#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 4.70 0.58 2.46 1.01 -1.26 -5.02 121.20 123.66 1r38 s ILE 5 Ca 0.00 0.59 -0.20 0.00 0.00 0.00 0.00 60.65 61.04 1r38 s ILE 5 Cb 0.00 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1r38 s ILE 5 CO 0.00 -0.59 1.28 -2.65 0.00 0.00 0.00 174.94 172.98 1r38 n PRO 6 N 6.56 1.41 -3.96 2.79 -0.02 -1.26 -4.76 135.00 135.76 1r38 n PRO 6 Ca 0.02 0.53 -0.29 0.00 -2.02 0.00 0.00 63.50 61.74 1r38 n PRO 6 Cb 0.48 -2.49 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 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 -1.09 6.17 -0.12 2.55 1.01 -1.26 -1.07 116.67 122.87 1r38 s ASP 7 Ca 0.75 0.17 0.00 0.00 0.71 0.00 0.00 52.55 54.19 1r38 s ASP 7 Cb -0.41 -1.84 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 1r38 s ASP 7 CO 0.46 0.13 -0.13 -0.63 0.21 0.00 0.00 175.17 175.21 1r38 s ILE 8 N -1.58 3.03 -0.39 0.77 1.01 0.47 -4.84 121.20 119.67 1r38 s ILE 8 Ca 0.34 -0.68 -0.24 0.00 0.00 0.00 0.00 60.65 60.07 1r38 s ILE 8 Cb -0.12 -2.26 0.02 0.00 0.01 0.00 0.00 42.46 40.11 1r38 s ILE 8 CO 0.27 0.53 0.84 -0.75 0.00 0.00 0.00 174.94 175.84 1r38 s LYS 9 N 0.20 3.71 0.76 2.79 2.20 -1.26 0.11 119.74 128.24 1r38 s LYS 9 Ca -0.08 0.32 -0.11 0.00 -0.36 0.00 0.00 55.97 55.73 1r38 s LYS 9 Cb -0.15 -3.84 0.05 0.00 -1.51 0.00 0.00 37.83 32.38 1r38 s LYS 9 CO 0.05 -0.96 1.08 -0.51 -0.36 0.00 0.00 175.35 174.65 1r38 s LEU 10 N 3.32 2.79 0.62 5.43 1.43 0.50 -4.92 118.68 127.86 1r38 s LEU 10 Ca 0.34 1.42 0.35 0.00 -1.03 0.00 0.00 54.13 55.21 1r38 s LEU 10 Cb -0.12 -4.13 2.03 0.00 0.03 0.00 0.00 46.19 44.00 1r38 s LEU 10 CO 0.19 -1.78 2.29 0.77 0.23 0.00 0.00 176.35 178.06 1r38 h SER 11 N -0.95 0.00 0.60 2.29 4.64 -1.80 0.85 113.55 119.17 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 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1r38 h SER 11 CO 0.58 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.00 1r38 n SER 12 N -3.58 0.00 0.00 4.97 3.41 -1.26 -4.89 113.62 112.27 1r38 n SER 12 Ca -0.03 0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1r38 n SER 12 Cb 0.09 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 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 0.84 2.40 3.86 5.00 0.00 0.29 -5.07 105.19 112.51 1r38 n GLY 13 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.59 3.41 -0.01 1.61 3.76 -1.26 -4.75 115.29 115.45 1r38 s HIS 14 Ca 0.00 1.19 -0.19 0.00 -0.15 0.00 0.00 55.06 55.91 1r38 s HIS 14 Cb 0.00 -2.53 -0.05 0.00 1.11 0.00 0.00 32.58 31.10 1r38 s HIS 14 CO 0.00 -0.02 0.54 -0.51 -0.85 0.00 0.00 174.74 173.90 1r38 s LEU 15 N -3.38 4.42 -0.11 0.89 1.43 -1.26 -0.37 118.68 120.30 1r38 s LEU 15 Ca 0.54 1.08 0.02 0.00 -1.03 0.00 0.00 54.13 54.74 1r38 s LEU 15 Cb -0.10 -2.82 0.01 0.00 0.03 0.00 0.00 46.19 43.31 1r38 s LEU 15 CO 0.23 0.15 -0.19 -0.32 0.23 0.00 0.00 176.35 176.45 1r38 s MET 16 N -0.33 2.59 0.27 1.70 -2.45 0.12 -4.91 119.30 116.29 1r38 s MET 16 Ca 0.29 -0.70 -0.31 0.00 -1.25 0.00 0.00 55.69 53.72 1r38 s MET 16 Cb -0.18 -2.10 -0.12 0.00 1.25 0.00 0.00 34.83 33.68 1r38 s MET 16 CO 0.16 0.01 1.54 -2.30 1.05 0.00 0.00 175.02 175.48 1r38 n PRO 17 N 3.99 2.47 0.07 4.11 -0.02 -1.26 -0.40 135.00 143.96 1r38 n PRO 17 Ca -0.20 0.88 0.10 0.00 -2.02 0.00 0.00 63.50 62.27 1r38 n PRO 17 Cb 0.52 -2.63 0.42 0.00 -0.02 0.00 0.00 33.50 31.79 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 2.34 0.37 -3.88 2.55 3.41 -0.23 -4.53 113.62 113.64 1r38 n SER 18 Ca 0.10 0.58 -0.22 0.00 -0.26 0.00 0.00 58.87 59.08 1r38 n SER 18 Cb 0.35 -0.66 -0.17 0.00 -0.26 0.00 0.00 64.21 63.47 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 -3.15 0.60 0.28 -1.33 1.01 -1.26 -0.81 121.20 116.54 1r38 s ILE 19 Ca 0.06 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.64 1r38 s ILE 19 Cb 0.10 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.91 1r38 s ILE 19 CO 0.37 0.26 0.17 0.61 0.00 0.00 0.00 174.94 176.35 1r38 n GLY 20 N 4.33 3.28 3.41 6.18 0.00 -0.01 -4.52 105.19 117.86 1r38 n GLY 20 Ca -0.20 -1.93 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 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 -2.91 3.07 0.08 1.61 5.36 -0.14 -3.45 117.98 121.60 1r38 s PHE 21 Ca 0.25 -0.58 -0.30 0.00 -0.96 0.00 0.00 56.93 55.34 1r38 s PHE 21 Cb 0.01 -2.21 -0.06 0.00 -0.34 0.00 0.00 43.02 40.42 1r38 s PHE 21 CO 0.17 -0.42 1.10 0.20 -1.46 0.00 0.00 175.22 174.82 1r38 s GLY 22 N 1.58 2.69 0.00 13.12 0.00 -0.69 -1.21 107.32 122.81 1r38 s GLY 22 Ca 0.06 0.75 0.15 0.00 0.00 0.00 0.00 44.72 45.67 1r38 s GLY 22 CO 0.02 1.81 1.25 0.00 0.00 0.00 0.00 173.10 176.18 1r38 s TRP 24 N -1.06 3.15 -0.64 0.00 -0.00 -1.26 -3.15 118.94 115.98 1r38 s TRP 24 Ca 0.28 1.09 0.00 0.00 -0.00 0.00 0.00 56.10 57.47 1r38 s TRP 24 Cb 0.15 -3.52 0.00 0.00 -0.00 0.00 0.00 33.47 30.10 1r38 s TRP 24 CO 0.21 -1.76 0.00 1.63 -0.00 0.00 0.00 176.95 177.03 1r38 n LYS 25 N 4.80 -0.59 -3.20 5.86 5.02 -1.26 -5.01 118.16 123.77 1r38 n LYS 25 Ca 0.11 0.37 -0.40 0.00 -2.02 0.00 0.00 58.31 56.38 1r38 n LYS 25 Cb 0.45 -4.29 -0.07 0.00 -0.02 0.00 0.00 35.03 31.11 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 -2.13 4.10 0.26 -0.35 1.43 -1.19 -5.01 118.68 115.79 1r38 s LEU 26 Ca 0.00 0.65 -0.31 0.00 -1.03 0.00 0.00 54.13 53.44 1r38 s LEU 26 Cb 0.00 -2.74 -0.12 0.00 0.03 0.00 0.00 46.19 43.35 1r38 s LEU 26 CO 0.00 -0.26 1.53 0.00 0.23 0.00 0.00 176.35 177.85 1r38 n ALA 27 N 5.23 1.96 0.26 4.21 0.00 -1.26 -4.70 120.51 126.20 1r38 n ALA 27 Ca -0.03 0.39 0.14 0.00 0.00 0.00 0.00 53.44 53.94 1r38 n ALA 27 Cb 0.50 -2.39 0.74 0.00 0.00 0.00 0.00 19.45 18.30 1r38 n ALA 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1r38 h ASN 28 N 4.75 0.00 -0.13 0.00 4.21 -1.95 0.41 115.58 122.87 1r38 h ASN 28 Ca -0.46 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.00 1r38 h ASN 28 Cb 1.24 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.44 1r38 h ASN 28 CO 0.79 0.00 -0.14 0.00 -1.29 0.00 0.00 177.43 176.80 1r38 h ALA 29 N 1.55 0.20 -0.10 -0.83 0.00 -2.03 -3.35 119.26 114.70 1r38 h ALA 29 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1r38 h ALA 29 Cb 0.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1r38 h ALA 29 CO 0.00 0.07 0.00 0.25 0.00 0.00 0.00 179.25 179.57 1r38 n THR 30 N -4.58 0.77 0.15 0.00 -2.24 -0.61 -4.79 114.28 102.98 1r38 n THR 30 Ca -0.06 -0.89 -0.14 0.00 -2.27 0.00 0.00 64.05 60.70 1r38 n THR 30 Cb 0.36 0.63 -0.07 0.00 -2.10 0.00 0.00 70.33 69.15 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 0.77 -0.36 -0.04 6.98 0.00 -0.37 -0.71 119.26 125.53 1r38 h ALA 31 Ca 0.00 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1r38 h ALA 31 Cb 0.49 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1r38 h ALA 31 CO 0.00 -0.72 -0.10 0.78 0.00 0.00 0.00 179.25 179.20 1r38 h GLY 32 N -0.39 -0.09 0.59 0.00 0.00 -1.83 0.49 103.07 101.84 1r38 h GLY 32 Ca -0.01 0.12 0.06 0.00 0.00 0.00 0.00 47.33 47.51 1r38 h GLY 32 CO -0.01 -0.11 0.25 -2.09 0.00 0.00 0.00 176.54 174.57 1r38 h GLU 33 N -0.16 0.45 -0.32 4.80 4.57 -1.86 -0.39 114.58 121.66 1r38 h GLU 33 Ca 0.05 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.12 1r38 h GLU 33 Cb 0.23 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1r38 h GLU 33 CO -0.13 0.30 -0.15 0.37 -1.18 0.00 0.00 179.01 178.22 1r38 h GLN 34 N 0.47 0.57 -0.35 1.92 5.75 -0.59 0.02 115.11 122.89 1r38 h GLN 34 Ca 0.26 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.53 1r38 h GLN 34 Cb 0.23 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1r38 h GLN 34 CO -0.22 0.71 0.05 0.28 -2.65 0.00 0.00 178.83 177.00 1r38 h VAL 35 N 0.52 1.24 -0.26 2.39 2.07 -0.30 -0.20 116.25 121.72 1r38 h VAL 35 Ca 0.09 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.79 1r38 h VAL 35 Cb 0.56 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 1r38 h VAL 35 CO 0.04 0.29 0.01 0.22 0.02 0.00 0.00 177.57 178.15 1r38 h TYR 36 N 0.42 0.01 -0.82 1.57 3.20 -0.68 -1.05 116.97 119.62 1r38 h TYR 36 Ca 0.11 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1r38 h TYR 36 Cb 0.37 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.64 1r38 h TYR 36 CO 0.03 -0.03 0.46 1.96 -1.64 0.00 0.00 178.16 178.94 1r38 h GLN 37 N 0.09 1.14 -0.55 1.82 1.08 -0.77 -1.42 115.11 116.50 1r38 h GLN 37 Ca 0.12 -0.12 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1r38 h GLN 37 Cb 0.15 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 1r38 h GLN 37 CO -0.20 0.82 0.13 0.00 -0.95 0.00 0.00 178.83 178.63 1r38 h ALA 38 N 1.36 1.19 -0.55 3.87 0.00 -0.47 0.11 119.26 124.77 1r38 h ALA 38 Ca 0.29 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1r38 h ALA 38 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1r38 h ALA 38 CO -0.05 0.55 0.05 0.82 0.00 0.00 0.00 179.25 180.62 1r38 h ILE 39 N 0.81 1.25 -0.06 0.00 2.04 -0.45 0.65 117.51 121.75 1r38 h ILE 39 Ca 0.18 -1.00 -0.09 0.00 1.00 0.00 0.00 64.86 64.94 1r38 h ILE 39 Cb 0.30 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1r38 h ILE 39 CO -0.00 0.36 -0.38 0.11 0.00 0.00 0.00 178.15 178.24 1r38 h LYS 40 N 0.85 0.12 -0.03 2.37 1.57 -0.28 -2.19 116.57 118.99 1r38 h LYS 40 Ca 0.17 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1r38 h LYS 40 Cb 0.44 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1r38 h LYS 40 CO 0.02 0.49 0.00 0.00 -0.57 0.00 0.00 179.45 179.38 1r38 n ALA 41 N -2.47 2.60 0.00 3.86 0.00 0.28 -4.88 120.51 119.89 1r38 n ALA 41 Ca -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1r38 n ALA 41 Cb 0.44 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 0.36 3.77 0.00 0.00 -0.82 -4.79 105.19 104.57 1r38 n GLY 42 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 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 3.24 0.00 1.61 1.51 0.14 -4.92 117.35 116.93 1r38 s TYR 43 Ca 0.00 1.61 0.00 0.00 -1.01 0.00 0.00 57.07 57.67 1r38 s TYR 43 Cb 0.00 -3.28 0.00 0.00 -0.11 0.00 0.00 41.96 38.57 1r38 s TYR 43 CO 0.00 -0.92 0.00 0.54 -1.11 0.00 0.00 175.55 174.06 1r38 n ARG 44 N 0.25 2.53 -4.02 -0.62 5.12 -1.26 -4.22 116.66 114.44 1r38 n ARG 44 Ca 0.03 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.60 1r38 n ARG 44 Cb 0.47 -0.79 -0.08 0.00 -1.16 0.00 0.00 32.46 30.91 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 -1.82 4.05 -0.14 0.55 0.20 -1.26 -0.44 118.68 119.82 1r38 s LEU 45 Ca 0.00 0.29 0.00 0.00 0.69 0.00 0.00 54.13 55.11 1r38 s LEU 45 Cb 0.00 -1.98 0.03 0.00 -0.43 0.00 0.00 46.19 43.80 1r38 s LEU 45 CO 0.00 0.34 -0.11 -0.36 -0.29 0.00 0.00 176.35 175.93 1r38 s PHE 46 N -0.62 1.93 -0.48 5.38 0.40 -0.22 -0.97 117.98 123.41 1r38 s PHE 46 Ca 0.12 -1.08 -0.19 0.00 -0.60 0.00 0.00 56.93 55.18 1r38 s PHE 46 Cb -0.12 -1.46 0.05 0.00 0.51 0.00 0.00 43.02 42.00 1r38 s PHE 46 CO 0.02 -0.62 0.58 0.34 0.70 0.00 0.00 175.22 176.24 1r38 s ASP 47 N 1.56 6.23 0.16 1.36 2.15 -0.35 -1.49 116.67 126.29 1r38 s ASP 47 Ca 0.04 -0.81 0.00 0.00 0.43 0.00 0.00 52.55 52.21 1r38 s ASP 47 Cb -0.13 -2.27 -0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1r38 s ASP 47 CO -0.10 -0.80 0.01 0.61 -0.17 0.00 0.00 175.17 174.73 1r38 n GLY 48 N 5.14 3.94 3.60 2.66 0.00 -0.33 -1.73 105.19 118.47 1r38 n GLY 48 Ca -0.06 -2.18 -0.09 0.00 0.00 0.00 0.00 46.02 43.68 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 -2.31 -1.96 0.27 4.61 0.00 -1.26 -3.65 121.76 117.46 1r38 s ALA 49 Ca 0.02 1.70 0.00 0.00 0.00 0.00 0.00 51.96 53.68 1r38 s ALA 49 Cb 0.00 -1.02 0.52 0.00 0.00 0.00 0.00 23.12 22.62 1r38 s ALA 49 CO 0.01 -0.27 1.82 0.93 0.00 0.00 0.00 175.76 178.26 1r38 h GLU 50 N 3.11 0.90 0.00 0.00 5.08 -1.92 -0.65 114.58 121.11 1r38 h GLU 50 Ca -0.22 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1r38 h GLU 50 Cb 1.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1r38 h GLU 50 CO 0.23 0.60 0.00 -0.40 -1.00 0.00 0.00 179.01 178.44 1r38 n ASP 51 N -4.66 0.55 0.05 1.42 5.75 -1.26 -2.47 116.55 115.92 1r38 n ASP 51 Ca 0.18 0.62 0.10 0.00 -0.01 0.00 0.00 54.79 55.67 1r38 n ASP 51 Cb 0.35 -0.74 0.41 0.00 -1.03 0.00 0.00 41.12 40.11 1r38 n ASP 51 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1r38 n TYR 52 N -2.08 0.32 -1.80 2.11 4.01 -0.25 -4.87 117.16 114.60 1r38 n TYR 52 Ca 0.03 0.12 -0.20 0.00 -0.16 0.00 0.00 57.90 57.69 1r38 n TYR 52 Cb 0.26 -0.70 -0.07 0.00 -0.31 0.00 0.00 39.34 38.52 1r38 n TYR 52 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1r38 n GLY 53 N 0.25 1.30 1.02 2.72 0.00 -1.03 -4.77 105.19 104.67 1r38 n GLY 53 Ca 0.04 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.41 0.71 0.23 1.61 0.23 -1.26 -4.85 115.26 110.51 1r38 n ASN 54 Ca -0.21 -2.14 0.06 0.00 -0.53 0.00 0.00 54.58 51.75 1r38 n ASN 54 Cb 0.67 -0.28 0.52 0.00 -2.08 0.00 0.00 39.78 38.61 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 0.59 0.00 -0.24 -3.83 5.08 -1.89 -1.27 114.58 113.02 1r38 h GLU 55 Ca -0.12 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1r38 h GLU 55 Cb 1.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.87 1r38 h GLU 55 CO 0.05 0.17 0.12 0.87 -1.00 0.00 0.00 179.01 179.22 1r38 h LYS 56 N 0.00 0.35 -0.58 2.33 1.57 -1.89 0.24 116.57 118.59 1r38 h LYS 56 Ca -0.00 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 1r38 h LYS 56 Cb 0.30 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1r38 h LYS 56 CO 0.02 0.35 -0.04 0.93 -0.57 0.00 0.00 179.45 180.14 1r38 h GLU 57 N 0.27 1.05 -0.26 3.15 3.07 -1.69 0.16 114.58 120.33 1r38 h GLU 57 Ca 0.08 -0.36 0.03 0.00 -0.50 0.00 0.00 59.36 58.61 1r38 h GLU 57 Cb 0.11 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 1r38 h GLU 57 CO -0.01 1.06 0.09 0.28 -1.40 0.00 0.00 179.01 179.03 1r38 h VAL 58 N 0.94 0.94 -0.84 3.13 2.07 -1.11 -0.40 116.25 120.98 1r38 h VAL 58 Ca 0.16 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.68 1r38 h VAL 58 Cb 0.61 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 1r38 h VAL 58 CO 0.04 0.04 0.55 1.23 0.02 0.00 0.00 177.57 179.45 1r38 h GLY 59 N 0.21 1.19 0.95 2.17 0.00 -0.42 -1.57 103.07 105.60 1r38 h GLY 59 Ca 0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1r38 h GLY 59 CO -0.11 0.25 0.17 -0.55 0.00 0.00 0.00 176.54 176.30 1r38 h ASP 60 N 0.90 0.41 0.01 0.19 3.32 0.84 -0.36 116.42 121.74 1r38 h ASP 60 Ca 0.37 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1r38 h ASP 60 Cb 0.27 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1r38 h ASP 60 CO -0.14 0.39 -0.00 1.23 -1.72 0.00 0.00 179.24 179.00 1r38 h GLY 61 N 0.39 -0.01 0.93 2.75 0.00 -0.48 0.16 103.07 106.81 1r38 h GLY 61 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1r38 h GLY 61 CO -0.02 -0.00 -0.03 -2.08 0.00 0.00 0.00 176.54 174.41 1r38 h VAL 62 N -0.02 0.92 -0.89 4.60 2.07 -1.27 -1.79 116.25 119.87 1r38 h VAL 62 Ca -0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1r38 h VAL 62 Cb 0.02 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 1r38 h VAL 62 CO 0.00 0.00 0.57 0.50 0.02 0.00 0.00 177.57 178.67 1r38 h LYS 63 N -0.06 1.07 -0.70 1.57 3.64 -0.91 -0.38 116.57 120.80 1r38 h LYS 63 Ca 0.01 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1r38 h LYS 63 Cb 0.07 -0.24 -0.04 0.00 -0.41 0.00 0.00 32.23 31.61 1r38 h LYS 63 CO -0.03 0.71 0.45 -0.09 -2.27 0.00 0.00 179.45 178.22 1r38 h ARG 64 N 1.10 0.88 -0.28 1.90 2.43 -0.63 0.19 114.38 119.97 1r38 h ARG 64 Ca 0.36 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.40 1r38 h ARG 64 Cb 0.04 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1r38 h ARG 64 CO -0.13 0.58 -0.18 0.00 -1.51 0.00 0.00 179.97 178.73 1r38 h ALA 65 N 1.27 1.17 -0.11 2.80 0.00 -0.47 -1.65 119.26 122.27 1r38 h ALA 65 Ca 0.27 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1r38 h ALA 65 Cb -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1r38 h ALA 65 CO -0.08 0.53 -0.38 0.82 0.00 0.00 0.00 179.25 180.14 1r38 h ILE 66 N 0.46 1.38 -0.19 0.00 2.04 -0.34 -1.48 117.51 119.38 1r38 h ILE 66 Ca 0.08 -1.71 -0.03 0.00 1.00 0.00 0.00 64.86 64.20 1r38 h ILE 66 Cb 0.57 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 1r38 h ILE 66 CO 0.04 0.51 -0.02 0.44 0.00 0.00 0.00 178.15 179.12 1r38 h ASP 67 N 0.03 0.25 0.82 1.72 3.32 -0.49 -1.74 116.42 120.33 1r38 h ASP 67 Ca -0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1r38 h ASP 67 Cb 1.01 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1r38 h ASP 67 CO 0.08 0.31 0.00 -0.62 -1.72 0.00 0.00 179.24 177.29 1r38 n GLU 68 N -4.36 0.10 -0.89 3.56 1.02 -0.64 -4.90 120.64 114.53 1r38 n GLU 68 Ca -0.00 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1r38 n GLU 68 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 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 1.21 0.49 0.16 0.62 0.00 -0.65 -4.95 105.19 102.07 1r38 n GLY 69 Ca 0.08 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 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 0.51 -8.12 0.99 3.38 -1.49 -3.47 115.31 107.11 1r38 h LEU 70 Ca 0.00 -0.40 -0.08 0.00 0.09 0.00 0.00 57.88 57.49 1r38 h LEU 70 Cb 0.00 -0.16 -0.11 0.00 0.09 0.00 0.00 40.66 40.48 1r38 h LEU 70 CO 0.00 1.19 -0.22 0.68 0.09 0.00 0.00 178.44 180.18 1r38 s VAL 71 N -3.33 0.03 0.21 1.22 -7.23 -1.20 -5.04 120.40 105.06 1r38 s VAL 71 Ca -0.06 -1.35 0.09 0.00 -1.81 0.00 0.00 61.98 58.85 1r38 s VAL 71 Cb 0.09 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 1r38 s VAL 71 CO 0.86 -0.14 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.89 1r38 s LYS 72 N -3.99 2.10 0.26 4.82 1.02 -1.26 -4.18 119.74 118.51 1r38 s LYS 72 Ca 0.20 -1.34 -0.04 0.00 0.02 0.00 0.00 55.97 54.80 1r38 s LYS 72 Cb 0.01 -2.13 0.52 0.00 -0.52 0.00 0.00 37.83 35.71 1r38 s LYS 72 CO 0.04 0.41 1.63 -0.09 -0.92 0.00 0.00 175.35 176.42 1r38 h ARG 73 N 2.59 0.12 0.00 1.68 9.65 -1.97 0.11 114.38 126.56 1r38 h ARG 73 Ca -0.46 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 1r38 h ARG 73 Cb 1.22 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.77 1r38 h ARG 73 CO 0.56 0.08 0.00 -0.85 2.80 0.00 0.00 179.97 182.56 1r38 n GLU 74 N -5.33 0.14 0.00 0.20 0.00 -1.26 -1.52 120.64 112.88 1r38 n GLU 74 Ca 0.16 0.55 0.12 0.00 0.00 0.00 0.00 57.16 57.99 1r38 n GLU 74 Cb 0.54 -1.88 0.22 0.00 0.00 0.00 0.00 31.44 30.31 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 -2.17 0.71 -4.14 3.44 1.02 0.37 -4.86 120.64 115.03 1r38 n GLU 75 Ca -0.00 -0.49 -0.35 0.00 -0.02 0.00 0.00 57.16 56.30 1r38 n GLU 75 Cb 0.09 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 29.94 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 -2.62 4.79 -0.29 -3.67 -1.09 -0.57 -4.85 121.20 112.88 1r38 s ILE 76 Ca 0.19 -0.06 -0.05 0.00 -2.23 0.00 0.00 60.65 58.50 1r38 s ILE 76 Cb 0.18 -3.07 0.02 0.00 -1.58 0.00 0.00 42.46 38.01 1r38 s ILE 76 CO 0.59 0.58 0.05 0.12 -1.23 0.00 0.00 174.94 175.05 1r38 s PHE 77 N -0.63 3.16 -0.27 3.97 2.19 0.41 -4.94 117.98 121.87 1r38 s PHE 77 Ca 0.11 -1.27 -0.08 0.00 0.33 0.00 0.00 56.93 56.02 1r38 s PHE 77 Cb -0.12 -2.20 -0.02 0.00 -1.31 0.00 0.00 43.02 39.37 1r38 s PHE 77 CO 0.02 -0.66 0.10 -0.51 1.83 0.00 0.00 175.22 176.00 1r38 s LEU 78 N 1.42 3.68 -0.13 6.12 1.43 -1.26 -1.05 118.68 128.89 1r38 s LEU 78 Ca 0.01 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.75 1r38 s LEU 78 Cb -0.18 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 1r38 s LEU 78 CO 0.01 -0.09 0.05 -0.89 0.23 0.00 0.00 176.35 175.66 1r38 s THR 79 N 1.62 4.68 0.28 5.49 2.01 -0.55 -1.22 115.64 127.94 1r38 s THR 79 Ca 0.06 -0.09 0.02 0.00 0.31 0.00 0.00 61.69 61.98 1r38 s THR 79 Cb -0.16 -3.04 -0.05 0.00 0.01 0.00 0.00 72.50 69.27 1r38 s THR 79 CO 0.05 0.55 0.12 -0.55 -0.69 0.00 0.00 174.62 174.10 1r38 s SER 80 N -0.36 1.31 -0.01 3.53 0.15 -0.12 -1.19 113.70 117.01 1r38 s SER 80 Ca 0.08 -1.45 0.01 0.00 0.70 0.00 0.00 55.95 55.29 1r38 s SER 80 Cb -0.12 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.45 1r38 s SER 80 CO 0.02 -0.79 -0.01 -0.54 1.20 0.00 0.00 173.24 173.11 1r38 s LYS 81 N -3.96 0.16 -0.16 5.44 1.02 -1.24 -1.41 119.74 119.59 1r38 s LYS 81 Ca 0.37 -0.03 -0.29 0.00 0.02 0.00 0.00 55.97 56.04 1r38 s LYS 81 Cb 0.07 -0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 37.17 1r38 s LYS 81 CO 0.15 0.00 1.25 -1.17 -0.92 0.00 0.00 175.35 174.66 1r38 s LEU 82 N 0.18 4.18 0.85 3.17 2.96 0.84 -2.95 118.68 127.91 1r38 s LEU 82 Ca -0.01 1.68 -0.11 0.00 -0.22 0.00 0.00 54.13 55.46 1r38 s LEU 82 Cb -0.03 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.22 1r38 s LEU 82 CO -0.00 -0.74 1.09 0.86 -1.32 0.00 0.00 176.35 176.24 1r38 s TRP 83 N 3.38 2.52 0.59 5.38 -0.00 -1.26 -2.10 118.94 127.46 1r38 s TRP 83 Ca 0.54 1.23 0.39 0.00 -0.00 0.00 0.00 56.10 58.26 1r38 s TRP 83 Cb -0.22 -3.14 2.12 0.00 -0.00 0.00 0.00 33.47 32.24 1r38 s TRP 83 CO 0.15 -2.13 2.30 -0.91 -0.00 0.00 0.00 176.95 176.35 1r38 h ASN 84 N -1.35 0.00 0.94 5.86 2.35 -1.90 -2.27 115.58 119.20 1r38 h ASN 84 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1r38 h ASN 84 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 1r38 h ASN 84 CO 0.56 0.01 -0.11 0.59 -1.65 0.00 0.00 177.43 176.83 1r38 n ASN 85 N -3.34 0.19 -1.59 5.81 4.13 -1.26 0.19 115.26 119.37 1r38 n ASN 85 Ca -0.03 0.35 -0.13 0.00 1.68 0.00 0.00 54.58 56.45 1r38 n ASN 85 Cb 0.10 -0.36 0.18 0.00 -1.54 0.00 0.00 39.78 38.16 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 -1.58 1.88 0.16 3.10 4.01 -0.85 -3.87 117.16 120.00 1r38 n TYR 86 Ca 0.06 -1.81 0.05 0.00 -0.16 0.00 0.00 57.90 56.04 1r38 n TYR 86 Cb 0.35 -0.68 0.11 0.00 -0.31 0.00 0.00 39.34 38.81 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 1.13 0.00 -2.60 -0.72 3.86 -1.75 -3.30 115.15 111.77 1r38 h HIS 87 Ca 0.38 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 59.06 1r38 h HIS 87 Cb 1.94 0.00 0.05 0.00 1.06 0.00 0.00 27.41 30.46 1r38 h HIS 87 CO 1.22 0.40 1.07 0.34 0.86 0.00 0.00 177.93 181.82 1r38 s ASP 88 N -6.39 6.42 0.32 2.45 -1.08 -1.26 -4.20 116.67 112.92 1r38 s ASP 88 Ca 0.04 2.79 0.09 0.00 -0.52 0.00 0.00 52.55 54.94 1r38 s ASP 88 Cb 0.08 -2.58 0.91 0.00 -1.46 0.00 0.00 42.92 39.87 1r38 s ASP 88 CO 0.72 -0.98 1.67 -0.65 0.52 0.00 0.00 175.17 176.44 1r38 h PRO 89 N 7.88 0.30 0.00 4.34 0.11 -1.87 0.51 132.00 143.27 1r38 h PRO 89 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1r38 h PRO 89 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1r38 h PRO 89 CO 0.95 0.20 0.00 1.57 -0.21 0.00 0.00 178.00 180.51 1r38 h LYS 90 N 0.31 0.00 -0.00 1.05 2.10 -1.95 -2.54 116.57 115.54 1r38 h LYS 90 Ca 0.65 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.30 1r38 h LYS 90 Cb 1.39 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.72 1r38 h LYS 90 CO -0.61 0.00 -0.69 0.09 -2.00 0.00 0.00 179.45 176.24 1r38 n ASN 91 N -2.59 1.00 0.18 7.07 3.02 0.17 -4.61 115.26 119.51 1r38 n ASN 91 Ca -0.00 -1.00 -0.15 0.00 -0.03 0.00 0.00 54.58 53.40 1r38 n ASN 91 Cb 0.16 0.88 -0.08 0.00 -0.61 0.00 0.00 39.78 40.13 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 0.44 0.72 -0.07 2.41 2.07 -1.00 -2.30 116.25 118.53 1r38 h VAL 92 Ca 0.00 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1r38 h VAL 92 Cb 0.44 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1r38 h VAL 92 CO 0.00 0.02 -0.08 -0.08 0.02 0.00 0.00 177.57 177.45 1r38 h GLU 93 N -0.45 0.10 0.01 1.57 4.81 -1.82 -1.53 114.58 117.27 1r38 h GLU 93 Ca -0.04 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1r38 h GLU 93 Cb 0.34 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1r38 h GLU 93 CO 0.07 0.19 -0.00 1.15 -0.73 0.00 0.00 179.01 179.68 1r38 h THR 94 N 0.10 1.06 -0.23 0.32 2.02 -1.75 0.78 112.91 115.21 1r38 h THR 94 Ca 0.02 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 1r38 h THR 94 Cb 0.21 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1r38 h THR 94 CO 0.01 0.05 0.13 0.00 0.37 0.00 0.00 175.52 176.09 1r38 h ALA 95 N 0.90 0.30 -0.75 6.16 0.00 -1.01 -2.29 119.26 122.56 1r38 h ALA 95 Ca -0.00 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1r38 h ALA 95 Cb 0.09 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1r38 h ALA 95 CO 0.00 -0.19 0.44 1.25 0.00 0.00 0.00 179.25 180.75 1r38 h LEU 96 N 0.28 0.67 -1.14 0.00 5.85 -1.05 -1.39 115.31 118.53 1r38 h LEU 96 Ca 0.08 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1r38 h LEU 96 Cb 0.04 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1r38 h LEU 96 CO -0.01 0.43 0.59 0.78 -0.34 0.00 0.00 178.44 179.88 1r38 h ASN 97 N 0.80 0.98 -0.56 1.25 2.35 -0.44 0.26 115.58 120.23 1r38 h ASN 97 Ca 0.33 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.03 1r38 h ASN 97 Cb 0.19 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1r38 h ASN 97 CO -0.18 0.69 0.20 0.50 -1.65 0.00 0.00 177.43 176.99 1r38 h LYS 98 N 1.15 0.85 -0.42 0.81 1.63 -0.82 0.24 116.57 120.01 1r38 h LYS 98 Ca 0.34 -0.17 -0.03 0.00 -0.85 0.00 0.00 60.65 59.95 1r38 h LYS 98 Cb -0.04 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 1r38 h LYS 98 CO -0.09 0.75 0.16 1.15 -3.45 0.00 0.00 179.45 177.97 1r38 h THR 99 N 0.77 1.20 -0.63 1.00 2.02 -0.10 0.13 112.91 117.30 1r38 h THR 99 Ca 0.18 -0.63 -0.05 0.00 0.77 0.00 0.00 66.41 66.69 1r38 h THR 99 Cb 0.24 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.45 1r38 h THR 99 CO -0.01 0.23 0.20 -0.07 0.37 0.00 0.00 175.52 176.24 1r38 h LEU 100 N 0.53 0.91 -0.11 2.58 3.38 -0.26 0.44 115.31 122.78 1r38 h LEU 100 Ca 0.14 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1r38 h LEU 100 Cb 0.20 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1r38 h LEU 100 CO -0.01 0.87 0.04 0.00 0.09 0.00 0.00 178.44 179.43 1r38 h ALA 101 N 1.07 0.15 -0.44 1.53 0.00 -0.29 0.22 119.26 121.50 1r38 h ALA 101 Ca 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1r38 h ALA 101 Cb 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1r38 h ALA 101 CO -0.01 -0.25 0.24 -0.44 0.00 0.00 0.00 179.25 178.79 1r38 h ASP 102 N 0.01 0.56 1.18 0.00 3.32 -0.56 -2.48 116.42 118.45 1r38 h ASP 102 Ca 0.04 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1r38 h ASP 102 Cb 0.19 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1r38 h ASP 102 CO -0.00 0.49 0.00 -0.07 -1.72 0.00 0.00 179.24 177.94 1r38 h LEU 103 N 0.58 0.00 -1.68 1.55 3.38 -0.80 -3.34 115.31 114.99 1r38 h LEU 103 Ca 0.15 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.88 1r38 h LEU 103 Cb 0.06 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.94 1r38 h LEU 103 CO -0.02 0.00 -0.56 0.29 0.09 0.00 0.00 178.44 178.24 1r38 n LYS 104 N -2.63 -4.93 -4.15 1.13 5.02 0.71 -4.52 118.16 108.81 1r38 n LYS 104 Ca 0.03 0.62 -0.11 0.00 -2.02 0.00 0.00 58.31 56.83 1r38 n LYS 104 Cb 0.34 -4.96 -0.09 0.00 -0.02 0.00 0.00 35.03 30.30 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 -3.26 0.01 -0.29 -0.18 -7.23 -0.88 -5.03 120.40 103.54 1r38 s VAL 105 Ca 0.03 -1.85 0.23 0.00 -1.81 0.00 0.00 61.98 58.58 1r38 s VAL 105 Cb -0.01 -2.37 -0.06 0.00 0.56 0.00 0.00 36.38 34.50 1r38 s VAL 105 CO 0.53 -0.06 0.99 0.47 -0.31 0.00 0.00 175.10 176.72 1r38 n ASP 106 N -0.27 0.70 -3.61 4.85 8.00 -1.26 -4.61 116.55 120.35 1r38 n ASP 106 Ca 0.00 0.20 -0.11 0.00 0.71 0.00 0.00 54.79 55.59 1r38 n ASP 106 Cb 0.65 0.67 -0.04 0.00 -0.02 0.00 0.00 41.12 42.37 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 -3.35 -0.25 0.01 1.24 1.13 -1.26 -4.62 117.35 110.26 1r38 s TYR 107 Ca -0.00 -0.03 0.04 0.00 -1.41 0.00 0.00 57.07 55.67 1r38 s TYR 107 Cb 0.11 0.29 -0.03 0.00 -1.10 0.00 0.00 41.96 41.23 1r38 s TYR 107 CO 0.80 -0.71 -0.10 0.14 -2.51 0.00 0.00 175.55 173.17 1r38 s VAL 108 N -3.68 3.37 0.27 -3.49 -7.23 -0.81 -4.99 120.40 103.85 1r38 s VAL 108 Ca 0.02 -0.89 0.03 0.00 -1.81 0.00 0.00 61.98 59.34 1r38 s VAL 108 Cb 0.01 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.53 1r38 s VAL 108 CO -0.11 0.39 1.66 0.44 -0.31 0.00 0.00 175.10 177.16 1r38 h ASP 109 N 4.57 0.38 -3.49 4.85 3.32 -1.50 -2.08 116.42 122.48 1r38 h ASP 109 Ca -0.48 -0.16 -0.24 0.00 0.02 0.00 0.00 57.03 56.16 1r38 h ASP 109 Cb 1.16 -0.11 -0.31 0.00 0.22 0.00 0.00 39.33 40.29 1r38 h ASP 109 CO 0.52 0.75 -0.61 -0.22 -1.72 0.00 0.00 179.24 177.96 1r38 s LEU 110 N -8.36 0.90 -0.09 1.55 2.96 -0.77 -0.88 118.68 114.00 1r38 s LEU 110 Ca -0.06 0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.12 1r38 s LEU 110 Cb 0.13 0.31 0.02 0.00 0.50 0.00 0.00 46.19 47.15 1r38 s LEU 110 CO 0.79 -0.13 -0.09 0.12 -1.32 0.00 0.00 176.35 175.72 1r38 s PHE 111 N 0.99 1.39 0.22 5.38 5.36 -0.63 -0.94 117.98 129.74 1r38 s PHE 111 Ca -0.08 -0.60 0.09 0.00 -0.96 0.00 0.00 56.93 55.39 1r38 s PHE 111 Cb -0.10 -1.11 -0.04 0.00 -0.34 0.00 0.00 43.02 41.43 1r38 s PHE 111 CO -0.05 -0.39 -0.06 -0.51 -1.46 0.00 0.00 175.22 172.75 1r38 s LEU 112 N 1.23 3.04 -0.29 6.12 1.43 -0.50 -1.81 118.68 127.90 1r38 s LEU 112 Ca -0.04 -0.63 -0.25 0.00 -1.03 0.00 0.00 54.13 52.18 1r38 s LEU 112 Cb -0.14 -1.65 0.00 0.00 0.03 0.00 0.00 46.19 44.43 1r38 s LEU 112 CO -0.03 0.06 0.87 -0.63 0.23 0.00 0.00 176.35 176.85 1r38 s ILE 113 N -2.00 4.73 0.14 -0.59 1.01 -0.83 -0.11 121.20 123.56 1r38 s ILE 113 Ca 0.28 1.41 -0.18 0.00 0.00 0.00 0.00 60.65 62.16 1r38 s ILE 113 Cb -0.08 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 1r38 s ILE 113 CO 0.17 -0.26 1.78 0.00 0.00 0.00 0.00 174.94 176.63 1r38 h ALA 114 N 8.00 0.38 -2.62 9.38 0.00 -1.70 -0.46 119.26 132.23 1r38 h ALA 114 Ca -0.23 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 1r38 h ALA 114 Cb 1.09 -0.08 -0.19 0.00 0.00 0.00 0.00 17.79 18.60 1r38 h ALA 114 CO 0.92 -0.19 -0.40 -0.06 0.00 0.00 0.00 179.25 179.51 1r38 s PHE 115 N -6.17 0.01 -0.85 0.00 0.08 -1.26 -4.20 117.98 105.59 1r38 s PHE 115 Ca -0.13 -0.12 -0.07 0.00 0.12 0.00 0.00 56.93 56.73 1r38 s PHE 115 Cb 0.10 -0.01 -0.08 0.00 -0.57 0.00 0.00 43.02 42.46 1r38 s PHE 115 CO 0.71 -0.37 3.04 -0.35 -0.10 0.00 0.00 175.22 178.14 1r38 n PRO 116 N 1.06 3.11 -4.11 0.24 -0.04 -1.26 -4.77 135.00 129.22 1r38 n PRO 116 Ca -0.21 -2.08 -0.17 0.00 -0.04 0.00 0.00 63.50 61.00 1r38 n PRO 116 Cb 0.57 -2.40 -0.15 0.00 -0.04 0.00 0.00 33.50 31.48 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 0.42 0.39 -0.33 0.52 1.01 -1.26 -5.02 121.20 116.92 1r38 s ILE 117 Ca 0.64 -0.13 0.03 0.00 0.00 0.00 0.00 60.65 61.20 1r38 s ILE 117 Cb 0.26 -0.38 0.10 0.00 0.01 0.00 0.00 42.46 42.45 1r38 s ILE 117 CO -0.08 0.15 0.05 0.00 0.00 0.00 0.00 174.94 175.06 1r38 s ALA 118 N 0.38 2.74 0.56 9.38 0.00 -1.26 -4.54 121.76 129.02 1r38 s ALA 118 Ca -0.04 -2.40 -0.15 0.00 0.00 0.00 0.00 51.96 49.36 1r38 s ALA 118 Cb -0.08 -1.91 -0.06 0.00 0.00 0.00 0.00 23.12 21.07 1r38 s ALA 118 CO -0.00 -1.66 1.01 -0.06 0.00 0.00 0.00 175.76 175.05 1r38 s PHE 119 N 0.99 3.41 0.38 0.00 0.08 0.13 -1.16 117.98 121.80 1r38 s PHE 119 Ca 0.10 1.43 -0.28 0.00 0.12 0.00 0.00 56.93 58.30 1r38 s PHE 119 Cb -0.19 -2.81 -0.11 0.00 -0.57 0.00 0.00 43.02 39.34 1r38 s PHE 119 CO -0.10 -0.59 1.47 1.17 -0.10 0.00 0.00 175.22 177.08 1r38 n LYS 120 N -1.97 2.63 -1.89 0.44 4.81 0.12 -4.29 118.16 118.01 1r38 n LYS 120 Ca 0.07 0.92 -0.41 0.00 -0.87 0.00 0.00 58.31 58.02 1r38 n LYS 120 Cb 0.54 -2.64 -0.02 0.00 0.02 0.00 0.00 35.03 32.93 1r38 n LYS 120 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 1r38 s PHE 121 N -1.12 2.85 -0.13 5.64 5.36 -1.25 -4.75 117.98 124.58 1r38 s PHE 121 Ca 0.54 0.95 0.00 0.00 -0.96 0.00 0.00 56.93 57.46 1r38 s PHE 121 Cb -0.48 -3.95 0.02 0.00 -0.34 0.00 0.00 43.02 38.27 1r38 s PHE 121 CO 0.64 -3.08 -0.12 0.08 -1.46 0.00 0.00 175.22 171.27 1r38 s VAL 122 N -0.20 1.37 0.41 3.12 1.01 -1.26 -4.85 120.40 119.99 1r38 s VAL 122 Ca 0.60 -0.52 -0.25 0.00 0.00 0.00 0.00 61.98 61.81 1r38 s VAL 122 Cb -0.45 -1.30 -0.11 0.00 0.00 0.00 0.00 36.38 34.52 1r38 s VAL 122 CO 0.48 0.42 1.03 -2.65 0.00 0.00 0.00 175.10 174.39 1r38 n PRO 123 N 4.71 1.41 -0.15 2.72 -0.02 -1.26 -4.86 135.00 137.55 1r38 n PRO 123 Ca -0.16 0.50 -0.01 0.00 -2.02 0.00 0.00 63.50 61.82 1r38 n PRO 123 Cb 0.50 -2.06 0.24 0.00 -0.02 0.00 0.00 33.50 32.16 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 1.20 0.00 4.25 2.04 -2.00 -1.93 117.51 122.69 1r38 h ILE 124 Ca -0.44 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 64.85 1r38 h ILE 124 Cb 1.33 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1r38 h ILE 124 CO 0.57 0.23 0.00 1.05 0.00 0.00 0.00 178.15 180.01 1r38 h GLU 125 N 0.85 0.00 0.08 2.37 9.09 -2.01 -3.02 114.58 121.94 1r38 h GLU 125 Ca 0.21 0.00 -0.32 0.00 0.05 0.00 0.00 59.36 59.30 1r38 h GLU 125 Cb 0.09 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.17 1r38 h GLU 125 CO -0.03 0.00 -1.72 0.93 0.05 0.00 0.00 179.01 178.24 1r38 h GLU 126 N 0.00 0.17 -1.36 1.06 5.08 -1.70 -3.47 114.58 114.36 1r38 h GLU 126 Ca 0.00 -0.30 0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1r38 h GLU 126 Cb 0.36 0.11 -0.25 0.00 0.50 0.00 0.00 28.75 29.47 1r38 h GLU 126 CO 0.00 0.95 0.25 0.21 -1.00 0.00 0.00 179.01 179.43 1r38 s LYS 127 N -2.59 0.37 -0.17 2.33 2.20 -1.14 -5.07 119.74 115.67 1r38 s LYS 127 Ca -0.12 0.78 -0.08 0.00 -0.36 0.00 0.00 55.97 56.19 1r38 s LYS 127 Cb 0.07 0.30 0.06 0.00 -1.51 0.00 0.00 37.83 36.76 1r38 s LYS 127 CO 0.82 -0.10 0.40 -0.47 -0.36 0.00 0.00 175.35 175.63 1r38 s TYR 128 N 1.97 -0.61 0.54 4.03 5.04 -1.25 -3.84 117.35 123.23 1r38 s TYR 128 Ca -0.06 1.28 -0.19 0.00 -2.44 0.00 0.00 57.07 55.66 1r38 s TYR 128 Cb -0.05 0.25 -0.06 0.00 0.35 0.00 0.00 41.96 42.44 1r38 s TYR 128 CO -0.17 -0.36 1.09 -2.14 -1.34 0.00 0.00 175.55 172.64 1r38 s PRO 129 N 1.62 3.44 0.38 4.97 0.02 -1.26 -5.10 135.00 139.08 1r38 s PRO 129 Ca -0.08 1.49 0.23 0.00 0.02 0.00 0.00 61.00 62.66 1r38 s PRO 129 Cb -0.09 -2.03 0.39 0.00 0.02 0.00 0.00 34.50 32.79 1r38 s PRO 129 CO -0.12 -0.75 1.59 -1.00 -0.33 0.00 0.00 177.00 176.39 1r38 h PRO 130 N 1.15 0.00 0.00 5.54 0.13 -1.93 -3.49 132.00 133.40 1r38 h PRO 130 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1r38 h PRO 130 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1r38 h PRO 130 CO 0.57 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.75 1r38 n GLY 131 N 1.14 3.52 0.38 1.56 0.00 -1.26 -1.61 105.19 108.91 1r38 n GLY 131 Ca 0.04 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 -1.91 1.61 3.72 -1.26 -4.90 117.46 128.73 1r38 n PHE 132 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1r38 n PHE 132 Cb 0.00 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.49 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 -2.06 2.82 -0.17 1.38 5.04 -0.64 -4.79 117.35 118.93 1r38 s TYR 133 Ca 0.38 0.48 0.13 0.00 -2.44 0.00 0.00 57.07 55.62 1r38 s TYR 133 Cb 0.21 -3.97 0.40 0.00 0.35 0.00 0.00 41.96 38.95 1r38 s TYR 133 CO 0.36 -3.69 1.20 0.00 -1.34 0.00 0.00 175.55 172.08 1r38 n GLY 135 N -0.97 0.69 2.26 0.00 0.00 -1.26 -4.65 105.19 101.26 1r38 n GLY 135 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.11 0.00 1.61 2.03 -1.26 -5.10 116.55 113.72 1r38 n ASP 136 Ca 0.00 -2.60 0.00 0.00 0.52 0.00 0.00 54.79 52.71 1r38 n ASP 136 Cb 0.00 -0.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.84 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 1.87 3.29 0.69 0.27 0.00 -1.26 -1.13 105.19 108.92 1r38 n GLY 137 Ca 0.24 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 3.48 2.07 -4.75 1.61 3.02 -1.26 -4.58 115.26 114.86 1r38 n ASN 138 Ca 0.00 -1.82 -0.40 0.00 -0.03 0.00 0.00 54.58 52.32 1r38 n ASN 138 Cb 0.00 -0.17 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 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 -1.41 7.45 0.04 6.41 0.01 -0.28 -4.99 114.94 122.17 1r38 s ASN 139 Ca 0.32 2.03 -0.27 0.00 -0.71 0.00 0.00 52.86 54.22 1r38 s ASN 139 Cb 0.17 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 39.18 1r38 s ASN 139 CO 0.25 -0.03 0.86 -0.36 -1.51 0.00 0.00 177.10 176.31 1r38 s PHE 140 N -0.76 3.73 -0.02 2.20 0.40 -1.26 -4.11 117.98 118.15 1r38 s PHE 140 Ca 0.45 1.59 0.01 0.00 -0.60 0.00 0.00 56.93 58.38 1r38 s PHE 140 Cb -0.28 -2.95 0.00 0.00 0.51 0.00 0.00 43.02 40.31 1r38 s PHE 140 CO 0.34 0.18 -0.05 0.08 0.70 0.00 0.00 175.22 176.47 1r38 s VAL 141 N 0.26 0.44 0.26 -0.44 1.01 -1.26 -5.06 120.40 115.61 1r38 s VAL 141 Ca 0.43 -0.19 0.10 0.00 0.00 0.00 0.00 61.98 62.33 1r38 s VAL 141 Cb -0.21 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 1r38 s VAL 141 CO 0.25 0.15 -0.07 -0.31 0.00 0.00 0.00 175.10 175.12 1r38 s TYR 142 N 0.20 2.58 0.05 5.22 2.02 -1.26 0.12 117.35 126.27 1r38 s TYR 142 Ca -0.02 -0.25 0.08 0.00 -0.37 0.00 0.00 57.07 56.51 1r38 s TYR 142 Cb -0.06 -1.15 -0.03 0.00 -0.40 0.00 0.00 41.96 40.32 1r38 s TYR 142 CO -0.00 0.63 -0.21 -1.21 -1.57 0.00 0.00 175.55 173.18 1r38 s GLU 143 N -3.49 1.94 -1.34 -0.62 2.02 -0.31 -4.55 118.70 112.34 1r38 s GLU 143 Ca 0.30 -1.05 -0.14 0.00 0.02 0.00 0.00 54.97 54.10 1r38 s GLU 143 Cb -0.06 -2.10 0.09 0.00 0.10 0.00 0.00 34.13 32.16 1r38 s GLU 143 CO 0.18 0.52 1.92 -0.25 0.02 0.00 0.00 175.26 177.65 1r38 n ASP 144 N 1.57 4.60 -4.03 -0.19 8.00 -1.26 -4.73 116.55 120.51 1r38 n ASP 144 Ca -0.16 -2.94 -0.31 0.00 0.71 0.00 0.00 54.79 52.08 1r38 n ASP 144 Cb 0.52 -1.63 -0.15 0.00 -0.02 0.00 0.00 41.12 39.84 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 2.63 2.18 0.57 2.53 1.01 -1.26 -5.10 120.40 122.96 1r38 s VAL 145 Ca 0.47 -1.98 -0.20 0.00 0.00 0.00 0.00 61.98 60.26 1r38 s VAL 145 Cb 0.08 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1r38 s VAL 145 CO -0.01 -0.33 1.30 -2.84 0.00 0.00 0.00 175.10 173.21 1r38 s PRO 146 N 1.02 3.00 0.23 2.72 0.02 -1.26 -4.88 135.00 135.84 1r38 s PRO 146 Ca 0.02 2.09 -0.13 0.00 0.02 0.00 0.00 61.00 62.99 1r38 s PRO 146 Cb -0.19 -2.10 0.29 0.00 0.02 0.00 0.00 34.50 32.52 1r38 s PRO 146 CO -0.07 -1.25 1.59 0.82 -0.33 0.00 0.00 177.00 177.76 1r38 h ILE 147 N 1.14 0.20 -0.77 2.83 1.08 -1.98 -1.06 117.51 118.95 1r38 h ILE 147 Ca -0.51 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.10 1r38 h ILE 147 Cb 1.31 0.20 -0.05 0.00 -3.07 0.00 0.00 36.82 35.20 1r38 h ILE 147 CO 0.56 0.00 0.51 0.25 -0.69 0.00 0.00 178.15 178.78 1r38 h LEU 148 N -0.02 0.48 -0.26 1.44 5.85 -1.98 -0.01 115.31 120.81 1r38 h LEU 148 Ca 0.35 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.09 1r38 h LEU 148 Cb 0.57 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1r38 h LEU 148 CO -0.80 0.26 0.14 -0.33 -0.34 0.00 0.00 178.44 177.37 1r38 h GLU 149 N 0.52 0.37 -0.26 1.25 4.39 -1.55 0.05 114.58 119.35 1r38 h GLU 149 Ca 0.38 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 60.02 1r38 h GLU 149 Cb 0.73 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1r38 h GLU 149 CO -0.13 0.35 0.15 1.15 -1.16 0.00 0.00 179.01 179.36 1r38 h THR 150 N 0.30 1.10 -0.78 1.13 2.02 -1.03 -2.54 112.91 113.12 1r38 h THR 150 Ca 0.09 -0.26 0.06 0.00 0.77 0.00 0.00 66.41 67.07 1r38 h THR 150 Cb 0.09 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.25 1r38 h THR 150 CO -0.01 0.10 0.47 -0.25 0.37 0.00 0.00 175.52 176.19 1r38 h TRP 151 N 0.32 0.86 -0.87 3.16 2.91 -0.78 -1.68 115.95 119.87 1r38 h TRP 151 Ca 0.09 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.12 1r38 h TRP 151 Cb 0.03 -0.27 -0.04 0.00 -0.51 0.00 0.00 29.16 28.37 1r38 h TRP 151 CO -0.04 0.43 0.45 0.87 -1.03 0.00 0.00 178.44 179.12 1r38 h LYS 152 N 0.85 1.23 -0.53 2.65 1.57 -0.71 0.48 116.57 122.11 1r38 h LYS 152 Ca 0.34 -0.16 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1r38 h LYS 152 Cb 0.17 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1r38 h LYS 152 CO -0.17 0.91 0.24 0.00 -0.57 0.00 0.00 179.45 179.86 1r38 h ALA 153 N 1.27 1.43 -0.31 3.86 0.00 -0.93 -1.57 119.26 123.01 1r38 h ALA 153 Ca 0.30 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 1r38 h ALA 153 Cb 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1r38 h ALA 153 CO -0.04 0.45 -0.46 -0.07 0.00 0.00 0.00 179.25 179.12 1r38 h LEU 154 N 0.75 0.88 -0.82 0.00 3.38 -0.46 -2.60 115.31 116.44 1r38 h LEU 154 Ca 0.18 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.74 1r38 h LEU 154 Cb 0.10 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1r38 h LEU 154 CO -0.02 1.20 0.54 -0.33 0.09 0.00 0.00 178.44 179.92 1r38 h GLU 155 N 0.64 1.05 -0.81 1.13 5.08 -0.08 -1.22 114.58 120.36 1r38 h GLU 155 Ca 0.04 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1r38 h GLU 155 Cb 1.04 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 30.02 1r38 h GLU 155 CO 0.10 0.69 0.42 0.87 -1.00 0.00 0.00 179.01 180.10 1r38 h LYS 156 N 1.08 1.15 0.00 2.33 1.57 -1.21 -1.66 116.57 119.83 1r38 h LYS 156 Ca 0.31 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 1r38 h LYS 156 Cb -0.08 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.01 1r38 h LYS 156 CO -0.08 0.86 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.43 1r38 h LEU 157 N 1.14 0.00 -0.24 2.94 3.38 -0.91 0.64 115.31 122.27 1r38 h LEU 157 Ca 0.28 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.04 1r38 h LEU 157 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1r38 h LEU 157 CO -0.04 0.16 -0.81 0.58 0.09 0.00 0.00 178.44 178.41 1r38 h VAL 158 N 0.00 1.33 -0.03 1.22 2.07 -0.38 -1.76 116.25 118.71 1r38 h VAL 158 Ca -0.00 -2.14 -0.09 0.00 0.82 0.00 0.00 66.70 65.29 1r38 h VAL 158 Cb 0.39 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1r38 h VAL 158 CO 0.02 0.66 -0.43 0.00 0.02 0.00 0.00 177.57 177.84 1r38 h ALA 159 N 0.71 1.25 -0.00 1.67 0.00 -0.37 -1.68 119.26 120.83 1r38 h ALA 159 Ca -0.06 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1r38 h ALA 159 Cb 1.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1r38 h ALA 159 CO 0.15 0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.95 1r38 n ALA 160 N -2.46 2.62 -1.02 0.00 0.00 0.07 -4.90 120.51 114.82 1r38 n ALA 160 Ca -0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 53.44 53.23 1r38 n ALA 160 Cb 0.46 -1.49 -0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 1.12 0.47 0.02 0.00 0.00 -0.63 -4.91 105.19 101.27 1r38 n GLY 161 Ca 0.20 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.84 0.09 -3.92 1.61 5.02 -0.69 -4.71 118.16 112.72 1r38 n LYS 162 Ca -0.01 0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.17 1r38 n LYS 162 Cb 0.04 -1.55 -0.14 0.00 -0.02 0.00 0.00 35.03 33.35 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 -3.05 0.09 -0.15 -0.18 1.01 -1.20 -1.92 121.20 115.78 1r38 s ILE 163 Ca 0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 60.65 60.56 1r38 s ILE 163 Cb 0.16 -0.10 -0.13 0.00 0.01 0.00 0.00 42.46 42.41 1r38 s ILE 163 CO 0.70 0.04 0.20 0.11 0.00 0.00 0.00 174.94 175.99 1r38 h LYS 164 N 6.27 0.00 -5.04 2.79 6.56 -1.44 -3.40 116.57 122.31 1r38 h LYS 164 Ca -0.27 0.00 -0.41 0.00 -1.06 0.00 0.00 60.65 58.91 1r38 h LYS 164 Cb 1.20 0.00 -0.26 0.00 -0.57 0.00 0.00 32.23 32.60 1r38 h LYS 164 CO 0.50 0.54 -0.78 -1.12 -2.06 0.00 0.00 179.45 176.53 1r38 s SER 165 N -6.15 1.37 0.17 0.86 0.01 -0.06 -5.02 113.70 104.88 1r38 s SER 165 Ca -0.17 -0.37 0.10 0.00 1.31 0.00 0.00 55.95 56.82 1r38 s SER 165 Cb 0.02 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.11 1r38 s SER 165 CO 0.40 0.03 -0.20 0.27 0.41 0.00 0.00 173.24 174.15 1r38 s ILE 166 N -0.71 2.63 0.00 1.44 -4.36 -1.26 -1.60 121.20 117.34 1r38 s ILE 166 Ca 0.01 -1.81 0.00 0.00 -0.26 0.00 0.00 60.65 58.59 1r38 s ILE 166 Cb -0.07 -2.25 0.00 0.00 1.25 0.00 0.00 42.46 41.39 1r38 s ILE 166 CO 0.01 -0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.75 1r38 n GLY 167 N 0.39 2.40 3.10 6.27 0.00 -0.75 -1.15 105.19 115.45 1r38 n GLY 167 Ca -0.13 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.86 0.56 0.05 1.61 -7.23 -0.04 -1.96 120.40 110.52 1r38 s VAL 168 Ca 0.00 -1.44 0.06 0.00 -1.81 0.00 0.00 61.98 58.79 1r38 s VAL 168 Cb 0.00 -1.05 -0.02 0.00 0.56 0.00 0.00 36.38 35.86 1r38 s VAL 168 CO 0.00 -0.61 -0.18 -0.55 -0.31 0.00 0.00 175.10 173.45 1r38 s SER 169 N -2.21 2.09 -1.50 4.85 0.15 -0.18 -0.91 113.70 115.99 1r38 s SER 169 Ca -0.01 -0.50 -0.06 0.00 0.70 0.00 0.00 55.95 56.07 1r38 s SER 169 Cb -0.03 -0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.14 1r38 s SER 169 CO -0.02 0.09 0.75 0.59 1.20 0.00 0.00 173.24 175.85 1r38 n ASN 170 N 1.81 -5.95 -4.58 5.45 3.02 -0.19 -4.08 115.26 110.74 1r38 n ASN 170 Ca -0.18 -0.38 -0.35 0.00 -0.03 0.00 0.00 54.58 53.64 1r38 n ASN 170 Cb 0.54 -4.78 -0.11 0.00 -0.61 0.00 0.00 39.78 34.83 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 -3.20 3.20 0.78 3.10 0.40 -1.26 -4.47 117.98 116.53 1r38 s PHE 171 Ca 0.39 -0.05 -0.12 0.00 -0.60 0.00 0.00 56.93 56.56 1r38 s PHE 171 Cb -0.18 -2.16 0.06 0.00 0.51 0.00 0.00 43.02 41.25 1r38 s PHE 171 CO 0.49 -0.03 1.15 -1.25 0.70 0.00 0.00 175.22 176.28 1r38 s PRO 172 N 0.89 2.18 0.17 0.24 0.04 -1.26 -4.81 135.00 132.45 1r38 s PRO 172 Ca 0.04 0.25 -0.17 0.00 0.04 0.00 0.00 61.00 61.16 1r38 s PRO 172 Cb -0.14 -1.96 0.12 0.00 0.04 0.00 0.00 34.50 32.56 1r38 s PRO 172 CO 0.03 -1.47 1.65 0.78 0.04 0.00 0.00 177.00 178.02 1r38 h GLY 173 N -0.97 0.22 1.04 0.56 0.00 -1.97 -1.59 103.07 100.36 1r38 h GLY 173 Ca -0.46 0.20 0.04 0.00 0.00 0.00 0.00 47.33 47.11 1r38 h GLY 173 CO 0.65 -0.19 0.53 0.00 0.00 0.00 0.00 176.54 177.54 1r38 h ALA 174 N 1.32 1.54 -0.06 3.60 0.00 -1.99 0.30 119.26 123.97 1r38 h ALA 174 Ca 0.21 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 1r38 h ALA 174 Cb 0.38 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1r38 h ALA 174 CO -0.47 0.37 -0.88 1.25 0.00 0.00 0.00 179.25 179.51 1r38 h LEU 175 N 0.97 0.73 -0.38 0.00 5.85 -1.82 -1.48 115.31 119.18 1r38 h LEU 175 Ca 0.33 -0.54 -0.08 0.00 0.84 0.00 0.00 57.88 58.44 1r38 h LEU 175 Cb 0.10 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1r38 h LEU 175 CO -0.10 1.32 -0.06 0.25 -0.34 0.00 0.00 178.44 179.51 1r38 h LEU 176 N 0.37 0.72 -0.23 2.25 5.85 -0.79 -1.05 115.31 122.42 1r38 h LEU 176 Ca -0.08 -0.35 0.03 0.00 0.84 0.00 0.00 57.88 58.33 1r38 h LEU 176 Cb 1.51 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 1r38 h LEU 176 CO 0.17 0.90 0.05 0.25 -0.34 0.00 0.00 178.44 179.46 1r38 h LEU 177 N 0.53 0.02 -0.71 2.25 5.85 -0.89 -1.16 115.31 121.19 1r38 h LEU 177 Ca 0.10 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1r38 h LEU 177 Cb 0.57 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 1r38 h LEU 177 CO 0.03 0.04 0.36 -0.78 -0.34 0.00 0.00 178.44 177.75 1r38 h ASP 178 N 0.14 0.91 -0.73 1.25 3.58 -1.11 -2.36 116.42 118.09 1r38 h ASP 178 Ca 0.10 -0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.45 1r38 h ASP 178 Cb 0.10 -0.23 -0.04 0.00 1.72 0.00 0.00 39.33 40.88 1r38 h ASP 178 CO -0.13 0.77 0.48 0.25 -2.88 0.00 0.00 179.24 177.73 1r38 h LEU 179 N 0.98 0.82 -1.68 2.28 5.85 -0.74 -1.07 115.31 121.76 1r38 h LEU 179 Ca 0.25 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1r38 h LEU 179 Cb 0.08 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1r38 h LEU 179 CO -0.03 0.59 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.55 1r38 h LEU 180 N 0.97 0.14 -1.05 2.25 3.38 -0.69 -0.19 115.31 120.11 1r38 h LEU 180 Ca 0.27 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1r38 h LEU 180 Cb -0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1r38 h LEU 180 CO -0.06 0.21 -0.41 0.03 0.09 0.00 0.00 178.44 178.30 1r38 h ARG 181 N 0.15 0.13 -0.00 1.13 3.08 -0.97 -3.25 114.38 114.65 1r38 h ARG 181 Ca 0.04 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1r38 h ARG 181 Cb 0.18 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1r38 h ARG 181 CO 0.01 0.52 -0.62 0.41 -1.07 0.00 0.00 179.97 179.22 1r38 n GLY 182 N -0.27 -0.34 3.73 0.04 0.00 -0.82 -5.00 105.19 102.53 1r38 n GLY 182 Ca -0.02 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.32 3.39 -0.14 4.61 0.00 -0.15 -4.94 121.76 122.22 1r38 s ALA 183 Ca 0.08 0.86 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 1r38 s ALA 183 Cb 0.12 -3.41 -0.25 0.00 0.00 0.00 0.00 23.12 19.59 1r38 s ALA 183 CO 0.58 -0.35 0.36 1.15 0.00 0.00 0.00 175.76 177.50 1r38 h THR 184 N 4.06 0.73 -3.78 0.00 2.02 -1.91 -3.42 112.91 110.62 1r38 h THR 184 Ca -0.43 -2.32 -0.66 0.00 0.77 0.00 0.00 66.41 63.77 1r38 h THR 184 Cb 1.21 2.47 -0.18 0.00 -1.74 0.00 0.00 68.15 69.91 1r38 h THR 184 CO 0.77 0.75 -0.48 -0.63 0.37 0.00 0.00 175.52 176.29 1r38 s ILE 185 N -2.51 5.29 0.31 3.11 1.01 -1.26 -5.06 121.20 122.09 1r38 s ILE 185 Ca -0.23 -0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 1r38 s ILE 185 Cb 0.06 -3.65 -0.10 0.00 0.01 0.00 0.00 42.46 38.78 1r38 s ILE 185 CO 0.73 0.08 1.24 -0.54 0.00 0.00 0.00 174.94 176.46 1r38 s LYS 186 N 1.75 4.45 -0.08 2.79 -0.14 -1.26 -4.89 119.74 122.36 1r38 s LYS 186 Ca 0.07 2.08 -0.32 0.00 -1.36 0.00 0.00 55.97 56.43 1r38 s LYS 186 Cb -0.17 -3.12 -0.10 0.00 -1.68 0.00 0.00 37.83 32.76 1r38 s LYS 186 CO 0.11 -0.06 1.96 -0.35 -0.76 0.00 0.00 175.35 176.25 1r38 n PRO 187 N 1.03 2.31 0.19 -1.68 -0.04 -1.26 -4.81 135.00 130.73 1r38 n PRO 187 Ca -0.00 0.82 0.06 0.00 -0.04 0.00 0.00 63.50 64.34 1r38 n PRO 187 Cb 0.43 -2.80 0.31 0.00 -0.04 0.00 0.00 33.50 31.39 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 10.38 0.94 -3.38 0.55 0.00 -1.48 -3.44 119.26 122.83 1r38 h ALA 188 Ca -0.47 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 53.87 1r38 h ALA 188 Cb 1.26 -0.06 -0.24 0.00 0.00 0.00 0.00 17.79 18.75 1r38 h ALA 188 CO 0.95 0.45 -0.72 0.08 0.00 0.00 0.00 179.25 180.01 1r38 s VAL 189 N -3.50 0.22 -0.21 0.00 1.01 -1.25 -1.98 120.40 114.69 1r38 s VAL 189 Ca 0.01 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1r38 s VAL 189 Cb 0.10 -0.28 0.05 0.00 0.00 0.00 0.00 36.38 36.25 1r38 s VAL 189 CO 0.69 -0.23 -0.09 -0.22 0.00 0.00 0.00 175.10 175.24 1r38 s LEU 190 N -0.86 2.46 -0.27 3.92 2.96 0.33 -0.86 118.68 126.36 1r38 s LEU 190 Ca -0.07 -1.02 -0.08 0.00 -0.22 0.00 0.00 54.13 52.74 1r38 s LEU 190 Cb -0.06 -1.24 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 1r38 s LEU 190 CO -0.00 -0.18 0.11 -1.58 -1.32 0.00 0.00 176.35 173.38 1r38 s GLN 191 N 1.37 3.56 0.06 1.98 0.74 -0.09 -1.61 119.66 125.67 1r38 s GLN 191 Ca -0.03 -0.56 -0.00 0.00 0.05 0.00 0.00 55.36 54.82 1r38 s GLN 191 Cb -0.17 -3.44 -0.04 0.00 1.10 0.00 0.00 33.01 30.46 1r38 s GLN 191 CO -0.07 -0.27 -0.04 0.14 -0.55 0.00 0.00 175.29 174.50 1r38 s VAL 192 N 1.63 0.33 0.14 1.34 -7.23 -0.84 -1.02 120.40 114.74 1r38 s VAL 192 Ca 0.06 -1.81 -0.32 0.00 -1.81 0.00 0.00 61.98 58.09 1r38 s VAL 192 Cb -0.16 -1.52 -0.12 0.00 0.56 0.00 0.00 36.38 35.14 1r38 s VAL 192 CO 0.05 -0.96 1.76 1.21 -0.31 0.00 0.00 175.10 176.85 1r38 n GLU 193 N 0.12 2.62 -3.45 4.82 2.13 -1.26 -1.46 120.64 124.16 1r38 n GLU 193 Ca -0.14 0.95 -0.09 0.00 0.66 0.00 0.00 57.16 58.54 1r38 n GLU 193 Cb 0.61 -2.80 -0.08 0.00 0.27 0.00 0.00 31.44 29.43 1r38 n GLU 193 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1r38 s HIS 194 N 1.99 -0.82 0.27 4.31 2.46 -0.75 -4.82 115.29 117.93 1r38 s HIS 194 Ca 0.80 1.07 -0.21 0.00 0.47 0.00 0.00 55.06 57.19 1r38 s HIS 194 Cb -0.54 0.12 0.02 0.00 -0.13 0.00 0.00 32.58 32.05 1r38 s HIS 194 CO 0.37 -0.64 0.72 -3.38 -2.47 0.00 0.00 174.74 169.34 1r38 s HIS 195 N 2.57 -0.21 0.64 3.88 -3.43 -1.18 -3.95 115.29 113.60 1r38 s HIS 195 Ca 0.08 -0.23 0.29 0.00 -0.80 0.00 0.00 55.06 54.40 1r38 s HIS 195 Cb -0.14 0.70 1.57 0.00 -1.43 0.00 0.00 32.58 33.28 1r38 s HIS 195 CO -0.15 -1.21 1.92 -1.35 -2.00 0.00 0.00 174.74 171.95 1r38 h PRO 196 N 2.00 0.00 0.00 -0.38 0.11 -1.93 -0.26 132.00 131.54 1r38 h PRO 196 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1r38 h PRO 196 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1r38 h PRO 196 CO 0.24 0.00 -0.47 0.66 -0.21 0.00 0.00 178.00 178.22 1r38 n TYR 197 N -3.22 0.28 -3.36 0.65 4.01 -1.26 -1.85 117.16 112.41 1r38 n TYR 197 Ca 0.02 0.08 -0.26 0.00 -0.16 0.00 0.00 57.90 57.58 1r38 n TYR 197 Cb 0.48 -0.49 -0.10 0.00 -0.31 0.00 0.00 39.34 38.92 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 -3.60 1.16 0.03 7.72 2.96 -0.12 -0.62 118.68 126.20 1r38 s LEU 198 Ca 0.09 -2.87 0.06 0.00 -0.22 0.00 0.00 54.13 51.19 1r38 s LEU 198 Cb 0.16 -0.28 -0.24 0.00 0.50 0.00 0.00 46.19 46.33 1r38 s LEU 198 CO 0.68 -0.18 0.94 1.56 -1.32 0.00 0.00 176.35 178.03 1r38 h GLN 199 N 5.77 0.08 -6.93 1.98 4.20 -1.76 -3.13 115.11 115.32 1r38 h GLN 199 Ca 0.23 -0.13 -0.54 0.00 0.06 0.00 0.00 58.65 58.27 1r38 h GLN 199 Cb 0.93 0.05 -0.11 0.00 0.30 0.00 0.00 27.48 28.65 1r38 h GLN 199 CO 0.33 0.87 -0.88 1.04 -0.67 0.00 0.00 178.83 179.53 1r38 n GLN 200 N -3.28 -0.64 -0.03 1.46 6.02 -1.26 -4.81 117.38 114.83 1r38 n GLN 200 Ca -0.11 0.03 0.10 0.00 -0.01 0.00 0.00 57.00 57.01 1r38 n GLN 200 Cb 1.01 -2.64 0.50 0.00 1.02 0.00 0.00 30.24 30.13 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 -1.71 0.39 -0.21 -1.09 0.13 -2.00 -2.35 132.00 125.16 1r38 h PRO 201 Ca -0.61 -0.02 -0.16 0.00 -0.87 0.00 0.00 66.00 64.34 1r38 h PRO 201 Cb 1.24 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1r38 h PRO 201 CO 0.55 0.26 -0.52 0.87 -0.23 0.00 0.00 178.00 178.93 1r38 h LYS 202 N 0.40 0.59 -0.17 0.86 1.57 -1.99 -0.39 116.57 117.45 1r38 h LYS 202 Ca 0.22 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1r38 h LYS 202 Cb 0.35 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1r38 h LYS 202 CO -0.05 0.97 0.06 1.25 -0.57 0.00 0.00 179.45 181.10 1r38 h LEU 203 N 0.46 0.24 -0.27 2.94 5.85 -1.80 -0.60 115.31 122.14 1r38 h LEU 203 Ca 0.02 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.58 1r38 h LEU 203 Cb 1.06 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1r38 h LEU 203 CO 0.10 0.37 0.08 0.40 -0.34 0.00 0.00 178.44 179.04 1r38 h ILE 204 N 0.10 0.91 -0.03 4.05 1.08 -1.33 -1.49 117.51 120.79 1r38 h ILE 204 Ca 0.05 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 1r38 h ILE 204 Cb 0.21 0.70 -0.00 0.00 -3.07 0.00 0.00 36.82 34.65 1r38 h ILE 204 CO -0.00 0.03 -0.00 -0.08 -0.69 0.00 0.00 178.15 177.41 1r38 h GLU 205 N 0.19 0.01 0.01 2.37 4.81 -0.95 -1.58 114.58 119.44 1r38 h GLU 205 Ca 0.12 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1r38 h GLU 205 Cb 0.10 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1r38 h GLU 205 CO -0.14 0.01 -0.16 0.35 -0.73 0.00 0.00 179.01 178.34 1r38 h PHE 206 N 0.01 -0.41 -0.34 0.92 3.57 -0.77 -1.50 116.94 118.42 1r38 h PHE 206 Ca 0.01 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.54 1r38 h PHE 206 Cb 0.02 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1r38 h PHE 206 CO -0.10 -0.23 0.20 0.00 -2.23 0.00 0.00 178.31 175.95 1r38 h ALA 207 N 0.66 0.43 -0.57 2.41 0.00 -1.17 -0.25 119.26 120.76 1r38 h ALA 207 Ca 0.05 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1r38 h ALA 207 Cb 0.33 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1r38 h ALA 207 CO -0.14 -0.16 0.26 1.96 0.00 0.00 0.00 179.25 181.16 1r38 h GLN 208 N 0.40 0.83 -0.07 0.00 4.20 -1.17 0.84 115.11 120.15 1r38 h GLN 208 Ca 0.14 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1r38 h GLN 208 Cb 0.01 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1r38 h GLN 208 CO -0.07 0.69 -0.15 -0.22 -0.67 0.00 0.00 178.83 178.41 1r38 h LYS 209 N 0.77 0.10 -0.00 1.46 3.64 -0.94 0.66 116.57 122.26 1r38 h LYS 209 Ca 0.19 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1r38 h LYS 209 Cb 0.15 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1r38 h LYS 209 CO -0.02 0.26 0.00 0.00 -2.27 0.00 0.00 179.45 177.42 1r38 n ALA 210 N -2.50 2.60 -1.00 5.00 0.00 -0.14 -4.86 120.51 119.61 1r38 n ALA 210 Ca -0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 53.44 53.30 1r38 n ALA 210 Cb 0.25 -1.28 -0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 0.79 0.47 3.66 0.00 0.00 0.22 -5.02 105.19 105.30 1r38 n GLY 211 Ca 0.13 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.99 5.16 0.17 1.61 1.01 0.20 -4.52 120.40 122.04 1r38 s VAL 212 Ca 0.00 0.79 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 1r38 s VAL 212 Cb 0.00 -3.77 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 1r38 s VAL 212 CO 0.00 0.20 1.00 -0.89 0.00 0.00 0.00 175.10 175.42 1r38 s THR 213 N 1.58 4.16 -0.13 3.92 2.01 -0.84 -3.52 115.64 122.82 1r38 s THR 213 Ca 0.20 1.91 -0.13 0.00 0.31 0.00 0.00 61.69 63.99 1r38 s THR 213 Cb -0.15 -4.22 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 1r38 s THR 213 CO 0.09 0.35 0.28 -0.63 -0.69 0.00 0.00 174.62 174.02 1r38 s ILE 214 N -0.42 5.30 -0.14 1.82 -1.09 -1.26 -0.52 121.20 124.89 1r38 s ILE 214 Ca 0.46 0.52 0.02 0.00 -2.23 0.00 0.00 60.65 59.42 1r38 s ILE 214 Cb -0.26 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 37.02 1r38 s ILE 214 CO 0.32 0.46 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.41 1r38 s THR 215 N -0.05 2.34 0.16 2.92 2.01 -0.64 -1.11 115.64 121.28 1r38 s THR 215 Ca 0.17 -0.89 -0.13 0.00 0.31 0.00 0.00 61.69 61.15 1r38 s THR 215 Cb -0.13 -1.95 -0.07 0.00 0.01 0.00 0.00 72.50 70.35 1r38 s THR 215 CO 0.05 0.54 0.54 0.00 -0.69 0.00 0.00 174.62 175.06 1r38 s ALA 216 N 0.71 3.59 0.16 7.40 0.00 -0.10 -1.99 121.76 131.53 1r38 s ALA 216 Ca -0.08 -0.18 0.09 0.00 0.00 0.00 0.00 51.96 51.78 1r38 s ALA 216 Cb -0.16 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1r38 s ALA 216 CO 0.01 0.47 -0.19 1.52 0.00 0.00 0.00 175.76 177.57 1r38 s TYR 217 N -1.54 1.85 -1.32 0.00 -0.85 -0.53 -4.07 117.35 110.89 1r38 s TYR 217 Ca 0.39 -0.46 -0.04 0.00 -0.52 0.00 0.00 57.07 56.45 1r38 s TYR 217 Cb -0.14 -0.93 0.02 0.00 0.38 0.00 0.00 41.96 41.28 1r38 s TYR 217 CO 0.19 0.33 0.97 0.43 -1.52 0.00 0.00 175.55 175.96 1r38 n SER 218 N 0.38 -3.35 0.33 -0.18 7.64 -1.26 -1.81 113.62 115.37 1r38 n SER 218 Ca -0.14 -0.67 0.21 0.00 1.01 0.00 0.00 58.87 59.28 1r38 n SER 218 Cb 0.57 -4.67 1.10 0.00 -1.01 0.00 0.00 64.21 60.20 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 -2.13 0.00 -0.49 6.43 0.02 -1.86 0.17 113.55 115.70 1r38 h SER 219 Ca -0.59 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1r38 h SER 219 Cb 1.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.90 1r38 h SER 219 CO 0.56 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.74 1r38 n PHE 220 N -3.06 1.37 0.00 3.45 0.99 -1.26 -4.74 117.46 114.21 1r38 n PHE 220 Ca -0.03 -0.51 0.00 0.00 -0.00 0.00 0.00 57.45 56.91 1r38 n PHE 220 Cb 0.16 -0.30 0.00 0.00 -1.00 0.00 0.00 39.48 38.35 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 0.77 3.84 0.30 1.37 0.00 0.61 -2.91 105.19 109.17 1r38 n GLY 221 Ca 0.21 -0.01 0.18 0.00 0.00 0.00 0.00 46.02 46.41 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 -0.49 1.61 0.13 -1.91 -3.36 132.00 127.99 1r38 h PRO 222 Ca 0.00 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.22 1r38 h PRO 222 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 1r38 h PRO 222 CO 0.00 0.02 -0.36 0.37 -0.23 0.00 0.00 178.00 177.80 1r38 h GLN 223 N 0.00 -0.22 -0.16 0.86 5.75 -1.89 -1.17 115.11 118.27 1r38 h GLN 223 Ca -0.00 0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.56 1r38 h GLN 223 Cb 0.32 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 1r38 h GLN 223 CO 0.00 -0.15 0.13 1.03 -2.65 0.00 0.00 178.83 177.20 1r38 h SER 224 N -0.23 0.00 0.72 -0.69 0.87 -1.83 -2.92 113.55 109.46 1r38 h SER 224 Ca 0.19 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1r38 h SER 224 Cb 0.56 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1r38 h SER 224 CO -0.61 0.00 -0.78 0.49 -0.53 0.00 0.00 176.83 175.39 1r38 n PHE 225 N -4.24 0.47 0.16 2.24 3.01 -0.47 -4.25 117.46 114.39 1r38 n PHE 225 Ca 0.01 0.14 0.01 0.00 1.01 0.00 0.00 57.45 58.62 1r38 n PHE 225 Cb 0.26 -0.59 0.30 0.00 -0.01 0.00 0.00 39.48 39.44 1r38 n PHE 225 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 1r38 h VAL 226 N 0.00 1.31 0.00 -4.37 -1.51 -1.28 -2.18 116.25 108.22 1r38 h VAL 226 Ca 0.00 -1.49 0.00 0.00 -1.23 0.00 0.00 66.70 63.98 1r38 h VAL 226 Cb 0.75 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1r38 h VAL 226 CO 0.00 0.43 0.00 1.05 -1.23 0.00 0.00 177.57 177.82 1r38 h GLU 227 N 0.02 0.00 -0.31 5.19 4.11 -1.76 -0.66 114.58 121.17 1r38 h GLU 227 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1r38 h GLU 227 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1r38 h GLU 227 CO 0.06 0.00 0.00 -1.33 0.07 0.00 0.00 179.01 177.81 1r38 n MET 228 N -2.34 1.88 -2.67 1.06 2.81 -0.82 -4.92 117.12 112.11 1r38 n MET 228 Ca 0.02 -1.35 -0.22 0.00 -1.81 0.00 0.00 57.70 54.35 1r38 n MET 228 Cb 0.23 -1.35 0.01 0.00 -0.71 0.00 0.00 33.22 31.40 1r38 n MET 228 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1r38 n ASN 229 N 0.58 -6.00 -4.67 7.83 5.15 -0.25 -4.94 115.26 112.96 1r38 n ASN 229 Ca 0.15 -0.13 -0.43 0.00 -0.60 0.00 0.00 54.58 53.57 1r38 n ASN 229 Cb 0.35 -4.93 -0.02 0.00 -0.53 0.00 0.00 39.78 34.65 1r38 n ASN 229 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 1r38 s GLN 230 N -5.34 4.29 0.17 1.20 0.74 -1.21 -4.94 119.66 114.57 1r38 s GLN 230 Ca 0.13 1.51 -0.17 0.00 0.05 0.00 0.00 55.36 56.88 1r38 s GLN 230 Cb -0.06 -3.65 0.10 0.00 1.10 0.00 0.00 33.01 30.50 1r38 s GLN 230 CO 0.16 -0.58 1.68 0.78 -0.55 0.00 0.00 175.29 176.78 1r38 h GLY 231 N 9.13 0.33 0.40 2.59 0.00 -1.92 -1.81 103.07 111.78 1r38 h GLY 231 Ca -0.25 0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.19 1r38 h GLY 231 CO 0.94 -0.14 -0.43 -0.09 0.00 0.00 0.00 176.54 176.82 1r38 h ARG 232 N 0.03 -0.74 -0.52 4.80 2.43 -1.98 0.25 114.38 118.65 1r38 h ARG 232 Ca 0.19 0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.49 1r38 h ARG 232 Cb 0.29 0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.95 1r38 h ARG 232 CO -0.39 -0.49 0.16 0.00 -1.51 0.00 0.00 179.97 177.75 1r38 h ALA 233 N -0.39 0.63 -0.67 2.80 0.00 -1.86 -1.94 119.26 117.83 1r38 h ALA 233 Ca -0.01 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1r38 h ALA 233 Cb 0.73 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1r38 h ALA 233 CO -0.16 -0.24 0.44 -0.07 0.00 0.00 0.00 179.25 179.22 1r38 h LEU 234 N 0.33 0.77 0.00 0.00 3.38 -0.87 -0.85 115.31 118.06 1r38 h LEU 234 Ca 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1r38 h LEU 234 Cb 0.31 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1r38 h LEU 234 CO -0.28 0.55 0.00 0.59 0.09 0.00 0.00 178.44 179.39 1r38 n ASN 235 N -4.44 0.00 -4.66 -0.43 3.02 0.04 -4.81 115.26 103.98 1r38 n ASN 235 Ca 0.07 0.16 -0.38 0.00 -0.03 0.00 0.00 54.58 54.40 1r38 n ASN 235 Cb 0.04 -0.37 -0.08 0.00 -0.61 0.00 0.00 39.78 38.76 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 -2.75 5.22 0.11 3.41 2.01 -0.33 -5.04 115.64 118.28 1r38 s THR 236 Ca 0.19 0.61 -0.33 0.00 0.31 0.00 0.00 61.69 62.47 1r38 s THR 236 Cb 0.17 -3.69 -0.13 0.00 0.01 0.00 0.00 72.50 68.86 1r38 s THR 236 CO 0.41 0.25 1.69 -2.65 -0.69 0.00 0.00 174.62 173.64 1r38 n PRO 237 N 4.56 2.33 -1.06 4.92 -0.02 -1.26 -4.91 135.00 139.56 1r38 n PRO 237 Ca -0.09 0.84 -0.33 0.00 -2.02 0.00 0.00 63.50 61.90 1r38 n PRO 237 Cb 0.51 -2.66 0.13 0.00 -0.02 0.00 0.00 33.50 31.47 1r38 n PRO 237 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1r38 s THR 238 N 1.82 2.09 0.05 3.45 -4.23 -1.26 -4.91 115.64 112.65 1r38 s THR 238 Ca 0.81 0.04 0.12 0.00 -1.18 0.00 0.00 61.69 61.48 1r38 s THR 238 Cb -0.63 -2.38 -0.05 0.00 1.34 0.00 0.00 72.50 70.78 1r38 s THR 238 CO 0.40 -0.03 1.44 -0.07 -0.54 0.00 0.00 174.62 175.81 1r38 h LEU 239 N -1.05 0.00 -1.43 4.79 3.38 -1.91 -3.02 115.31 116.07 1r38 h LEU 239 Ca -0.46 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.45 1r38 h LEU 239 Cb 1.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1r38 h LEU 239 CO 0.46 0.70 -0.28 -0.26 0.09 0.00 0.00 178.44 179.14 1r38 h PHE 240 N 0.00 0.00 -0.33 1.13 -1.00 -1.92 -2.94 116.94 111.88 1r38 h PHE 240 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1r38 h PHE 240 Cb 1.44 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.00 1r38 h PHE 240 CO 0.00 0.28 0.00 0.00 -1.61 0.00 0.00 178.31 176.98 1r38 n ALA 241 N -2.44 2.32 -2.29 2.45 0.00 -1.21 -4.76 120.51 114.58 1r38 n ALA 241 Ca -0.02 -1.01 -0.42 0.00 0.00 0.00 0.00 53.44 51.99 1r38 n ALA 241 Cb 0.35 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.18 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 -1.10 3.13 0.25 0.00 5.04 -1.11 -4.93 115.29 116.56 1r38 s HIS 242 Ca 0.28 1.01 -0.03 0.00 -1.54 0.00 0.00 55.06 54.78 1r38 s HIS 242 Cb 0.16 -3.58 0.47 0.00 0.04 0.00 0.00 32.58 29.67 1r38 s HIS 242 CO 0.21 -2.02 1.77 -0.44 -2.34 0.00 0.00 174.74 171.93 1r38 h ASP 243 N 7.30 0.53 -0.22 9.88 3.32 -1.92 -0.09 116.42 135.22 1r38 h ASP 243 Ca -0.39 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1r38 h ASP 243 Cb 1.19 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 1r38 h ASP 243 CO 0.87 0.25 0.14 0.74 -1.72 0.00 0.00 179.24 179.52 1r38 h THR 244 N 0.64 1.06 -0.62 0.35 2.02 -1.95 0.24 112.91 114.66 1r38 h THR 244 Ca 0.43 -0.13 -0.08 0.00 0.77 0.00 0.00 66.41 67.41 1r38 h THR 244 Cb 0.55 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1r38 h THR 244 CO -0.33 0.06 0.09 0.40 0.37 0.00 0.00 175.52 176.11 1r38 h ILE 245 N 0.29 1.26 -0.65 3.11 1.08 -1.69 -2.41 117.51 118.49 1r38 h ILE 245 Ca 0.08 -1.03 -0.08 0.00 -0.39 0.00 0.00 64.86 63.43 1r38 h ILE 245 Cb -0.02 0.72 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 1r38 h ILE 245 CO -0.02 0.38 0.08 0.11 -0.69 0.00 0.00 178.15 178.02 1r38 h LYS 246 N 0.94 1.08 -0.52 2.37 1.57 -0.74 0.08 116.57 121.35 1r38 h LYS 246 Ca 0.19 -0.30 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1r38 h LYS 246 Cb 0.45 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1r38 h LYS 246 CO 0.01 1.00 0.08 0.00 -0.57 0.00 0.00 179.45 179.98 1r38 h ALA 247 N 1.07 0.69 -0.35 3.86 0.00 -0.86 0.24 119.26 123.90 1r38 h ALA 247 Ca 0.19 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1r38 h ALA 247 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1r38 h ALA 247 CO 0.02 0.43 -0.23 0.82 0.00 0.00 0.00 179.25 180.28 1r38 h ILE 248 N 0.74 1.27 -0.21 0.00 2.04 -1.23 -0.29 117.51 119.83 1r38 h ILE 248 Ca 0.16 -1.33 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 1r38 h ILE 248 Cb 0.41 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 1r38 h ILE 248 CO 0.01 0.44 0.03 0.00 0.00 0.00 0.00 178.15 178.62 1r38 h ALA 249 N 1.13 0.28 -0.20 1.87 0.00 -0.46 -2.94 119.26 118.94 1r38 h ALA 249 Ca 0.09 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1r38 h ALA 249 Cb 0.72 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1r38 h ALA 249 CO 0.06 -0.03 0.10 0.00 0.00 0.00 0.00 179.25 179.37 1r38 h ALA 250 N 0.83 0.24 -0.90 0.00 0.00 -0.30 0.16 119.26 119.29 1r38 h ALA 250 Ca 0.06 0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.22 1r38 h ALA 250 Cb 0.34 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 17.95 1r38 h ALA 250 CO 0.01 -0.32 0.30 -0.22 0.00 0.00 0.00 179.25 179.02 1r38 h LYS 251 N 0.21 0.24 -0.27 0.00 3.64 -0.93 0.12 116.57 119.59 1r38 h LYS 251 Ca 0.08 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1r38 h LYS 251 Cb 0.02 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1r38 h LYS 251 CO -0.06 0.16 0.00 0.66 -2.27 0.00 0.00 179.45 177.94 1r38 n TYR 252 N -5.18 0.34 -3.45 1.91 4.01 -1.05 -4.96 117.16 108.78 1r38 n TYR 252 Ca 0.23 -0.18 -0.18 0.00 -0.16 0.00 0.00 57.90 57.61 1r38 n TYR 252 Cb 0.72 -0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.84 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 1.39 -2.69 -4.44 7.72 4.05 0.43 -5.02 115.26 116.71 1r38 n ASN 253 Ca 0.17 -0.60 -0.21 0.00 0.45 0.00 0.00 54.58 54.38 1r38 n ASN 253 Cb 0.59 -5.09 -0.11 0.00 1.23 0.00 0.00 39.78 36.40 1r38 n ASN 253 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1r38 s LYS 254 N -5.49 1.61 0.44 1.20 3.01 0.41 -5.02 119.74 115.90 1r38 s LYS 254 Ca 0.09 -1.87 -0.10 0.00 -1.01 0.00 0.00 55.97 53.08 1r38 s LYS 254 Cb -0.04 -0.91 -0.06 0.00 -1.01 0.00 0.00 37.83 35.82 1r38 s LYS 254 CO 0.73 -0.14 0.81 0.95 0.51 0.00 0.00 175.35 178.20 1r38 s THR 255 N -3.25 4.79 0.36 2.17 -4.23 -1.26 -4.23 115.64 109.99 1r38 s THR 255 Ca 0.34 0.58 0.04 0.00 -1.18 0.00 0.00 61.69 61.47 1r38 s THR 255 Cb 0.08 -3.77 0.27 0.00 1.34 0.00 0.00 72.50 70.42 1r38 s THR 255 CO 0.14 -0.65 2.00 -0.65 -0.54 0.00 0.00 174.62 174.91 1r38 h PRO 256 N 0.88 0.79 -0.52 3.99 0.11 -1.90 -1.87 132.00 133.49 1r38 h PRO 256 Ca -0.47 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1r38 h PRO 256 Cb 1.19 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 1r38 h PRO 256 CO 0.63 0.52 0.32 0.00 -0.21 0.00 0.00 178.00 179.26 1r38 h ALA 257 N 1.61 0.66 -0.70 -0.75 0.00 -1.94 0.26 119.26 118.40 1r38 h ALA 257 Ca 0.26 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1r38 h ALA 257 Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1r38 h ALA 257 CO -0.07 0.04 0.33 0.93 0.00 0.00 0.00 179.25 180.49 1r38 h GLU 258 N 0.64 0.99 -0.35 0.00 5.08 -1.72 -0.93 114.58 118.29 1r38 h GLU 258 Ca 0.20 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 1r38 h GLU 258 Cb -0.01 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1r38 h GLU 258 CO -0.08 0.77 -0.09 0.28 -1.00 0.00 0.00 179.01 178.89 1r38 h VAL 259 N 0.99 1.28 -0.80 3.13 2.07 -0.90 0.12 116.25 122.13 1r38 h VAL 259 Ca 0.24 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 1r38 h VAL 259 Cb 0.10 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1r38 h VAL 259 CO -0.03 0.38 0.48 -0.07 0.02 0.00 0.00 177.57 178.35 1r38 h LEU 260 N 0.48 0.96 0.19 2.57 3.38 -0.38 -0.10 115.31 122.40 1r38 h LEU 260 Ca 0.09 -0.06 -0.31 0.00 0.09 0.00 0.00 57.88 57.69 1r38 h LEU 260 Cb 0.60 -0.24 0.03 0.00 0.09 0.00 0.00 40.66 41.13 1r38 h LEU 260 CO 0.04 0.74 -1.37 -0.07 0.09 0.00 0.00 178.44 177.87 1r38 h LEU 261 N 1.10 0.70 -0.76 1.67 3.38 -1.03 -3.31 115.31 117.07 1r38 h LEU 261 Ca 0.29 -0.73 -0.10 0.00 0.09 0.00 0.00 57.88 57.43 1r38 h LEU 261 Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1r38 h LEU 261 CO -0.05 1.57 -0.12 -0.09 0.09 0.00 0.00 178.44 179.84 1r38 h ARG 262 N 0.14 0.82 -1.02 1.13 9.65 -0.53 -1.30 114.38 123.26 1r38 h ARG 262 Ca -0.20 -0.28 0.27 0.00 -1.10 0.00 0.00 59.98 58.67 1r38 h ARG 262 Cb 2.07 -0.06 -0.13 0.00 -1.39 0.00 0.00 29.97 30.46 1r38 h ARG 262 CO 0.25 0.90 0.61 2.35 2.80 0.00 0.00 179.97 186.87 1r38 h TRP 263 N 0.74 0.93 0.00 2.20 7.01 -1.10 0.13 115.95 125.86 1r38 h TRP 263 Ca 0.12 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.13 1r38 h TRP 263 Cb 0.61 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 27.41 1r38 h TRP 263 CO 0.03 -0.00 -0.19 0.00 -2.79 0.00 0.00 178.44 175.49 1r38 h ALA 264 N 1.74 0.03 -0.83 2.65 0.00 -1.58 -3.37 119.26 117.89 1r38 h ALA 264 Ca 0.67 -0.38 0.18 0.00 0.00 0.00 0.00 54.91 55.38 1r38 h ALA 264 Cb 1.42 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 19.23 1r38 h ALA 264 CO -0.48 0.13 0.33 0.00 0.00 0.00 0.00 179.25 179.23 1r38 h ALA 265 N -0.54 1.24 0.00 0.00 0.00 -0.62 0.35 119.26 119.68 1r38 h ALA 265 Ca -0.04 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1r38 h ALA 265 Cb 0.59 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1r38 h ALA 265 CO -0.02 -0.28 -0.02 0.37 0.00 0.00 0.00 179.25 179.30 1r38 h GLN 266 N 0.41 0.00 -0.64 0.00 4.15 -0.95 -1.93 115.11 116.15 1r38 h GLN 266 Ca 0.49 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.91 1r38 h GLN 266 Cb 0.86 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.55 1r38 h GLN 266 CO -0.48 0.02 0.00 0.54 -1.93 0.00 0.00 178.83 176.97 1r38 n ARG 267 N -3.18 3.93 -1.03 1.69 1.74 0.09 -4.90 116.66 115.00 1r38 n ARG 267 Ca -0.01 -2.58 -0.01 0.00 -0.77 0.00 0.00 57.85 54.47 1r38 n ARG 267 Cb 0.18 -2.02 -0.00 0.00 -1.02 0.00 0.00 32.46 29.60 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 0.73 0.50 3.73 -0.13 0.00 -0.73 -5.03 105.19 104.27 1r38 n GLY 268 Ca 0.23 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.99 5.30 0.45 -0.61 1.01 -1.08 -4.65 121.20 119.63 1r38 s ILE 269 Ca 0.00 0.56 -0.21 0.00 0.00 0.00 0.00 60.65 61.00 1r38 s ILE 269 Cb 0.00 -3.64 -0.09 0.00 0.01 0.00 0.00 42.46 38.74 1r38 s ILE 269 CO 0.00 0.39 1.03 0.00 0.00 0.00 0.00 174.94 176.35 1r38 s ALA 270 N 0.45 2.95 0.18 9.38 0.00 -0.27 -3.63 121.76 130.83 1r38 s ALA 270 Ca 0.17 0.60 0.08 0.00 0.00 0.00 0.00 51.96 52.80 1r38 s ALA 270 Cb -0.13 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1r38 s ALA 270 CO 0.04 -0.21 -0.16 0.14 0.00 0.00 0.00 175.76 175.56 1r38 s VAL 271 N -1.93 1.77 -0.39 0.00 -7.23 0.01 -0.92 120.40 111.70 1r38 s VAL 271 Ca 0.64 -2.03 0.10 0.00 -1.81 0.00 0.00 61.98 58.88 1r38 s VAL 271 Cb -0.16 -1.91 0.34 0.00 0.56 0.00 0.00 36.38 35.20 1r38 s VAL 271 CO 0.21 -0.44 0.81 2.30 -0.31 0.00 0.00 175.10 177.67 1r38 n ILE 272 N 0.02 -0.15 -1.69 -0.62 -5.35 -1.26 -0.83 119.36 109.47 1r38 n ILE 272 Ca -0.11 -3.85 -0.43 0.00 -0.27 0.00 0.00 62.75 58.09 1r38 n ILE 272 Cb 0.58 0.09 -0.01 0.00 -1.74 0.00 0.00 39.64 38.57 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 0.35 2.10 -4.68 6.28 -0.04 -1.22 -2.49 135.00 135.29 1r38 n PRO 273 Ca 0.20 0.74 -0.34 0.00 -0.04 0.00 0.00 63.50 64.06 1r38 n PRO 273 Cb 0.66 -2.31 -0.12 0.00 -0.04 0.00 0.00 33.50 31.70 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 -1.86 2.71 -0.20 0.54 2.36 -1.26 -1.71 119.74 120.32 1r38 s LYS 274 Ca 0.56 -0.58 -0.15 0.00 -2.55 0.00 0.00 55.97 53.24 1r38 s LYS 274 Cb -0.57 -2.55 0.06 0.00 -1.05 0.00 0.00 37.83 33.71 1r38 s LYS 274 CO 0.62 0.65 0.50 0.45 1.55 0.00 0.00 175.35 179.12 1r38 s SER 275 N -0.77 -0.58 0.00 1.43 0.15 -1.26 -4.97 113.70 107.69 1r38 s SER 275 Ca 0.12 1.05 0.26 0.00 0.70 0.00 0.00 55.95 58.08 1r38 s SER 275 Cb -0.11 1.01 0.69 0.00 -1.71 0.00 0.00 66.02 65.89 1r38 s SER 275 CO 0.01 -0.19 1.54 0.59 1.20 0.00 0.00 173.24 176.39 1r38 n ASN 276 N 3.43 0.39 -4.53 5.45 5.03 -1.26 -4.83 115.26 118.94 1r38 n ASN 276 Ca -0.17 -0.08 -0.41 0.00 0.87 0.00 0.00 54.58 54.79 1r38 n ASN 276 Cb 0.56 0.07 -0.10 0.00 -1.02 0.00 0.00 39.78 39.29 1r38 n ASN 276 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1r38 s LEU 277 N -2.99 4.57 0.30 3.41 2.96 -1.26 -4.99 118.68 120.68 1r38 s LEU 277 Ca 0.12 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.64 1r38 s LEU 277 Cb 0.18 -2.18 0.79 0.00 0.50 0.00 0.00 46.19 45.48 1r38 s LEU 277 CO 0.66 -0.28 1.65 -0.65 -1.32 0.00 0.00 176.35 176.41 1r38 h PRO 278 N 8.50 0.21 0.00 0.98 0.11 -2.00 -0.13 132.00 139.68 1r38 h PRO 278 Ca -0.31 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1r38 h PRO 278 Cb 1.15 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1r38 h PRO 278 CO 0.65 0.14 0.00 1.05 -0.21 0.00 0.00 178.00 179.64 1r38 h GLU 279 N 0.22 0.00 0.00 1.05 4.11 -2.00 -2.55 114.58 115.41 1r38 h GLU 279 Ca 0.59 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.02 1r38 h GLU 279 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1r38 h GLU 279 CO -0.66 0.00 -0.21 0.00 0.07 0.00 0.00 179.01 178.21 1r38 h ARG 280 N 0.00 0.00 0.18 1.06 3.08 -1.43 -3.37 114.38 113.91 1r38 h ARG 280 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1r38 h ARG 280 Cb 0.38 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1r38 h ARG 280 CO 0.00 0.00 -0.48 -0.07 -1.07 0.00 0.00 179.97 178.35 1r38 h LEU 281 N 0.00 -1.42 -0.30 3.04 3.38 -1.46 0.21 115.31 118.75 1r38 h LEU 281 Ca 0.00 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1r38 h LEU 281 Cb 0.88 0.51 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 1r38 h LEU 281 CO 0.00 -0.53 0.16 0.58 0.09 0.00 0.00 178.44 178.74 1r38 h VAL 282 N -0.74 1.14 -0.62 1.22 2.07 -1.76 -2.93 116.25 114.63 1r38 h VAL 282 Ca -0.02 -0.37 0.10 0.00 0.82 0.00 0.00 66.70 67.23 1r38 h VAL 282 Cb 0.71 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.24 1r38 h VAL 282 CO -0.22 0.14 0.22 1.56 0.02 0.00 0.00 177.57 179.29 1r38 h GLN 283 N 0.36 0.38 0.00 1.57 4.20 -1.67 -1.52 115.11 118.44 1r38 h GLN 283 Ca 0.11 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1r38 h GLN 283 Cb 0.08 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1r38 h GLN 283 CO -0.02 0.25 0.00 0.09 -0.67 0.00 0.00 178.83 178.49 1r38 n ASN 284 N -5.01 0.00 0.00 1.46 3.02 0.72 -2.97 115.26 112.48 1r38 n ASN 284 Ca 0.09 -0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 1r38 n ASN 284 Cb 0.29 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 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 -1.13 1.17 -0.28 3.52 -4.01 -0.64 -4.78 116.66 110.52 1r38 n ARG 285 Ca 0.11 -0.89 0.08 0.00 -1.04 0.00 0.00 57.85 56.11 1r38 n ARG 285 Cb 0.09 -0.80 0.18 0.00 -3.04 0.00 0.00 32.46 28.89 1r38 n ARG 285 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1r38 n SER 286 N -0.22 2.61 -0.00 2.89 7.64 -0.80 -4.75 113.62 120.99 1r38 n SER 286 Ca 0.00 -3.24 0.14 0.00 1.01 0.00 0.00 58.87 56.79 1r38 n SER 286 Cb 0.28 -0.48 0.69 0.00 -1.01 0.00 0.00 64.21 63.69 1r38 n SER 286 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1r38 n PHE 287 N -1.17 0.00 -1.62 1.43 1.16 -1.25 -4.46 117.46 111.54 1r38 n PHE 287 Ca 0.19 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.36 1r38 n PHE 287 Cb 0.73 -0.37 -0.01 0.00 -1.61 0.00 0.00 39.48 38.21 1r38 n PHE 287 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 1r38 n ASN 288 N -1.37 6.79 -0.13 5.98 3.02 -1.26 -4.27 115.26 124.02 1r38 n ASN 288 Ca 0.11 -2.78 0.04 0.00 -0.03 0.00 0.00 54.58 51.92 1r38 n ASN 288 Cb 0.28 -1.56 0.05 0.00 -0.61 0.00 0.00 39.78 37.95 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 3.81 0.98 -3.57 3.41 -2.24 -1.26 -5.06 114.28 110.34 1r38 n THR 289 Ca 0.65 -1.12 -0.08 0.00 -2.27 0.00 0.00 64.05 61.22 1r38 n THR 289 Cb 0.30 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 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 -1.36 -0.34 -0.05 4.78 -0.71 -1.26 -5.16 117.98 113.88 1r38 s PHE 290 Ca 0.12 0.11 0.06 0.00 -1.04 0.00 0.00 56.93 56.18 1r38 s PHE 290 Cb 0.11 0.59 -0.01 0.00 -1.21 0.00 0.00 43.02 42.49 1r38 s PHE 290 CO 0.01 -0.77 -0.24 -0.51 -1.34 0.00 0.00 175.22 172.37 1r38 s ASP 291 N -2.70 2.99 0.37 1.98 1.01 -1.26 -5.08 116.67 113.98 1r38 s ASP 291 Ca 0.06 -0.50 -0.23 0.00 0.71 0.00 0.00 52.55 52.60 1r38 s ASP 291 Cb -0.02 -0.79 -0.10 0.00 1.01 0.00 0.00 42.92 43.02 1r38 s ASP 291 CO -0.06 0.24 0.92 -0.76 0.21 0.00 0.00 175.17 175.72 1r38 s LEU 292 N -0.18 4.14 0.56 1.23 1.43 -1.26 -5.06 118.68 119.54 1r38 s LEU 292 Ca -0.03 1.71 0.02 0.00 -1.03 0.00 0.00 54.13 54.80 1r38 s LEU 292 Cb -0.13 -4.23 0.05 0.00 0.03 0.00 0.00 46.19 41.90 1r38 s LEU 292 CO 0.03 -0.20 0.79 0.42 0.23 0.00 0.00 176.35 177.62 1r38 s THR 293 N -1.89 2.60 0.25 5.49 -4.23 -1.26 -4.92 115.64 111.68 1r38 s THR 293 Ca 0.55 -0.70 -0.05 0.00 -1.18 0.00 0.00 61.69 60.31 1r38 s THR 293 Cb -0.14 -2.90 0.26 0.00 1.34 0.00 0.00 72.50 71.06 1r38 s THR 293 CO 0.18 0.00 1.93 0.50 -0.54 0.00 0.00 174.62 176.69 1r38 h LYS 294 N 0.04 1.30 -0.84 3.99 3.64 -1.99 -0.70 116.57 122.02 1r38 h LYS 294 Ca -0.41 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1r38 h LYS 294 Cb 1.29 -0.29 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 1r38 h LYS 294 CO 0.49 0.86 0.42 0.93 -2.27 0.00 0.00 179.45 179.88 1r38 h GLU 295 N 1.34 1.20 -0.09 1.90 3.07 -1.98 0.78 114.58 120.79 1r38 h GLU 295 Ca 0.38 -0.16 0.02 0.00 -0.50 0.00 0.00 59.36 59.09 1r38 h GLU 295 Cb -0.12 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.55 1r38 h GLU 295 CO -0.09 0.91 -0.04 -0.44 -1.40 0.00 0.00 179.01 177.94 1r38 h ASP 296 N 1.19 -0.14 -0.59 1.42 3.32 -1.55 -0.34 116.42 119.72 1r38 h ASP 296 Ca 0.29 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 1r38 h ASP 296 Cb 0.09 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1r38 h ASP 296 CO -0.04 -0.06 0.34 -0.26 -1.72 0.00 0.00 179.24 177.50 1r38 h PHE 297 N -0.04 0.81 -0.26 4.55 0.04 -0.67 -1.38 116.94 119.99 1r38 h PHE 297 Ca 0.05 -0.01 -0.13 0.00 2.80 0.00 0.00 57.97 60.68 1r38 h PHE 297 Cb 0.11 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 1r38 h PHE 297 CO -0.16 0.56 -0.39 0.93 -0.60 0.00 0.00 178.31 178.65 1r38 h GLU 298 N 0.84 0.61 -0.39 1.51 5.08 -0.23 0.35 114.58 122.35 1r38 h GLU 298 Ca 0.22 -0.30 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 1r38 h GLU 298 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1r38 h GLU 298 CO -0.04 0.90 -0.23 0.93 -1.00 0.00 0.00 179.01 179.56 1r38 h GLU 299 N 0.50 0.84 -0.06 2.33 4.39 -0.51 -2.92 114.58 119.16 1r38 h GLU 299 Ca 0.05 -0.39 -0.12 0.00 0.34 0.00 0.00 59.36 59.24 1r38 h GLU 299 Cb 0.89 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.52 1r38 h GLU 299 CO 0.08 1.03 -0.50 0.82 -1.16 0.00 0.00 179.01 179.27 1r38 h ILE 300 N 0.64 1.35 -0.46 3.13 2.04 -1.11 -2.79 117.51 120.31 1r38 h ILE 300 Ca 0.08 -1.74 0.10 0.00 1.00 0.00 0.00 64.86 64.30 1r38 h ILE 300 Cb 0.80 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.73 1r38 h ILE 300 CO 0.07 0.51 0.32 0.00 0.00 0.00 0.00 178.15 179.04 1r38 h ALA 301 N 1.37 2.20 0.00 1.87 0.00 -0.73 0.96 119.26 124.93 1r38 h ALA 301 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1r38 h ALA 301 Cb 0.93 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1r38 h ALA 301 CO 0.07 -0.31 0.00 1.63 0.00 0.00 0.00 179.25 180.64 1r38 n LYS 302 N -4.45 0.09 0.11 0.00 5.02 -1.05 -1.92 118.16 115.96 1r38 n LYS 302 Ca 0.07 0.44 0.12 0.00 -2.02 0.00 0.00 58.31 56.92 1r38 n LYS 302 Cb 0.41 -1.72 0.25 0.00 -0.02 0.00 0.00 35.03 33.95 1r38 n LYS 302 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1r38 h LEU 303 N 0.00 0.00 -8.93 -0.35 3.38 -0.96 -3.45 115.31 105.00 1r38 h LEU 303 Ca 0.00 -0.07 -0.58 0.00 0.09 0.00 0.00 57.88 57.31 1r38 h LEU 303 Cb 0.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1r38 h LEU 303 CO 0.00 0.04 1.39 -0.62 0.09 0.00 0.00 178.44 179.34 1r38 s ASP 304 N -4.76 5.65 0.00 -0.43 2.15 -0.77 -4.22 116.67 114.28 1r38 s ASP 304 Ca 0.07 1.61 0.00 0.00 0.43 0.00 0.00 52.55 54.66 1r38 s ASP 304 Cb 0.11 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.22 1r38 s ASP 304 CO 0.67 -1.85 0.79 2.30 -0.17 0.00 0.00 175.17 176.91 1r38 n ILE 305 N 7.60 0.61 -2.61 4.11 -5.35 -0.80 -4.98 119.36 117.95 1r38 n ILE 305 Ca 0.27 -0.65 -0.16 0.00 -0.27 0.00 0.00 62.75 61.94 1r38 n ILE 305 Cb 0.46 0.73 0.01 0.00 -1.74 0.00 0.00 39.64 39.10 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 -0.31 -0.21 3.57 3.28 0.00 0.21 -4.96 105.19 106.77 1r38 n GLY 306 Ca 0.00 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.70 4.18 -0.20 0.99 2.96 -0.51 -4.96 118.68 116.43 1r38 s LEU 307 Ca 0.14 0.16 -0.06 0.00 -0.22 0.00 0.00 54.13 54.15 1r38 s LEU 307 Cb -0.06 -2.99 -0.03 0.00 0.50 0.00 0.00 46.19 43.62 1r38 s LEU 307 CO 0.17 -0.80 0.02 -0.60 -1.32 0.00 0.00 176.35 173.82 1r38 s ARG 308 N 3.16 3.66 -0.06 1.98 3.52 -1.26 -4.29 118.95 125.65 1r38 s ARG 308 Ca 0.30 -0.50 0.13 0.00 -0.13 0.00 0.00 55.73 55.54 1r38 s ARG 308 Cb -0.13 -3.12 -0.23 0.00 -1.56 0.00 0.00 34.95 29.91 1r38 s ARG 308 CO 0.19 0.01 0.59 1.19 -0.81 0.00 0.00 175.30 176.48 1r38 n PHE 309 N 4.26 0.88 -3.54 5.12 3.72 -1.26 -4.61 117.46 122.03 1r38 n PHE 309 Ca -0.17 0.32 -0.41 0.00 -0.05 0.00 0.00 57.45 57.14 1r38 n PHE 309 Cb 0.52 -1.16 -0.06 0.00 -0.94 0.00 0.00 39.48 37.84 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 -6.02 6.02 -0.19 4.37 2.47 -1.26 -5.02 114.94 115.30 1r38 s ASN 310 Ca -0.05 -2.99 0.01 0.00 0.42 0.00 0.00 52.86 50.25 1r38 s ASN 310 Cb 0.08 -2.01 0.04 0.00 -1.45 0.00 0.00 41.25 37.91 1r38 s ASN 310 CO 0.83 -0.40 -0.10 -0.62 -3.72 0.00 0.00 177.10 173.08 1r38 s ASP 311 N 1.10 3.27 0.45 -4.21 -1.08 -1.26 -4.99 116.67 109.96 1r38 s ASP 311 Ca 0.20 -0.83 0.24 0.00 -0.52 0.00 0.00 52.55 51.64 1r38 s ASP 311 Cb -0.14 -1.19 1.31 0.00 -1.46 0.00 0.00 42.92 41.44 1r38 s ASP 311 CO -0.07 -0.14 1.70 -0.65 0.52 0.00 0.00 175.17 176.53 1r38 h PRO 312 N 8.00 0.00 -0.15 4.34 0.11 -1.96 0.16 132.00 142.50 1r38 h PRO 312 Ca -0.28 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 1r38 h PRO 312 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1r38 h PRO 312 CO 0.47 0.00 -0.10 2.35 -0.21 0.00 0.00 178.00 180.51 1r38 h TRP 313 N 0.00 0.24 0.00 0.65 2.91 -1.90 -1.84 115.95 116.01 1r38 h TRP 313 Ca 0.00 -0.02 -0.09 0.00 1.13 0.00 0.00 58.89 59.91 1r38 h TRP 313 Cb 0.34 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.91 1r38 h TRP 313 CO 0.00 0.34 -0.41 -0.44 -1.03 0.00 0.00 178.44 176.90 1r38 h ASP 314 N 0.22 0.00 0.04 2.65 3.32 -1.01 -0.44 116.42 121.21 1r38 h ASP 314 Ca 0.05 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1r38 h ASP 314 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1r38 h ASP 314 CO 0.02 0.41 -0.02 -0.50 -1.72 0.00 0.00 179.24 177.43 1r38 h TRP 315 N 0.00 -0.05 0.00 4.55 6.55 -1.44 -3.43 115.95 122.13 1r38 h TRP 315 Ca -0.00 -0.00 -0.15 0.00 0.95 0.00 0.00 58.89 59.68 1r38 h TRP 315 Cb 0.81 0.02 -0.14 0.00 -0.86 0.00 0.00 29.16 28.99 1r38 h TRP 315 CO 0.00 0.56 -0.27 -3.47 -1.05 0.00 0.00 178.44 174.21 1r38 n ASP 316 N -4.80 -1.25 -3.90 -3.49 2.03 -1.10 -4.99 116.55 99.05 1r38 n ASP 316 Ca -0.09 -2.09 -0.29 0.00 0.52 0.00 0.00 54.79 52.84 1r38 n ASP 316 Cb 0.31 0.52 0.02 0.00 -0.72 0.00 0.00 41.12 41.26 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 -0.91 -4.17 -4.68 1.67 5.03 -0.17 -4.92 115.26 107.11 1r38 n ASN 317 Ca -0.22 -0.80 -0.43 0.00 0.87 0.00 0.00 54.58 54.01 1r38 n ASN 317 Cb 0.80 -3.84 -0.02 0.00 -1.02 0.00 0.00 39.78 35.69 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 -3.37 4.43 0.00 2.41 1.01 -1.15 -4.90 121.20 119.63 1r38 s ILE 318 Ca 0.57 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.95 1r38 s ILE 318 Cb -0.28 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.07 1r38 s ILE 318 CO 0.83 -0.05 1.76 -0.81 0.00 0.00 0.00 174.94 176.67 1r38 n PRO 319 N 5.59 0.89 -0.35 2.79 -0.04 -1.26 -3.38 135.00 139.24 1r38 n PRO 319 Ca 0.11 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.54 1r38 n PRO 319 Cb 0.46 -1.05 0.09 0.00 -0.04 0.00 0.00 33.50 32.97 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 1.07 1.26 -0.34 0.52 1.08 -1.94 -3.14 117.51 116.02 1r38 h ILE 320 Ca 0.00 -0.58 -0.14 0.00 -0.39 0.00 0.00 64.86 63.75 1r38 h ILE 320 Cb 0.89 -0.06 -0.08 0.00 -3.07 0.00 0.00 36.82 34.50 1r38 h ILE 320 CO 0.00 0.28 -0.03 0.49 -0.69 0.00 0.00 178.15 178.19 1r38 n PHE 321 N -4.35 1.09 -0.08 1.37 3.72 -1.26 -4.71 117.46 113.24 1r38 n PHE 321 Ca 0.10 -1.41 0.00 0.00 -0.05 0.00 0.00 57.45 56.09 1r38 n PHE 321 Cb 0.06 -0.46 0.00 0.00 -0.94 0.00 0.00 39.48 38.15 1r38 n PHE 321 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04