#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r38 s ILE 5 N 0.00 4.47 0.48 2.46 1.01 -1.26 -5.01 121.20 123.36 1r38 s ILE 5 Ca 0.00 0.85 -0.24 0.00 0.00 0.00 0.00 60.65 61.26 1r38 s ILE 5 Cb 0.00 -4.43 -0.08 0.00 0.01 0.00 0.00 42.46 37.96 1r38 s ILE 5 CO 0.00 -0.80 1.31 -2.65 0.00 0.00 0.00 174.94 172.80 1r38 n PRO 6 N 7.15 1.85 -3.87 2.79 -0.02 -1.26 -4.73 135.00 136.91 1r38 n PRO 6 Ca 0.07 0.67 -0.32 0.00 -2.02 0.00 0.00 63.50 61.89 1r38 n PRO 6 Cb 0.48 -2.48 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 1r38 n PRO 6 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1r38 s ASP 7 N -0.69 6.39 -0.12 2.55 1.01 -1.26 -0.75 116.67 123.80 1r38 s ASP 7 Ca 0.65 0.36 -0.01 0.00 0.71 0.00 0.00 52.55 54.27 1r38 s ASP 7 Cb -0.46 -2.00 -0.02 0.00 1.01 0.00 0.00 42.92 41.45 1r38 s ASP 7 CO 0.54 0.19 -0.10 -0.63 0.21 0.00 0.00 175.17 175.39 1r38 s ILE 8 N -1.45 3.37 -0.29 0.77 1.01 -0.04 -4.86 121.20 119.71 1r38 s ILE 8 Ca 0.33 -0.56 -0.24 0.00 0.00 0.00 0.00 60.65 60.17 1r38 s ILE 8 Cb -0.13 -2.42 0.00 0.00 0.01 0.00 0.00 42.46 39.92 1r38 s ILE 8 CO 0.24 0.53 0.84 -0.75 0.00 0.00 0.00 174.94 175.80 1r38 s LYS 9 N 0.09 4.03 0.74 2.79 2.20 -1.26 -0.20 119.74 128.12 1r38 s LYS 9 Ca -0.04 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.20 1r38 s LYS 9 Cb -0.14 -3.71 0.03 0.00 -1.51 0.00 0.00 37.83 32.50 1r38 s LYS 9 CO 0.04 -0.67 1.10 -0.51 -0.36 0.00 0.00 175.35 174.94 1r38 s LEU 10 N 3.03 2.79 0.37 5.43 1.43 0.14 -4.92 118.68 126.95 1r38 s LEU 10 Ca 0.35 1.20 0.27 0.00 -1.03 0.00 0.00 54.13 54.92 1r38 s LEU 10 Cb -0.14 -3.93 1.28 0.00 0.03 0.00 0.00 46.19 43.42 1r38 s LEU 10 CO 0.12 -1.58 1.82 0.77 0.23 0.00 0.00 176.35 177.71 1r38 h SER 11 N -0.82 0.00 0.88 2.29 4.64 -1.81 0.37 113.55 119.11 1r38 h SER 11 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1r38 h SER 11 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1r38 h SER 11 CO 0.62 0.00 -0.08 -1.54 -0.87 0.00 0.00 176.83 174.96 1r38 n SER 12 N -2.48 0.09 0.00 4.97 3.41 -1.26 -4.91 113.62 113.44 1r38 n SER 12 Ca 0.00 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 1r38 n SER 12 Cb 0.16 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1r38 n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r38 n GLY 13 N 1.48 1.06 3.85 5.00 0.00 0.12 -5.06 105.19 111.64 1r38 n GLY 13 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1r38 n GLY 13 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r38 s HIS 14 N -2.27 3.41 0.15 1.61 4.02 -1.26 -4.73 115.29 116.23 1r38 s HIS 14 Ca 0.00 1.12 -0.24 0.00 1.02 0.00 0.00 55.06 56.96 1r38 s HIS 14 Cb 0.00 -2.45 -0.08 0.00 -1.02 0.00 0.00 32.58 29.03 1r38 s HIS 14 CO 0.00 0.17 0.74 -0.51 1.02 0.00 0.00 174.74 176.16 1r38 s LEU 15 N -2.83 4.58 -0.11 0.89 1.43 -1.26 -0.68 118.68 120.70 1r38 s LEU 15 Ca 0.51 1.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.18 1r38 s LEU 15 Cb -0.11 -3.22 0.02 0.00 0.03 0.00 0.00 46.19 42.91 1r38 s LEU 15 CO 0.19 0.22 -0.09 -0.32 0.23 0.00 0.00 176.35 176.57 1r38 s MET 16 N -1.12 1.67 0.23 1.70 1.75 0.72 -4.93 119.30 119.31 1r38 s MET 16 Ca 0.34 -0.33 -0.31 0.00 -1.25 0.00 0.00 55.69 54.14 1r38 s MET 16 Cb -0.22 -1.62 -0.14 0.00 2.84 0.00 0.00 34.83 35.69 1r38 s MET 16 CO 0.25 -0.20 1.37 -2.30 -0.65 0.00 0.00 175.02 173.49 1r38 n PRO 17 N 4.67 1.90 0.11 4.11 -0.02 -1.26 -0.86 135.00 143.65 1r38 n PRO 17 Ca -0.15 0.68 0.12 0.00 -2.02 0.00 0.00 63.50 62.12 1r38 n PRO 17 Cb 0.50 -2.31 0.46 0.00 -0.02 0.00 0.00 33.50 32.14 1r38 n PRO 17 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1r38 n SER 18 N 2.12 0.60 -3.91 2.55 3.41 0.07 -4.56 113.62 113.90 1r38 n SER 18 Ca 0.12 0.62 -0.24 0.00 -0.26 0.00 0.00 58.87 59.12 1r38 n SER 18 Cb 0.30 -0.76 -0.17 0.00 -0.26 0.00 0.00 64.21 63.33 1r38 n SER 18 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1r38 s ILE 19 N -3.23 0.80 0.38 -1.33 1.01 -1.26 -1.04 121.20 116.53 1r38 s ILE 19 Ca 0.06 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.53 1r38 s ILE 19 Cb 0.10 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.74 1r38 s ILE 19 CO 0.42 0.31 0.14 0.61 0.00 0.00 0.00 174.94 176.42 1r38 n GLY 20 N 4.45 3.28 3.35 6.18 0.00 -0.08 -4.52 105.19 117.85 1r38 n GLY 20 Ca -0.17 -2.09 -0.36 0.00 0.00 0.00 0.00 46.02 43.39 1r38 n GLY 20 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1r38 s PHE 21 N -3.00 3.08 0.30 1.61 5.36 0.75 -3.43 117.98 122.66 1r38 s PHE 21 Ca 0.20 -0.86 -0.29 0.00 -0.96 0.00 0.00 56.93 55.02 1r38 s PHE 21 Cb 0.01 -2.20 -0.10 0.00 -0.34 0.00 0.00 43.02 40.39 1r38 s PHE 21 CO 0.14 -0.52 1.13 0.20 -1.46 0.00 0.00 175.22 174.70 1r38 s GLY 22 N 1.51 3.03 0.00 13.12 0.00 -0.93 -1.74 107.32 122.32 1r38 s GLY 22 Ca 0.04 0.94 0.11 0.00 0.00 0.00 0.00 44.72 45.81 1r38 s GLY 22 CO 0.01 1.53 0.89 0.00 0.00 0.00 0.00 173.10 175.53 1r38 s TRP 24 N -0.96 2.97 -1.13 0.00 -0.00 -1.26 -2.28 118.94 116.28 1r38 s TRP 24 Ca 0.14 0.57 0.00 0.00 -0.00 0.00 0.00 56.10 56.81 1r38 s TRP 24 Cb 0.10 -3.94 0.00 0.00 -0.00 0.00 0.00 33.47 29.62 1r38 s TRP 24 CO 0.15 -3.53 0.00 1.63 -0.00 0.00 0.00 176.95 175.20 1r38 n LYS 25 N 4.18 -0.82 -2.79 5.86 5.02 -1.26 -5.00 118.16 123.34 1r38 n LYS 25 Ca 0.14 0.79 -0.42 0.00 -2.02 0.00 0.00 58.31 56.80 1r38 n LYS 25 Cb 0.39 -4.81 -0.03 0.00 -0.02 0.00 0.00 35.03 30.55 1r38 n LYS 25 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1r38 s LEU 26 N -2.79 4.27 0.35 -0.35 1.43 -0.97 -5.00 118.68 115.62 1r38 s LEU 26 Ca 0.00 1.43 -0.28 0.00 -1.03 0.00 0.00 54.13 54.25 1r38 s LEU 26 Cb 0.00 -3.42 -0.11 0.00 0.03 0.00 0.00 46.19 42.70 1r38 s LEU 26 CO 0.00 -0.34 1.44 0.00 0.23 0.00 0.00 176.35 177.67 1r38 s ALA 27 N 1.62 3.56 0.56 4.21 0.00 -1.26 -4.81 121.76 125.63 1r38 s ALA 27 Ca 0.45 1.47 0.24 0.00 0.00 0.00 0.00 51.96 54.12 1r38 s ALA 27 Cb -0.18 -3.57 1.52 0.00 0.00 0.00 0.00 23.12 20.89 1r38 s ALA 27 CO 0.19 -0.91 2.14 -0.91 0.00 0.00 0.00 175.76 176.27 1r38 h ASN 28 N 3.31 0.00 0.16 0.00 4.21 -1.94 -0.57 115.58 120.74 1r38 h ASN 28 Ca -0.50 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 56.88 1r38 h ASN 28 Cb 1.23 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.42 1r38 h ASN 28 CO 0.66 0.00 -0.49 0.00 -1.29 0.00 0.00 177.43 176.31 1r38 h ALA 29 N 1.90 0.89 -0.00 -0.83 0.00 -2.02 -3.34 119.26 115.86 1r38 h ALA 29 Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1r38 h ALA 29 Cb 0.27 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1r38 h ALA 29 CO -0.00 0.66 0.00 0.25 0.00 0.00 0.00 179.25 180.16 1r38 n THR 30 N -3.97 0.33 0.07 0.00 -2.24 -0.97 -4.77 114.28 102.72 1r38 n THR 30 Ca -0.02 -0.66 -0.12 0.00 -2.27 0.00 0.00 64.05 60.98 1r38 n THR 30 Cb 0.55 0.84 -0.05 0.00 -2.10 0.00 0.00 70.33 69.57 1r38 n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r38 h ALA 31 N 0.01 -0.19 -0.13 6.98 0.00 -1.23 0.31 119.26 125.00 1r38 h ALA 31 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1r38 h ALA 31 Cb 0.16 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1r38 h ALA 31 CO 0.00 -0.63 -0.43 0.78 0.00 0.00 0.00 179.25 178.96 1r38 h GLY 32 N -0.24 -0.73 0.67 0.00 0.00 -1.79 0.17 103.07 101.15 1r38 h GLY 32 Ca 0.03 0.53 0.06 0.00 0.00 0.00 0.00 47.33 47.96 1r38 h GLY 32 CO -0.09 -0.22 0.44 -2.09 0.00 0.00 0.00 176.54 174.57 1r38 h GLU 33 N -0.50 0.77 -0.55 4.80 4.57 -1.79 0.56 114.58 122.43 1r38 h GLU 33 Ca 0.07 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1r38 h GLU 33 Cb 0.63 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1r38 h GLU 33 CO -0.40 0.51 0.13 1.96 -1.18 0.00 0.00 179.01 180.02 1r38 h GLN 34 N 0.79 0.86 -0.22 1.92 4.20 0.41 0.23 115.11 123.29 1r38 h GLN 34 Ca 0.34 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 1r38 h GLN 34 Cb 0.20 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1r38 h GLN 34 CO -0.19 0.78 -0.15 0.28 -0.67 0.00 0.00 178.83 178.88 1r38 h VAL 35 N 0.82 1.31 -0.77 -0.54 2.07 0.42 -0.39 116.25 119.17 1r38 h VAL 35 Ca 0.18 -1.26 0.05 0.00 0.82 0.00 0.00 66.70 66.49 1r38 h VAL 35 Cb 0.31 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.68 1r38 h VAL 35 CO 0.00 0.39 0.48 0.22 0.02 0.00 0.00 177.57 178.67 1r38 h TYR 36 N 0.20 0.88 -0.23 1.57 3.20 -0.71 0.71 116.97 122.59 1r38 h TYR 36 Ca 0.04 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 1r38 h TYR 36 Cb 0.67 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 1r38 h TYR 36 CO 0.07 0.47 -0.35 1.96 -1.64 0.00 0.00 178.16 178.67 1r38 h GLN 37 N 0.90 0.51 -0.69 1.82 1.08 -0.79 -1.33 115.11 116.61 1r38 h GLN 37 Ca 0.33 -0.23 -0.07 0.00 -1.45 0.00 0.00 58.65 57.23 1r38 h GLN 37 Cb 0.10 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.49 1r38 h GLN 37 CO -0.15 0.79 0.16 0.00 -0.95 0.00 0.00 178.83 178.69 1r38 h ALA 38 N 1.19 0.91 -0.40 3.87 0.00 -0.05 -0.59 119.26 124.20 1r38 h ALA 38 Ca 0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1r38 h ALA 38 Cb 0.81 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1r38 h ALA 38 CO 0.07 0.64 0.17 0.82 0.00 0.00 0.00 179.25 180.95 1r38 h ILE 39 N 1.04 1.19 -0.15 0.00 2.04 -0.47 -0.88 117.51 120.28 1r38 h ILE 39 Ca 0.22 -0.55 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1r38 h ILE 39 Cb 0.38 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1r38 h ILE 39 CO 0.00 0.20 0.10 0.11 0.00 0.00 0.00 178.15 178.57 1r38 h LYS 40 N 0.51 0.11 -0.12 2.37 1.57 -0.89 -0.08 116.57 120.05 1r38 h LYS 40 Ca 0.14 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1r38 h LYS 40 Cb 0.16 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1r38 h LYS 40 CO -0.01 0.08 0.00 0.00 -0.57 0.00 0.00 179.45 178.94 1r38 n ALA 41 N -2.54 2.52 0.00 3.86 0.00 -0.26 -4.90 120.51 119.20 1r38 n ALA 41 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1r38 n ALA 41 Cb 0.14 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1r38 n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r38 n GLY 42 N 0.86 0.31 3.75 0.00 0.00 -0.04 -5.00 105.19 105.06 1r38 n GLY 42 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1r38 n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r38 s TYR 43 N -2.00 3.53 0.00 1.61 1.51 -0.43 -4.93 117.35 116.63 1r38 s TYR 43 Ca 0.00 1.62 0.00 0.00 -1.01 0.00 0.00 57.07 57.68 1r38 s TYR 43 Cb 0.00 -3.33 0.00 0.00 -0.11 0.00 0.00 41.96 38.52 1r38 s TYR 43 CO 0.00 -0.73 0.00 0.54 -1.11 0.00 0.00 175.55 174.25 1r38 n ARG 44 N 1.58 1.49 -4.21 -0.62 5.12 -1.26 -4.21 116.66 114.55 1r38 n ARG 44 Ca 0.00 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.58 1r38 n ARG 44 Cb 0.45 -0.93 -0.10 0.00 -1.16 0.00 0.00 32.46 30.72 1r38 n ARG 44 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1r38 s LEU 45 N -2.84 3.66 -0.14 0.55 0.20 -1.26 -0.72 118.68 118.13 1r38 s LEU 45 Ca 0.00 0.09 0.00 0.00 0.69 0.00 0.00 54.13 54.91 1r38 s LEU 45 Cb 0.00 -1.88 0.02 0.00 -0.43 0.00 0.00 46.19 43.90 1r38 s LEU 45 CO 0.00 0.27 -0.13 -0.36 -0.29 0.00 0.00 176.35 175.84 1r38 s PHE 46 N -0.19 1.98 -0.50 5.38 0.40 -0.66 -0.18 117.98 124.21 1r38 s PHE 46 Ca 0.06 -1.07 -0.19 0.00 -0.60 0.00 0.00 56.93 55.13 1r38 s PHE 46 Cb -0.12 -1.49 0.06 0.00 0.51 0.00 0.00 43.02 41.98 1r38 s PHE 46 CO 0.02 -0.61 0.60 0.34 0.70 0.00 0.00 175.22 176.27 1r38 s ASP 47 N 1.49 6.22 0.00 1.36 2.15 -0.71 -1.45 116.67 125.73 1r38 s ASP 47 Ca 0.04 -0.91 0.00 0.00 0.43 0.00 0.00 52.55 52.11 1r38 s ASP 47 Cb -0.13 -2.28 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1r38 s ASP 47 CO -0.09 -0.86 0.00 0.61 -0.17 0.00 0.00 175.17 174.66 1r38 n GLY 48 N 5.16 3.63 3.60 2.66 0.00 0.29 -1.50 105.19 119.03 1r38 n GLY 48 Ca -0.07 -2.19 -0.07 0.00 0.00 0.00 0.00 46.02 43.69 1r38 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r38 s ALA 49 N -2.00 -2.00 0.22 4.61 0.00 -1.26 -3.92 121.76 117.41 1r38 s ALA 49 Ca 0.00 1.70 -0.08 0.00 0.00 0.00 0.00 51.96 53.58 1r38 s ALA 49 Cb 0.00 -1.02 0.19 0.00 0.00 0.00 0.00 23.12 22.29 1r38 s ALA 49 CO 0.00 -0.28 1.86 0.93 0.00 0.00 0.00 175.76 178.27 1r38 h GLU 50 N 2.42 1.16 0.00 0.00 5.08 -1.92 -2.11 114.58 119.21 1r38 h GLU 50 Ca -0.15 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1r38 h GLU 50 Cb 1.17 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1r38 h GLU 50 CO 0.27 0.83 0.00 -0.40 -1.00 0.00 0.00 179.01 178.71 1r38 n ASP 51 N -4.42 0.13 0.19 1.42 5.75 -1.26 -2.14 116.55 116.23 1r38 n ASP 51 Ca 0.09 0.53 0.14 0.00 -0.01 0.00 0.00 54.79 55.53 1r38 n ASP 51 Cb 0.07 -0.56 0.52 0.00 -1.03 0.00 0.00 41.12 40.12 1r38 n ASP 51 CO 0.00 0.00 0.00 1.88 -0.11 0.00 0.00 177.20 178.97 1r38 h TYR 52 N 0.00 0.00 -0.61 2.11 0.05 -1.77 -3.47 116.97 113.28 1r38 h TYR 52 Ca 0.00 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.52 1r38 h TYR 52 Cb 0.34 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 37.98 1r38 h TYR 52 CO 0.00 0.00 -0.24 0.41 -1.05 0.00 0.00 178.16 177.28 1r38 n GLY 53 N 0.27 1.29 0.60 3.88 0.00 -0.91 -4.75 105.19 105.58 1r38 n GLY 53 Ca 0.02 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.92 1r38 n GLY 53 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1r38 n ASN 54 N -0.74 0.94 0.07 1.61 0.23 -1.26 -4.85 115.26 111.26 1r38 n ASN 54 Ca -0.13 -2.46 0.04 0.00 -0.53 0.00 0.00 54.58 51.50 1r38 n ASN 54 Cb 0.52 -0.31 0.43 0.00 -2.08 0.00 0.00 39.78 38.34 1r38 n ASN 54 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1r38 h GLU 55 N 0.30 0.38 -0.73 -3.83 5.08 -1.88 -0.65 114.58 113.24 1r38 h GLU 55 Ca -0.04 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1r38 h GLU 55 Cb 1.36 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 1r38 h GLU 55 CO 0.02 0.33 0.23 -0.22 -1.00 0.00 0.00 179.01 178.37 1r38 h LYS 56 N 0.38 1.14 -0.02 2.33 3.64 -1.89 -0.57 116.57 121.57 1r38 h LYS 56 Ca 0.09 -0.24 -0.20 0.00 -1.27 0.00 0.00 60.65 59.03 1r38 h LYS 56 Cb 0.11 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1r38 h LYS 56 CO -0.01 0.97 -0.84 0.93 -2.27 0.00 0.00 179.45 178.23 1r38 h GLU 57 N 1.08 0.31 -0.69 1.90 3.07 -1.65 -0.94 114.58 117.65 1r38 h GLU 57 Ca 0.24 -0.30 -0.03 0.00 -0.50 0.00 0.00 59.36 58.76 1r38 h GLU 57 Cb 0.30 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.26 1r38 h GLU 57 CO -0.01 0.98 0.31 0.28 -1.40 0.00 0.00 179.01 179.17 1r38 h VAL 58 N 0.19 1.24 -0.83 3.13 2.07 -0.99 -1.88 116.25 119.17 1r38 h VAL 58 Ca -0.05 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1r38 h VAL 58 Cb 1.45 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1r38 h VAL 58 CO 0.14 0.28 0.43 1.23 0.02 0.00 0.00 177.57 179.67 1r38 h GLY 59 N 0.96 1.25 1.00 2.17 0.00 -0.78 -1.59 103.07 106.09 1r38 h GLY 59 Ca 0.23 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1r38 h GLY 59 CO -0.02 0.56 0.19 -0.55 0.00 0.00 0.00 176.54 176.72 1r38 h ASP 60 N 1.17 0.35 0.08 0.19 3.32 -0.68 0.18 116.42 121.02 1r38 h ASP 60 Ca 0.29 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.33 1r38 h ASP 60 Cb 0.07 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1r38 h ASP 60 CO -0.04 0.26 -0.15 1.23 -1.72 0.00 0.00 179.24 178.82 1r38 h GLY 61 N 0.40 -0.26 0.95 2.75 0.00 -0.96 -0.09 103.07 105.86 1r38 h GLY 61 Ca 0.11 0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.63 1r38 h GLY 61 CO -0.02 -0.15 0.42 -2.08 0.00 0.00 0.00 176.54 174.70 1r38 h VAL 62 N -0.29 1.13 -0.72 4.60 2.07 -1.03 -1.92 116.25 120.09 1r38 h VAL 62 Ca 0.03 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1r38 h VAL 62 Cb 0.31 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1r38 h VAL 62 CO -0.09 0.15 0.35 0.50 0.02 0.00 0.00 177.57 178.50 1r38 h LYS 63 N 0.84 1.03 -0.37 1.57 3.64 -0.37 -1.82 116.57 121.08 1r38 h LYS 63 Ca 0.24 -0.14 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1r38 h LYS 63 Cb -0.05 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.56 1r38 h LYS 63 CO -0.07 0.79 0.02 -0.09 -2.27 0.00 0.00 179.45 177.84 1r38 h ARG 64 N 1.02 0.64 0.00 1.90 2.43 -0.60 0.20 114.38 119.98 1r38 h ARG 64 Ca 0.25 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1r38 h ARG 64 Cb 0.10 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1r38 h ARG 64 CO -0.03 0.73 -0.13 0.00 -1.51 0.00 0.00 179.97 179.03 1r38 h ALA 65 N 0.89 1.73 0.18 2.80 0.00 -0.93 -1.04 119.26 122.88 1r38 h ALA 65 Ca 0.11 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 1r38 h ALA 65 Cb 0.43 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.22 1r38 h ALA 65 CO 0.01 0.16 -1.04 0.82 0.00 0.00 0.00 179.25 179.21 1r38 h ILE 66 N 0.00 1.42 -0.11 0.00 2.04 -0.92 0.12 117.51 120.07 1r38 h ILE 66 Ca -0.00 -2.58 -0.03 0.00 1.00 0.00 0.00 64.86 63.25 1r38 h ILE 66 Cb 0.24 3.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.45 1r38 h ILE 66 CO 0.02 0.75 -0.05 0.44 0.00 0.00 0.00 178.15 179.31 1r38 h ASP 67 N -0.22 0.15 0.24 1.72 3.32 -0.32 -0.99 116.42 120.32 1r38 h ASP 67 Ca -0.18 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1r38 h ASP 67 Cb 1.81 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 41.32 1r38 h ASP 67 CO 0.19 0.22 -0.03 -0.62 -1.72 0.00 0.00 179.24 177.28 1r38 n GLU 68 N -4.39 0.84 -1.01 3.56 1.02 -0.42 -4.91 120.64 115.34 1r38 n GLU 68 Ca -0.01 -0.16 -0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1r38 n GLU 68 Cb 0.18 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.10 1r38 n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r38 n GLY 69 N 1.16 0.47 0.21 0.62 0.00 -0.38 -4.93 105.19 102.35 1r38 n GLY 69 Ca 0.18 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 1r38 n GLY 69 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1r38 h LEU 70 N 0.00 0.65 -8.22 0.99 3.38 -0.97 -3.47 115.31 107.67 1r38 h LEU 70 Ca -0.01 -0.37 -0.09 0.00 0.09 0.00 0.00 57.88 57.50 1r38 h LEU 70 Cb 0.05 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 40.50 1r38 h LEU 70 CO 0.01 1.10 -0.24 0.68 0.09 0.00 0.00 178.44 180.08 1r38 s VAL 71 N -3.91 0.02 0.19 1.22 -7.23 -1.13 -5.02 120.40 104.53 1r38 s VAL 71 Ca -0.08 -1.46 0.07 0.00 -1.81 0.00 0.00 61.98 58.71 1r38 s VAL 71 Cb 0.11 -2.12 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 1r38 s VAL 71 CO 0.85 -0.08 0.02 -0.54 -0.31 0.00 0.00 175.10 175.04 1r38 s LYS 72 N -4.02 2.46 0.31 4.82 1.02 -1.26 -4.26 119.74 118.81 1r38 s LYS 72 Ca 0.23 -1.12 0.07 0.00 0.02 0.00 0.00 55.97 55.17 1r38 s LYS 72 Cb 0.01 -2.37 0.79 0.00 -0.52 0.00 0.00 37.83 35.74 1r38 s LYS 72 CO 0.06 0.45 1.75 -0.09 -0.92 0.00 0.00 175.35 176.60 1r38 h ARG 73 N 2.53 0.62 0.00 1.68 9.65 -1.97 0.10 114.38 127.00 1r38 h ARG 73 Ca -0.47 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 1r38 h ARG 73 Cb 1.21 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.65 1r38 h ARG 73 CO 0.59 0.41 0.00 -0.85 2.80 0.00 0.00 179.97 182.92 1r38 n GLU 74 N -4.85 0.00 0.00 0.20 0.00 -1.26 -2.13 120.64 112.60 1r38 n GLU 74 Ca 0.24 0.22 0.12 0.00 0.00 0.00 0.00 57.16 57.75 1r38 n GLU 74 Cb 0.65 -1.50 0.20 0.00 0.00 0.00 0.00 31.44 30.79 1r38 n GLU 74 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1r38 n GLU 75 N -1.50 0.01 -3.97 3.44 1.02 0.02 -4.85 120.64 114.82 1r38 n GLU 75 Ca 0.04 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.83 1r38 n GLU 75 Cb 0.19 -1.51 -0.08 0.00 -0.02 0.00 0.00 31.44 30.01 1r38 n GLU 75 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1r38 s ILE 76 N -3.01 5.01 -0.31 -3.67 -1.09 -0.91 -4.86 121.20 112.37 1r38 s ILE 76 Ca 0.10 0.04 -0.08 0.00 -2.23 0.00 0.00 60.65 58.49 1r38 s ILE 76 Cb 0.17 -3.23 0.01 0.00 -1.58 0.00 0.00 42.46 37.83 1r38 s ILE 76 CO 0.72 0.51 0.11 0.12 -1.23 0.00 0.00 174.94 175.17 1r38 s PHE 77 N -0.12 3.18 -0.24 3.97 2.19 0.10 -4.95 117.98 122.11 1r38 s PHE 77 Ca 0.08 -0.96 -0.07 0.00 0.33 0.00 0.00 56.93 56.31 1r38 s PHE 77 Cb -0.12 -2.29 -0.03 0.00 -1.31 0.00 0.00 43.02 39.27 1r38 s PHE 77 CO 0.01 -0.58 0.05 -0.51 1.83 0.00 0.00 175.22 176.01 1r38 s LEU 78 N 1.51 3.35 -0.14 6.12 1.43 -1.26 -1.66 118.68 128.04 1r38 s LEU 78 Ca 0.02 -0.22 -0.04 0.00 -1.03 0.00 0.00 54.13 52.86 1r38 s LEU 78 Cb -0.18 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 1r38 s LEU 78 CO 0.04 -0.02 0.01 -0.89 0.23 0.00 0.00 176.35 175.72 1r38 s THR 79 N 1.50 4.32 0.34 5.49 2.01 -0.53 -0.74 115.64 128.02 1r38 s THR 79 Ca 0.06 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 61.87 1r38 s THR 79 Cb -0.15 -2.89 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 1r38 s THR 79 CO 0.02 0.52 0.13 -0.55 -0.69 0.00 0.00 174.62 174.05 1r38 s SER 80 N -0.06 2.06 -0.01 3.53 0.15 -0.06 -0.55 113.70 118.77 1r38 s SER 80 Ca 0.04 -1.54 -0.00 0.00 0.70 0.00 0.00 55.95 55.14 1r38 s SER 80 Cb -0.13 0.31 0.01 0.00 -1.71 0.00 0.00 66.02 64.50 1r38 s SER 80 CO 0.02 -0.83 0.02 -0.54 1.20 0.00 0.00 173.24 173.10 1r38 s LYS 81 N -3.82 0.01 -0.27 5.44 1.02 -1.25 -1.36 119.74 119.50 1r38 s LYS 81 Ca 0.32 0.04 -0.29 0.00 0.02 0.00 0.00 55.97 56.07 1r38 s LYS 81 Cb 0.05 -0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.34 1r38 s LYS 81 CO 0.16 -0.02 1.26 -1.17 -0.92 0.00 0.00 175.35 174.65 1r38 s LEU 82 N 0.15 3.95 0.78 3.17 2.96 0.64 -3.03 118.68 127.29 1r38 s LEU 82 Ca -0.01 1.29 -0.11 0.00 -0.22 0.00 0.00 54.13 55.07 1r38 s LEU 82 Cb -0.02 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.19 1r38 s LEU 82 CO -0.00 -0.98 1.08 0.86 -1.32 0.00 0.00 176.35 175.99 1r38 s TRP 83 N 4.08 2.72 0.54 5.38 -0.00 -1.26 -2.02 118.94 128.39 1r38 s TRP 83 Ca 0.54 1.38 0.27 0.00 -0.00 0.00 0.00 56.10 58.30 1r38 s TRP 83 Cb -0.17 -3.04 1.44 0.00 -0.00 0.00 0.00 33.47 31.70 1r38 s TRP 83 CO 0.20 -1.75 1.96 -0.91 -0.00 0.00 0.00 176.95 176.45 1r38 h ASN 84 N -1.09 0.00 0.31 5.86 2.35 -1.91 -2.05 115.58 119.05 1r38 h ASN 84 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1r38 h ASN 84 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 1r38 h ASN 84 CO 0.55 0.00 -0.02 0.59 -1.65 0.00 0.00 177.43 176.90 1r38 n ASN 85 N -4.26 0.11 -1.02 5.81 4.13 -1.26 -0.22 115.26 118.56 1r38 n ASN 85 Ca 0.11 -0.57 -0.02 0.00 1.68 0.00 0.00 54.58 55.78 1r38 n ASN 85 Cb 0.69 -0.14 0.19 0.00 -1.54 0.00 0.00 39.78 38.98 1r38 n ASN 85 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1r38 n TYR 86 N -1.09 0.80 0.15 3.10 4.01 -0.77 -3.82 117.16 119.54 1r38 n TYR 86 Ca 0.18 -1.64 0.03 0.00 -0.16 0.00 0.00 57.90 56.31 1r38 n TYR 86 Cb 0.20 -0.40 0.11 0.00 -0.31 0.00 0.00 39.34 38.94 1r38 n TYR 86 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1r38 h HIS 87 N 1.10 0.00 -2.58 -0.72 3.86 -1.75 -3.27 115.15 111.79 1r38 h HIS 87 Ca 0.15 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.83 1r38 h HIS 87 Cb 1.37 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.87 1r38 h HIS 87 CO 0.93 0.48 1.08 0.34 0.86 0.00 0.00 177.93 181.62 1r38 s ASP 88 N -6.45 6.52 0.35 2.45 -1.08 -1.26 -4.20 116.67 113.01 1r38 s ASP 88 Ca 0.03 2.59 0.17 0.00 -0.52 0.00 0.00 52.55 54.82 1r38 s ASP 88 Cb 0.08 -2.56 1.21 0.00 -1.46 0.00 0.00 42.92 40.20 1r38 s ASP 88 CO 0.73 -0.96 1.59 -0.65 0.52 0.00 0.00 175.17 176.41 1r38 h PRO 89 N 8.85 0.06 0.00 4.34 0.11 -1.87 0.66 132.00 144.15 1r38 h PRO 89 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1r38 h PRO 89 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1r38 h PRO 89 CO 0.94 0.04 0.00 0.36 -0.21 0.00 0.00 178.00 179.13 1r38 n LYS 90 N -5.26 0.04 -0.00 1.05 2.85 -1.26 -2.84 118.16 112.75 1r38 n LYS 90 Ca 0.34 0.33 0.05 0.00 -1.05 0.00 0.00 58.31 57.99 1r38 n LYS 90 Cb 1.15 -1.59 -0.08 0.00 -0.65 0.00 0.00 35.03 33.86 1r38 n LYS 90 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1r38 n ASN 91 N -1.68 1.51 -0.08 -5.58 3.02 0.23 -4.62 115.26 108.07 1r38 n ASN 91 Ca 0.03 -0.36 -0.07 0.00 -0.03 0.00 0.00 54.58 54.14 1r38 n ASN 91 Cb 0.15 1.27 -0.00 0.00 -0.61 0.00 0.00 39.78 40.59 1r38 n ASN 91 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1r38 h VAL 92 N 0.00 0.83 -0.41 2.41 2.07 -1.32 -1.53 116.25 118.30 1r38 h VAL 92 Ca 0.00 -0.04 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1r38 h VAL 92 Cb 0.39 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1r38 h VAL 92 CO 0.00 0.02 -0.04 -0.08 0.02 0.00 0.00 177.57 177.49 1r38 h GLU 93 N 0.13 0.69 -0.48 1.57 4.81 -1.83 -0.66 114.58 118.81 1r38 h GLU 93 Ca 0.14 -0.19 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1r38 h GLU 93 Cb 0.16 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1r38 h GLU 93 CO -0.20 0.74 0.26 1.15 -0.73 0.00 0.00 179.01 180.23 1r38 h THR 94 N 0.65 1.00 -0.23 0.32 2.02 -1.61 0.31 112.91 115.37 1r38 h THR 94 Ca 0.12 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 1r38 h THR 94 Cb 0.47 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1r38 h THR 94 CO 0.02 0.09 -0.01 0.00 0.37 0.00 0.00 175.52 176.00 1r38 h ALA 95 N 1.24 0.32 -0.62 6.16 0.00 -0.86 -2.37 119.26 123.11 1r38 h ALA 95 Ca 0.20 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1r38 h ALA 95 Cb 0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1r38 h ALA 95 CO -0.12 0.05 0.41 1.25 0.00 0.00 0.00 179.25 180.84 1r38 h LEU 96 N 0.18 0.69 -1.08 0.00 5.85 -0.77 -1.72 115.31 118.47 1r38 h LEU 96 Ca 0.06 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.84 1r38 h LEU 96 Cb 0.43 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.22 1r38 h LEU 96 CO 0.01 0.50 0.62 0.78 -0.34 0.00 0.00 178.44 180.01 1r38 h ASN 97 N 0.82 0.96 -0.54 1.25 2.35 -0.19 0.26 115.58 120.49 1r38 h ASN 97 Ca 0.23 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.93 1r38 h ASN 97 Cb -0.07 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 1r38 h ASN 97 CO -0.06 0.60 0.08 0.50 -1.65 0.00 0.00 177.43 176.90 1r38 h LYS 98 N 1.08 0.91 -0.70 0.81 1.63 -0.84 -0.76 116.57 118.69 1r38 h LYS 98 Ca 0.42 -0.25 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1r38 h LYS 98 Cb 0.23 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 1r38 h LYS 98 CO -0.17 0.88 0.39 1.15 -3.45 0.00 0.00 179.45 178.25 1r38 h THR 99 N 0.79 1.21 -0.34 1.00 2.02 -0.40 -0.51 112.91 116.68 1r38 h THR 99 Ca 0.16 -0.52 -0.17 0.00 0.77 0.00 0.00 66.41 66.65 1r38 h THR 99 Cb 0.42 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1r38 h THR 99 CO 0.01 0.23 -0.45 -0.07 0.37 0.00 0.00 175.52 175.61 1r38 h LEU 100 N 0.96 0.99 -0.68 2.58 3.38 -0.76 -0.66 115.31 121.13 1r38 h LEU 100 Ca 0.25 -0.49 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 1r38 h LEU 100 Cb 0.03 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1r38 h LEU 100 CO -0.04 1.29 -0.18 0.00 0.09 0.00 0.00 178.44 179.60 1r38 h ALA 101 N 0.73 0.86 0.08 1.53 0.00 -0.96 -0.33 119.26 121.18 1r38 h ALA 101 Ca 0.04 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1r38 h ALA 101 Cb 1.05 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1r38 h ALA 101 CO 0.11 0.64 -0.04 -0.44 0.00 0.00 0.00 179.25 179.51 1r38 h ASP 102 N 0.74 -0.10 0.53 0.00 3.32 -0.98 -2.78 116.42 117.16 1r38 h ASP 102 Ca 0.11 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1r38 h ASP 102 Cb 0.70 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1r38 h ASP 102 CO 0.05 0.21 0.00 0.18 -1.72 0.00 0.00 179.24 177.96 1r38 n LEU 103 N -5.00 0.21 -3.58 1.55 4.77 -0.27 -4.04 117.00 110.64 1r38 n LEU 103 Ca -0.08 0.55 -0.22 0.00 -0.03 0.00 0.00 56.01 56.23 1r38 n LEU 103 Cb 0.19 -0.53 0.07 0.00 -2.33 0.00 0.00 43.42 40.82 1r38 n LEU 103 CO 0.33 -0.37 0.16 0.29 -1.33 0.00 0.00 177.39 176.46 1r38 n LYS 104 N -1.73 -6.97 -4.33 3.23 5.02 -0.18 -4.59 118.16 108.61 1r38 n LYS 104 Ca 0.03 0.79 -0.17 0.00 -2.02 0.00 0.00 58.31 56.94 1r38 n LYS 104 Cb 0.18 -5.78 -0.10 0.00 -0.02 0.00 0.00 35.03 29.31 1r38 n LYS 104 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1r38 s VAL 105 N -3.37 0.65 -0.17 -0.18 -7.23 -0.94 -5.05 120.40 104.12 1r38 s VAL 105 Ca 0.33 -2.00 0.22 0.00 -1.81 0.00 0.00 61.98 58.72 1r38 s VAL 105 Cb -0.15 -2.61 -0.11 0.00 0.56 0.00 0.00 36.38 34.07 1r38 s VAL 105 CO 0.75 -0.05 0.85 0.47 -0.31 0.00 0.00 175.10 176.81 1r38 n ASP 106 N -0.47 0.61 -3.61 4.85 8.00 -1.26 -4.63 116.55 120.04 1r38 n ASP 106 Ca -0.01 0.24 -0.12 0.00 0.71 0.00 0.00 54.79 55.61 1r38 n ASP 106 Cb 0.66 0.83 -0.05 0.00 -0.02 0.00 0.00 41.12 42.54 1r38 n ASP 106 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1r38 s TYR 107 N -3.33 -0.30 0.20 1.24 -0.85 -1.26 -4.53 117.35 108.51 1r38 s TYR 107 Ca -0.03 0.15 0.06 0.00 -0.52 0.00 0.00 57.07 56.73 1r38 s TYR 107 Cb 0.10 0.30 -0.04 0.00 0.38 0.00 0.00 41.96 42.70 1r38 s TYR 107 CO 0.82 -0.67 0.15 0.14 -1.52 0.00 0.00 175.55 174.48 1r38 s VAL 108 N -3.16 4.43 0.09 -3.49 -7.23 -0.82 -4.98 120.40 105.24 1r38 s VAL 108 Ca -0.01 -1.23 0.05 0.00 -1.81 0.00 0.00 61.98 58.98 1r38 s VAL 108 Cb 0.00 -3.31 -0.23 0.00 0.56 0.00 0.00 36.38 33.40 1r38 s VAL 108 CO -0.07 -0.20 1.19 0.44 -0.31 0.00 0.00 175.10 176.14 1r38 h ASP 109 N 2.07 0.11 -3.37 4.85 3.32 -1.28 -2.08 116.42 120.05 1r38 h ASP 109 Ca -0.48 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.27 1r38 h ASP 109 Cb 1.22 -0.03 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 1r38 h ASP 109 CO 0.62 1.09 -0.45 -0.22 -1.72 0.00 0.00 179.24 178.56 1r38 s LEU 110 N -6.77 0.38 -0.08 1.55 2.96 -0.93 -0.69 118.68 115.10 1r38 s LEU 110 Ca -0.01 0.58 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1r38 s LEU 110 Cb 0.09 0.83 0.01 0.00 0.50 0.00 0.00 46.19 47.63 1r38 s LEU 110 CO 0.84 -0.16 -0.14 0.12 -1.32 0.00 0.00 176.35 175.68 1r38 s PHE 111 N 1.20 1.67 0.11 5.38 5.36 -0.52 -0.88 117.98 130.30 1r38 s PHE 111 Ca -0.09 -0.68 0.10 0.00 -0.96 0.00 0.00 56.93 55.31 1r38 s PHE 111 Cb -0.09 -1.22 -0.04 0.00 -0.34 0.00 0.00 43.02 41.33 1r38 s PHE 111 CO -0.08 -0.35 -0.25 -0.51 -1.46 0.00 0.00 175.22 172.57 1r38 s LEU 112 N 0.76 2.37 -0.25 6.12 1.43 -0.47 -1.97 118.68 126.68 1r38 s LEU 112 Ca -0.12 -0.69 -0.29 0.00 -1.03 0.00 0.00 54.13 52.00 1r38 s LEU 112 Cb -0.16 -1.29 -0.01 0.00 0.03 0.00 0.00 46.19 44.77 1r38 s LEU 112 CO 0.02 0.19 1.31 -0.63 0.23 0.00 0.00 176.35 177.48 1r38 s ILE 113 N -1.03 4.16 0.21 -0.59 1.01 -0.81 -0.26 121.20 123.88 1r38 s ILE 113 Ca 0.14 1.34 -0.10 0.00 0.00 0.00 0.00 60.65 62.04 1r38 s ILE 113 Cb -0.10 -4.07 0.17 0.00 0.01 0.00 0.00 42.46 38.47 1r38 s ILE 113 CO 0.06 -0.35 1.88 0.00 0.00 0.00 0.00 174.94 176.54 1r38 h ALA 114 N 9.02 1.00 -2.48 9.38 0.00 -1.68 -0.20 119.26 134.30 1r38 h ALA 114 Ca -0.27 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 1r38 h ALA 114 Cb 1.10 -0.32 -0.20 0.00 0.00 0.00 0.00 17.79 18.38 1r38 h ALA 114 CO 1.01 0.43 -0.24 -0.06 0.00 0.00 0.00 179.25 180.39 1r38 s PHE 115 N -6.11 -0.20 -1.18 0.00 0.08 -1.26 -4.29 117.98 105.02 1r38 s PHE 115 Ca -0.13 0.28 -0.07 0.00 0.12 0.00 0.00 56.93 57.13 1r38 s PHE 115 Cb 0.15 0.12 -0.04 0.00 -0.57 0.00 0.00 43.02 42.69 1r38 s PHE 115 CO 0.79 -0.42 2.87 -0.35 -0.10 0.00 0.00 175.22 178.00 1r38 n PRO 116 N 1.15 3.61 -4.19 0.24 -0.04 -1.26 -4.78 135.00 129.73 1r38 n PRO 116 Ca -0.21 -2.43 -0.18 0.00 -0.04 0.00 0.00 63.50 60.63 1r38 n PRO 116 Cb 0.57 -2.57 -0.16 0.00 -0.04 0.00 0.00 33.50 31.30 1r38 n PRO 116 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1r38 s ILE 117 N 0.53 0.51 -0.49 0.52 1.01 -1.26 -5.01 121.20 117.01 1r38 s ILE 117 Ca 0.64 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 61.12 1r38 s ILE 117 Cb 0.22 -0.50 0.13 0.00 0.01 0.00 0.00 42.46 42.33 1r38 s ILE 117 CO -0.08 0.19 0.25 0.00 0.00 0.00 0.00 174.94 175.30 1r38 s ALA 118 N 0.46 3.27 0.61 9.38 0.00 -1.26 -4.53 121.76 129.69 1r38 s ALA 118 Ca -0.06 -3.02 -0.16 0.00 0.00 0.00 0.00 51.96 48.72 1r38 s ALA 118 Cb -0.10 -2.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 1r38 s ALA 118 CO -0.00 -1.94 1.08 -0.06 0.00 0.00 0.00 175.76 174.84 1r38 s PHE 119 N 0.20 2.84 0.35 0.00 0.08 0.70 -0.81 117.98 121.34 1r38 s PHE 119 Ca 0.15 1.53 -0.28 0.00 0.12 0.00 0.00 56.93 58.44 1r38 s PHE 119 Cb -0.23 -3.08 -0.12 0.00 -0.57 0.00 0.00 43.02 39.02 1r38 s PHE 119 CO -0.03 -1.33 1.43 1.17 -0.10 0.00 0.00 175.22 176.36 1r38 n LYS 120 N -2.07 2.46 -1.92 0.44 3.00 0.13 -4.22 118.16 115.97 1r38 n LYS 120 Ca 0.09 0.87 -0.40 0.00 -0.00 0.00 0.00 58.31 58.87 1r38 n LYS 120 Cb 0.52 -2.55 0.00 0.00 0.00 0.00 0.00 35.03 33.01 1r38 n LYS 120 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 1r38 s PHE 121 N -0.93 2.67 -0.08 5.64 5.36 -1.25 -4.69 117.98 124.69 1r38 s PHE 121 Ca 0.56 1.31 -0.01 0.00 -0.96 0.00 0.00 56.93 57.83 1r38 s PHE 121 Cb -0.52 -3.83 0.03 0.00 -0.34 0.00 0.00 43.02 38.36 1r38 s PHE 121 CO 0.61 -2.53 -0.03 0.08 -1.46 0.00 0.00 175.22 171.89 1r38 s VAL 122 N -1.20 0.60 0.42 3.12 1.01 -1.26 -4.81 120.40 118.28 1r38 s VAL 122 Ca 0.57 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 62.27 1r38 s VAL 122 Cb -0.42 -0.70 -0.10 0.00 0.00 0.00 0.00 36.38 35.16 1r38 s VAL 122 CO 0.55 0.29 1.06 -2.65 0.00 0.00 0.00 175.10 174.34 1r38 n PRO 123 N 4.97 1.44 -0.34 2.72 -0.02 -1.26 -4.85 135.00 137.66 1r38 n PRO 123 Ca -0.10 0.52 0.05 0.00 -2.02 0.00 0.00 63.50 61.95 1r38 n PRO 123 Cb 0.50 -2.10 0.21 0.00 -0.02 0.00 0.00 33.50 32.09 1r38 n PRO 123 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1r38 h ILE 124 N 1.62 0.94 0.00 4.25 2.04 -2.00 0.25 117.51 124.61 1r38 h ILE 124 Ca -0.45 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1r38 h ILE 124 Cb 1.33 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1r38 h ILE 124 CO 0.57 0.18 0.00 -0.33 0.00 0.00 0.00 178.15 178.57 1r38 h GLU 125 N 0.97 0.00 0.00 2.37 4.39 -2.01 -3.05 114.58 117.24 1r38 h GLU 125 Ca 0.46 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.16 1r38 h GLU 125 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1r38 h GLU 125 CO -0.25 0.00 -0.00 1.49 -1.16 0.00 0.00 179.01 179.09 1r38 h GLU 126 N 0.00 -0.00 -1.95 2.33 4.57 -1.29 -3.46 114.58 114.78 1r38 h GLU 126 Ca 0.00 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 1r38 h GLU 126 Cb 0.37 0.00 -0.22 0.00 -0.16 0.00 0.00 28.75 28.74 1r38 h GLU 126 CO 0.00 0.80 0.09 0.21 -1.18 0.00 0.00 179.01 178.92 1r38 s LYS 127 N -3.00 0.70 -0.22 1.92 2.20 -1.09 -5.06 119.74 115.19 1r38 s LYS 127 Ca -0.18 1.12 -0.11 0.00 -0.36 0.00 0.00 55.97 56.45 1r38 s LYS 127 Cb -0.01 0.19 0.08 0.00 -1.51 0.00 0.00 37.83 36.57 1r38 s LYS 127 CO 0.68 -0.13 0.51 -0.47 -0.36 0.00 0.00 175.35 175.58 1r38 s TYR 128 N 1.35 -0.84 0.38 4.03 5.04 -1.25 -3.66 117.35 122.40 1r38 s TYR 128 Ca -0.08 1.66 -0.24 0.00 -2.44 0.00 0.00 57.07 55.98 1r38 s TYR 128 Cb -0.05 0.43 -0.10 0.00 0.35 0.00 0.00 41.96 42.59 1r38 s TYR 128 CO -0.15 -0.45 0.98 -1.25 -1.34 0.00 0.00 175.55 173.33 1r38 s PRO 129 N 1.87 4.32 0.55 4.97 0.04 -1.26 -5.09 135.00 140.40 1r38 s PRO 129 Ca -0.08 1.32 0.33 0.00 0.04 0.00 0.00 61.00 62.61 1r38 s PRO 129 Cb -0.09 -2.51 1.47 0.00 0.04 0.00 0.00 34.50 33.42 1r38 s PRO 129 CO -0.15 0.03 2.03 -1.00 0.04 0.00 0.00 177.00 177.95 1r38 h PRO 130 N 2.53 0.00 0.00 0.56 0.13 -1.92 -3.49 132.00 129.82 1r38 h PRO 130 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1r38 h PRO 130 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1r38 h PRO 130 CO 0.63 0.05 0.00 0.41 -0.23 0.00 0.00 178.00 178.86 1r38 n GLY 131 N -0.22 3.46 0.37 1.56 0.00 -1.26 -1.08 105.19 108.03 1r38 n GLY 131 Ca -0.00 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.03 1r38 n GLY 131 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1r38 n PHE 132 N 14.00 0.04 -2.17 1.61 3.72 -1.26 -4.88 117.46 128.52 1r38 n PHE 132 Ca 0.00 -0.02 -0.42 0.00 -0.05 0.00 0.00 57.45 56.96 1r38 n PHE 132 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1r38 n PHE 132 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1r38 s TYR 133 N -1.96 3.24 -0.16 1.38 5.04 -0.24 -4.80 117.35 119.84 1r38 s TYR 133 Ca 0.38 0.95 0.15 0.00 -2.44 0.00 0.00 57.07 56.11 1r38 s TYR 133 Cb 0.20 -3.68 0.35 0.00 0.35 0.00 0.00 41.96 39.18 1r38 s TYR 133 CO 0.32 -2.38 1.18 0.00 -1.34 0.00 0.00 175.55 173.33 1r38 n GLY 135 N -1.21 0.56 2.41 0.00 0.00 -1.26 -4.66 105.19 101.03 1r38 n GLY 135 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 1r38 n GLY 135 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r38 n ASP 136 N 0.00 -1.06 0.00 1.61 2.03 -1.26 -5.11 116.55 112.76 1r38 n ASP 136 Ca 0.00 -2.93 0.00 0.00 0.52 0.00 0.00 54.79 52.38 1r38 n ASP 136 Cb 0.00 0.35 0.00 0.00 -0.72 0.00 0.00 41.12 40.75 1r38 n ASP 136 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1r38 n GLY 137 N 1.52 2.79 1.14 0.27 0.00 -1.26 -1.96 105.19 107.70 1r38 n GLY 137 Ca 0.16 -0.32 0.10 0.00 0.00 0.00 0.00 46.02 45.96 1r38 n GLY 137 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1r38 n ASN 138 N 3.69 3.32 -4.76 1.61 3.02 -1.26 -4.55 115.26 116.32 1r38 n ASN 138 Ca 0.00 -2.00 -0.39 0.00 -0.03 0.00 0.00 54.58 52.17 1r38 n ASN 138 Cb 0.00 -0.41 -0.06 0.00 -0.61 0.00 0.00 39.78 38.70 1r38 n ASN 138 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1r38 s ASN 139 N -1.02 7.46 0.00 6.41 0.01 -0.83 -5.00 114.94 121.97 1r38 s ASN 139 Ca 0.42 1.94 -0.24 0.00 -0.71 0.00 0.00 52.86 54.26 1r38 s ASN 139 Cb 0.22 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.23 1r38 s ASN 139 CO 0.28 0.02 0.75 -0.36 -1.51 0.00 0.00 177.10 176.28 1r38 s PHE 140 N -1.36 3.67 -0.02 2.20 0.40 -1.26 -4.17 117.98 117.44 1r38 s PHE 140 Ca 0.45 1.39 0.02 0.00 -0.60 0.00 0.00 56.93 58.20 1r38 s PHE 140 Cb -0.24 -2.82 0.00 0.00 0.51 0.00 0.00 43.02 40.48 1r38 s PHE 140 CO 0.30 0.20 -0.07 0.08 0.70 0.00 0.00 175.22 176.42 1r38 s VAL 141 N 0.30 0.63 0.35 -0.44 1.01 -1.26 -5.07 120.40 115.93 1r38 s VAL 141 Ca 0.39 -0.29 0.09 0.00 0.00 0.00 0.00 61.98 62.16 1r38 s VAL 141 Cb -0.19 -0.57 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1r38 s VAL 141 CO 0.21 0.20 0.04 -0.31 0.00 0.00 0.00 175.10 175.25 1r38 s TYR 142 N 0.15 2.57 0.10 5.22 2.02 -1.26 0.20 117.35 126.34 1r38 s TYR 142 Ca -0.02 -0.46 0.10 0.00 -0.37 0.00 0.00 57.07 56.32 1r38 s TYR 142 Cb -0.07 -1.57 -0.04 0.00 -0.40 0.00 0.00 41.96 39.88 1r38 s TYR 142 CO 0.00 0.43 -0.26 -1.21 -1.57 0.00 0.00 175.55 172.94 1r38 s GLU 143 N -3.75 1.51 -1.35 -0.62 2.02 0.01 -4.55 118.70 111.97 1r38 s GLU 143 Ca 0.36 -1.26 -0.13 0.00 0.02 0.00 0.00 54.97 53.96 1r38 s GLU 143 Cb 0.01 -1.90 0.10 0.00 0.10 0.00 0.00 34.13 32.44 1r38 s GLU 143 CO 0.20 0.46 1.97 -0.25 0.02 0.00 0.00 175.26 177.66 1r38 n ASP 144 N 1.20 4.58 -4.05 -0.19 8.00 -1.26 -4.77 116.55 120.06 1r38 n ASP 144 Ca -0.18 -2.97 -0.32 0.00 0.71 0.00 0.00 54.79 52.04 1r38 n ASP 144 Cb 0.53 -1.59 -0.15 0.00 -0.02 0.00 0.00 41.12 39.89 1r38 n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1r38 s VAL 145 N 2.09 2.30 0.51 2.53 1.01 -1.26 -5.10 120.40 122.48 1r38 s VAL 145 Ca 0.45 -1.97 -0.23 0.00 0.00 0.00 0.00 61.98 60.23 1r38 s VAL 145 Cb 0.10 -2.52 -0.06 0.00 0.00 0.00 0.00 36.38 33.89 1r38 s VAL 145 CO -0.03 -0.32 1.38 -2.84 0.00 0.00 0.00 175.10 173.30 1r38 s PRO 146 N 1.02 3.35 0.26 2.72 0.02 -1.26 -4.88 135.00 136.22 1r38 s PRO 146 Ca 0.01 2.30 -0.08 0.00 0.02 0.00 0.00 61.00 63.25 1r38 s PRO 146 Cb -0.20 -2.41 0.44 0.00 0.02 0.00 0.00 34.50 32.35 1r38 s PRO 146 CO -0.06 -1.04 1.60 0.82 -0.33 0.00 0.00 177.00 177.99 1r38 h ILE 147 N 1.77 0.20 -0.53 2.83 1.08 -1.98 -0.95 117.51 119.92 1r38 h ILE 147 Ca -0.51 -0.01 0.05 0.00 -0.39 0.00 0.00 64.86 64.00 1r38 h ILE 147 Cb 1.29 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 35.17 1r38 h ILE 147 CO 0.59 0.01 0.35 0.25 -0.69 0.00 0.00 178.15 178.66 1r38 h LEU 148 N 0.03 0.45 -0.15 1.44 5.85 -1.98 -0.39 115.31 120.56 1r38 h LEU 148 Ca 0.43 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.14 1r38 h LEU 148 Cb 0.73 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1r38 h LEU 148 CO -0.81 0.30 0.05 -0.33 -0.34 0.00 0.00 178.44 177.31 1r38 h GLU 149 N 0.52 0.23 -0.85 1.25 4.39 -1.53 0.23 114.58 118.82 1r38 h GLU 149 Ca 0.23 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.90 1r38 h GLU 149 Cb 0.24 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 1r38 h GLU 149 CO -0.06 0.35 0.56 1.15 -1.16 0.00 0.00 179.01 179.85 1r38 h THR 150 N 0.06 1.19 -0.31 1.13 2.02 -1.28 -2.17 112.91 113.55 1r38 h THR 150 Ca 0.05 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1r38 h THR 150 Cb 0.21 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.57 1r38 h THR 150 CO -0.00 0.21 0.15 -0.25 0.37 0.00 0.00 175.52 175.99 1r38 h TRP 151 N 1.13 0.45 -0.74 3.16 2.91 -0.68 -1.62 115.95 120.56 1r38 h TRP 151 Ca 0.32 -0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.36 1r38 h TRP 151 Cb -0.08 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.39 1r38 h TRP 151 CO -0.02 0.40 0.49 0.87 -1.03 0.00 0.00 178.44 179.15 1r38 h LYS 152 N 0.37 0.84 -0.54 2.65 1.57 -0.64 0.11 116.57 120.94 1r38 h LYS 152 Ca 0.11 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1r38 h LYS 152 Cb 0.12 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 1r38 h LYS 152 CO -0.01 0.56 0.14 0.00 -0.57 0.00 0.00 179.45 179.57 1r38 h ALA 153 N 1.58 1.24 -0.42 3.86 0.00 -0.80 -1.35 119.26 123.36 1r38 h ALA 153 Ca 0.30 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1r38 h ALA 153 Cb 0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1r38 h ALA 153 CO -0.09 0.53 -0.24 -0.07 0.00 0.00 0.00 179.25 179.38 1r38 h LEU 154 N 0.79 0.89 -1.16 0.00 3.38 0.07 -2.20 115.31 117.08 1r38 h LEU 154 Ca 0.18 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 1r38 h LEU 154 Cb 0.27 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1r38 h LEU 154 CO -0.00 1.09 0.12 -0.33 0.09 0.00 0.00 178.44 179.41 1r38 h GLU 155 N 0.75 0.71 -0.38 1.13 5.08 -0.40 -1.16 114.58 120.31 1r38 h GLU 155 Ca 0.10 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 1r38 h GLU 155 Cb 0.79 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 1r38 h GLU 155 CO 0.07 0.64 -0.17 0.87 -1.00 0.00 0.00 179.01 179.42 1r38 h LYS 156 N 0.69 0.71 0.00 2.33 1.57 -0.89 -2.06 116.57 118.92 1r38 h LYS 156 Ca 0.16 -0.25 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1r38 h LYS 156 Cb 0.24 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1r38 h LYS 156 CO -0.00 0.84 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.32 1r38 h LEU 157 N 0.63 0.00 -0.54 2.94 3.38 -0.73 0.20 115.31 121.19 1r38 h LEU 157 Ca 0.10 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1r38 h LEU 157 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1r38 h LEU 157 CO 0.05 0.32 -0.35 0.58 0.09 0.00 0.00 178.44 179.12 1r38 h VAL 158 N 0.00 1.28 0.00 1.22 2.07 -0.80 -2.04 116.25 117.98 1r38 h VAL 158 Ca -0.00 -1.52 -0.05 0.00 0.82 0.00 0.00 66.70 65.95 1r38 h VAL 158 Cb 0.79 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1r38 h VAL 158 CO 0.04 0.50 -0.24 0.00 0.02 0.00 0.00 177.57 177.89 1r38 h ALA 159 N 0.94 1.07 -0.05 1.67 0.00 -0.65 -1.82 119.26 120.42 1r38 h ALA 159 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1r38 h ALA 159 Cb 0.90 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1r38 h ALA 159 CO 0.08 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1r38 n ALA 160 N -2.25 2.57 -0.94 0.00 0.00 -0.02 -4.89 120.51 114.97 1r38 n ALA 160 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1r38 n ALA 160 Cb 0.41 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1r38 n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r38 n GLY 161 N 0.81 0.41 0.02 0.00 0.00 -0.68 -4.89 105.19 100.86 1r38 n GLY 161 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 1r38 n GLY 161 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1r38 n LYS 162 N -1.65 0.07 -3.85 1.61 5.02 -0.80 -4.65 118.16 113.91 1r38 n LYS 162 Ca 0.00 0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.20 1r38 n LYS 162 Cb 0.13 -1.56 -0.14 0.00 -0.02 0.00 0.00 35.03 33.44 1r38 n LYS 162 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1r38 s ILE 163 N -3.04 -0.01 -0.17 -0.18 1.01 -1.21 -1.95 121.20 115.65 1r38 s ILE 163 Ca 0.11 0.04 -0.18 0.00 0.00 0.00 0.00 60.65 60.62 1r38 s ILE 163 Cb 0.17 -0.05 -0.22 0.00 0.01 0.00 0.00 42.46 42.37 1r38 s ILE 163 CO 0.65 0.01 0.31 0.11 0.00 0.00 0.00 174.94 176.02 1r38 h LYS 164 N 6.32 0.09 -4.39 2.79 1.79 -1.46 -3.40 116.57 118.31 1r38 h LYS 164 Ca -0.28 -0.16 -0.29 0.00 -2.18 0.00 0.00 60.65 57.75 1r38 h LYS 164 Cb 1.19 0.06 -0.24 0.00 -1.58 0.00 0.00 32.23 31.66 1r38 h LYS 164 CO 0.49 1.08 -0.74 -1.12 -1.08 0.00 0.00 179.45 178.08 1r38 s SER 165 N -6.90 0.68 0.12 0.86 0.01 0.13 -5.01 113.70 103.59 1r38 s SER 165 Ca -0.26 -0.34 0.10 0.00 1.31 0.00 0.00 55.95 56.76 1r38 s SER 165 Cb 0.06 -0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.24 1r38 s SER 165 CO 0.66 -0.09 -0.25 0.27 0.41 0.00 0.00 173.24 174.24 1r38 s ILE 166 N -0.82 2.06 0.00 1.44 -4.36 -1.26 -1.44 121.20 116.82 1r38 s ILE 166 Ca -0.05 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.65 1r38 s ILE 166 Cb -0.06 -1.85 0.00 0.00 1.25 0.00 0.00 42.46 41.80 1r38 s ILE 166 CO 0.00 0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.82 1r38 n GLY 167 N 0.95 2.11 3.24 6.27 0.00 -0.83 -0.80 105.19 116.13 1r38 n GLY 167 Ca -0.18 -0.99 -0.15 0.00 0.00 0.00 0.00 46.02 44.70 1r38 n GLY 167 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r38 s VAL 168 N -2.99 1.15 0.02 1.61 -7.23 -0.20 -1.93 120.40 110.82 1r38 s VAL 168 Ca 0.00 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.24 1r38 s VAL 168 Cb 0.00 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 35.17 1r38 s VAL 168 CO 0.00 -0.69 -0.13 -0.55 -0.31 0.00 0.00 175.10 173.42 1r38 s SER 169 N -3.00 1.56 -1.43 4.85 0.15 -0.09 -0.60 113.70 115.14 1r38 s SER 169 Ca 0.14 -0.35 -0.09 0.00 0.70 0.00 0.00 55.95 56.35 1r38 s SER 169 Cb 0.01 -0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.22 1r38 s SER 169 CO 0.01 0.09 1.03 0.59 1.20 0.00 0.00 173.24 176.15 1r38 n ASN 170 N 2.31 -5.95 -4.63 5.45 3.02 -0.20 -4.01 115.26 111.26 1r38 n ASN 170 Ca -0.16 -0.54 -0.36 0.00 -0.03 0.00 0.00 54.58 53.48 1r38 n ASN 170 Cb 0.55 -4.72 -0.10 0.00 -0.61 0.00 0.00 39.78 34.90 1r38 n ASN 170 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1r38 s PHE 171 N -3.28 3.27 0.85 3.10 0.40 -1.26 -4.44 117.98 116.62 1r38 s PHE 171 Ca 0.55 0.13 -0.13 0.00 -0.60 0.00 0.00 56.93 56.88 1r38 s PHE 171 Cb -0.25 -2.26 0.11 0.00 0.51 0.00 0.00 43.02 41.12 1r38 s PHE 171 CO 0.68 -0.00 1.20 -1.25 0.70 0.00 0.00 175.22 176.55 1r38 s PRO 172 N 1.14 1.65 0.20 0.24 0.04 -1.26 -4.79 135.00 132.23 1r38 s PRO 172 Ca 0.07 0.05 -0.12 0.00 0.04 0.00 0.00 61.00 61.03 1r38 s PRO 172 Cb -0.14 -1.92 0.25 0.00 0.04 0.00 0.00 34.50 32.73 1r38 s PRO 172 CO 0.05 -1.80 1.66 0.78 0.04 0.00 0.00 177.00 177.73 1r38 h GLY 173 N -1.21 0.57 1.46 0.56 0.00 -1.97 -1.71 103.07 100.78 1r38 h GLY 173 Ca -0.46 0.09 -0.04 0.00 0.00 0.00 0.00 47.33 46.92 1r38 h GLY 173 CO 0.61 -0.19 0.12 0.00 0.00 0.00 0.00 176.54 177.09 1r38 h ALA 174 N 1.53 1.35 -0.19 3.60 0.00 -1.99 -0.84 119.26 122.72 1r38 h ALA 174 Ca 0.29 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 1r38 h ALA 174 Cb 0.46 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1r38 h ALA 174 CO -0.51 0.47 -0.59 1.25 0.00 0.00 0.00 179.25 179.87 1r38 h LEU 175 N 0.67 0.86 -0.57 0.00 5.85 -1.83 -1.53 115.31 118.75 1r38 h LEU 175 Ca 0.15 -0.59 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 1r38 h LEU 175 Cb 0.24 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1r38 h LEU 175 CO -0.00 1.30 0.02 0.25 -0.34 0.00 0.00 178.44 179.67 1r38 h LEU 176 N 0.46 0.96 -0.69 2.25 5.85 -1.10 -1.07 115.31 121.98 1r38 h LEU 176 Ca -0.02 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1r38 h LEU 176 Cb 1.22 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 1r38 h LEU 176 CO 0.13 1.02 0.37 0.25 -0.34 0.00 0.00 178.44 179.87 1r38 h LEU 177 N 0.88 0.86 -0.64 2.25 5.85 -1.07 -0.70 115.31 122.74 1r38 h LEU 177 Ca 0.16 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 1r38 h LEU 177 Cb 0.51 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1r38 h LEU 177 CO 0.02 0.71 -0.01 -0.78 -0.34 0.00 0.00 178.44 178.05 1r38 h ASP 178 N 0.94 1.04 -0.64 1.25 3.58 -1.00 -2.74 116.42 118.85 1r38 h ASP 178 Ca 0.24 -0.30 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 1r38 h ASP 178 Cb 0.05 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.79 1r38 h ASP 178 CO -0.04 1.09 0.37 0.25 -2.88 0.00 0.00 179.24 178.04 1r38 h LEU 179 N 0.96 0.78 -2.00 2.28 5.85 -0.79 -2.20 115.31 120.20 1r38 h LEU 179 Ca 0.17 -0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1r38 h LEU 179 Cb 0.57 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1r38 h LEU 179 CO 0.03 0.63 0.22 -0.07 -0.34 0.00 0.00 178.44 178.91 1r38 h LEU 180 N 0.87 0.00 -0.91 2.25 3.38 -0.85 -0.05 115.31 120.01 1r38 h LEU 180 Ca 0.23 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 1r38 h LEU 180 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1r38 h LEU 180 CO -0.04 0.00 -0.50 0.03 0.09 0.00 0.00 178.44 178.02 1r38 h ARG 181 N 0.00 0.11 -0.00 1.13 3.08 -1.12 -3.32 114.38 114.26 1r38 h ARG 181 Ca 0.14 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1r38 h ARG 181 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1r38 h ARG 181 CO -0.00 0.59 -0.60 0.41 -1.07 0.00 0.00 179.97 179.30 1r38 n GLY 182 N -0.03 -0.30 3.75 0.04 0.00 -0.45 -5.00 105.19 103.19 1r38 n GLY 182 Ca -0.02 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1r38 n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r38 s ALA 183 N -2.25 3.39 -0.18 4.61 0.00 -0.16 -4.93 121.76 122.24 1r38 s ALA 183 Ca 0.07 0.85 -0.19 0.00 0.00 0.00 0.00 51.96 52.69 1r38 s ALA 183 Cb 0.11 -3.35 -0.21 0.00 0.00 0.00 0.00 23.12 19.68 1r38 s ALA 183 CO 0.55 -0.20 0.29 1.15 0.00 0.00 0.00 175.76 177.55 1r38 h THR 184 N 3.50 0.92 -3.80 0.00 2.02 -1.92 -3.42 112.91 110.21 1r38 h THR 184 Ca -0.45 -2.23 -0.65 0.00 0.77 0.00 0.00 66.41 63.85 1r38 h THR 184 Cb 1.21 2.36 -0.17 0.00 -1.74 0.00 0.00 68.15 69.81 1r38 h THR 184 CO 0.71 0.45 -0.45 -0.63 0.37 0.00 0.00 175.52 175.97 1r38 s ILE 185 N -2.39 5.27 0.39 3.11 1.01 -1.26 -5.06 121.20 122.27 1r38 s ILE 185 Ca -0.27 0.11 -0.25 0.00 0.00 0.00 0.00 60.65 60.24 1r38 s ILE 185 Cb 0.05 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.81 1r38 s ILE 185 CO 0.64 0.13 1.17 -0.54 0.00 0.00 0.00 174.94 176.34 1r38 s LYS 186 N 1.82 4.08 0.10 2.79 -0.14 -1.26 -4.92 119.74 122.21 1r38 s LYS 186 Ca 0.08 1.84 -0.32 0.00 -1.36 0.00 0.00 55.97 56.22 1r38 s LYS 186 Cb -0.16 -2.70 -0.11 0.00 -1.68 0.00 0.00 37.83 33.18 1r38 s LYS 186 CO 0.11 -0.30 1.81 -0.35 -0.76 0.00 0.00 175.35 175.86 1r38 n PRO 187 N 0.12 2.65 0.16 -1.68 -0.04 -1.26 -4.84 135.00 130.11 1r38 n PRO 187 Ca 0.04 0.97 0.09 0.00 -0.04 0.00 0.00 63.50 64.56 1r38 n PRO 187 Cb 0.46 -2.84 0.08 0.00 -0.04 0.00 0.00 33.50 31.16 1r38 n PRO 187 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r38 h ALA 188 N 8.32 0.78 -3.11 0.55 0.00 -1.32 -3.43 119.26 121.04 1r38 h ALA 188 Ca -0.46 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.11 1r38 h ALA 188 Cb 1.23 0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.81 1r38 h ALA 188 CO 0.94 0.18 -0.71 0.08 0.00 0.00 0.00 179.25 179.74 1r38 s VAL 189 N -3.19 0.15 -0.20 0.00 1.01 -1.26 -1.37 120.40 115.54 1r38 s VAL 189 Ca 0.04 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.21 1r38 s VAL 189 Cb 0.07 -0.27 0.05 0.00 0.00 0.00 0.00 36.38 36.24 1r38 s VAL 189 CO 0.73 -0.41 -0.04 -0.22 0.00 0.00 0.00 175.10 175.16 1r38 s LEU 190 N -1.26 1.94 -0.26 3.92 2.96 -0.08 -1.04 118.68 124.86 1r38 s LEU 190 Ca -0.13 -0.92 -0.09 0.00 -0.22 0.00 0.00 54.13 52.77 1r38 s LEU 190 Cb -0.09 -0.97 -0.04 0.00 0.50 0.00 0.00 46.19 45.60 1r38 s LEU 190 CO -0.01 -0.23 0.11 -1.58 -1.32 0.00 0.00 176.35 173.32 1r38 s GLN 191 N 1.57 3.76 0.08 1.98 0.74 0.23 -2.06 119.66 125.96 1r38 s GLN 191 Ca -0.02 -0.42 0.00 0.00 0.05 0.00 0.00 55.36 54.97 1r38 s GLN 191 Cb -0.17 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.45 1r38 s GLN 191 CO -0.07 -0.18 -0.04 0.14 -0.55 0.00 0.00 175.29 174.58 1r38 s VAL 192 N 1.66 0.47 0.17 1.34 -7.23 -0.88 -1.03 120.40 114.90 1r38 s VAL 192 Ca 0.07 -1.88 -0.32 0.00 -1.81 0.00 0.00 61.98 58.04 1r38 s VAL 192 Cb -0.15 -1.64 -0.11 0.00 0.56 0.00 0.00 36.38 35.04 1r38 s VAL 192 CO 0.06 -0.90 1.70 -0.70 -0.31 0.00 0.00 175.10 174.95 1r38 s GLU 193 N -3.88 4.16 -0.18 4.82 2.12 -1.26 -1.54 118.70 122.94 1r38 s GLU 193 Ca 0.11 2.51 -0.06 0.00 0.36 0.00 0.00 54.97 57.89 1r38 s GLU 193 Cb 0.07 -3.25 0.09 0.00 0.26 0.00 0.00 34.13 31.29 1r38 s GLU 193 CO -0.06 -0.73 0.36 -1.58 -0.54 0.00 0.00 175.26 172.71 1r38 s HIS 194 N 1.64 -0.68 0.11 5.30 2.46 -0.63 -4.82 115.29 118.67 1r38 s HIS 194 Ca 0.75 1.25 -0.26 0.00 0.47 0.00 0.00 55.06 57.27 1r38 s HIS 194 Cb -0.46 0.15 0.07 0.00 -0.13 0.00 0.00 32.58 32.21 1r38 s HIS 194 CO 0.33 -0.47 0.93 -3.38 -2.47 0.00 0.00 174.74 169.67 1r38 s HIS 195 N 2.54 -0.20 0.66 3.88 -3.43 -1.11 -3.96 115.29 113.67 1r38 s HIS 195 Ca 0.01 -0.06 0.29 0.00 -0.80 0.00 0.00 55.06 54.51 1r38 s HIS 195 Cb -0.12 0.61 1.59 0.00 -1.43 0.00 0.00 32.58 33.22 1r38 s HIS 195 CO -0.12 -0.75 1.90 -1.35 -2.00 0.00 0.00 174.74 172.42 1r38 h PRO 196 N 2.00 0.00 0.00 -0.38 0.11 -1.94 0.24 132.00 132.03 1r38 h PRO 196 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1r38 h PRO 196 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1r38 h PRO 196 CO 0.27 0.00 -0.55 0.66 -0.21 0.00 0.00 178.00 178.18 1r38 n TYR 197 N -2.95 0.22 -3.35 0.65 4.01 -1.26 -2.08 117.16 112.39 1r38 n TYR 197 Ca -0.01 0.06 -0.25 0.00 -0.16 0.00 0.00 57.90 57.54 1r38 n TYR 197 Cb 0.41 -0.43 -0.09 0.00 -0.31 0.00 0.00 39.34 38.93 1r38 n TYR 197 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1r38 s LEU 198 N -3.51 0.96 0.03 7.72 2.96 0.82 -0.40 118.68 127.27 1r38 s LEU 198 Ca 0.09 -2.66 0.16 0.00 -0.22 0.00 0.00 54.13 51.49 1r38 s LEU 198 Cb 0.16 -0.16 -0.16 0.00 0.50 0.00 0.00 46.19 46.53 1r38 s LEU 198 CO 0.70 -0.20 0.79 0.00 -1.32 0.00 0.00 176.35 176.32 1r38 n GLN 199 N 3.21 0.62 -3.77 1.98 6.02 -1.15 -2.73 117.38 121.56 1r38 n GLN 199 Ca 0.24 0.25 -0.23 0.00 -0.01 0.00 0.00 57.00 57.25 1r38 n GLN 199 Cb 0.46 -1.81 -0.05 0.00 1.02 0.00 0.00 30.24 29.86 1r38 n GLN 199 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1r38 n GLN 200 N -2.94 -0.85 -0.33 -1.09 6.02 -1.26 -4.78 117.38 112.16 1r38 n GLN 200 Ca -0.11 0.01 0.17 0.00 -0.01 0.00 0.00 57.00 57.06 1r38 n GLN 200 Cb 0.90 -2.13 0.41 0.00 1.02 0.00 0.00 30.24 30.43 1r38 n GLN 200 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1r38 h PRO 201 N -0.83 0.58 -0.17 -1.09 0.13 -1.99 -0.07 132.00 128.55 1r38 h PRO 201 Ca -0.45 -0.03 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1r38 h PRO 201 Cb 0.93 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 1r38 h PRO 201 CO 0.44 0.38 -0.34 0.87 -0.23 0.00 0.00 178.00 179.12 1r38 h LYS 202 N 0.60 0.36 0.05 0.86 1.57 -1.99 0.13 116.57 118.14 1r38 h LYS 202 Ca 0.57 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1r38 h LYS 202 Cb 1.12 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1r38 h LYS 202 CO -0.34 0.66 -0.03 1.25 -0.57 0.00 0.00 179.45 180.43 1r38 h LEU 203 N 0.31 -0.06 -0.50 2.94 5.85 -1.38 -0.36 115.31 122.11 1r38 h LEU 203 Ca 0.04 -0.35 0.07 0.00 0.84 0.00 0.00 57.88 58.48 1r38 h LEU 203 Cb 0.75 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.74 1r38 h LEU 203 CO 0.06 0.32 0.18 0.40 -0.34 0.00 0.00 178.44 179.06 1r38 h ILE 204 N -0.45 0.83 -0.22 4.05 1.08 -1.27 0.07 117.51 121.60 1r38 h ILE 204 Ca -0.01 -0.12 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1r38 h ILE 204 Cb 0.40 0.45 -0.01 0.00 -3.07 0.00 0.00 36.82 34.59 1r38 h ILE 204 CO 0.01 0.06 0.08 -0.08 -0.69 0.00 0.00 178.15 177.54 1r38 h GLU 205 N 0.35 0.34 -0.32 2.37 4.81 -0.94 -0.24 114.58 120.96 1r38 h GLU 205 Ca 0.24 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1r38 h GLU 205 Cb 0.25 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1r38 h GLU 205 CO -0.24 0.40 0.18 0.35 -0.73 0.00 0.00 179.01 178.97 1r38 h PHE 206 N 0.20 0.44 -0.11 0.92 3.57 -0.62 -1.50 116.94 119.84 1r38 h PHE 206 Ca 0.07 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1r38 h PHE 206 Cb 0.20 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 1r38 h PHE 206 CO -0.01 0.35 0.04 0.00 -2.23 0.00 0.00 178.31 176.46 1r38 h ALA 207 N 1.05 0.14 -0.67 2.41 0.00 -0.82 -1.27 119.26 120.09 1r38 h ALA 207 Ca 0.11 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1r38 h ALA 207 Cb 0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1r38 h ALA 207 CO -0.02 -0.25 0.40 1.96 0.00 0.00 0.00 179.25 181.34 1r38 h GLN 208 N 0.00 0.75 -0.30 0.00 4.20 -0.99 -0.62 115.11 118.15 1r38 h GLN 208 Ca 0.04 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1r38 h GLN 208 Cb 0.20 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1r38 h GLN 208 CO -0.00 0.50 -0.03 -0.22 -0.67 0.00 0.00 178.83 178.40 1r38 h LYS 209 N 0.77 0.46 0.00 1.46 3.64 -1.04 -0.38 116.57 121.48 1r38 h LYS 209 Ca 0.28 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1r38 h LYS 209 Cb 0.09 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1r38 h LYS 209 CO -0.14 0.52 0.00 0.00 -2.27 0.00 0.00 179.45 177.56 1r38 n ALA 210 N -2.48 2.50 -0.77 5.00 0.00 -0.38 -4.86 120.51 119.53 1r38 n ALA 210 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1r38 n ALA 210 Cb 0.25 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1r38 n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r38 n GLY 211 N 0.68 0.63 3.75 0.00 0.00 -0.15 -5.04 105.19 105.05 1r38 n GLY 211 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1r38 n GLY 211 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r38 s VAL 212 N -2.07 4.88 0.05 1.61 1.01 -0.40 -4.57 120.40 120.91 1r38 s VAL 212 Ca 0.00 1.39 -0.22 0.00 0.00 0.00 0.00 61.98 63.15 1r38 s VAL 212 Cb 0.00 -4.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 1r38 s VAL 212 CO 0.00 0.37 0.64 -0.89 0.00 0.00 0.00 175.10 175.22 1r38 s THR 213 N 0.02 4.75 -0.11 3.92 2.01 -0.47 -3.63 115.64 122.12 1r38 s THR 213 Ca 0.34 1.37 -0.13 0.00 0.31 0.00 0.00 61.69 63.58 1r38 s THR 213 Cb -0.19 -3.98 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 1r38 s THR 213 CO 0.19 0.47 0.30 -0.63 -0.69 0.00 0.00 174.62 174.26 1r38 s ILE 214 N -0.59 5.27 -0.17 1.82 -1.09 -1.26 -0.91 121.20 124.27 1r38 s ILE 214 Ca 0.32 0.57 0.01 0.00 -2.23 0.00 0.00 60.65 59.33 1r38 s ILE 214 Cb -0.20 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.08 1r38 s ILE 214 CO 0.20 0.47 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.30 1r38 s THR 215 N -0.14 2.17 0.13 2.92 2.01 -0.88 -1.17 115.64 120.69 1r38 s THR 215 Ca 0.18 -0.92 -0.16 0.00 0.31 0.00 0.00 61.69 61.11 1r38 s THR 215 Cb -0.14 -1.90 -0.07 0.00 0.01 0.00 0.00 72.50 70.40 1r38 s THR 215 CO 0.06 0.53 0.57 0.00 -0.69 0.00 0.00 174.62 175.09 1r38 s ALA 216 N 1.13 3.57 0.16 7.40 0.00 -0.29 -2.07 121.76 131.66 1r38 s ALA 216 Ca 0.01 -0.06 0.08 0.00 0.00 0.00 0.00 51.96 51.98 1r38 s ALA 216 Cb -0.14 -2.57 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 1r38 s ALA 216 CO -0.08 0.43 -0.17 1.52 0.00 0.00 0.00 175.76 177.46 1r38 s TYR 217 N -1.37 1.70 -1.21 0.00 -0.85 -0.59 -3.93 117.35 111.10 1r38 s TYR 217 Ca 0.35 -0.50 -0.00 0.00 -0.52 0.00 0.00 57.07 56.40 1r38 s TYR 217 Cb -0.16 -0.85 -0.00 0.00 0.38 0.00 0.00 41.96 41.32 1r38 s TYR 217 CO 0.19 0.28 0.96 0.43 -1.52 0.00 0.00 175.55 175.89 1r38 n SER 218 N 0.31 -2.08 0.31 -0.18 7.64 -1.26 -1.60 113.62 116.76 1r38 n SER 218 Ca -0.13 -0.65 0.19 0.00 1.01 0.00 0.00 58.87 59.28 1r38 n SER 218 Cb 0.57 -4.98 1.02 0.00 -1.01 0.00 0.00 64.21 59.81 1r38 n SER 218 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1r38 h SER 219 N -1.87 0.00 -0.51 6.43 0.02 -1.85 -0.66 113.55 115.10 1r38 h SER 219 Ca -0.59 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.32 1r38 h SER 219 Cb 1.34 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.86 1r38 h SER 219 CO 0.51 0.02 0.04 0.49 -1.14 0.00 0.00 176.83 176.75 1r38 n PHE 220 N -3.42 1.84 0.00 3.45 0.99 -1.26 -4.72 117.46 114.33 1r38 n PHE 220 Ca -0.03 -0.69 0.00 0.00 -0.00 0.00 0.00 57.45 56.73 1r38 n PHE 220 Cb 0.11 -0.48 0.00 0.00 -1.00 0.00 0.00 39.48 38.11 1r38 n PHE 220 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1r38 n GLY 221 N 0.41 4.06 0.27 1.37 0.00 -0.25 -2.72 105.19 108.33 1r38 n GLY 221 Ca 0.26 0.11 0.13 0.00 0.00 0.00 0.00 46.02 46.52 1r38 n GLY 221 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r38 h PRO 222 N 0.00 0.00 -0.82 1.61 0.13 -1.92 -3.35 132.00 127.66 1r38 h PRO 222 Ca 0.00 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.24 1r38 h PRO 222 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 1r38 h PRO 222 CO 0.00 0.08 -0.46 0.37 -0.23 0.00 0.00 178.00 177.76 1r38 h GLN 223 N 0.00 -0.09 -0.65 0.86 5.75 -1.87 -0.26 115.11 118.85 1r38 h GLN 223 Ca -0.00 0.01 0.12 0.00 -0.15 0.00 0.00 58.65 58.63 1r38 h GLN 223 Cb 0.23 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1r38 h GLN 223 CO 0.01 -0.06 0.44 1.03 -2.65 0.00 0.00 178.83 177.60 1r38 h SER 224 N -0.10 0.34 0.41 -0.69 0.87 -1.83 -2.17 113.55 110.38 1r38 h SER 224 Ca 0.23 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1r38 h SER 224 Cb 0.54 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1r38 h SER 224 CO -0.85 0.20 -0.21 0.49 -0.53 0.00 0.00 176.83 175.93 1r38 n PHE 225 N -4.46 0.00 0.19 2.24 3.01 -0.13 -4.18 117.46 114.11 1r38 n PHE 225 Ca 0.11 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.43 1r38 n PHE 225 Cb 0.45 -0.21 -0.08 0.00 -0.01 0.00 0.00 39.48 39.63 1r38 n PHE 225 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1r38 h VAL 226 N 0.60 0.71 0.00 -4.37 2.07 -1.08 -2.29 116.25 111.89 1r38 h VAL 226 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1r38 h VAL 226 Cb 0.44 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1r38 h VAL 226 CO 0.00 0.02 0.00 1.05 0.02 0.00 0.00 177.57 178.66 1r38 h GLU 227 N -0.47 0.00 -0.00 1.57 4.11 -1.75 0.42 114.58 118.46 1r38 h GLU 227 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1r38 h GLU 227 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1r38 h GLU 227 CO 0.07 0.00 -0.16 -1.33 0.07 0.00 0.00 179.01 177.66 1r38 n MET 228 N -2.72 0.21 -2.56 1.06 2.81 -0.88 -4.92 117.12 110.13 1r38 n MET 228 Ca -0.02 -0.06 -0.16 0.00 -1.81 0.00 0.00 57.70 55.64 1r38 n MET 228 Cb 0.06 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.08 1r38 n MET 228 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1r38 n ASN 229 N -1.34 -4.89 -4.70 7.83 3.02 0.15 -4.95 115.26 110.38 1r38 n ASN 229 Ca 0.09 -0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 1r38 n ASN 229 Cb 0.31 -3.88 -0.03 0.00 -0.61 0.00 0.00 39.78 35.58 1r38 n ASN 229 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1r38 s GLN 230 N -5.10 4.36 0.13 3.52 0.74 -1.11 -4.92 119.66 117.28 1r38 s GLN 230 Ca 0.11 1.89 -0.23 0.00 0.05 0.00 0.00 55.36 57.18 1r38 s GLN 230 Cb -0.05 -3.40 -0.03 0.00 1.10 0.00 0.00 33.01 30.64 1r38 s GLN 230 CO 0.14 -0.40 1.66 0.78 -0.55 0.00 0.00 175.29 176.92 1r38 h GLY 231 N 7.32 -0.15 0.15 2.59 0.00 -1.92 0.32 103.07 111.38 1r38 h GLY 231 Ca -0.40 0.21 0.08 0.00 0.00 0.00 0.00 47.33 47.22 1r38 h GLY 231 CO 0.85 -0.16 -0.13 -0.09 0.00 0.00 0.00 176.54 177.01 1r38 h ARG 232 N -0.23 -0.05 -0.60 4.80 2.43 -1.97 0.08 114.38 118.84 1r38 h ARG 232 Ca 0.09 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 1r38 h ARG 232 Cb 0.36 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 1r38 h ARG 232 CO -0.23 -0.03 -0.02 0.00 -1.51 0.00 0.00 179.97 178.18 1r38 h ALA 233 N 1.30 0.81 -0.71 2.80 0.00 -1.85 -2.64 119.26 118.98 1r38 h ALA 233 Ca 0.19 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1r38 h ALA 233 Cb 0.34 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1r38 h ALA 233 CO -0.43 0.67 0.47 -0.07 0.00 0.00 0.00 179.25 179.88 1r38 h LEU 234 N 0.97 0.79 -2.32 0.00 3.38 -0.13 -2.30 115.31 115.70 1r38 h LEU 234 Ca 0.17 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1r38 h LEU 234 Cb 0.58 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1r38 h LEU 234 CO 0.03 0.56 0.00 0.59 0.09 0.00 0.00 178.44 179.72 1r38 n ASN 235 N -4.44 3.50 -4.47 -0.43 3.02 -0.06 -4.88 115.26 107.51 1r38 n ASN 235 Ca 0.08 -2.41 -0.34 0.00 -0.03 0.00 0.00 54.58 51.88 1r38 n ASN 235 Cb 0.06 -0.53 -0.13 0.00 -0.61 0.00 0.00 39.78 38.58 1r38 n ASN 235 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1r38 s THR 236 N -1.88 3.78 0.12 3.41 2.01 -0.87 -5.05 115.64 117.15 1r38 s THR 236 Ca 0.33 -0.39 -0.31 0.00 0.31 0.00 0.00 61.69 61.62 1r38 s THR 236 Cb 0.23 -2.66 -0.09 0.00 0.01 0.00 0.00 72.50 69.99 1r38 s THR 236 CO 0.13 0.48 1.66 -2.84 -0.69 0.00 0.00 174.62 173.37 1r38 s PRO 237 N 0.51 4.19 0.74 4.92 0.02 -1.26 -4.93 135.00 139.18 1r38 s PRO 237 Ca -0.04 2.41 -0.16 0.00 0.02 0.00 0.00 61.00 63.24 1r38 s PRO 237 Cb -0.14 -3.42 0.02 0.00 0.02 0.00 0.00 34.50 30.97 1r38 s PRO 237 CO 0.03 -0.72 1.00 0.25 -0.33 0.00 0.00 177.00 177.23 1r38 n THR 238 N 4.43 2.71 0.11 0.99 -2.24 -1.26 -4.90 114.28 114.12 1r38 n THR 238 Ca 0.16 -0.35 -0.04 0.00 -2.27 0.00 0.00 64.05 61.55 1r38 n THR 238 Cb 0.39 -1.12 0.07 0.00 -2.10 0.00 0.00 70.33 67.57 1r38 n THR 238 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1r38 h LEU 239 N -0.35 0.05 -0.95 3.22 3.38 -1.92 -3.04 115.31 115.70 1r38 h LEU 239 Ca -0.47 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 1r38 h LEU 239 Cb 1.33 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.03 1r38 h LEU 239 CO 0.47 0.78 0.39 -0.26 0.09 0.00 0.00 178.44 179.91 1r38 h PHE 240 N 0.02 1.13 -0.38 1.13 0.05 -1.91 -2.91 116.94 114.07 1r38 h PHE 240 Ca -0.01 -0.05 0.00 0.00 3.82 0.00 0.00 57.97 61.73 1r38 h PHE 240 Cb 1.33 -0.36 0.00 0.00 2.00 0.00 0.00 35.95 38.92 1r38 h PHE 240 CO 0.01 0.81 0.00 0.00 -0.18 0.00 0.00 178.31 178.95 1r38 n ALA 241 N -2.43 2.45 -2.12 2.45 0.00 -1.19 -4.52 120.51 115.15 1r38 n ALA 241 Ca 0.08 -0.84 -0.41 0.00 0.00 0.00 0.00 53.44 52.27 1r38 n ALA 241 Cb 0.13 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1r38 n ALA 241 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1r38 s HIS 242 N -1.50 3.46 0.32 0.00 5.04 -1.10 -4.91 115.29 116.60 1r38 s HIS 242 Ca 0.36 1.43 0.02 0.00 -1.54 0.00 0.00 55.06 55.33 1r38 s HIS 242 Cb 0.20 -3.40 0.59 0.00 0.04 0.00 0.00 32.58 30.01 1r38 s HIS 242 CO 0.27 -1.10 1.91 -0.44 -2.34 0.00 0.00 174.74 173.04 1r38 h ASP 243 N 5.52 0.84 -0.28 9.88 3.32 -1.91 0.11 116.42 133.91 1r38 h ASP 243 Ca -0.44 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.59 1r38 h ASP 243 Cb 1.21 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1r38 h ASP 243 CO 0.75 0.53 0.05 0.74 -1.72 0.00 0.00 179.24 179.59 1r38 h THR 244 N 0.95 1.23 -0.02 0.35 2.02 -1.95 0.14 112.91 115.62 1r38 h THR 244 Ca 0.39 -0.77 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1r38 h THR 244 Cb 0.27 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1r38 h THR 244 CO -0.15 0.25 -0.00 0.40 0.37 0.00 0.00 175.52 176.39 1r38 h ILE 245 N 0.27 1.25 -0.53 3.11 1.08 -1.70 -2.20 117.51 118.81 1r38 h ILE 245 Ca 0.08 -0.76 0.07 0.00 -0.39 0.00 0.00 64.86 63.87 1r38 h ILE 245 Cb 0.33 1.72 -0.06 0.00 -3.07 0.00 0.00 36.82 35.74 1r38 h ILE 245 CO 0.00 0.20 0.19 0.11 -0.69 0.00 0.00 178.15 177.96 1r38 h LYS 246 N -0.27 0.36 0.02 2.37 1.57 -0.76 -0.02 116.57 119.84 1r38 h LYS 246 Ca 0.01 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1r38 h LYS 246 Cb 0.33 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1r38 h LYS 246 CO 0.00 0.24 -0.11 0.00 -0.57 0.00 0.00 179.45 179.00 1r38 h ALA 247 N 1.36 -0.14 -0.47 3.86 0.00 -0.62 0.14 119.26 123.38 1r38 h ALA 247 Ca 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1r38 h ALA 247 Cb 0.29 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1r38 h ALA 247 CO -0.26 -0.61 0.21 0.82 0.00 0.00 0.00 179.25 179.40 1r38 h ILE 248 N -0.20 1.17 -0.21 0.00 2.04 -1.02 -1.19 117.51 118.09 1r38 h ILE 248 Ca 0.04 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 1r38 h ILE 248 Cb 0.24 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1r38 h ILE 248 CO -0.10 0.20 0.02 0.00 0.00 0.00 0.00 178.15 178.27 1r38 h ALA 249 N 1.57 0.28 -0.71 1.87 0.00 -0.44 -2.68 119.26 119.15 1r38 h ALA 249 Ca 0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1r38 h ALA 249 Cb 0.10 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1r38 h ALA 249 CO -0.02 -0.02 0.32 0.00 0.00 0.00 0.00 179.25 179.53 1r38 h ALA 250 N 0.81 0.92 -0.68 0.00 0.00 -0.63 0.47 119.26 120.15 1r38 h ALA 250 Ca 0.06 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.94 1r38 h ALA 250 Cb 0.36 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1r38 h ALA 250 CO 0.01 0.51 0.46 -0.22 0.00 0.00 0.00 179.25 180.00 1r38 h LYS 251 N 1.00 0.35 -0.01 0.00 3.64 -1.07 -1.73 116.57 118.75 1r38 h LYS 251 Ca 0.24 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1r38 h LYS 251 Cb 0.15 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1r38 h LYS 251 CO -0.03 0.23 -0.14 0.66 -2.27 0.00 0.00 179.45 177.90 1r38 n TYR 252 N -4.46 0.00 -3.16 1.91 4.01 -0.96 -5.01 117.16 109.49 1r38 n TYR 252 Ca 0.12 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.80 1r38 n TYR 252 Cb 0.49 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.55 1r38 n TYR 252 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1r38 n ASN 253 N 0.22 -7.28 -4.09 7.72 5.15 0.15 -5.05 115.26 112.09 1r38 n ASN 253 Ca 0.06 -0.34 -0.10 0.00 -0.60 0.00 0.00 54.58 53.60 1r38 n ASN 253 Cb 0.29 -5.16 -0.08 0.00 -0.53 0.00 0.00 39.78 34.30 1r38 n ASN 253 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1r38 s LYS 254 N -3.61 1.21 0.65 1.20 -0.14 -0.17 -5.02 119.74 113.85 1r38 s LYS 254 Ca 0.18 -1.40 -0.11 0.00 -1.36 0.00 0.00 55.97 53.28 1r38 s LYS 254 Cb -0.03 0.33 -0.02 0.00 -1.68 0.00 0.00 37.83 36.44 1r38 s LYS 254 CO 0.75 -0.42 1.04 0.95 -0.76 0.00 0.00 175.35 176.91 1r38 s THR 255 N -4.06 4.42 0.31 2.17 -4.23 -1.26 -4.44 115.64 108.55 1r38 s THR 255 Ca 0.27 0.78 -0.00 0.00 -1.18 0.00 0.00 61.69 61.56 1r38 s THR 255 Cb 0.05 -3.67 0.27 0.00 1.34 0.00 0.00 72.50 70.48 1r38 s THR 255 CO 0.06 -1.03 1.97 -0.65 -0.54 0.00 0.00 174.62 174.43 1r38 h PRO 256 N -0.49 1.00 -0.47 3.99 0.11 -1.90 -2.21 132.00 132.04 1r38 h PRO 256 Ca -0.44 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1r38 h PRO 256 Cb 1.20 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 32.04 1r38 h PRO 256 CO 0.60 0.66 0.23 0.00 -0.21 0.00 0.00 178.00 179.28 1r38 h ALA 257 N 1.52 0.59 -0.74 -0.75 0.00 -1.93 -0.54 119.26 117.40 1r38 h ALA 257 Ca 0.31 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1r38 h ALA 257 Cb -0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1r38 h ALA 257 CO -0.08 -0.13 0.49 0.93 0.00 0.00 0.00 179.25 180.46 1r38 h GLU 258 N 0.45 0.97 -0.30 0.00 5.08 -1.77 -1.15 114.58 117.86 1r38 h GLU 258 Ca 0.21 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1r38 h GLU 258 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1r38 h GLU 258 CO -0.16 0.64 -0.20 0.28 -1.00 0.00 0.00 179.01 178.58 1r38 h VAL 259 N 1.00 1.30 -0.59 3.13 2.07 -0.93 -1.24 116.25 120.99 1r38 h VAL 259 Ca 0.27 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 1r38 h VAL 259 Cb -0.11 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1r38 h VAL 259 CO -0.06 0.43 0.28 -0.07 0.02 0.00 0.00 177.57 178.17 1r38 h LEU 260 N 0.42 0.74 -0.01 2.57 3.38 -0.58 0.04 115.31 121.86 1r38 h LEU 260 Ca 0.06 -0.07 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 1r38 h LEU 260 Cb 0.74 -0.19 0.02 0.00 0.09 0.00 0.00 40.66 41.32 1r38 h LEU 260 CO 0.05 0.63 -1.08 -0.07 0.09 0.00 0.00 178.44 178.07 1r38 h LEU 261 N 0.82 0.79 -0.72 1.67 3.38 -1.14 -3.28 115.31 116.84 1r38 h LEU 261 Ca 0.20 -0.67 -0.10 0.00 0.09 0.00 0.00 57.88 57.40 1r38 h LEU 261 Cb 0.09 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1r38 h LEU 261 CO -0.03 1.47 -0.15 -0.09 0.09 0.00 0.00 178.44 179.74 1r38 h ARG 262 N 0.31 0.83 -0.99 1.13 9.65 -0.99 -1.08 114.38 123.24 1r38 h ARG 262 Ca -0.13 -0.30 0.18 0.00 -1.10 0.00 0.00 59.98 58.63 1r38 h ARG 262 Cb 1.73 -0.06 -0.10 0.00 -1.39 0.00 0.00 29.97 30.15 1r38 h ARG 262 CO 0.20 0.92 0.60 2.35 2.80 0.00 0.00 179.97 186.84 1r38 h TRP 263 N 0.74 1.05 0.00 2.20 7.01 -1.05 0.19 115.95 126.09 1r38 h TRP 263 Ca 0.12 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.11 1r38 h TRP 263 Cb 0.66 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.39 1r38 h TRP 263 CO 0.04 0.25 -0.26 0.00 -2.79 0.00 0.00 178.44 175.68 1r38 h ALA 264 N 1.63 0.05 -0.78 2.65 0.00 -1.54 -3.35 119.26 117.92 1r38 h ALA 264 Ca 0.56 -0.57 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1r38 h ALA 264 Cb 0.84 0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 1r38 h ALA 264 CO -0.37 0.15 0.38 0.00 0.00 0.00 0.00 179.25 179.41 1r38 h ALA 265 N -0.25 1.12 0.00 0.00 0.00 -0.94 -0.34 119.26 118.85 1r38 h ALA 265 Ca -0.07 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1r38 h ALA 265 Cb 0.92 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1r38 h ALA 265 CO -0.04 -0.09 -0.02 0.37 0.00 0.00 0.00 179.25 179.46 1r38 h GLN 266 N 0.58 0.00 -0.64 0.00 4.15 -0.80 -0.42 115.11 117.99 1r38 h GLN 266 Ca 0.41 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.83 1r38 h GLN 266 Cb 0.54 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1r38 h GLN 266 CO -0.34 0.02 0.00 0.54 -1.93 0.00 0.00 178.83 177.13 1r38 n ARG 267 N -3.35 3.42 -1.04 1.69 1.74 -0.18 -4.90 116.66 114.04 1r38 n ARG 267 Ca -0.02 -2.37 -0.01 0.00 -0.77 0.00 0.00 57.85 54.68 1r38 n ARG 267 Cb 0.13 -1.85 -0.01 0.00 -1.02 0.00 0.00 32.46 29.71 1r38 n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1r38 n GLY 268 N 0.88 0.51 3.66 -0.13 0.00 -0.17 -5.03 105.19 104.92 1r38 n GLY 268 Ca 0.21 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 1r38 n GLY 268 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r38 s ILE 269 N -2.03 5.31 0.56 -0.61 1.01 -0.94 -4.66 121.20 119.83 1r38 s ILE 269 Ca 0.00 0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.81 1r38 s ILE 269 Cb 0.00 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 1r38 s ILE 269 CO 0.00 0.31 1.14 0.00 0.00 0.00 0.00 174.94 176.40 1r38 s ALA 270 N 1.16 2.66 0.12 9.38 0.00 -0.32 -3.21 121.76 131.55 1r38 s ALA 270 Ca 0.11 0.85 0.05 0.00 0.00 0.00 0.00 51.96 52.97 1r38 s ALA 270 Cb -0.14 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1r38 s ALA 270 CO 0.06 -0.86 -0.12 0.14 0.00 0.00 0.00 175.76 174.98 1r38 s VAL 271 N -1.75 1.17 -0.36 0.00 -7.23 -0.21 -1.13 120.40 110.88 1r38 s VAL 271 Ca 0.73 -1.78 0.13 0.00 -1.81 0.00 0.00 61.98 59.25 1r38 s VAL 271 Cb -0.25 -1.55 0.37 0.00 0.56 0.00 0.00 36.38 35.51 1r38 s VAL 271 CO 0.28 -0.55 0.79 2.30 -0.31 0.00 0.00 175.10 177.62 1r38 n ILE 272 N 0.35 0.06 -1.72 -0.62 -5.35 -1.25 -0.91 119.36 109.92 1r38 n ILE 272 Ca -0.14 -4.14 -0.39 0.00 -0.27 0.00 0.00 62.75 57.80 1r38 n ILE 272 Cb 0.58 0.00 0.03 0.00 -1.74 0.00 0.00 39.64 38.51 1r38 n ILE 272 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1r38 n PRO 273 N 0.21 1.75 -4.92 6.28 -0.04 -1.22 -2.69 135.00 134.36 1r38 n PRO 273 Ca 0.21 0.64 -0.32 0.00 -0.04 0.00 0.00 63.50 63.99 1r38 n PRO 273 Cb 0.69 -2.48 -0.14 0.00 -0.04 0.00 0.00 33.50 31.53 1r38 n PRO 273 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1r38 s LYS 274 N -2.61 2.22 -0.28 0.54 2.36 -1.26 -2.19 119.74 118.52 1r38 s LYS 274 Ca 0.68 -0.87 -0.17 0.00 -2.55 0.00 0.00 55.97 53.05 1r38 s LYS 274 Cb -0.45 -2.21 0.11 0.00 -1.05 0.00 0.00 37.83 34.23 1r38 s LYS 274 CO 0.53 0.57 0.81 0.45 1.55 0.00 0.00 175.35 179.26 1r38 s SER 275 N -0.96 -0.75 0.00 1.43 0.15 -1.26 -4.99 113.70 107.32 1r38 s SER 275 Ca 0.12 1.22 0.24 0.00 0.70 0.00 0.00 55.95 58.23 1r38 s SER 275 Cb -0.10 1.30 1.05 0.00 -1.71 0.00 0.00 66.02 66.56 1r38 s SER 275 CO 0.02 -0.20 1.76 0.59 1.20 0.00 0.00 173.24 176.62 1r38 n ASN 276 N 3.86 0.00 -4.66 5.45 5.03 -1.26 -4.78 115.26 118.90 1r38 n ASN 276 Ca -0.19 0.38 -0.35 0.00 0.87 0.00 0.00 54.58 55.30 1r38 n ASN 276 Cb 0.58 -0.45 -0.09 0.00 -1.02 0.00 0.00 39.78 38.79 1r38 n ASN 276 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1r38 s LEU 277 N -2.91 3.78 0.14 3.41 1.43 -1.26 -5.03 118.68 118.23 1r38 s LEU 277 Ca 0.14 0.12 -0.26 0.00 -1.03 0.00 0.00 54.13 53.09 1r38 s LEU 277 Cb 0.16 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1r38 s LEU 277 CO 0.42 0.24 1.61 -0.65 0.23 0.00 0.00 176.35 178.20 1r38 h PRO 278 N 6.20 -0.38 -0.92 1.29 0.11 -1.99 -0.10 132.00 136.21 1r38 h PRO 278 Ca -0.41 0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.78 1r38 h PRO 278 Cb 1.18 0.09 -0.06 0.00 0.11 0.00 0.00 31.00 32.32 1r38 h PRO 278 CO 0.65 -0.25 0.58 1.49 -0.21 0.00 0.00 178.00 180.26 1r38 h GLU 279 N -0.40 1.05 -0.55 1.05 4.81 -1.99 -0.65 114.58 117.90 1r38 h GLU 279 Ca 0.09 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.15 1r38 h GLU 279 Cb 0.54 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1r38 h GLU 279 CO -0.35 0.70 -0.09 0.00 -0.73 0.00 0.00 179.01 178.54 1r38 h ARG 280 N 1.08 1.03 -0.46 1.92 3.08 -1.89 -0.85 114.38 118.29 1r38 h ARG 280 Ca 0.39 -0.37 0.09 0.00 0.07 0.00 0.00 59.98 60.17 1r38 h ARG 280 Cb 0.12 -0.07 -0.09 0.00 0.08 0.00 0.00 29.97 30.01 1r38 h ARG 280 CO -0.16 1.06 -0.18 1.25 -1.07 0.00 0.00 179.97 180.87 1r38 h LEU 281 N 0.92 -0.63 -0.19 3.04 5.85 0.43 0.64 115.31 125.37 1r38 h LEU 281 Ca 0.15 0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 1r38 h LEU 281 Cb 0.65 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1r38 h LEU 281 CO 0.05 -0.21 -0.08 0.58 -0.34 0.00 0.00 178.44 178.43 1r38 h VAL 282 N -0.08 1.30 -0.60 1.05 2.07 -0.99 -3.15 116.25 115.85 1r38 h VAL 282 Ca 0.22 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1r38 h VAL 282 Cb 0.42 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 1r38 h VAL 282 CO -0.51 0.34 0.25 1.56 0.02 0.00 0.00 177.57 179.22 1r38 h GLN 283 N 0.09 0.87 0.00 1.57 4.20 -0.49 -2.28 115.11 119.07 1r38 h GLN 283 Ca 0.04 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1r38 h GLN 283 Cb 0.55 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.18 1r38 h GLN 283 CO 0.03 0.71 0.00 0.09 -0.67 0.00 0.00 178.83 178.98 1r38 n ASN 284 N -4.33 0.08 0.00 1.46 3.02 0.22 -1.88 115.26 113.83 1r38 n ASN 284 Ca 0.05 0.53 0.00 0.00 -0.03 0.00 0.00 54.58 55.13 1r38 n ASN 284 Cb 0.16 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1r38 n ASN 284 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1r38 n ARG 285 N -1.60 1.24 -0.04 3.52 1.85 -0.89 -4.69 116.66 116.05 1r38 n ARG 285 Ca 0.02 -1.02 0.05 0.00 -1.00 0.00 0.00 57.85 55.90 1r38 n ARG 285 Cb 0.09 -0.95 0.07 0.00 -1.05 0.00 0.00 32.46 30.62 1r38 n ARG 285 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1r38 n SER 286 N -0.27 2.16 0.13 2.89 7.64 -0.79 -4.77 113.62 120.61 1r38 n SER 286 Ca 0.00 -2.56 0.13 0.00 1.01 0.00 0.00 58.87 57.45 1r38 n SER 286 Cb 0.17 -0.22 0.45 0.00 -1.01 0.00 0.00 64.21 63.60 1r38 n SER 286 CO 0.00 0.00 0.00 2.19 -3.01 0.00 0.00 175.04 174.22 1r38 h PHE 287 N 0.00 0.00 -0.01 1.43 -5.15 -1.83 -3.39 116.94 108.00 1r38 h PHE 287 Ca 0.00 0.00 -0.68 0.00 -0.20 0.00 0.00 57.97 57.09 1r38 h PHE 287 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.94 1r38 h PHE 287 CO 0.00 0.00 2.74 0.09 -2.00 0.00 0.00 178.31 179.14 1r38 n ASN 288 N -2.32 3.24 -0.04 -0.68 3.02 -1.26 -4.22 115.26 112.99 1r38 n ASN 288 Ca 0.04 -2.76 0.00 0.00 -0.03 0.00 0.00 54.58 51.82 1r38 n ASN 288 Cb 0.33 -1.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.10 1r38 n ASN 288 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1r38 n THR 289 N 5.54 0.30 -3.58 3.41 -2.24 -1.26 -5.08 114.28 111.36 1r38 n THR 289 Ca 0.51 -0.31 -0.09 0.00 -2.27 0.00 0.00 64.05 61.88 1r38 n THR 289 Cb 0.40 0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 69.41 1r38 n THR 289 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1r38 s PHE 290 N -0.33 -0.38 -0.02 4.78 -0.71 -1.26 -5.17 117.98 114.90 1r38 s PHE 290 Ca 0.01 0.10 0.07 0.00 -1.04 0.00 0.00 56.93 56.07 1r38 s PHE 290 Cb 0.01 0.60 -0.02 0.00 -1.21 0.00 0.00 43.02 42.40 1r38 s PHE 290 CO 0.00 -0.90 -0.24 -0.51 -1.34 0.00 0.00 175.22 172.23 1r38 s ASP 291 N -2.77 2.79 0.33 1.98 1.01 -1.26 -5.08 116.67 113.67 1r38 s ASP 291 Ca 0.05 -0.43 -0.22 0.00 0.71 0.00 0.00 52.55 52.66 1r38 s ASP 291 Cb -0.02 -0.31 -0.10 0.00 1.01 0.00 0.00 42.92 43.50 1r38 s ASP 291 CO -0.06 0.29 0.87 -0.76 0.21 0.00 0.00 175.17 175.73 1r38 s LEU 292 N -0.56 4.19 0.59 1.23 1.43 -1.26 -5.06 118.68 119.25 1r38 s LEU 292 Ca 0.09 1.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.83 1r38 s LEU 292 Cb -0.09 -4.08 0.05 0.00 0.03 0.00 0.00 46.19 42.10 1r38 s LEU 292 CO -0.01 -0.15 0.83 0.42 0.23 0.00 0.00 176.35 177.68 1r38 s THR 293 N -1.80 2.54 0.35 5.49 -4.23 -1.26 -4.93 115.64 111.80 1r38 s THR 293 Ca 0.52 -0.61 0.03 0.00 -1.18 0.00 0.00 61.69 60.45 1r38 s THR 293 Cb -0.14 -2.93 0.28 0.00 1.34 0.00 0.00 72.50 71.04 1r38 s THR 293 CO 0.19 0.00 1.98 0.50 -0.54 0.00 0.00 174.62 176.76 1r38 h LYS 294 N -0.09 0.82 -0.45 3.99 3.64 -1.99 -0.88 116.57 121.60 1r38 h LYS 294 Ca -0.41 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 58.79 1r38 h LYS 294 Cb 1.29 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1r38 h LYS 294 CO 0.51 0.54 -0.22 0.93 -2.27 0.00 0.00 179.45 178.95 1r38 h GLU 295 N 0.85 0.92 0.06 1.90 3.07 -1.99 -1.53 114.58 117.86 1r38 h GLU 295 Ca 0.28 -0.39 0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1r38 h GLU 295 Cb 0.05 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 1r38 h GLU 295 CO -0.08 1.04 -0.11 -0.44 -1.40 0.00 0.00 179.01 178.03 1r38 h ASP 296 N 0.80 -0.30 -0.92 1.42 3.32 -1.56 0.08 116.42 119.25 1r38 h ASP 296 Ca 0.11 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.21 1r38 h ASP 296 Cb 0.78 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.40 1r38 h ASP 296 CO 0.06 -0.16 0.60 -0.26 -1.72 0.00 0.00 179.24 177.76 1r38 h PHE 297 N -0.22 1.14 -0.76 4.55 0.04 -1.23 0.17 116.94 120.63 1r38 h PHE 297 Ca 0.02 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.77 1r38 h PHE 297 Cb 0.24 -0.39 -0.03 0.00 2.20 0.00 0.00 35.95 37.97 1r38 h PHE 297 CO -0.14 0.70 0.27 0.93 -0.60 0.00 0.00 178.31 179.47 1r38 h GLU 298 N 1.22 1.17 -0.32 1.51 5.08 -0.88 0.44 114.58 122.80 1r38 h GLU 298 Ca 0.34 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 1r38 h GLU 298 Cb -0.10 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 1r38 h GLU 298 CO -0.09 0.97 -0.14 0.93 -1.00 0.00 0.00 179.01 179.69 1r38 h GLU 299 N 1.13 0.66 -0.53 2.33 4.39 -0.11 -3.02 114.58 119.42 1r38 h GLU 299 Ca 0.25 -0.28 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 1r38 h GLU 299 Cb 0.27 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 1r38 h GLU 299 CO -0.01 0.87 0.08 0.82 -1.16 0.00 0.00 179.01 179.60 1r38 h ILE 300 N 0.42 1.25 -0.96 3.13 2.04 -0.40 -2.54 117.51 120.46 1r38 h ILE 300 Ca 0.07 -0.96 0.28 0.00 1.00 0.00 0.00 64.86 65.25 1r38 h ILE 300 Cb 0.66 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 1r38 h ILE 300 CO 0.04 0.35 0.70 0.00 0.00 0.00 0.00 178.15 179.24 1r38 h ALA 301 N 0.98 2.91 0.00 1.87 0.00 -0.01 0.98 119.26 125.99 1r38 h ALA 301 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1r38 h ALA 301 Cb 0.41 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1r38 h ALA 301 CO 0.01 -1.19 -0.05 0.87 0.00 0.00 0.00 179.25 178.89 1r38 h LYS 302 N 0.00 0.00 0.00 0.00 1.57 -1.34 -2.58 116.57 114.21 1r38 h LYS 302 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1r38 h LYS 302 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.15 1r38 h LYS 302 CO -0.00 0.05 0.00 1.28 -0.57 0.00 0.00 179.45 180.20 1r38 n LEU 303 N -3.38 0.62 -4.57 2.94 4.77 0.34 -4.80 117.00 112.92 1r38 n LEU 303 Ca -0.02 0.60 -0.43 0.00 -0.03 0.00 0.00 56.01 56.13 1r38 n LEU 303 Cb 0.19 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 1r38 n LEU 303 CO 0.26 -0.31 1.88 -0.67 -1.33 0.00 0.00 177.39 177.23 1r38 n ASP 304 N -2.12 2.97 -0.04 -1.43 2.03 -0.88 -4.38 116.55 112.68 1r38 n ASP 304 Ca 0.04 0.10 0.01 0.00 0.52 0.00 0.00 54.79 55.47 1r38 n ASP 304 Cb 0.33 -1.53 0.02 0.00 -0.72 0.00 0.00 41.12 39.22 1r38 n ASP 304 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1r38 n ILE 305 N 7.75 0.84 -3.67 5.18 -5.35 -1.12 -5.01 119.36 117.98 1r38 n ILE 305 Ca 0.33 -0.90 -0.25 0.00 -0.27 0.00 0.00 62.75 61.66 1r38 n ILE 305 Cb 0.44 0.51 0.07 0.00 -1.74 0.00 0.00 39.64 38.91 1r38 n ILE 305 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1r38 n GLY 306 N -0.49 -0.52 3.54 3.28 0.00 -0.20 -4.95 105.19 105.85 1r38 n GLY 306 Ca 0.02 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1r38 n GLY 306 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1r38 s LEU 307 N -7.26 4.41 -0.20 0.99 2.96 0.46 -4.95 118.68 115.09 1r38 s LEU 307 Ca 0.57 -0.14 -0.05 0.00 -0.22 0.00 0.00 54.13 54.30 1r38 s LEU 307 Cb -0.26 -2.67 -0.02 0.00 0.50 0.00 0.00 46.19 43.74 1r38 s LEU 307 CO 0.76 -0.61 -0.01 -0.60 -1.32 0.00 0.00 176.35 174.57 1r38 s ARG 308 N 2.59 3.57 0.07 1.98 3.52 -1.26 -4.23 118.95 125.19 1r38 s ARG 308 Ca 0.21 -0.54 0.18 0.00 -0.13 0.00 0.00 55.73 55.45 1r38 s ARG 308 Cb -0.15 -3.07 -0.13 0.00 -1.56 0.00 0.00 34.95 30.04 1r38 s ARG 308 CO 0.16 -0.03 0.80 1.19 -0.81 0.00 0.00 175.30 176.61 1r38 n PHE 309 N 4.35 0.88 -3.67 5.12 3.72 -1.26 -4.63 117.46 121.97 1r38 n PHE 309 Ca -0.17 0.29 -0.38 0.00 -0.05 0.00 0.00 57.45 57.14 1r38 n PHE 309 Cb 0.52 -1.03 -0.09 0.00 -0.94 0.00 0.00 39.48 37.94 1r38 n PHE 309 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1r38 s ASN 310 N -5.62 5.44 -0.20 4.37 2.47 -1.26 -5.03 114.94 115.12 1r38 s ASN 310 Ca -0.03 -2.91 -0.00 0.00 0.42 0.00 0.00 52.86 50.33 1r38 s ASN 310 Cb 0.09 -1.90 0.05 0.00 -1.45 0.00 0.00 41.25 38.04 1r38 s ASN 310 CO 0.81 -0.37 -0.05 -0.62 -3.72 0.00 0.00 177.10 173.15 1r38 s ASP 311 N 0.76 3.27 0.67 -4.21 -1.08 -1.26 -4.98 116.67 109.83 1r38 s ASP 311 Ca 0.18 -0.88 0.34 0.00 -0.52 0.00 0.00 52.55 51.66 1r38 s ASP 311 Cb -0.18 -1.03 1.84 0.00 -1.46 0.00 0.00 42.92 42.09 1r38 s ASP 311 CO -0.04 -0.20 2.04 -0.65 0.52 0.00 0.00 175.17 176.83 1r38 h PRO 312 N 8.05 0.00 -0.35 4.34 0.11 -1.96 0.13 132.00 142.32 1r38 h PRO 312 Ca -0.22 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.89 1r38 h PRO 312 Cb 1.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1r38 h PRO 312 CO 0.41 0.00 0.23 2.35 -0.21 0.00 0.00 178.00 180.78 1r38 h TRP 313 N 0.00 0.43 -0.00 0.65 2.91 -1.89 -0.34 115.95 117.71 1r38 h TRP 313 Ca 0.00 0.01 -0.09 0.00 1.13 0.00 0.00 58.89 59.94 1r38 h TRP 313 Cb 0.50 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.99 1r38 h TRP 313 CO 0.00 0.27 -0.42 -0.44 -1.03 0.00 0.00 178.44 176.82 1r38 h ASP 314 N 0.47 0.01 0.28 2.65 3.32 -1.06 -0.22 116.42 121.86 1r38 h ASP 314 Ca 0.13 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1r38 h ASP 314 Cb -0.04 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1r38 h ASP 314 CO -0.03 0.43 -0.14 -0.50 -1.72 0.00 0.00 179.24 177.28 1r38 h TRP 315 N 0.01 -0.35 -0.08 4.55 6.55 -1.17 -3.42 115.95 122.04 1r38 h TRP 315 Ca -0.00 -0.01 -0.18 0.00 0.95 0.00 0.00 58.89 59.65 1r38 h TRP 315 Cb 0.75 0.12 -0.20 0.00 -0.86 0.00 0.00 29.16 28.97 1r38 h TRP 315 CO 0.00 0.00 -0.44 -3.47 -1.05 0.00 0.00 178.44 173.49 1r38 n ASP 316 N -5.06 -0.84 -3.81 -3.49 2.03 -1.10 -4.99 116.55 99.29 1r38 n ASP 316 Ca -0.08 -2.16 -0.23 0.00 0.52 0.00 0.00 54.79 52.83 1r38 n ASP 316 Cb 0.26 0.43 0.01 0.00 -0.72 0.00 0.00 41.12 41.10 1r38 n ASP 316 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1r38 n ASN 317 N -1.21 -1.04 -4.64 1.67 5.03 -0.09 -4.92 115.26 110.06 1r38 n ASN 317 Ca -0.14 -0.89 -0.42 0.00 0.87 0.00 0.00 54.58 54.01 1r38 n ASN 317 Cb 0.86 -3.67 -0.04 0.00 -1.02 0.00 0.00 39.78 35.91 1r38 n ASN 317 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1r38 s ILE 318 N -3.75 4.85 0.00 2.41 1.01 -1.16 -4.91 121.20 119.65 1r38 s ILE 318 Ca 0.04 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.23 1r38 s ILE 318 Cb -0.02 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1r38 s ILE 318 CO 0.84 -0.05 0.61 -0.81 0.00 0.00 0.00 174.94 175.53 1r38 n PRO 319 N 5.89 0.58 -0.23 2.79 -0.04 -1.26 -3.04 135.00 139.69 1r38 n PRO 319 Ca 0.05 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.47 1r38 n PRO 319 Cb 0.48 -1.21 0.07 0.00 -0.04 0.00 0.00 33.50 32.80 1r38 n PRO 319 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1r38 h ILE 320 N 0.48 1.08 -0.73 0.52 1.08 -1.95 -3.10 117.51 114.90 1r38 h ILE 320 Ca 0.00 -0.28 -0.43 0.00 -0.39 0.00 0.00 64.86 63.76 1r38 h ILE 320 Cb 0.58 0.21 -0.25 0.00 -3.07 0.00 0.00 36.82 34.29 1r38 h ILE 320 CO 0.00 0.15 0.23 0.49 -0.69 0.00 0.00 178.15 178.33 1r38 n PHE 321 N -4.70 2.33 -0.39 1.37 3.72 -1.26 -4.73 117.46 113.80 1r38 n PHE 321 Ca 0.07 -2.08 0.00 0.00 -0.05 0.00 0.00 57.45 55.39 1r38 n PHE 321 Cb 0.09 -0.81 0.00 0.00 -0.94 0.00 0.00 39.48 37.81 1r38 n PHE 321 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04