAL 2117CO -0.04 0.50 -0.06 0.25 -1.23 0.00 0.00 177.57 176.98 1t70 h LEU 2118N 0.58 -0.14 -1.08 4.19 7.12 -0.99 -0.06 115.31 124.92 1t70 h LEU 2118Ca 0.05 -0.10 -0.10 0.00 0.13 0.00 0.00 57.88 57.87 1t70 h LEU 2118Cb 0.90 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 41.05 1t70 h LEU 2118CO 0.08 0.01 -0.46 1.56 -0.13 0.00 0.00 178.44 179.51 1t70 h GLN 2119N -0.29 0.00 0.03 1.25 4.20 -0.96 -0.82 115.11 118.52 1t70 h GLN 2119Ca -0.02 -0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.40 1t70 h GLN 2119Cb 0.23 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 1t70 h GLN 2119CO 0.03 0.46 -1.67 -0.91 -0.67 0.00 0.00 178.83 176.06 1t70 h ASN 2120N 0.00 0.10 0.04 1.46 2.35 -1.35 -3.41 115.58 114.76 1t70 h ASN 2120Ca -0.00 -0.20 -0.30 0.00 -0.55 0.00 0.00 56.30 55.24 1t70 h ASN 2120Cb 0.81 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 39.12 1t70 h ASN 2120CO 0.06 1.18 -1.65 1.57 -1.65 0.00 0.00 177.43 176.94 1t70 n HIS 2121N -3.18 0.96 -0.30 1.19 -0.00 -0.04 -4.46 115.22 109.39 1t70 n HIS 2121Ca -0.18 0.33 0.11 0.00 0.46 0.00 0.00 57.72 58.45 1t70 n HIS 2121Cb 1.04 -1.11 0.28 0.00 -0.12 0.00 0.00 29.99 30.08 1t70 n HIS 2121CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 1t70 h LEU 2122N -0.64 0.39 -2.74 0.27 7.12 -1.27 -0.38 115.31 118.05 1t70 h LEU 2122Ca -0.41 0.13 0.00 0.00 0.13 0.00 0.00 57.88 57.73 1t70 h LEU 2122Cb 1.57 0.09 -0.00 0.00 -0.53 0.00 0.00 40.66 41.80 1t70 h LEU 2122CO -0.14 0.07 0.07 1.55 -0.13 0.00 0.00 178.44 179.86 1t70 h PRO 2123N 0.47 0.00 0.00 5.25 0.13 -1.77 0.01 132.00 136.08 1t70 h PRO 2123Ca 0.52 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.53 1t70 h PRO 2123Cb 0.92 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.03 1t70 h PRO 2123CO -0.47 0.00 -0.78 1.79 -0.23 0.00 0.00 178.00 178.31 1t70 h THR 2124N 0.00 0.83 0.00 1.56 1.35 -1.30 -3.37 112.91 111.98 1t70 h THR 2124Ca 0.00 -2.25 -0.12 0.00 -0.55 0.00 0.00 66.41 63.50 1t70 h THR 2124Cb 0.15 2.35 -0.02 0.00 -1.73 0.00 0.00 68.15 68.89 1t70 h THR 2124CO -0.00 0.47 -2.06 2.30 -0.25 0.00 0.00 175.52 175.98 1t70 n ILE 2125N -3.14 0.45 -0.33 6.82 -5.35 -0.54 -4.59 119.36 112.68 1t70 n ILE 2125Ca -0.01 -0.59 0.24 0.00 -0.27 0.00 0.00 62.75 62.12 1t70 n ILE 2125Cb 0.78 -0.15 0.46 0.00 -1.74 0.00 0.00 39.64 38.99 1t70 n ILE 2125CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1t70 h ARG 2126N 0.00 0.05 0.00 6.28 1.12 -1.20 0.32 114.38 120.94 1t70 h ARG 2126Ca -0.18 -0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.69 1t70 h ARG 2126Cb 1.36 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.31 1t70 h ARG 2126CO 0.01 0.03 0.05 -1.35 -3.11 0.00 0.00 179.97 175.61 1t70 h PRO 2127N 0.05 0.00 -0.07 0.20 0.11 -1.81 0.32 132.00 130.81 1t70 h PRO 2127Ca 0.74 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.85 1t70 h PRO 2127Cb 1.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.89 1t70 h PRO 2127CO -0.79 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 178.04 1t70 n GLN 2128N -2.46 1.63 -4.15 1.05 6.02 0.11 -4.89 117.38 114.69 1t70 n GLN 2128Ca -0.02 -0.92 -0.11 0.00 -0.01 0.00 0.00 57.00 55.94 1t70 n GLN 2128Cb 0.09 -1.44 -0.10 0.00 1.02 0.00 0.00 30.24 29.81 1t70 n GLN 2128CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1t70 s PHE 2129N -1.92 0.86 -0.13 1.08 0.08 0.10 -4.89 117.98 113.16 1t70 s PHE 2129Ca 0.36 -0.86 0.21 0.00 0.12 0.00 0.00 56.93 56.76 1t70 s PHE 2129Cb 0.19 -0.50 -0.19 0.00 -0.57 0.00 0.00 43.02 41.95 1t70 s PHE 2129CO 0.31 -0.14 0.66 -0.25 -0.10 0.00 0.00 175.22 175.70 1t70 n ASP 2130N 0.17 0.42 -3.68 1.36 8.00 0.13 -4.96 116.55 118.00 1t70 n ASP 2130Ca -0.14 0.17 -0.14 0.00 0.71 0.00 0.00 54.79 55.40 1t70 n ASP 2130Cb 0.60 1.05 -0.08 0.00 -0.02 0.00 0.00 41.12 42.66 1t70 n ASP 2130CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1t70 s PHE 2131N -3.22 -0.53 -0.10 1.24 2.19 -1.15 -4.98 117.98 111.42 1t70 s PHE 2131Ca -0.05 1.20 -0.01 0.00 0.33 0.00 0.00 56.93 58.41 1t70 s PHE 2131Cb 0.11 0.22 0.02 0.00 -1.31 0.00 0.00 43.02 42.06 1t70 s PHE 2131CO 0.85 -0.35 -0.06 0.08 1.83 0.00 0.00 175.22 177.57 1t70 s VAL 2132N -0.20 0.88 -0.19 3.12 1.01 -1.26 -1.76 120.40 122.00 1t70 s VAL 2132Ca -0.04 -0.20 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 1t70 s VAL 2132Cb -0.03 -0.92 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1t70 s VAL 2132CO 0.03 0.34 0.25 -0.63 0.00 0.00 0.00 175.10 175.09 1t70 s ILE 2133N 1.72 5.32 -0.08 2.22 1.01 -0.20 -0.77 121.20 130.41 1t70 s ILE 2133Ca 0.04 0.44 0.03 0.00 0.00 0.00 0.00 60.65 61.16 1t70 s ILE 2133Cb -0.13 -3.59 0.01 0.00 0.01 0.00 0.00 42.46 38.76 1t70 s ILE 2133CO -0.07 0.37 -0.16 -0.69 0.00 0.00 0.00 174.94 174.39 1t70 s VAL 2134N 0.65 1.46 -0.17 2.92 1.01 0.03 -0.51 120.40 125.79 1t70 s VAL 2134Ca 0.14 -0.67 -0.22 0.00 0.00 0.00 0.00 61.98 61.23 1t70 s VAL 2134Cb -0.13 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 1t70 s VAL 2134CO 0.03 0.43 0.68 0.21 0.00 0.00 0.00 175.10 176.44 1t70 s ASN 2135N 0.52 6.79 -0.18 3.32 3.84 -0.67 -0.21 114.94 128.35 1t70 s ASN 2135Ca -0.15 0.96 0.15 0.00 0.21 0.00 0.00 52.86 54.03 1t70 s ASN 2135Cb -0.16 -2.38 0.44 0.00 -0.55 0.00 0.00 41.25 38.60 1t70 s ASN 2135CO 0.05 -0.26 1.19 0.23 -2.79 0.00 0.00 177.10 175.52 1t70 n MET 2136N 4.83 1.56 0.30 0.43 2.81 0.39 -0.95 117.12 126.49 1t70 n MET 2136Ca -0.00 -3.15 0.18 0.00 -1.81 0.00 0.00 57.70 52.92 1t70 n MET 2136Cb 0.50 -1.33 0.96 0.00 -0.71 0.00 0.00 33.22 32.63 1t70 n MET 2136CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 1t70 h GLU 2137N 1.34 0.00 -0.11 0.03 4.11 -1.81 -2.90 114.58 115.24 1t70 h GLU 2137Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1t70 h GLU 2137Cb 1.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1t70 h GLU 2137CO 0.17 0.03 0.00 0.09 0.07 0.00 0.00 179.01 179.37 1t70 n ASN 2138N -3.35 2.62 -0.31 3.06 3.02 -1.20 0.79 115.26 119.89 1t70 n ASN 2138Ca -0.02 -2.51 0.08 0.00 -0.03 0.00 0.00 54.58 52.10 1t70 n ASN 2138Cb 0.15 -0.27 0.23 0.00 -0.61 0.00 0.00 39.78 39.29 1t70 n ASN 2138CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1t70 h SER 2139N 0.71 0.61 -2.70 6.41 0.02 0.29 0.01 113.55 118.90 1t70 h SER 2139Ca 0.00 0.08 -0.66 0.00 -0.84 0.00 0.00 61.79 60.38 1t70 h SER 2139Cb 0.86 -0.02 -0.16 0.00 0.14 0.00 0.00 62.40 63.22 1t70 h SER 2139CO 0.04 0.27 0.46 0.00 -1.14 0.00 0.00 176.83 176.46 1t70 s ALA 2140N -5.96 3.23 -1.32 3.77 0.00 0.49 -3.28 121.76 118.69 1t70 s ALA 2140Ca -0.12 -2.08 0.00 0.00 0.00 0.00 0.00 51.96 49.76 1t70 s ALA 2140Cb 0.22 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1t70 s ALA 2140CO 0.79 -2.68 0.00 0.41 0.00 0.00 0.00 175.76 174.27 1t70 n GLY 2141N 5.33 1.19 0.76 0.00 0.00 -1.26 0.69 105.19 111.90 1t70 n GLY 2141Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1t70 n GLY 2141CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t70 n GLY 2142N -0.21 0.66 2.64 -0.02 0.00 -0.35 -4.76 105.19 103.14 1t70 n GLY 2142Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1t70 n GLY 2142CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t70 s PHE 2143N -2.46 1.05 0.00 1.61 0.08 0.22 -4.53 117.98 113.95 1t70 s PHE 2143Ca 0.00 -1.32 0.00 0.00 0.12 0.00 0.00 56.93 55.73 1t70 s PHE 2143Cb 0.00 -1.33 0.00 0.00 -0.57 0.00 0.00 43.02 41.12 1t70 s PHE 2143CO 0.00 -0.85 0.00 0.41 -0.10 0.00 0.00 175.22 174.68 1t70 n GLY 2144N 5.04 -1.61 2.86 4.36 0.00 0.24 -4.21 105.19 111.86 1t70 n GLY 2144Ca -0.04 -1.46 -0.14 0.00 0.00 0.00 0.00 46.02 44.38 1t70 n GLY 2144CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1t70 s MET 2145N 0.00 0.03 0.52 1.61 1.75 -1.26 -0.38 119.30 121.57 1t70 s MET 2145Ca 0.00 0.29 0.08 0.00 -1.25 0.00 0.00 55.69 54.81 1t70 s MET 2145Cb 0.00 -0.21 0.09 0.00 2.84 0.00 0.00 34.83 37.54 1t70 s MET 2145CO 0.00 -0.17 0.72 -2.39 -0.65 0.00 0.00 175.02 172.53 1t70 n HIS 2146N 4.21 -2.41 -0.12 4.11 1.44 -1.26 -4.06 115.22 117.13 1t70 n HIS 2146Ca -0.27 -1.85 -0.10 0.00 -2.01 0.00 0.00 57.72 53.49 1t70 n HIS 2146Cb 0.51 -0.49 -0.02 0.00 0.12 0.00 0.00 29.99 30.10 1t70 n HIS 2146CO 0.00 0.00 0.00 -0.09 -2.81 0.00 0.00 176.34 173.44 1t70 h ARG 2147N 0.00 0.55 -0.70 -1.40 2.43 -1.99 -2.76 114.38 110.52 1t70 h ARG 2147Ca -0.24 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1t70 h ARG 2147Cb 1.10 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 1t70 h ARG 2147CO 0.34 0.60 0.42 -0.44 -1.51 0.00 0.00 179.97 179.38 1t70 h ASP 2148N 0.41 0.85 -0.69 -3.80 3.45 -1.98 -0.21 116.42 114.45 1t70 h ASP 2148Ca 0.11 -0.07 0.02 0.00 0.43 0.00 0.00 57.03 57.52 1t70 h ASP 2148Cb 0.30 -0.21 -0.04 0.00 -0.56 0.00 0.00 39.33 38.81 1t70 h ASP 2148CO 0.00 0.67 0.44 0.00 -1.57 0.00 0.00 179.24 178.78 1t70 h ALA 2149N 1.22 0.88 -0.35 3.45 0.00 -1.93 -0.56 119.26 121.98 1t70 h ALA 2149Ca 0.25 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 1t70 h ALA 2149Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1t70 h ALA 2149CO -0.05 0.24 -0.35 0.00 0.00 0.00 0.00 179.25 179.10 1t70 h ALA 2150N 1.27 0.51 -0.28 0.00 0.00 -1.15 -2.26 119.26 117.35 1t70 h ALA 2150Ca 0.26 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1t70 h ALA 2150Cb -0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1t70 h ALA 2150CO -0.08 0.58 -0.10 -0.09 0.00 0.00 0.00 179.25 179.56 1t70 h ARG 2151N 0.64 0.47 -0.27 0.00 2.43 -0.79 -2.72 114.38 114.14 1t70 h ARG 2151Ca 0.05 -0.12 -0.15 0.00 -0.81 0.00 0.00 59.98 58.95 1t70 h ARG 2151Cb 0.94 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1t70 h ARG 2151CO 0.09 0.57 -0.41 0.78 -1.51 0.00 0.00 179.97 179.49 1t70 h GLY 2152N 0.89 0.82 0.74 2.80 0.00 -0.99 -2.25 103.07 105.07 1t70 h GLY 2152Ca 0.08 -0.92 0.04 0.00 0.00 0.00 0.00 47.33 46.54 1t70 h GLY 2152CO 0.02 0.82 0.19 0.00 0.00 0.00 0.00 176.54 177.58 1t70 h ALA 2153N 0.67 0.51 0.10 3.60 0.00 -1.16 0.37 119.26 123.35 1t70 h ALA 2153Ca 0.02 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1t70 h ALA 2153Cb 1.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1t70 h ALA 2153CO 0.09 -0.18 -0.05 -0.07 0.00 0.00 0.00 179.25 179.05 1t70 h LEU 2154N 0.38 -0.11 -1.57 0.00 3.38 -1.53 -0.38 115.31 115.48 1t70 h LEU 2154Ca 0.18 -0.29 0.21 0.00 0.09 0.00 0.00 57.88 58.07 1t70 h LEU 2154Cb 0.12 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 1t70 h LEU 2154CO -0.15 0.24 0.60 -0.08 0.09 0.00 0.00 178.44 179.14 1t70 h GLU 2155N -0.48 0.34 0.00 1.13 4.57 -1.20 0.50 114.58 119.45 1t70 h GLU 2155Ca -0.01 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1t70 h GLU 2155Cb 0.40 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1t70 h GLU 2155CO 0.02 0.23 0.00 0.00 -1.18 0.00 0.00 179.01 178.08 1t70 h ALA 2156N 1.61 1.00 0.00 2.92 0.00 -0.59 -3.47 119.26 120.73 1t70 h ALA 2156Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1t70 h ALA 2156Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1t70 h ALA 2156CO -0.16 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.50 1t70 n GLY 2157N 0.82 0.67 3.75 0.00 0.00 0.18 -3.46 105.19 107.14 1t70 n GLY 2157Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1t70 n GLY 2157CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t70 s ALA 2158N -1.27 3.57 -0.52 4.61 0.00 -0.18 -4.54 121.76 123.43 1t70 s ALA 2158Ca 0.00 1.26 0.12 0.00 0.00 0.00 0.00 51.96 53.35 1t70 s ALA 2158Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 1t70 s ALA 2158CO 0.00 -0.67 0.50 0.41 0.00 0.00 0.00 175.76 175.99 1t70 n GLY 2159N 1.89 -0.22 3.47 0.00 0.00 0.05 -4.40 105.19 105.97 1t70 n GLY 2159Ca 0.05 -0.35 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 1t70 n GLY 2159CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t70 s LEU 2161N 1.47 3.84 -0.01 0.00 1.02 -0.08 -0.79 118.68 124.13 1t70 s LEU 2161Ca -0.09 -0.63 -0.02 0.00 0.02 0.00 0.00 54.13 53.40 1t70 s LEU 2161Cb -0.06 -1.90 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 1t70 s LEU 2161CO -0.16 -0.18 0.15 0.42 0.02 0.00 0.00 176.35 176.61 1t70 s THR 2162N 1.53 5.24 0.00 5.49 -4.23 0.71 -0.64 115.64 123.74 1t70 s THR 2162Ca 0.03 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.33 1t70 s THR 2162Cb -0.17 -3.43 0.00 0.00 1.34 0.00 0.00 72.50 70.24 1t70 s THR 2162CO 0.03 0.34 0.00 0.18 -0.54 0.00 0.00 174.62 174.63 1t70 n LEU 2163N 1.05 0.00 0.00 4.79 4.77 -0.91 -0.46 117.00 126.23 1t70 n LEU 2163Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1t70 n LEU 2163Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1t70 n LEU 2163CO 0.42 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1t70 n GLY 2164N 5.00 -0.45 0.00 -0.72 0.00 -1.26 -4.70 105.19 103.05 1t70 n GLY 2164Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1t70 n GLY 2164CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1t70 n ASN 2165N 0.00 0.00 -1.01 1.61 2.85 -1.26 0.15 115.26 117.60 1t70 n ASN 2165Ca 0.00 0.32 -0.02 0.00 -0.11 0.00 0.00 54.58 54.78 1t70 n ASN 2165Cb 0.00 -0.16 0.05 0.00 1.24 0.00 0.00 39.78 40.91 1t70 n ASN 2165CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1t70 n HIS 2166N -2.30 0.50 -0.25 1.20 8.25 -1.26 -4.50 115.22 116.87 1t70 n HIS 2166Ca 0.00 -0.47 0.24 0.00 -0.26 0.00 0.00 57.72 57.23 1t70 n HIS 2166Cb 0.00 -0.29 0.59 0.00 1.12 0.00 0.00 29.99 31.41 1t70 n HIS 2166CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1t70 h ALA 2167N 2.08 2.46 -0.46 -1.41 0.00 -0.56 -2.40 119.26 118.97 1t70 h ALA 2167Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1t70 h ALA 2167Cb 1.09 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1t70 h ALA 2167CO 0.16 -0.76 0.00 0.91 0.00 0.00 0.00 179.25 179.55 1t70 n TRP 2168N -4.44 1.38 0.24 0.00 7.02 -1.26 -4.62 117.44 115.76 1t70 n TRP 2168Ca 0.21 -0.73 0.13 0.00 -1.02 0.00 0.00 57.50 56.09 1t70 n TRP 2168Cb 0.85 -0.33 0.28 0.00 -2.42 0.00 0.00 31.31 29.68 1t70 n TRP 2168CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1t70 h HIS 2169N 3.07 0.00 -3.45 -5.99 3.86 -1.70 -3.42 115.15 107.52 1t70 h HIS 2169Ca 0.00 0.00 -0.67 0.00 -1.16 0.00 0.00 60.37 58.54 1t70 h HIS 2169Cb 1.54 0.00 -0.30 0.00 1.06 0.00 0.00 27.41 29.71 1t70 h HIS 2169CO 0.72 0.00 -0.73 -1.58 0.86 0.00 0.00 177.93 177.20 1t70 s HIS 2170N -3.29 3.02 0.33 2.45 5.65 -1.26 -4.94 115.29 117.24 1t70 s HIS 2170Ca 0.06 -1.28 0.05 0.00 0.25 0.00 0.00 55.06 54.13 1t70 s HIS 2170Cb 0.06 -2.09 0.26 0.00 -1.18 0.00 0.00 32.58 29.63 1t70 s HIS 2170CO 0.64 -0.66 0.98 1.57 -0.65 0.00 0.00 174.74 176.63 1t70 h LYS 2171N 8.07 0.00 0.00 2.88 -0.00 -1.91 -1.17 116.57 124.43 1t70 h LYS 2171Ca -0.36 0.00 -0.12 0.00 -0.00 0.00 0.00 60.65 60.17 1t70 h LYS 2171Cb 1.13 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.34 1t70 h LYS 2171CO 0.59 0.00 -0.57 -0.44 -0.00 0.00 0.00 179.45 179.03 1t70 h ASP 2172N 0.00 0.00 -0.17 7.07 5.19 -1.94 -3.17 116.42 123.40 1t70 h ASP 2172Ca 0.00 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.42 1t70 h ASP 2172Cb 1.32 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.82 1t70 h ASP 2172CO 0.00 0.57 0.11 0.40 -3.12 0.00 0.00 179.24 177.20 1t70 h ILE 2173N 0.00 1.02 0.35 0.35 5.03 -1.35 -1.75 117.51 121.15 1t70 h ILE 2173Ca -0.01 -0.06 -0.02 0.00 -0.12 0.00 0.00 64.86 64.65 1t70 h ILE 2173Cb 1.05 0.82 0.00 0.00 -3.03 0.00 0.00 36.82 35.66 1t70 h ILE 2173CO 0.07 0.03 -0.17 1.88 -0.68 0.00 0.00 178.15 179.29 1t70 h TYR 2174N 0.18 -0.43 -0.03 1.37 0.05 -1.76 0.21 116.97 116.57 1t70 h TYR 2174Ca 0.07 -0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 1t70 h TYR 2174Cb 0.04 0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 1t70 h TYR 2174CO -0.00 -0.13 -0.37 -1.00 -1.05 0.00 0.00 178.16 175.61 1t70 h PRO 2175N -0.72 0.05 0.17 4.88 0.13 -1.67 -1.11 132.00 133.73 1t70 h PRO 2175Ca -0.05 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 1t70 h PRO 2175Cb 0.50 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 1t70 h PRO 2175CO 0.08 0.41 -0.08 0.52 -0.23 0.00 0.00 178.00 178.70 1t70 h MET 2176N 0.04 -0.22 -0.18 0.86 2.86 -1.20 0.32 114.93 117.41 1t70 h MET 2176Ca 0.00 0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1t70 h MET 2176Cb 0.68 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 1t70 h MET 2176CO 0.05 0.03 0.04 -0.07 1.06 0.00 0.00 176.91 178.02 1t70 h LEU 2177N -0.45 0.23 0.06 1.22 3.38 -0.89 -2.08 115.31 116.78 1t70 h LEU 2177Ca -0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1t70 h LEU 2177Cb 0.35 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1t70 h LEU 2177CO 0.04 0.24 -0.03 -1.28 0.09 0.00 0.00 178.44 177.50 1t70 h SER 2178N 0.26 -0.07 0.43 -0.43 0.87 -0.78 -2.96 113.55 110.86 1t70 h SER 2178Ca 0.06 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1t70 h SER 2178Cb 0.11 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1t70 h SER 2178CO -0.00 0.26 0.00 -1.84 -0.53 0.00 0.00 176.83 174.72 1t70 n GLU 2179N -4.97 0.02 -3.82 2.24 0.28 0.11 -4.93 120.64 109.57 1t70 n GLU 2179Ca -0.08 0.26 -0.30 0.00 -0.16 0.00 0.00 57.16 56.88 1t70 n GLU 2179Cb 0.19 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.57 1t70 n GLU 2179CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1t70 n ASP 2180N -1.48 -3.49 0.02 -1.84 2.03 -0.82 -4.88 116.55 106.09 1t70 n ASP 2180Ca 0.04 -0.94 0.00 0.00 0.52 0.00 0.00 54.79 54.41 1t70 n ASP 2180Cb 0.15 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.29 1t70 n ASP 2180CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1t70 n THR 2181N -3.38 0.28 -2.17 5.18 -2.24 -1.26 -5.04 114.28 105.65 1t70 n THR 2181Ca -0.16 0.09 -0.41 0.00 -2.27 0.00 0.00 64.05 61.30 1t70 n THR 2181Cb 0.49 -1.37 -0.03 0.00 -2.10 0.00 0.00 70.33 67.32 1t70 n THR 2181CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1t70 s TYR 2182N -2.00 3.16 -1.09 4.78 1.51 -1.26 -4.88 117.35 117.57 1t70 s TYR 2182Ca 0.00 1.37 -0.15 0.00 -1.01 0.00 0.00 57.07 57.28 1t70 s TYR 2182Cb 0.00 -3.63 -0.07 0.00 -0.11 0.00 0.00 41.96 38.15 1t70 s TYR 2182CO 0.00 -1.77 2.17 -0.35 -1.11 0.00 0.00 175.55 174.49 1t70 n PRO 2183N 1.40 2.25 -3.52 -1.71 -0.04 -1.26 -4.91 135.00 127.21 1t70 n PRO 2183Ca 0.02 -2.01 -0.38 0.00 -0.04 0.00 0.00 63.50 61.09 1t70 n PRO 2183Cb 0.42 -2.90 -0.06 0.00 -0.04 0.00 0.00 33.50 30.92 1t70 n PRO 2183CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1t70 s ILE 2184N 3.84 5.05 -0.18 0.52 1.01 -1.26 -0.91 121.20 129.29 1t70 s ILE 2184Ca 0.52 0.81 -0.01 0.00 0.00 0.00 0.00 60.65 61.97 1t70 s ILE 2184Cb 0.14 -3.70 0.05 0.00 0.01 0.00 0.00 42.46 38.96 1t70 s ILE 2184CO 0.01 0.58 -0.03 -0.69 0.00 0.00 0.00 174.94 174.81 1t70 s VAL 2185N -1.05 0.97 0.53 2.92 1.01 0.19 -4.65 120.40 120.33 1t70 s VAL 2185Ca 0.23 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.60 1t70 s VAL 2185Cb -0.16 -1.24 0.03 0.00 0.00 0.00 0.00 36.38 35.01 1t70 s VAL 2185CO 0.13 0.02 0.74 0.00 0.00 0.00 0.00 175.10 175.99 1t70 s ARG 2186N 1.68 2.57 0.01 2.72 1.04 -0.61 -2.15 118.95 124.20 1t70 s ARG 2186Ca -0.00 -0.90 -0.36 0.00 -1.04 0.00 0.00 55.73 53.43 1t70 s ARG 2186Cb -0.16 -2.54 -0.14 0.00 -2.04 0.00 0.00 34.95 30.07 1t70 s ARG 2186CO -0.07 -0.65 1.63 -2.30 -0.04 0.00 0.00 175.30 173.87 1t70 n PRO 2187N -2.26 1.78 -0.04 3.89 -0.02 -1.26 -3.92 135.00 133.17 1t70 n PRO 2187Ca 0.08 0.65 -0.07 0.00 -2.02 0.00 0.00 63.50 62.14 1t70 n PRO 2187Cb 0.60 -2.39 0.11 0.00 -0.02 0.00 0.00 33.50 31.79 1t70 n PRO 2187CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1t70 h LEU 2188N 6.70 0.67 -2.63 2.45 5.85 -0.10 -3.30 115.31 124.95 1t70 h LEU 2188Ca -0.47 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1t70 h LEU 2188Cb 1.29 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1t70 h LEU 2188CO 0.89 0.94 0.00 -0.46 -0.34 0.00 0.00 178.44 179.47 1t70 n ASN 2189N -4.07 4.23 -4.34 1.25 6.94 -1.26 -4.57 115.26 113.44 1t70 n ASN 2189Ca -0.01 -2.18 -0.46 0.00 -0.02 0.00 0.00 54.58 51.91 1t70 n ASN 2189Cb 0.47 -0.84 -0.01 0.00 -2.36 0.00 0.00 39.78 37.04 1t70 n ASN 2189CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1t70 s TYR 2190N 0.07 3.91 0.20 -2.53 2.02 -1.25 -1.70 117.35 118.07 1t70 s TYR 2190Ca 0.00 -2.21 -0.22 0.00 -0.37 0.00 0.00 57.07 54.26 1t70 s TYR 2190Cb 0.00 -3.85 0.13 0.00 -0.40 0.00 0.00 41.96 37.84 1t70 s TYR 2190CO 0.00 -1.00 1.55 0.00 -1.57 0.00 0.00 175.55 174.53 1t70 h ALA 2191N 7.42 -0.10 -0.41 3.71 0.00 -1.94 -3.43 119.26 124.51 1t70 h ALA 2191Ca 0.14 0.21 -0.45 0.00 0.00 0.00 0.00 54.91 54.80 1t70 h ALA 2191Cb 0.98 1.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.86 1t70 h ALA 2191CO 0.86 -0.74 0.44 -3.47 0.00 0.00 0.00 179.25 176.34 1t70 n ASP 2192N -5.41 0.59 0.17 0.00 2.03 -1.26 -4.74 116.55 107.94 1t70 n ASP 2192Ca 0.07 0.57 0.13 0.00 0.52 0.00 0.00 54.79 56.08 1t70 n ASP 2192Cb 0.36 -0.47 0.60 0.00 -0.72 0.00 0.00 41.12 40.89 1t70 n ASP 2192CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1t70 h PRO 2193N 3.11 0.00 0.00 -0.67 0.11 -2.04 -2.57 132.00 129.95 1t70 h PRO 2193Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1t70 h PRO 2193Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1t70 h PRO 2193CO 0.53 0.00 -0.71 0.78 -0.21 0.00 0.00 178.00 178.39 1t70 h GLY 2194N 1.19 0.00 -6.22 -0.55 0.00 -1.93 -3.47 103.07 92.09 1t70 h GLY 2194Ca 0.00 0.00 -0.78 0.00 0.00 0.00 0.00 47.33 46.55 1t70 h GLY 2194CO 0.00 0.00 0.48 -1.30 0.00 0.00 0.00 176.54 175.72 1t70 n THR 2195N -2.48 0.06 -1.17 4.70 -2.24 -0.97 -4.87 114.28 107.31 1t70 n THR 2195Ca 0.02 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.44 1t70 n THR 2195Cb 0.50 -0.55 0.10 0.00 -2.10 0.00 0.00 70.33 68.28 1t70 n THR 2195CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1t70 n PRO 2196N 3.16 0.23 0.00 -0.78 -0.02 -1.26 -4.84 135.00 131.49 1t70 n PRO 2196Ca 0.24 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1t70 n PRO 2196Cb 0.08 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1t70 n PRO 2196CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1t70 n GLY 2197N 1.10 -0.06 3.33 -1.23 0.00 -1.26 -4.93 105.19 102.14 1t70 n GLY 2197Ca 0.12 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.99 1t70 n GLY 2197CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1t70 s VAL 2198N 0.00 1.77 -0.29 1.61 -7.23 -1.26 -5.02 120.40 109.98 1t70 s VAL 2198Ca 0.00 -2.01 0.12 0.00 -1.81 0.00 0.00 61.98 58.27 1t70 s VAL 2198Cb 0.00 -1.90 0.74 0.00 0.56 0.00 0.00 36.38 35.78 1t70 s VAL 2198CO 0.00 -0.42 1.74 0.61 -0.31 0.00 0.00 175.10 176.72 1t70 n GLY 2199N 0.06 3.58 3.64 2.32 0.00 -1.25 -1.58 105.19 111.97 1t70 n GLY 2199Ca -0.11 -1.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.89 1t70 n GLY 2199CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1t70 s TRP 2200N -2.93 -0.04 -0.17 1.61 1.48 -1.26 -3.13 118.94 114.50 1t70 s TRP 2200Ca 0.53 0.07 -0.13 0.00 -1.06 0.00 0.00 56.10 55.51 1t70 s TRP 2200Cb 0.42 0.50 0.05 0.00 -1.16 0.00 0.00 33.47 33.28 1t70 s TRP 2200CO 0.13 -0.04 0.43 1.03 -4.06 0.00 0.00 176.95 174.44 1t70 s ARG 2201N -1.24 0.47 -0.10 3.25 0.52 -0.72 -4.99 118.95 116.14 1t70 s ARG 2201Ca 0.09 0.68 -0.03 0.00 -0.52 0.00 0.00 55.73 55.95 1t70 s ARG 2201Cb -0.01 0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.58 1t70 s ARG 2201CO -0.07 -0.10 0.04 0.95 0.02 0.00 0.00 175.30 176.15 1t70 s THR 2202N 0.67 4.63 0.20 0.02 -4.23 -1.26 -0.20 115.64 115.46 1t70 s THR 2202Ca -0.04 -0.12 0.11 0.00 -1.18 0.00 0.00 61.69 60.46 1t70 s THR 2202Cb -0.05 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.77 1t70 s THR 2202CO -0.05 0.60 -0.23 -0.36 -0.54 0.00 0.00 174.62 174.05 1t70 s PHE 2203N -0.84 2.25 -0.38 3.99 0.08 0.49 -4.91 117.98 118.66 1t70 s PHE 2203Ca 0.13 -0.37 -0.18 0.00 0.12 0.00 0.00 56.93 56.64 1t70 s PHE 2203Cb -0.12 -1.10 0.00 0.00 -0.57 0.00 0.00 43.02 41.24 1t70 s PHE 2203CO 0.03 0.51 0.49 -0.51 -0.10 0.00 0.00 175.22 175.64 1t70 s ASP 2204N -2.79 6.26 0.00 1.36 -0.00 -1.26 -0.23 116.67 120.01 1t70 s ASP 2204Ca 0.22 -0.26 0.00 0.00 -0.00 0.00 0.00 52.55 52.50 1t70 s ASP 2204Cb -0.07 -2.25 0.00 0.00 -0.00 0.00 0.00 42.92 40.60 1t70 s ASP 2204CO 0.10 -0.52 0.00 0.52 -0.00 0.00 0.00 175.17 175.27 1t70 n VAL 2205N 5.46 0.00 -3.08 -1.27 0.31 -0.03 -4.85 118.33 114.86 1t70 n VAL 2205Ca -0.06 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.02 1t70 n VAL 2205Cb 0.48 -0.54 -0.05 0.00 -0.91 0.00 0.00 33.84 32.83 1t70 n VAL 2205CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1t70 n ASN 2206N -0.66 3.51 0.00 4.52 3.02 -1.26 -4.78 115.26 119.62 1t70 n ASN 2206Ca 0.00 -3.48 0.00 0.00 -0.03 0.00 0.00 54.58 51.07 1t70 n ASN 2206Cb 0.00 -0.59 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 1t70 n ASN 2206CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t70 n GLY 2207N 0.13 0.84 3.38 7.41 0.00 -1.26 -5.01 105.19 110.67 1t70 n GLY 2207Ca 0.29 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.09 1t70 n GLY 2207CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1t70 s GLU 2208N -0.24 1.41 -0.16 1.61 2.02 -1.26 -5.13 118.70 116.94 1t70 s GLU 2208Ca 0.00 -1.56 -0.17 0.00 0.02 0.00 0.00 54.97 53.26 1t70 s GLU 2208Cb 0.00 -1.42 -0.04 0.00 0.10 0.00 0.00 34.13 32.77 1t70 s GLU 2208CO 0.00 0.27 0.45 0.15 0.02 0.00 0.00 175.26 176.15 1t70 s LYS 2209N -3.22 4.25 -0.16 1.61 1.02 -1.26 -0.85 119.74 121.13 1t70 s LYS 2209Ca 0.22 0.35 0.02 0.00 0.02 0.00 0.00 55.97 56.57 1t70 s LYS 2209Cb -0.04 -3.49 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1t70 s LYS 2209CO 0.09 0.03 -0.21 -1.17 -0.92 0.00 0.00 175.35 173.17 1t70 s LEU 2210N 1.05 2.12 -0.19 3.17 2.96 0.68 -0.97 118.68 127.49 1t70 s LEU 2210Ca 0.23 -0.63 -0.04 0.00 -0.22 0.00 0.00 54.13 53.47 1t70 s LEU 2210Cb -0.15 -1.46 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 1t70 s LEU 2210CO 0.09 0.04 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.25 1t70 s THR 2211N 1.08 3.85 -0.23 3.68 2.01 0.26 0.18 115.64 126.48 1t70 s THR 2211Ca -0.00 -0.35 -0.07 0.00 0.31 0.00 0.00 61.69 61.57 1t70 s THR 2211Cb -0.14 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1t70 s THR 2211CO -0.08 0.45 0.06 -0.69 -0.69 0.00 0.00 174.62 173.67 1t70 s VAL 2212N 0.87 4.35 -0.02 3.82 1.01 0.72 -0.19 120.40 130.95 1t70 s VAL 2212Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 61.88 1t70 s VAL 2212Cb -0.14 -3.01 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1t70 s VAL 2212CO 0.02 0.37 -0.23 0.54 0.00 0.00 0.00 175.10 175.80 1t70 s VAL 2213N 1.32 1.80 -0.17 2.92 0.11 -0.15 -1.75 120.40 124.48 1t70 s VAL 2213Ca 0.05 -0.97 -0.03 0.00 -2.93 0.00 0.00 61.98 58.10 1t70 s VAL 2213Cb -0.15 -1.50 -0.02 0.00 -1.53 0.00 0.00 36.38 33.18 1t70 s VAL 2213CO 0.03 0.51 -0.07 0.21 -3.33 0.00 0.00 175.10 172.45 1t70 s ASN 2214N -0.48 4.39 0.21 3.54 2.47 -1.18 -1.02 114.94 122.87 1t70 s ASN 2214Ca 0.07 -0.27 0.11 0.00 0.42 0.00 0.00 52.86 53.19 1t70 s ASN 2214Cb -0.09 -1.71 -0.05 0.00 -1.45 0.00 0.00 41.25 37.95 1t70 s ASN 2214CO -0.00 0.11 -0.21 -0.76 -3.72 0.00 0.00 177.10 172.52 1t70 s LEU 2215N 0.68 2.56 -0.11 3.21 1.43 -0.44 0.54 118.68 126.54 1t70 s LEU 2215Ca -0.04 -0.87 0.03 0.00 -1.03 0.00 0.00 54.13 52.22 1t70 s LEU 2215Cb -0.15 -1.22 -0.01 0.00 0.03 0.00 0.00 46.19 44.84 1t70 s LEU 2215CO 0.02 0.10 -0.20 -0.76 0.23 0.00 0.00 176.35 175.74 1t70 s LEU 2216N -2.92 2.30 0.95 1.79 1.43 -1.26 -0.25 118.68 120.72 1t70 s LEU 2216Ca 0.24 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 1t70 s LEU 2216Cb -0.07 -1.48 0.18 0.00 0.03 0.00 0.00 46.19 44.85 1t70 s LEU 2216CO 0.12 0.16 1.26 -0.83 0.23 0.00 0.00 176.35 177.29 1t70 s GLY 2217N 0.33 1.71 0.00 -3.19 0.00 -0.01 -4.56 107.32 101.60 1t70 s GLY 2217Ca -0.16 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.55 1t70 s GLY 2217CO 0.08 -0.31 0.00 0.54 0.00 0.00 0.00 173.10 173.41 1t70 n ARG 2218N -3.76 0.79 -1.66 2.90 1.74 -1.26 -4.84 116.66 110.57 1t70 n ARG 2218Ca 0.13 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.77 1t70 n ARG 2218Cb 0.60 -0.84 -0.01 0.00 -1.02 0.00 0.00 32.46 31.19 1t70 n ARG 2218CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1t70 n VAL 2219N -1.99 1.84 -2.56 1.55 0.31 -1.26 -0.82 118.33 115.40 1t70 n VAL 2219Ca 0.00 -0.46 -0.12 0.00 -0.01 0.00 0.00 64.34 63.75 1t70 n VAL 2219Cb 0.34 -1.37 -0.00 0.00 -0.91 0.00 0.00 33.84 31.89 1t70 n VAL 2219CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1t70 n PHE 2220N 0.53 -1.54 -4.08 3.52 3.72 -1.26 -4.39 117.46 113.96 1t70 n PHE 2220Ca 0.07 0.06 -0.10 0.00 -0.05 0.00 0.00 57.45 57.42 1t70 n PHE 2220Cb 0.34 -2.53 -0.08 0.00 -0.94 0.00 0.00 39.48 36.28 1t70 n PHE 2220CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1t70 s MET 2221N -5.14 1.31 0.61 -1.08 -1.94 -0.00 -4.98 119.30 108.08 1t70 s MET 2221Ca 0.05 -1.39 -0.19 0.00 -1.71 0.00 0.00 55.69 52.44 1t70 s MET 2221Cb -0.02 0.36 -0.03 0.00 2.01 0.00 0.00 34.83 37.15 1t70 s MET 2221CO 0.06 -0.49 1.25 -1.91 -0.01 0.00 0.00 175.02 173.92 1t70 n GLU 2222N -0.29 1.22 -2.91 2.03 2.13 -1.26 -4.89 120.64 116.66 1t70 n GLU 2222Ca -0.01 0.47 -0.40 0.00 0.66 0.00 0.00 57.16 57.87 1t70 n GLU 2222Cb 0.64 -2.47 -0.05 0.00 0.27 0.00 0.00 31.44 29.83 1t70 n GLU 2222CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1t70 s ALA 2223N -1.38 3.36 0.00 4.31 0.00 -1.26 -4.75 121.76 122.03 1t70 s ALA 2223Ca 0.79 0.39 0.00 0.00 0.00 0.00 0.00 51.96 53.13 1t70 s ALA 2223Cb -0.40 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1t70 s ALA 2223CO 0.44 0.11 0.00 1.33 0.00 0.00 0.00 175.76 177.63 1t70 n VAL 2224N 2.45 0.00 -2.31 0.00 0.24 -1.26 -5.13 118.33 112.32 1t70 n VAL 2224Ca -0.02 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.92 1t70 n VAL 2224Cb 0.49 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.86 1t70 n VAL 2224CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1t70 s ASP 2225N -0.02 5.97 -0.61 -1.34 -0.00 -0.69 -4.89 116.67 115.09 1t70 s ASP 2225Ca 0.00 2.17 -0.29 0.00 -0.00 0.00 0.00 52.55 54.44 1t70 s ASP 2225Cb 0.00 -2.58 -0.12 0.00 -0.00 0.00 0.00 42.92 40.22 1t70 s ASP 2225CO 0.00 -1.05 2.46 -3.20 -0.00 0.00 0.00 175.17 173.38 1t70 n ASN 2226N -0.98 1.74 -0.13 0.27 2.85 -1.26 -4.81 115.26 112.93 1t70 n ASN 2226Ca 0.10 -0.15 0.14 0.00 -0.11 0.00 0.00 54.58 54.55 1t70 n ASN 2226Cb 0.50 -1.35 0.50 0.00 1.24 0.00 0.00 39.78 40.68 1t70 n ASN 2226CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1t70 h PRO 2227N 16.23 0.40 -0.50 1.20 0.13 -1.90 -0.62 132.00 146.94 1t70 h PRO 2227Ca -0.20 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.85 1t70 h PRO 2227Cb 1.29 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1t70 h PRO 2227CO 1.20 0.26 0.06 0.74 -0.23 0.00 0.00 178.00 180.03 1t70 h PHE 2228N 0.41 0.90 0.00 1.56 0.04 -1.94 -1.60 116.94 116.30 1t70 h PHE 2228Ca 0.33 -0.13 -0.16 0.00 2.80 0.00 0.00 57.97 60.80 1t70 h PHE 2228Cb 0.71 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.59 1t70 h PHE 2228CO -0.00 0.83 -0.77 0.00 -0.60 0.00 0.00 178.31 177.76 1t70 h ARG 2229N 0.71 0.00 -0.75 1.51 3.08 -1.81 -2.76 114.38 114.36 1t70 h ARG 2229Ca 0.15 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.17 1t70 h ARG 2229Cb 0.43 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1t70 h ARG 2229CO 0.01 0.77 0.37 1.15 -1.07 0.00 0.00 179.97 181.20 1t70 h THR 2230N 0.00 1.24 -0.20 2.04 2.02 -0.96 -2.12 112.91 114.93 1t70 h THR 2230Ca -0.01 -0.67 -0.11 0.00 0.77 0.00 0.00 66.41 66.40 1t70 h THR 2230Cb 1.58 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 1t70 h THR 2230CO 0.10 0.28 -0.33 0.24 0.37 0.00 0.00 175.52 176.18 1t70 h MET 2231N 1.05 0.42 0.00 6.66 2.86 -1.24 -1.73 114.93 122.96 1t70 h MET 2231Ca 0.26 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1t70 h MET 2231Cb 0.11 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 1t70 h MET 2231CO -0.03 0.71 -0.10 -0.44 1.06 0.00 0.00 176.91 178.11 1t70 h ASP 2232N 0.36 0.00 0.01 1.22 3.45 -1.12 -2.14 116.42 118.21 1t70 h ASP 2232Ca 0.04 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 1t70 h ASP 2232Cb 0.77 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.54 1t70 h ASP 2232CO 0.06 0.10 -0.01 0.00 -1.57 0.00 0.00 179.24 177.82 1t70 h ALA 2233N 1.90 -0.02 -0.77 3.45 0.00 -0.72 -3.34 119.26 119.77 1t70 h ALA 2233Ca -0.00 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.64 1t70 h ALA 2233Cb 0.21 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 1t70 h ALA 2233CO 0.01 -0.03 0.42 1.25 0.00 0.00 0.00 179.25 180.90 1t70 h LEU 2234N -0.97 0.59 -0.71 0.00 5.85 -1.24 -1.39 115.31 117.44 1t70 h LEU 2234Ca -0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1t70 h LEU 2234Cb 0.73 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1t70 h LEU 2234CO 0.00 0.34 0.00 0.18 -0.34 0.00 0.00 178.44 178.62 1t70 n LEU 2235N -4.79 0.24 -0.01 2.25 4.77 -0.82 -1.84 117.00 116.81 1t70 n LEU 2235Ca 0.12 -0.12 0.10 0.00 -0.03 0.00 0.00 56.01 56.09 1t70 n LEU 2235Cb 0.27 -0.12 -0.15 0.00 -2.33 0.00 0.00 43.42 41.09 1t70 n LEU 2235CO 0.26 0.06 -0.43 -0.62 -1.33 0.00 0.00 177.39 175.33 1t70 n GLU 2236N 0.10 0.39 -1.25 3.23 -0.58 -0.52 -4.95 120.64 117.04 1t70 n GLU 2236Ca 0.00 -0.11 -0.29 0.00 -0.42 0.00 0.00 57.16 56.34 1t70 n GLU 2236Cb 0.06 -1.50 0.15 0.00 -0.57 0.00 0.00 31.44 29.57 1t70 n GLU 2236CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1t70 s ARG 2237N -3.27 1.01 -0.17 3.49 0.52 -0.77 -5.02 118.95 114.75 1t70 s ARG 2237Ca -0.01 0.64 -0.09 0.00 -0.52 0.00 0.00 55.73 55.76 1t70 s ARG 2237Cb 0.15 -1.79 -0.07 0.00 0.52 0.00 0.00 34.95 33.75 1t70 s ARG 2237CO 0.88 -2.36 -0.22 -0.25 0.02 0.00 0.00 175.30 173.37 1t70 n ASP 2238N -3.94 1.21 -1.67 0.23 8.00 -1.26 -4.70 116.55 114.42 1t70 n ASP 2238Ca 0.06 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.77 1t70 n ASP 2238Cb 0.56 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 1t70 n ASP 2238CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1t70 n ASP 2239N -3.77 1.62 -0.05 -2.24 3.85 -1.26 -4.08 116.55 110.62 1t70 n ASP 2239Ca -0.33 -1.31 -0.11 0.00 -0.71 0.00 0.00 54.79 52.33 1t70 n ASP 2239Cb 0.73 -0.33 -0.14 0.00 -1.35 0.00 0.00 41.12 40.02 1t70 n ASP 2239CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1t70 n LEU 2240N 1.64 0.94 0.00 -2.12 4.77 -1.26 -4.98 117.00 115.99 1t70 n LEU 2240Ca 0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1t70 n LEU 2240Cb 0.17 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1t70 n LEU 2240CO 0.00 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1t70 n GLY 2241N 1.70 2.28 3.67 -0.72 0.00 -1.26 -3.48 105.19 107.38 1t70 n GLY 2241Ca -0.25 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 1t70 n GLY 2241CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t70 s THR 2242N 0.00 4.96 -0.16 2.61 2.01 -0.15 -4.90 115.64 120.01 1t70 s THR 2242Ca 0.00 1.39 -0.08 0.00 0.31 0.00 0.00 61.69 63.31 1t70 s THR 2242Cb 0.00 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 1t70 s THR 2242CO 0.00 0.08 0.12 -0.69 -0.69 0.00 0.00 174.62 173.44 1t70 s VAL 2243N 1.97 5.30 -0.10 3.82 1.01 -1.26 -0.57 120.40 130.57 1t70 s VAL 2243Ca 0.33 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.49 1t70 s VAL 2243Cb -0.16 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 1t70 s VAL 2243CO 0.11 0.52 -0.21 0.12 0.00 0.00 0.00 175.10 175.64 1t70 s PHE 2244N -0.21 2.62 -0.16 5.22 2.19 0.74 -1.87 117.98 126.50 1t70 s PHE 2244Ca 0.10 -0.87 0.01 0.00 0.33 0.00 0.00 56.93 56.50 1t70 s PHE 2244Cb -0.12 -1.73 0.01 0.00 -1.31 0.00 0.00 43.02 39.87 1t70 s PHE 2244CO 0.01 -0.32 -0.17 0.08 1.83 0.00 0.00 175.22 176.65 1t70 s VAL 2245N 0.24 2.45 -0.64 3.12 1.01 0.19 -0.98 120.40 125.80 1t70 s VAL 2245Ca -0.14 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 1t70 s VAL 2245Cb -0.17 -2.03 0.16 0.00 0.00 0.00 0.00 36.38 34.35 1t70 s VAL 2245CO 0.07 0.52 0.54 -0.62 0.00 0.00 0.00 175.10 175.61 1t70 s ASP 2246N 0.98 6.08 -0.46 3.32 3.68 -0.19 -1.57 116.67 128.51 1t70 s ASP 2246Ca -0.03 -2.34 -0.25 0.00 2.13 0.00 0.00 52.55 52.06 1t70 s ASP 2246Cb -0.15 -2.09 0.03 0.00 -1.45 0.00 0.00 42.92 39.26 1t70 s ASP 2246CO -0.04 -0.62 0.93 0.12 0.13 0.00 0.00 175.17 175.69 1t70 s PHE 2247N 0.71 2.93 -0.91 -5.34 5.36 -1.02 -1.33 117.98 118.39 1t70 s PHE 2247Ca 0.12 0.40 -0.15 0.00 -0.96 0.00 0.00 56.93 56.33 1t70 s PHE 2247Cb -0.20 -3.96 0.19 0.00 -0.34 0.00 0.00 43.02 38.71 1t70 s PHE 2247CO -0.03 -1.09 0.94 -1.58 -1.46 0.00 0.00 175.22 172.00 1t70 s HIS 2248N 3.74 3.60 0.36 10.12 5.65 0.65 -1.30 115.29 138.12 1t70 s HIS 2248Ca 0.37 -1.88 0.04 0.00 0.25 0.00 0.00 55.06 53.84 1t70 s HIS 2248Cb -0.10 -3.99 -0.03 0.00 -1.18 0.00 0.00 32.58 27.27 1t70 s HIS 2248CO 0.26 -1.16 0.13 0.00 -0.65 0.00 0.00 174.74 173.32 1t70 s ALA 2249N 0.89 2.53 -0.10 1.58 0.00 -1.19 -0.83 121.76 124.64 1t70 s ALA 2249Ca 0.25 -1.53 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 1t70 s ALA 2249Cb -0.08 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.87 1t70 s ALA 2249CO -0.09 -0.39 -0.12 -1.91 0.00 0.00 0.00 175.76 173.25 1t70 n GLU 2250N -0.78 0.21 -2.29 0.00 4.07 -1.26 -4.51 120.64 116.07 1t70 n GLU 2250Ca -0.03 0.08 -0.42 0.00 -0.06 0.00 0.00 57.16 56.74 1t70 n GLU 2250Cb 0.65 -0.90 -0.03 0.00 -0.06 0.00 0.00 31.44 31.10 1t70 n GLU 2250CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1t70 s ALA 2251N -2.18 3.49 0.28 4.31 0.00 -1.26 -4.92 121.76 121.48 1t70 s ALA 2251Ca -0.13 1.00 0.16 0.00 0.00 0.00 0.00 51.96 52.99 1t70 s ALA 2251Cb 0.05 -3.48 0.73 0.00 0.00 0.00 0.00 23.12 20.42 1t70 s ALA 2251CO 0.18 -0.51 1.78 1.79 0.00 0.00 0.00 175.76 179.00 1t70 h THR 2252N 4.25 1.06 -0.22 0.00 1.35 -1.97 -2.63 112.91 114.75 1t70 h THR 2252Ca -0.42 -1.43 -0.08 0.00 -0.55 0.00 0.00 66.41 63.93 1t70 h THR 2252Cb 1.21 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 69.44 1t70 h THR 2252CO 0.82 0.38 -0.19 0.77 -0.25 0.00 0.00 175.52 177.05 1t70 h SER 2253N 0.00 0.39 -0.02 5.36 4.64 -1.99 -0.90 113.55 121.02 1t70 h SER 2253Ca -0.00 -0.11 -0.18 0.00 -0.47 0.00 0.00 61.79 61.03 1t70 h SER 2253Cb 0.79 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1t70 h SER 2253CO 0.05 0.60 -0.60 -0.08 -0.87 0.00 0.00 176.83 175.93 1t70 h GLU 2254N 0.36 0.62 -0.09 4.77 4.81 -1.88 -2.58 114.58 120.60 1t70 h GLU 2254Ca 0.06 -0.42 -0.04 0.00 -0.13 0.00 0.00 59.36 58.84 1t70 h GLU 2254Cb 0.55 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 1t70 h GLU 2254CO 0.04 1.04 -0.09 0.87 -0.73 0.00 0.00 179.01 180.13 1t70 h LYS 2255N 0.47 0.22 0.00 1.92 1.57 -1.25 -1.54 116.57 117.95 1t70 h LYS 2255Ca -0.00 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1t70 h LYS 2255Cb 1.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 1t70 h LYS 2255CO 0.12 0.64 -0.18 0.93 -0.57 0.00 0.00 179.45 180.39 1t70 h GLU 2256N -0.20 0.00 -0.33 3.15 5.08 -1.25 -1.15 114.58 119.88 1t70 h GLU 2256Ca 0.01 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1t70 h GLU 2256Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1t70 h GLU 2256CO 0.02 0.18 -0.16 0.00 -1.00 0.00 0.00 179.01 178.06 1t70 h ALA 2257N 1.82 0.46 -0.49 3.43 0.00 -1.28 -2.10 119.26 121.11 1t70 h ALA 2257Ca -0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1t70 h ALA 2257Cb 0.36 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1t70 h ALA 2257CO 0.02 0.38 -0.00 1.98 0.00 0.00 0.00 179.25 181.63 1t70 h MET 2258N 0.46 0.86 -0.06 0.00 1.85 -0.58 0.31 114.93 117.77 1t70 h MET 2258Ca 0.07 -0.27 0.02 0.00 -0.61 0.00 0.00 59.70 58.91 1t70 h MET 2258Cb 0.69 -0.08 -0.03 0.00 0.43 0.00 0.00 31.60 32.62 1t70 h MET 2258CO 0.05 0.90 -0.09 0.78 -0.40 0.00 0.00 176.91 178.15 1t70 h GLY 2259N 0.72 -0.05 2.00 1.39 0.00 -1.19 0.34 103.07 106.28 1t70 h GLY 2259Ca 0.14 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 1t70 h GLY 2259CO 0.03 -0.10 -0.19 1.49 0.00 0.00 0.00 176.54 177.76 1t70 h TRP 2260N -0.13 0.00 -0.10 5.60 4.06 -1.23 0.85 115.95 125.00 1t70 h TRP 2260Ca 0.05 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.85 1t70 h TRP 2260Cb 0.20 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.37 1t70 h TRP 2260CO -0.18 0.19 -0.52 1.25 -3.56 0.00 0.00 178.44 175.62 1t70 h HIS 2261N 0.00 0.72 -0.03 0.49 2.76 0.42 -3.24 115.15 116.26 1t70 h HIS 2261Ca -0.00 -0.32 0.00 0.00 -2.20 0.00 0.00 60.37 57.85 1t70 h HIS 2261Cb 0.42 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.27 1t70 h HIS 2261CO 0.00 1.10 0.00 1.28 -1.30 0.00 0.00 177.93 179.01 1t70 n LEU 2262N -4.21 1.67 -4.63 0.26 4.32 0.11 -4.91 117.00 109.61 1t70 n LEU 2262Ca -0.08 -0.57 -0.43 0.00 -0.02 0.00 0.00 56.01 54.91 1t70 n LEU 2262Cb 0.61 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 42.37 1t70 n LEU 2262CO 0.47 0.29 1.65 0.00 -1.22 0.00 0.00 177.39 178.58 1t70 s ALA 2263N -1.98 3.11 0.00 -1.18 0.00 0.27 -2.26 121.76 119.73 1t70 s ALA 2263Ca 0.37 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1t70 s ALA 2263Cb 0.21 -3.95 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1t70 s ALA 2263CO 0.33 -2.23 0.00 0.41 0.00 0.00 0.00 175.76 174.26 1t70 n GLY 2264N 5.13 0.86 0.01 0.00 0.00 -1.25 -4.89 105.19 105.04 1t70 n GLY 2264Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1t70 n GLY 2264CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1t70 n ARG 2265N -1.63 0.00 -3.75 1.61 1.85 -0.96 -5.02 116.66 108.76 1t70 n ARG 2265Ca 0.00 -0.24 -0.13 0.00 -1.00 0.00 0.00 57.85 56.49 1t70 n ARG 2265Cb 0.00 -0.23 -0.11 0.00 -1.05 0.00 0.00 32.46 31.07 1t70 n ARG 2265CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1t70 s VAL 2266N 0.00 -0.01 0.15 8.89 1.01 -1.10 -4.88 120.40 124.47 1t70 s VAL 2266Ca 0.00 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.04 1t70 s VAL 2266Cb 0.00 -0.47 -0.17 0.00 0.00 0.00 0.00 36.38 35.74 1t70 s VAL 2266CO 0.00 0.01 1.34 0.00 0.00 0.00 0.00 175.10 176.45 1t70 h ALA 2267N 5.97 0.46 -2.97 5.51 0.00 -1.48 -3.39 119.26 123.35 1t70 h ALA 2267Ca -0.29 -0.77 -0.15 0.00 0.00 0.00 0.00 54.91 53.70 1t70 h ALA 2267Cb 1.18 -0.08 -0.25 0.00 0.00 0.00 0.00 17.79 18.64 1t70 h ALA 2267CO 0.31 0.98 -0.37 0.00 0.00 0.00 0.00 179.25 180.18 1t70 s ALA 2268N -3.06 -0.73 -0.36 0.00 0.00 -1.14 0.52 121.76 116.99 1t70 s ALA 2268Ca -0.02 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.72 1t70 s ALA 2268Cb 0.10 -0.43 0.12 0.00 0.00 0.00 0.00 23.12 22.91 1t70 s ALA 2268CO 0.83 -0.15 0.16 0.08 0.00 0.00 0.00 175.76 176.68 1t70 s VAL 2269N 0.01 0.97 -0.24 0.00 1.01 0.37 -0.64 120.40 121.88 1t70 s VAL 2269Ca -0.01 -1.86 -0.06 0.00 0.00 0.00 0.00 61.98 60.05 1t70 s VAL 2269Cb -0.02 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 1t70 s VAL 2269CO 0.01 -0.80 0.03 -0.63 0.00 0.00 0.00 175.10 173.71 1t70 s ILE 2270N 1.09 3.97 0.60 2.22 1.09 -0.61 -2.86 121.20 126.71 1t70 s ILE 2270Ca 0.14 -0.29 -0.12 0.00 -1.10 0.00 0.00 60.65 59.27 1t70 s ILE 2270Cb -0.21 -2.84 -0.04 0.00 -1.06 0.00 0.00 42.46 38.31 1t70 s ILE 2270CO -0.13 0.37 1.02 -0.83 -0.10 0.00 0.00 174.94 175.28 1t70 s GLY 2271N 1.54 1.77 0.21 6.18 0.00 -0.30 -2.43 107.32 114.30 1t70 s GLY 2271Ca 0.06 0.01 -0.00 0.00 0.00 0.00 0.00 44.72 44.79 1t70 s GLY 2271CO 0.01 0.29 0.27 -1.30 0.00 0.00 0.00 173.10 172.38 1t70 n THR 2272N -2.50 0.00 0.00 0.90 -2.24 -0.42 -1.09 114.28 108.93 1t70 n THR 2272Ca 0.06 -1.13 0.00 0.00 -2.27 0.00 0.00 64.05 60.71 1t70 n THR 2272Cb 0.54 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1t70 n THR 2272CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1t70 n HIS 2273N -0.35 0.00 1.02 4.78 -0.00 -1.26 -3.20 115.22 116.21 1t70 n HIS 2273Ca 0.01 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.84 1t70 n HIS 2273Cb 0.35 0.00 0.11 0.00 -0.00 0.00 0.00 29.99 30.45 1t70 n HIS 2273CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1t70 n THR 2274N -0.04 0.00 -0.87 3.57 -2.24 -1.26 -4.93 114.28 108.51 1t70 n THR 2274Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1t70 n THR 2274Cb 0.00 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1t70 n THR 2274CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1t70 n HIS 2275N -1.35 0.00 -3.98 4.78 -0.00 -1.26 -4.97 115.22 108.44 1t70 n HIS 2275Ca 0.06 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.48 1t70 n HIS 2275Cb 0.34 -0.98 -0.16 0.00 -0.00 0.00 0.00 29.99 29.18 1t70 n HIS 2275CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1t70 s VAL 2276N -1.85 1.43 0.53 1.59 1.01 -1.26 -3.50 120.40 118.35 1t70 s VAL 2276Ca 0.00 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 1t70 s VAL 2276Cb 0.00 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 1t70 s VAL 2276CO 0.00 0.34 1.22 -2.16 0.00 0.00 0.00 175.10 174.50 1t70 s PRO 2277N 1.53 3.31 0.09 2.72 0.04 -1.26 -4.18 135.00 137.25 1t70 s PRO 2277Ca 0.03 1.88 0.07 0.00 0.04 0.00 0.00 61.00 63.02 1t70 s PRO 2277Cb -0.14 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 1t70 s PRO 2277CO -0.09 -0.95 -0.12 0.95 0.04 0.00 0.00 177.00 176.83 1t70 s THR 2278N -1.53 3.23 -0.43 1.26 -4.23 -0.63 -4.87 115.64 108.43 1t70 s THR 2278Ca 0.71 -1.26 0.06 0.00 -1.18 0.00 0.00 61.69 60.03 1t70 s THR 2278Cb -0.31 -2.48 0.47 0.00 1.34 0.00 0.00 72.50 71.52 1t70 s THR 2278CO 0.36 0.16 1.39 0.00 -0.54 0.00 0.00 174.62 176.00 1t70 n ALA 2279N 0.90 3.78 0.23 3.99 0.00 -1.26 -4.24 120.51 123.92 1t70 n ALA 2279Ca -0.14 -1.43 0.11 0.00 0.00 0.00 0.00 53.44 51.98 1t70 n ALA 2279Cb 0.52 -1.16 0.26 0.00 0.00 0.00 0.00 19.45 19.08 1t70 n ALA 2279CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1t70 n ASP 2280N 0.03 3.37 -3.26 0.00 3.85 -1.26 -4.99 116.55 114.29 1t70 n ASP 2280Ca 0.25 -1.97 -0.43 0.00 -0.71 0.00 0.00 54.79 51.93 1t70 n ASP 2280Cb 0.99 -0.31 -0.06 0.00 -1.35 0.00 0.00 41.12 40.40 1t70 n ASP 2280CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1t70 n THR 2281N 1.39 0.00 -3.57 2.12 -1.04 -1.26 -4.80 114.28 107.12 1t70 n THR 2281Ca 0.20 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.17 1t70 n THR 2281Cb 0.57 -0.03 0.02 0.00 -1.82 0.00 0.00 70.33 69.07 1t70 n THR 2281CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1t70 n ARG 2282N 1.24 0.59 -3.77 -2.82 0.00 -0.24 -5.01 116.66 106.66 1t70 n ARG 2282Ca 0.15 -1.20 -0.29 0.00 -0.00 0.00 0.00 57.85 56.51 1t70 n ARG 2282Cb 0.05 1.54 -0.16 0.00 0.00 0.00 0.00 32.46 33.89 1t70 n ARG 2282CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1t70 s ILE 2283N -2.37 0.76 0.56 5.15 1.01 -1.26 -0.83 121.20 124.21 1t70 s ILE 2283Ca 0.11 -0.84 -0.18 0.00 0.00 0.00 0.00 60.65 59.74 1t70 s ILE 2283Cb -0.03 -1.29 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 1t70 s ILE 2283CO 0.06 -0.29 1.10 -0.76 0.00 0.00 0.00 174.94 175.05 1t70 s LEU 2284N 1.73 3.66 0.09 2.97 1.43 0.11 -4.82 118.68 123.86 1t70 s LEU 2284Ca 0.00 2.06 -0.34 0.00 -1.03 0.00 0.00 54.13 54.82 1t70 s LEU 2284Cb -0.17 -4.57 -0.13 0.00 0.03 0.00 0.00 46.19 41.35 1t70 s LEU 2284CO -0.11 -1.23 1.65 1.17 0.23 0.00 0.00 176.35 178.06 1t70 n LYS 2285N -1.56 2.12 0.00 1.70 4.81 -1.26 -2.04 118.16 121.93 1t70 n LYS 2285Ca 0.11 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1t70 n LYS 2285Cb 0.52 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.01 1t70 n LYS 2285CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1t70 n GLY 2286N 3.66 1.26 2.59 3.14 0.00 -1.26 -4.21 105.19 110.36 1t70 n GLY 2286Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1t70 n GLY 2286CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t70 n GLY 2287N -0.56 0.09 3.24 -0.02 0.00 -0.87 -3.91 105.19 103.15 1t70 n GLY 2287Ca 0.00 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1t70 n GLY 2287CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t70 s THR 2288N -3.18 3.12 0.17 2.61 2.01 -0.97 0.03 115.64 119.41 1t70 s THR 2288Ca 0.25 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 1t70 s THR 2288Cb -0.11 -2.57 -0.08 0.00 0.01 0.00 0.00 72.50 69.76 1t70 s THR 2288CO 0.41 0.20 1.16 0.00 -0.69 0.00 0.00 174.62 175.70 1t70 s ALA 2289N 1.37 3.41 -0.05 7.40 0.00 0.18 0.09 121.76 134.17 1t70 s ALA 2289Ca 0.01 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 52.82 1t70 s ALA 2289Cb -0.16 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.58 1t70 s ALA 2289CO -0.03 -0.33 0.13 -0.47 0.00 0.00 0.00 175.76 175.06 1t70 s TYR 2290N 0.04 -0.14 -0.14 0.00 6.14 -0.01 -0.48 117.35 122.75 1t70 s TYR 2290Ca 0.52 0.35 -0.08 0.00 0.64 0.00 0.00 57.07 58.50 1t70 s TYR 2290Cb -0.31 0.02 0.05 0.00 0.42 0.00 0.00 41.96 42.14 1t70 s TYR 2290CO 0.35 -0.08 0.35 -1.14 0.64 0.00 0.00 175.55 175.67 1t70 s GLN 2291N 0.27 0.34 0.52 4.97 0.74 -1.13 -1.07 119.66 124.28 1t70 s GLN 2291Ca -0.02 0.67 0.30 0.00 0.05 0.00 0.00 55.36 56.36 1t70 s GLN 2291Cb -0.03 -0.03 1.32 0.00 1.10 0.00 0.00 33.01 35.37 1t70 s GLN 2291CO -0.01 -0.15 1.98 1.79 -0.55 0.00 0.00 175.29 178.36 1t70 h THR 2292N 5.52 0.33 -1.12 -0.34 1.35 -1.89 -0.77 112.91 115.99 1t70 h THR 2292Ca -0.37 -0.69 0.15 0.00 -0.55 0.00 0.00 66.41 64.95 1t70 h THR 2292Cb 1.18 1.52 -0.22 0.00 -1.73 0.00 0.00 68.15 68.89 1t70 h THR 2292CO 0.32 0.11 0.03 -0.62 -0.25 0.00 0.00 175.52 175.10 1t70 s ASP 2293N -5.94 -0.85 0.03 5.36 3.68 -1.25 -3.79 116.67 113.91 1t70 s ASP 2293Ca -0.01 0.91 0.06 0.00 2.13 0.00 0.00 52.55 55.64 1t70 s ASP 2293Cb 0.11 1.86 0.26 0.00 -1.45 0.00 0.00 42.92 43.71 1t70 s ASP 2293CO 0.58 -0.16 1.18 0.00 0.13 0.00 0.00 175.17 176.90 1t70 n ALA 2294N 5.26 1.19 0.00 3.66 0.00 -0.25 -1.61 120.51 128.76 1t70 n ALA 2294Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1t70 n ALA 2294Cb 0.52 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1t70 n ALA 2294CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t70 n GLY 2295N -1.06 -1.10 3.46 0.00 0.00 -1.26 -3.53 105.19 101.70 1t70 n GLY 2295Ca 0.01 -1.63 -0.28 0.00 0.00 0.00 0.00 46.02 44.11 1t70 n GLY 2295CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1t70 n PHE 2296N -1.23 0.50 -3.92 1.61 -1.74 -1.23 -4.01 117.46 107.44 1t70 n PHE 2296Ca 0.00 -2.29 -0.30 0.00 -0.56 0.00 0.00 57.45 54.30 1t70 n PHE 2296Cb 0.00 -0.35 -0.15 0.00 1.52 0.00 0.00 39.48 40.50 1t70 n PHE 2296CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 1t70 s THR 2297N -2.66 1.63 -1.89 1.97 2.01 0.32 -2.43 115.64 114.59 1t70 s THR 2297Ca 0.10 -1.65 0.00 0.00 0.31 0.00 0.00 61.69 60.45 1t70 s THR 2297Cb -0.01 -2.07 0.00 0.00 0.01 0.00 0.00 72.50 70.43 1t70 s THR 2297CO 0.06 -0.41 0.00 0.61 -0.69 0.00 0.00 174.62 174.19 1t70 n GLY 2298N 4.57 -0.68 3.61 4.40 0.00 -0.36 0.14 105.19 116.88 1t70 n GLY 2298Ca -0.04 -0.82 -0.57 0.00 0.00 0.00 0.00 46.02 44.58 1t70 n GLY 2298CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1t70 n PRO 2299N 0.00 0.65 0.07 1.61 -0.04 -1.26 -0.19 135.00 135.85 1t70 n PRO 2299Ca 0.00 0.24 -0.08 0.00 -0.04 0.00 0.00 63.50 63.62 1t70 n PRO 2299Cb 0.00 -1.83 -0.09 0.00 -0.04 0.00 0.00 33.50 31.54 1t70 n PRO 2299CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1t70 h HIS 2300N 4.71 0.09 -3.51 0.54 2.76 -0.85 -3.40 115.15 115.49 1t70 h HIS 2300Ca -0.48 -0.06 -0.69 0.00 -2.20 0.00 0.00 60.37 56.94 1t70 h HIS 2300Cb 1.36 -0.01 -0.35 0.00 1.55 0.00 0.00 27.41 29.97 1t70 h HIS 2300CO 0.63 1.00 -0.48 -0.51 -1.30 0.00 0.00 177.93 177.28 1t70 s ASP 2301N -6.80 5.21 0.05 3.26 1.01 -1.26 -5.03 116.67 113.10 1t70 s ASP 2301Ca -0.00 -2.41 -0.27 0.00 0.71 0.00 0.00 52.55 50.58 1t70 s ASP 2301Cb 0.10 -1.83 0.10 0.00 1.01 0.00 0.00 42.92 42.29 1t70 s ASP 2301CO 0.82 -0.46 1.20 -0.94 0.21 0.00 0.00 175.17 176.01 1t70 s SER 2302N 1.27 -0.02 -0.48 0.27 1.04 -1.26 -4.74 113.70 109.77 1t70 s SER 2302Ca 0.12 -0.32 -0.12 0.00 0.48 0.00 0.00 55.95 56.12 1t70 s SER 2302Cb -0.22 0.26 0.11 0.00 0.10 0.00 0.00 66.02 66.27 1t70 s SER 2302CO -0.04 -0.51 0.37 -0.63 0.98 0.00 0.00 173.24 173.42 1t70 s ILE 2303N -2.26 4.61 0.00 -1.02 1.01 -0.31 -4.46 121.20 118.77 1t70 s ILE 2303Ca 0.22 -1.53 0.00 0.00 0.00 0.00 0.00 60.65 59.34 1t70 s ILE 2303Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.54 1t70 s ILE 2303CO 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 174.94 174.22 1t70 n ILE 2304N 5.04 0.00 0.00 2.92 3.06 -1.26 -1.06 119.36 128.06 1t70 n ILE 2304Ca -0.11 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.14 1t70 n ILE 2304Cb 0.41 -0.72 0.00 0.00 0.54 0.00 0.00 39.64 39.87 1t70 n ILE 2304CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1t70 n GLY 2305N -0.57 1.48 3.93 4.50 0.00 -1.26 -4.97 105.19 108.31 1t70 n GLY 2305Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1t70 n GLY 2305CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t70 s SER 2306N -1.89 6.37 0.54 1.61 0.01 -0.22 -2.09 113.70 118.03 1t70 s SER 2306Ca 0.00 0.35 -0.19 0.00 1.31 0.00 0.00 55.95 57.42 1t70 s SER 2306Cb 0.00 -1.99 -0.09 0.00 0.21 0.00 0.00 66.02 64.16 1t70 s SER 2306CO 0.00 -0.06 0.67 0.00 0.41 0.00 0.00 173.24 174.26 1t70 n ALA 2307N -0.82 -0.77 -0.17 1.44 0.00 0.79 -1.16 120.51 119.82 1t70 n ALA 2307Ca -0.05 0.03 -0.11 0.00 0.00 0.00 0.00 53.44 53.31 1t70 n ALA 2307Cb 0.54 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.09 1t70 n ALA 2307CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1t70 h ILE 2308N 0.50 1.27 0.44 0.00 2.04 -1.91 -3.35 117.51 116.51 1t70 h ILE 2308Ca -0.45 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.09 1t70 h ILE 2308Cb 1.39 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 1t70 h ILE 2308CO 0.49 0.45 -0.37 -0.08 0.00 0.00 0.00 178.15 178.64 1t70 h GLU 2309N 0.84 -0.77 0.00 2.37 4.81 -1.99 -2.91 114.58 116.94 1t70 h GLU 2309Ca 0.12 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1t70 h GLU 2309Cb 0.71 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.27 1t70 h GLU 2309CO 0.05 -0.51 0.00 0.41 -0.73 0.00 0.00 179.01 178.23 1t70 n GLY 2310N -1.43 -3.16 0.54 1.92 0.00 -1.25 -1.33 105.19 100.48 1t70 n GLY 2310Ca -0.10 0.67 0.37 0.00 0.00 0.00 0.00 46.02 46.96 1t70 n GLY 2310CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1t70 h PRO 2311N 0.00 0.03 -0.43 1.61 0.11 -1.71 -0.43 132.00 131.17 1t70 h PRO 2311Ca 0.00 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.99 1t70 h PRO 2311Cb 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1t70 h PRO 2311CO 0.00 0.02 -0.21 -0.07 -0.21 0.00 0.00 178.00 177.53 1t70 h LEU 2312N 0.03 0.88 0.17 2.35 3.38 -0.99 -2.15 115.31 118.97 1t70 h LEU 2312Ca 0.62 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1t70 h LEU 2312Cb 2.40 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.91 1t70 h LEU 2312CO -0.04 1.06 -0.08 1.56 0.09 0.00 0.00 178.44 181.03 1t70 h GLN 2313N 0.75 -0.22 -0.89 1.13 1.08 -0.48 -1.61 115.11 114.88 1t70 h GLN 2313Ca 0.10 0.01 0.24 0.00 -1.45 0.00 0.00 58.65 57.56 1t70 h GLN 2313Cb 0.74 0.05 -0.16 0.00 -0.05 0.00 0.00 27.48 28.07 1t70 h GLN 2313CO 0.06 0.09 0.11 0.00 -0.95 0.00 0.00 178.83 178.14 1t70 h ARG 2314N -0.53 0.10 -0.08 1.46 2.47 -1.43 0.68 114.38 117.05 1t70 h ARG 2314Ca -0.02 -0.01 -0.13 0.00 -1.26 0.00 0.00 59.98 58.57 1t70 h ARG 2314Cb 0.41 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 1t70 h ARG 2314CO 0.04 0.07 -0.52 0.74 0.56 0.00 0.00 179.97 180.86 1t70 h PHE 2315N 0.10 0.25 0.00 3.04 0.04 -1.21 -0.27 116.94 118.90 1t70 h PHE 2315Ca 0.54 -0.08 -0.17 0.00 2.80 0.00 0.00 57.97 61.06 1t70 h PHE 2315Cb 1.09 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 39.17 1t70 h PHE 2315CO -0.38 0.68 -0.95 -0.07 -0.60 0.00 0.00 178.31 176.99 1t70 h LEU 2316N 0.16 0.00 0.00 1.54 3.38 0.61 -3.38 115.31 117.62 1t70 h LEU 2316Ca 0.00 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1t70 h LEU 2316Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1t70 h LEU 2316CO 0.08 1.36 -0.32 0.35 0.09 0.00 0.00 178.44 180.00 1t70 n THR 2317N -4.48 0.10 -1.45 0.22 -2.24 0.20 -4.91 114.28 101.72 1t70 n THR 2317Ca -0.26 -0.07 -0.16 0.00 -2.27 0.00 0.00 64.05 61.29 1t70 n THR 2317Cb 0.63 -0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.67 1t70 n THR 2317CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1t70 n GLU 2318N -1.66 -1.50 -4.21 -0.78 1.02 -0.11 -4.95 120.64 108.46 1t70 n GLU 2318Ca 0.06 1.01 -0.24 0.00 -0.02 0.00 0.00 57.16 57.97 1t70 n GLU 2318Cb 0.36 -5.35 -0.07 0.00 -0.02 0.00 0.00 31.44 26.36 1t70 n GLU 2318CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1t70 s ARG 2319N -3.33 2.27 -0.11 3.49 0.52 -1.25 -5.03 118.95 115.51 1t70 s ARG 2319Ca 0.00 -1.59 -0.29 0.00 -0.52 0.00 0.00 55.73 53.33 1t70 s ARG 2319Cb 0.00 -2.10 -0.04 0.00 0.52 0.00 0.00 34.95 33.33 1t70 s ARG 2319CO 0.00 0.16 1.57 -1.25 0.02 0.00 0.00 175.30 175.80 1t70 s PRO 2320N -3.78 4.12 -0.12 3.54 0.04 -1.26 -4.13 135.00 133.41 1t70 s PRO 2320Ca 0.36 1.98 0.02 0.00 0.04 0.00 0.00 61.00 63.39 1t70 s PRO 2320Cb -0.02 -3.95 0.02 0.00 0.04 0.00 0.00 34.50 30.58 1t70 s PRO 2320CO 0.21 -0.90 -0.16 -1.01 0.04 0.00 0.00 177.00 175.18 1t70 s HIS 2321N 4.16 2.07 0.57 0.56 3.76 -1.26 -5.02 115.29 120.12 1t70 s HIS 2321Ca 0.69 -1.01 -0.20 0.00 -0.15 0.00 0.00 55.06 54.39 1t70 s HIS 2321Cb -0.29 -1.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.87 1t70 s HIS 2321CO 0.26 -0.52 1.27 0.50 -0.85 0.00 0.00 174.74 175.41 1t70 s ARG 2322N 1.04 3.05 -0.17 1.40 3.52 -1.26 -4.81 118.95 121.72 1t70 s ARG 2322Ca -0.05 2.01 -0.29 0.00 -0.13 0.00 0.00 55.73 57.27 1t70 s ARG 2322Cb -0.15 -2.09 0.10 0.00 -1.56 0.00 0.00 34.95 31.26 1t70 s ARG 2322CO -0.03 -1.19 0.88 1.52 -0.81 0.00 0.00 175.30 175.67 1t70 s TYR 2323N -1.44 -0.52 0.22 5.12 -0.00 -1.26 -4.62 117.35 114.84 1t70 s TYR 2323Ca 0.75 1.05 0.00 0.00 -0.00 0.00 0.00 57.07 58.86 1t70 s TYR 2323Cb -0.35 0.40 -0.00 0.00 -0.00 0.00 0.00 41.96 42.01 1t70 s TYR 2323CO 0.40 -0.39 0.00 0.41 -0.00 0.00 0.00 175.55 175.96 1t70 n GLY 2324N 1.35 3.91 3.77 5.49 0.00 -1.26 -4.97 105.19 113.48 1t70 n GLY 2324Ca -0.14 -2.27 -0.41 0.00 0.00 0.00 0.00 46.02 43.20 1t70 n GLY 2324CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t70 s VAL 2325N -1.83 2.40 0.49 1.61 1.01 -1.26 -0.15 120.40 122.67 1t70 s VAL 2325Ca 0.00 0.38 -0.23 0.00 0.00 0.00 0.00 61.98 62.14 1t70 s VAL 2325Cb 0.00 -3.24 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 1t70 s VAL 2325CO 0.00 0.08 1.25 0.00 0.00 0.00 0.00 175.10 176.44 1t70 s ALA 2326N -0.80 2.93 0.24 5.51 0.00 -0.89 -4.34 121.76 124.42 1t70 s ALA 2326Ca 0.54 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.68 1t70 s ALA 2326Cb -0.43 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1t70 s ALA 2326CO 0.54 -0.95 0.17 -1.83 0.00 0.00 0.00 175.76 173.69 1t70 s GLU 2327N -2.75 2.87 0.00 0.00 4.04 -1.26 -4.74 118.70 116.86 1t70 s GLU 2327Ca 0.66 -1.06 0.00 0.00 0.04 0.00 0.00 54.97 54.61 1t70 s GLU 2327Cb -0.34 -2.54 0.00 0.00 0.02 0.00 0.00 34.13 31.27 1t70 s GLU 2327CO 0.41 0.41 0.00 0.41 -1.84 0.00 0.00 175.26 174.65 1t70 n GLY 2328N -1.04 -0.58 3.66 -3.83 0.00 -1.26 -4.89 105.19 97.24 1t70 n GLY 2328Ca -0.08 -2.17 -0.59 0.00 0.00 0.00 0.00 46.02 43.18 1t70 n GLY 2328CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1t70 n ARG 2329N 0.00 0.64 -4.18 1.61 0.63 -1.26 -4.79 116.66 109.31 1t70 n ARG 2329Ca 0.00 0.23 -0.28 0.00 -0.92 0.00 0.00 57.85 56.88 1t70 n ARG 2329Cb 0.00 -1.83 -0.08 0.00 0.45 0.00 0.00 32.46 31.00 1t70 n ARG 2329CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1t70 s ALA 2330N 2.16 3.21 0.23 5.13 0.00 -1.26 -0.16 121.76 131.06 1t70 s ALA 2330Ca 0.96 -1.28 0.10 0.00 0.00 0.00 0.00 51.96 51.74 1t70 s ALA 2330Cb -1.20 -1.05 -0.05 0.00 0.00 0.00 0.00 23.12 20.82 1t70 s ALA 2330CO 0.65 0.56 -0.19 -1.83 0.00 0.00 0.00 175.76 174.95 1t70 s GLU 2331N -2.69 1.49 -0.12 0.00 -1.05 0.73 -2.32 118.70 114.75 1t70 s GLU 2331Ca 0.26 -1.63 -0.02 0.00 -0.15 0.00 0.00 54.97 53.43 1t70 s GLU 2331Cb -0.10 -1.52 0.04 0.00 -0.44 0.00 0.00 34.13 32.11 1t70 s GLU 2331CO 0.18 0.29 0.02 -1.17 0.95 0.00 0.00 175.26 175.52 1t70 s LEU 2332N -3.22 0.80 0.11 1.83 0.20 -0.26 -1.22 118.68 116.92 1t70 s LEU 2332Ca 0.24 -0.37 0.07 0.00 0.69 0.00 0.00 54.13 54.76 1t70 s LEU 2332Cb -0.04 -0.50 -0.04 0.00 -0.43 0.00 0.00 46.19 45.18 1t70 s LEU 2332CO 0.11 -0.24 -0.08 0.20 -0.29 0.00 0.00 176.35 176.04 1t70 s ASN 2333N 1.93 4.49 0.05 3.68 0.01 -1.02 -1.58 114.94 122.50 1t70 s ASN 2333Ca 0.03 -0.36 -0.15 0.00 -0.71 0.00 0.00 52.86 51.66 1t70 s ASN 2333Cb -0.14 -0.89 0.05 0.00 0.41 0.00 0.00 41.25 40.68 1t70 s ASN 2333CO -0.06 0.17 0.70 0.61 -1.51 0.00 0.00 177.10 177.01 1t70 n GLY 2334N 0.65 0.64 2.83 0.66 0.00 0.15 -1.97 105.19 108.15 1t70 n GLY 2334Ca -0.13 -1.01 -0.20 0.00 0.00 0.00 0.00 46.02 44.68 1t70 n GLY 2334CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t70 s VAL 2335N -2.17 0.37 -0.13 1.61 1.01 0.13 -0.69 120.40 120.52 1t70 s VAL 2335Ca 0.16 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.01 1t70 s VAL 2335Cb -0.01 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.87 1t70 s VAL 2335CO 0.02 0.21 0.34 0.00 0.00 0.00 0.00 175.10 175.67 1t70 s ALA 2336N 1.26 3.59 0.21 5.51 0.00 0.49 -1.17 121.76 131.65 1t70 s ALA 2336Ca -0.06 -0.37 0.05 0.00 0.00 0.00 0.00 51.96 51.57 1t70 s ALA 2336Cb -0.13 -2.44 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 1t70 s ALA 2336CO -0.02 0.13 -0.06 -0.51 0.00 0.00 0.00 175.76 175.30 1t70 s LEU 2337N 0.28 2.38 -0.23 0.00 1.43 -0.10 -1.65 118.68 120.79 1t70 s LEU 2337Ca 0.19 -1.13 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 1t70 s LEU 2337Cb -0.14 -0.39 0.07 0.00 0.03 0.00 0.00 46.19 45.76 1t70 s LEU 2337CO 0.06 -0.39 0.07 -1.00 0.23 0.00 0.00 176.35 175.32 1t70 s HIS 2338N -3.28 0.97 -0.06 0.29 3.76 -0.72 -2.39 115.29 113.86 1t70 s HIS 2338Ca 0.24 -0.98 -0.06 0.00 -0.15 0.00 0.00 55.06 54.11 1t70 s HIS 2338Cb 0.04 -1.11 -0.04 0.00 1.11 0.00 0.00 32.58 32.57 1t70 s HIS 2338CO 0.06 -0.69 0.19 -0.06 -0.85 0.00 0.00 174.74 173.39 1t70 s PHE 2339N 1.87 3.59 -0.25 1.40 0.08 0.19 -1.51 117.98 123.34 1t70 s PHE 2339Ca 0.03 0.50 -0.10 0.00 0.12 0.00 0.00 56.93 57.48 1t70 s PHE 2339Cb -0.17 -1.93 0.10 0.00 -0.57 0.00 0.00 43.02 40.46 1t70 s PHE 2339CO -0.16 0.68 0.57 -2.00 -0.10 0.00 0.00 175.22 174.21 1t70 s GLU 2340N -1.45 0.51 -0.87 0.44 2.12 -0.28 -4.46 118.70 114.70 1t70 s GLU 2340Ca 0.21 1.24 -0.02 0.00 0.36 0.00 0.00 54.97 56.76 1t70 s GLU 2340Cb -0.13 0.52 0.00 0.00 0.26 0.00 0.00 34.13 34.79 1t70 s GLU 2340CO 0.11 -0.20 0.30 0.41 -0.54 0.00 0.00 175.26 175.34 1t70 n GLY 2341N 5.16 0.01 2.86 -1.50 0.00 -1.26 -2.46 105.19 107.99 1t70 n GLY 2341Ca -0.13 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1t70 n GLY 2341CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t70 n GLY 2342N -1.16 0.37 3.12 -0.02 0.00 -1.26 -4.98 105.19 101.26 1t70 n GLY 2342Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 1t70 n GLY 2342CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1t70 n LYS 2343N -1.47 0.93 -4.47 1.61 5.02 -1.03 -3.88 118.16 114.86 1t70 n LYS 2343Ca 0.00 -3.18 -0.34 0.00 -2.02 0.00 0.00 58.31 52.78 1t70 n LYS 2343Cb 0.14 0.88 -0.13 0.00 -0.02 0.00 0.00 35.03 35.90 1t70 n LYS 2343CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1t70 s ALA 2344N -2.76 2.81 -0.35 7.82 0.00 0.10 -1.13 121.76 128.26 1t70 s ALA 2344Ca 0.01 -0.91 0.08 0.00 0.00 0.00 0.00 51.96 51.14 1t70 s ALA 2344Cb 0.00 -1.44 -0.09 0.00 0.00 0.00 0.00 23.12 21.59 1t70 s ALA 2344CO 0.01 0.12 0.33 0.25 0.00 0.00 0.00 175.76 176.46 1t70 n THR 2345N 3.74 0.00 -3.59 0.00 -2.24 -0.57 -4.64 114.28 106.98 1t70 n THR 2345Ca -0.18 -0.30 -0.16 0.00 -2.27 0.00 0.00 64.05 61.14 1t70 n THR 2345Cb 0.52 0.95 -0.07 0.00 -2.10 0.00 0.00 70.33 69.63 1t70 n THR 2345CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t70 s ALA 2346N -1.82 -1.56 -0.28 6.98 0.00 -1.20 -4.99 121.76 118.89 1t70 s ALA 2346Ca 0.03 1.26 -0.22 0.00 0.00 0.00 0.00 51.96 53.03 1t70 s ALA 2346Cb 0.06 -0.22 0.10 0.00 0.00 0.00 0.00 23.12 23.07 1t70 s ALA 2346CO 0.33 -0.34 0.87 0.00 0.00 0.00 0.00 175.76 176.63 1t70 s ALA 2347N -0.88 -1.96 -0.12 0.00 0.00 -1.26 -1.76 121.76 115.78 1t70 s ALA 2347Ca -0.09 2.08 -0.29 0.00 0.00 0.00 0.00 51.96 53.66 1t70 s ALA 2347Cb -0.02 -1.42 0.09 0.00 0.00 0.00 0.00 23.12 21.77 1t70 s ALA 2347CO 0.07 -0.31 0.78 -1.83 0.00 0.00 0.00 175.76 174.47 1t70 s GLU 2348N 0.73 0.89 0.79 0.00 -1.05 -0.66 -4.87 118.70 114.53 1t70 s GLU 2348Ca -0.02 0.37 -0.11 0.00 -0.15 0.00 0.00 54.97 55.06 1t70 s GLU 2348Cb -0.05 0.42 0.07 0.00 -0.44 0.00 0.00 34.13 34.13 1t70 s GLU 2348CO -0.08 -0.24 1.11 1.03 0.95 0.00 0.00 175.26 178.02 1t70 s ARG 2349N -0.83 2.06 -0.05 -4.83 0.52 -1.26 -0.38 118.95 114.18 1t70 s ARG 2349Ca -0.06 1.30 -0.02 0.00 -0.52 0.00 0.00 55.73 56.43 1t70 s ARG 2349Cb -0.01 -1.87 0.03 0.00 0.52 0.00 0.00 34.95 33.62 1t70 s ARG 2349CO 0.06 -1.81 0.05 -0.47 0.02 0.00 0.00 175.30 173.15 1t70 s TYR 2350N -2.75 0.18 0.03 -0.53 6.14 0.13 -4.70 117.35 115.86 1t70 s TYR 2350Ca 0.64 0.17 0.03 0.00 0.64 0.00 0.00 57.07 58.55 1t70 s TYR 2350Cb -0.19 -0.55 -0.02 0.00 0.42 0.00 0.00 41.96 41.62 1t70 s TYR 2350CO 0.54 -0.22 -0.10 0.50 0.64 0.00 0.00 175.55 176.91 1t70 s ARG 2351N 2.13 0.71 -0.13 4.97 3.52 -1.26 -0.67 118.95 128.21 1t70 s ARG 2351Ca 0.05 -0.62 -0.06 0.00 -0.13 0.00 0.00 55.73 54.97 1t70 s ARG 2351Cb -0.12 -0.64 0.06 0.00 -1.56 0.00 0.00 34.95 32.69 1t70 s ARG 2351CO -0.04 0.15 0.29 0.12 -0.81 0.00 0.00 175.30 175.02 1t70 s PHE 2352N -0.82 -0.44 -0.26 5.12 2.19 -0.62 -5.00 117.98 118.14 1t70 s PHE 2352Ca -0.02 0.99 -0.03 0.00 0.33 0.00 0.00 56.93 58.20 1t70 s PHE 2352Cb -0.07 0.09 0.02 0.00 -1.31 0.00 0.00 43.02 41.75 1t70 s PHE 2352CO 0.01 -0.30 -0.02 0.42 1.83 0.00 0.00 175.22 177.15 1t70 s ILE 2353N 1.69 3.21 0.32 3.12 -1.09 -1.26 -1.10 121.20 126.09 1t70 s ILE 2353Ca -0.06 -0.90 -0.28 0.00 -2.23 0.00 0.00 60.65 57.17 1t70 s ILE 2353Cb -0.11 -2.63 -0.10 0.00 -1.58 0.00 0.00 42.46 38.05 1t70 s ILE 2353CO -0.10 0.17 1.18 -1.83 -1.23 0.00 0.00 174.94 173.14 1t70 s GLU 2354N 1.38 4.44 0.00 2.79 -1.05 -0.98 -5.04 118.70 120.24 1t70 s GLU 2354Ca 0.01 1.96 0.00 0.00 -0.15 0.00 0.00 54.97 56.79 1t70 s GLU 2354Cb -0.17 -3.06 0.00 0.00 -0.44 0.00 0.00 34.13 30.46 1t70 s GLU 2354CO -0.02 -0.02 0.30 -0.25 0.95 0.00 0.00 175.26 176.22