#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jul h GLU 77 N 0.00 0.07 0.00 -0.52 4.57 -2.04 1.51 114.58 118.16 2jul h GLU 77 Ca 0.00 -0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.10 2jul h GLU 77 Cb 0.00 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 2jul h GLU 77 CO 0.00 0.04 -0.34 0.78 -1.18 0.00 0.00 179.01 178.31 2jul h GLY 78 N 0.07 0.00 0.00 1.92 0.00 -2.05 -2.34 103.07 100.67 2jul h GLY 78 Ca 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.94 2jul h GLY 78 CO -0.81 0.00 -0.00 -2.00 0.00 0.00 0.00 176.54 173.73 2jul h LEU 79 N 0.00 -0.00 -0.90 3.11 7.12 0.17 -2.30 115.31 122.51 2jul h LEU 79 Ca -0.00 0.00 0.25 0.00 0.13 0.00 0.00 57.88 58.25 2jul h LEU 79 Cb 0.68 0.00 -0.14 0.00 -0.53 0.00 0.00 40.66 40.67 2jul h LEU 79 CO 0.04 0.00 0.31 0.44 -0.13 0.00 0.00 178.44 179.10 2jul h ASP 80 N -0.00 0.12 -0.90 1.25 3.32 -1.41 1.17 116.42 119.96 2jul h ASP 80 Ca -0.00 0.19 0.09 0.00 0.02 0.00 0.00 57.03 57.34 2jul h ASP 80 Cb 0.00 0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.71 2jul h ASP 80 CO 0.00 -0.14 0.55 -0.61 -1.72 0.00 0.00 179.24 177.32 2jul h GLN 81 N 0.25 0.90 -0.84 3.56 4.15 -1.50 0.14 115.11 121.76 2jul h GLN 81 Ca 0.58 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 60.04 2jul h GLN 81 Cb 1.20 -0.20 -0.06 0.00 0.21 0.00 0.00 27.48 28.63 2jul h GLN 81 CO -0.63 0.59 0.55 1.25 -1.93 0.00 0.00 178.83 178.66 2jul h LEU 82 N 0.93 0.75 -0.19 -2.39 7.12 0.20 -1.32 115.31 120.40 2jul h LEU 82 Ca 0.43 0.02 0.01 0.00 0.13 0.00 0.00 57.88 58.47 2jul h LEU 82 Cb 0.35 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.32 2jul h LEU 82 CO -0.23 0.46 0.09 -0.61 -0.13 0.00 0.00 178.44 178.02 2jul h GLN 83 N 0.84 0.19 0.18 1.25 4.15 -0.20 -1.30 115.11 120.23 2jul h GLN 83 Ca 0.38 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.79 2jul h GLN 83 Cb 0.37 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 2jul h GLN 83 CO -0.15 0.13 -0.20 0.00 -1.93 0.00 0.00 178.83 176.68 2jul h ALA 84 N 1.10 -0.39 -1.52 3.38 0.00 -0.96 -3.28 119.26 117.59 2jul h ALA 84 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2jul h ALA 84 Cb 0.02 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2jul h ALA 84 CO -0.05 -0.75 0.00 1.04 0.00 0.00 0.00 179.25 179.49 2jul n GLN 85 N -5.32 0.00 0.00 0.00 6.02 -0.83 -4.72 117.38 112.53 2jul n GLN 85 Ca -0.08 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 2jul n GLN 85 Cb 0.24 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.25 2jul n GLN 85 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2jul n THR 86 N -1.47 0.00 -2.59 5.09 5.66 -0.51 -4.99 114.28 115.47 2jul n THR 86 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 2jul n THR 86 Cb 0.00 -0.67 0.02 0.00 -1.55 0.00 0.00 70.33 68.13 2jul n THR 86 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 2jul n LYS 87 N -1.45 2.02 -5.01 1.09 2.85 -1.26 -4.81 118.16 111.60 2jul n LYS 87 Ca 0.00 -3.72 -0.32 0.00 -1.05 0.00 0.00 58.31 53.22 2jul n LYS 87 Cb 0.00 -1.63 -0.16 0.00 -0.65 0.00 0.00 35.03 32.59 2jul n LYS 87 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2jul s PHE 88 N -3.32 2.68 0.20 5.58 0.40 -1.26 -5.08 117.98 117.18 2jul s PHE 88 Ca 0.35 -0.84 -0.32 0.00 -0.60 0.00 0.00 56.93 55.52 2jul s PHE 88 Cb 0.43 -1.77 -0.14 0.00 0.51 0.00 0.00 43.02 42.05 2jul s PHE 88 CO -0.04 -0.31 1.42 2.41 0.70 0.00 0.00 175.22 179.40 2jul n THR 89 N 3.49 0.64 -0.65 0.64 -1.04 -1.26 -4.39 114.28 111.71 2jul n THR 89 Ca -0.19 -0.16 0.50 0.00 -2.04 0.00 0.00 64.05 62.17 2jul n THR 89 Cb 0.53 -1.37 0.79 0.00 -1.82 0.00 0.00 70.33 68.46 2jul n THR 89 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 2jul h LYS 90 N 4.56 0.00 0.37 -2.82 2.10 -1.96 1.60 116.57 120.43 2jul h LYS 90 Ca -0.45 -0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.18 2jul h LYS 90 Cb 1.28 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 2jul h LYS 90 CO 0.78 0.00 -0.18 0.87 -2.00 0.00 0.00 179.45 178.93 2jul h LYS 91 N 0.00 -0.48 -0.23 0.07 1.57 -2.00 -0.46 116.57 115.04 2jul h LYS 91 Ca 0.92 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.72 2jul h LYS 91 Cb 3.53 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 35.94 2jul h LYS 91 CO -0.12 -0.32 0.09 0.93 -0.57 0.00 0.00 179.45 179.46 2jul h GLU 92 N -0.89 0.31 -0.46 3.15 4.39 -0.92 -1.52 114.58 118.64 2jul h GLU 92 Ca -0.05 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 2jul h GLU 92 Cb 0.39 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2jul h GLU 92 CO 0.08 0.27 0.26 1.25 -1.16 0.00 0.00 179.01 179.71 2jul h LEU 93 N 0.31 0.58 -1.08 1.33 6.46 0.22 -1.58 115.31 121.55 2jul h LEU 93 Ca 0.08 -0.09 0.10 0.00 -0.12 0.00 0.00 57.88 57.86 2jul h LEU 93 Cb 0.08 -0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 39.79 2jul h LEU 93 CO -0.01 0.50 0.62 -0.61 -0.62 0.00 0.00 178.44 178.32 2jul h GLN 94 N 0.61 0.96 -0.18 1.25 4.15 -0.03 -0.07 115.11 121.81 2jul h GLN 94 Ca 0.16 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.57 2jul h GLN 94 Cb 0.05 -0.22 -0.05 0.00 0.21 0.00 0.00 27.48 27.47 2jul h GLN 94 CO -0.03 0.64 -0.14 1.03 -1.93 0.00 0.00 178.83 178.40 2jul h SER 95 N 0.99 -0.46 -0.45 -0.69 0.87 -0.98 2.18 113.55 115.02 2jul h SER 95 Ca 0.46 0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 61.11 2jul h SER 95 Cb 0.40 0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.57 2jul h SER 95 CO -0.22 -0.18 0.28 -0.07 -0.53 0.00 0.00 176.83 176.11 2jul h LEU 96 N -0.15 0.54 -0.88 2.23 3.38 -0.88 -0.11 115.31 119.43 2jul h LEU 96 Ca 0.11 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2jul h LEU 96 Cb 0.32 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2jul h LEU 96 CO -0.27 0.43 0.06 0.22 0.09 0.00 0.00 178.44 178.96 2jul h TYR 97 N 0.60 0.94 -0.50 1.13 5.03 -0.09 -2.60 116.97 121.48 2jul h TYR 97 Ca 0.16 -0.12 -0.01 0.00 2.58 0.00 0.00 58.73 61.34 2jul h TYR 97 Cb -0.02 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 37.98 2jul h TYR 97 CO -0.03 0.83 0.29 -0.09 -1.32 0.00 0.00 178.16 177.83 2jul h ARG 98 N 0.84 0.69 -0.75 1.82 1.12 0.43 -1.69 114.38 116.84 2jul h ARG 98 Ca 0.17 -0.07 0.11 0.00 -1.11 0.00 0.00 59.98 59.07 2jul h ARG 98 Cb 0.41 -0.14 -0.08 0.00 -0.01 0.00 0.00 29.97 30.16 2jul h ARG 98 CO 0.01 0.52 0.38 0.78 -3.11 0.00 0.00 179.97 178.54 2jul h GLY 99 N 0.67 1.14 0.97 2.80 0.00 -0.67 0.53 103.07 108.51 2jul h GLY 99 Ca 0.18 -0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.29 2jul h GLY 99 CO -0.03 0.04 0.54 -2.75 0.00 0.00 0.00 176.54 174.34 2jul h PHE 100 N 0.61 1.03 -0.34 5.60 3.57 -1.07 -1.72 116.94 124.62 2jul h PHE 100 Ca 0.38 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.77 2jul h PHE 100 Cb 0.43 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2jul h PHE 100 CO -0.11 0.63 -0.34 -0.22 -2.23 0.00 0.00 178.31 176.05 2jul h LYS 101 N 1.09 0.75 -0.37 1.11 3.64 -0.03 -2.72 116.57 120.06 2jul h LYS 101 Ca 0.31 -0.36 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2jul h LYS 101 Cb -0.09 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2jul h LYS 101 CO -0.08 0.98 0.25 -0.97 -2.27 0.00 0.00 179.45 177.36 2jul h ASN 102 N 0.63 0.26 -3.18 4.20 -1.24 0.80 -3.40 115.58 113.64 2jul h ASN 102 Ca 0.06 -0.00 -0.54 0.00 0.71 0.00 0.00 56.30 56.53 2jul h ASN 102 Cb 0.87 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 2jul h ASN 102 CO 0.08 0.18 0.59 -1.61 -1.29 0.00 0.00 177.43 175.37 2jul s GLU 103 N -5.30 4.42 0.21 6.67 2.02 -0.78 -4.93 118.70 121.02 2jul s GLU 103 Ca -0.07 1.67 -0.19 0.00 0.02 0.00 0.00 54.97 56.40 2jul s GLU 103 Cb 0.18 -3.45 0.19 0.00 0.10 0.00 0.00 34.13 31.15 2jul s GLU 103 CO 0.72 -0.31 1.56 0.00 0.02 0.00 0.00 175.26 177.26 2jul n PRO 105 N -5.45 2.41 -2.76 0.00 -0.01 -1.26 -5.00 135.00 122.92 2jul n PRO 105 Ca 0.08 0.85 -0.07 0.00 -0.01 0.00 0.00 63.50 64.35 2jul n PRO 105 Cb 0.38 -2.60 -0.03 0.00 -0.01 0.00 0.00 33.50 31.24 2jul n PRO 105 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 175.50 177.90 2jul n THR 106 N 0.12 0.00 0.00 3.45 -1.04 -1.26 -4.85 114.28 110.70 2jul n THR 106 Ca 0.03 -0.82 0.00 0.00 -2.04 0.00 0.00 64.05 61.22 2jul n THR 106 Cb 0.40 0.41 0.00 0.00 -1.82 0.00 0.00 70.33 69.31 2jul n THR 106 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jul n GLY 107 N -0.14 0.17 3.15 3.41 0.00 -1.26 -4.60 105.19 105.92 2jul n GLY 107 Ca 0.02 0.08 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 2jul n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jul s LEU 108 N 0.00 2.49 -0.09 0.99 1.43 -1.26 -4.76 118.68 117.47 2jul s LEU 108 Ca 0.00 -0.96 -0.02 0.00 -1.03 0.00 0.00 54.13 52.12 2jul s LEU 108 Cb 0.00 -0.05 -0.03 0.00 0.03 0.00 0.00 46.19 46.14 2jul s LEU 108 CO 0.00 -0.46 -0.01 0.54 0.23 0.00 0.00 176.35 176.65 2jul s VAL 109 N -3.45 4.18 0.25 -1.59 0.11 -0.72 -4.99 120.40 114.18 2jul s VAL 109 Ca 0.09 -0.29 0.07 0.00 -2.93 0.00 0.00 61.98 58.92 2jul s VAL 109 Cb 0.04 -2.76 -0.04 0.00 -1.53 0.00 0.00 36.38 32.10 2jul s VAL 109 CO -0.05 0.59 0.18 -0.62 -3.33 0.00 0.00 175.10 171.87 2jul s ASP 110 N -0.71 5.45 0.58 3.54 -1.08 -1.26 -2.58 116.67 120.60 2jul s ASP 110 Ca 0.11 -0.28 0.29 0.00 -0.52 0.00 0.00 52.55 52.15 2jul s ASP 110 Cb -0.12 -1.36 1.50 0.00 -1.46 0.00 0.00 42.92 41.48 2jul s ASP 110 CO 0.02 -0.03 1.94 -0.08 0.52 0.00 0.00 175.17 177.54 2jul h GLU 111 N 1.56 0.00 -0.68 4.34 4.81 -2.00 -0.21 114.58 122.40 2jul h GLU 111 Ca -0.48 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.78 2jul h GLU 111 Cb 1.24 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 2jul h GLU 111 CO 0.61 0.00 0.42 0.38 -0.73 0.00 0.00 179.01 179.69 2jul h ASP 112 N 0.00 0.68 -0.56 1.04 3.04 -2.00 -1.73 116.42 116.89 2jul h ASP 112 Ca 0.21 0.00 0.01 0.00 -3.24 0.00 0.00 57.03 54.01 2jul h ASP 112 Cb 1.07 -0.14 -0.03 0.00 -1.04 0.00 0.00 39.33 39.19 2jul h ASP 112 CO -0.00 0.47 0.37 0.74 -2.04 0.00 0.00 179.24 178.78 2jul h THR 113 N 0.81 1.14 -0.47 1.15 2.02 -1.42 -0.96 112.91 115.18 2jul h THR 113 Ca 0.28 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 67.22 2jul h THR 113 Cb 0.05 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 2jul h THR 113 CO -0.12 0.14 0.28 -0.26 0.37 0.00 0.00 175.52 175.93 2jul h PHE 114 N 0.76 0.53 -0.60 3.16 -1.00 -1.42 -1.86 116.94 116.52 2jul h PHE 114 Ca 0.21 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.97 2jul h PHE 114 Cb -0.08 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 39.28 2jul h PHE 114 CO -0.04 0.31 0.25 -0.22 -1.61 0.00 0.00 178.31 177.01 2jul h LYS 115 N 0.57 0.89 -0.76 1.51 3.11 -0.95 -1.95 116.57 118.99 2jul h LYS 115 Ca 0.19 -0.15 0.04 0.00 -2.81 0.00 0.00 60.65 57.92 2jul h LYS 115 Cb 0.00 -0.15 -0.04 0.00 -1.00 0.00 0.00 32.23 31.04 2jul h LYS 115 CO -0.08 0.75 0.50 1.25 -2.81 0.00 0.00 179.45 179.06 2jul h LEU 116 N 0.83 0.77 0.01 5.20 5.85 -0.72 0.77 115.31 128.02 2jul h LEU 116 Ca 0.20 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 2jul h LEU 116 Cb 0.18 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2jul h LEU 116 CO -0.02 0.52 -0.01 0.40 -0.34 0.00 0.00 178.44 178.99 2jul h ILE 117 N 0.89 1.36 0.00 4.05 2.04 -0.89 -1.56 117.51 123.40 2jul h ILE 117 Ca 0.31 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.94 2jul h ILE 117 Cb 0.12 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 2jul h ILE 117 CO -0.10 0.30 -0.34 0.22 0.00 0.00 0.00 178.15 178.23 2jul h TYR 118 N -0.52 0.00 0.00 1.37 5.03 -1.03 -2.69 116.97 119.13 2jul h TYR 118 Ca -0.00 0.00 -0.15 0.00 2.58 0.00 0.00 58.73 61.16 2jul h TYR 118 Cb 0.50 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.76 2jul h TYR 118 CO 0.10 0.34 -0.71 0.66 -1.32 0.00 0.00 178.16 177.23 2jul h SER 119 N 0.00 0.00 0.01 -2.11 4.64 0.60 -3.06 113.55 113.63 2jul h SER 119 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.08 2jul h SER 119 Cb 0.77 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.87 2jul h SER 119 CO 0.04 0.71 -0.87 -0.61 -0.87 0.00 0.00 176.83 175.23 2jul h GLN 120 N 0.00 0.67 0.00 4.77 5.75 -0.97 -3.00 115.11 122.33 2jul h GLN 120 Ca -0.01 -0.62 0.00 0.00 -0.15 0.00 0.00 58.65 57.88 2jul h GLN 120 Cb 1.31 0.15 0.00 0.00 1.07 0.00 0.00 27.48 30.01 2jul h GLN 120 CO 0.09 1.22 0.00 0.34 -2.65 0.00 0.00 178.83 177.83 2jul n PHE 121 N -3.87 0.00 -2.75 3.99 7.35 -1.05 -4.20 117.46 116.92 2jul n PHE 121 Ca -0.08 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.53 2jul n PHE 121 Cb 0.79 0.00 0.05 0.00 0.35 0.00 0.00 39.48 40.68 2jul n PHE 121 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2jul n PHE 122 N -0.81 -3.23 0.57 -5.13 3.72 -1.15 -4.96 117.46 106.46 2jul n PHE 122 Ca 0.14 -1.71 0.05 0.00 -0.05 0.00 0.00 57.45 55.88 2jul n PHE 122 Cb 0.07 1.55 0.27 0.00 -0.94 0.00 0.00 39.48 40.43 2jul n PHE 122 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2jul n PRO 123 N 1.63 0.27 0.00 -1.08 -0.05 -1.14 -4.57 135.00 130.05 2jul n PRO 123 Ca 0.09 0.03 0.00 0.00 -0.05 0.00 0.00 63.50 63.56 2jul n PRO 123 Cb 0.63 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.58 2jul n PRO 123 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2jul n GLN 124 N -1.04 1.73 -1.11 0.54 10.64 -1.26 -4.92 117.38 121.95 2jul n GLN 124 Ca 0.07 0.00 -0.37 0.00 -1.83 0.00 0.00 57.00 54.87 2jul n GLN 124 Cb 0.04 0.00 0.04 0.00 -0.86 0.00 0.00 30.24 29.46 2jul n GLN 124 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jul n GLY 125 N 4.08 -3.41 2.54 2.61 0.00 -1.26 -4.92 105.19 104.83 2jul n GLY 125 Ca 0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 2jul n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jul n ASP 126 N 2.09 -2.71 -0.51 1.61 5.68 -1.26 -4.90 116.55 116.55 2jul n ASP 126 Ca 0.04 -0.84 -0.02 0.00 -0.50 0.00 0.00 54.79 53.47 2jul n ASP 126 Cb 0.52 -0.76 -0.02 0.00 -1.14 0.00 0.00 41.12 39.72 2jul n ASP 126 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jul n ALA 127 N -4.77 1.46 -0.26 2.12 0.00 -1.26 -4.60 120.51 113.20 2jul n ALA 127 Ca -0.15 -0.17 -0.06 0.00 0.00 0.00 0.00 53.44 53.06 2jul n ALA 127 Cb 0.45 -0.12 0.08 0.00 0.00 0.00 0.00 19.45 19.86 2jul n ALA 127 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2jul h THR 128 N 3.12 1.26 0.84 0.00 2.02 -1.97 0.24 112.91 118.41 2jul h THR 128 Ca -0.14 -0.88 -0.04 0.00 0.77 0.00 0.00 66.41 66.12 2jul h THR 128 Cb 0.80 0.43 0.01 0.00 -1.74 0.00 0.00 68.15 67.65 2jul h THR 128 CO -0.07 0.35 -0.41 0.74 0.37 0.00 0.00 175.52 176.50 2jul h THR 129 N 1.09 0.02 0.00 3.16 2.02 -1.98 -1.34 112.91 115.87 2jul h THR 129 Ca 0.24 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 2jul h THR 129 Cb 0.28 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.71 2jul h THR 129 CO -0.01 0.00 -0.04 0.22 0.37 0.00 0.00 175.52 176.06 2jul h TYR 130 N -1.29 0.00 -0.68 3.16 3.20 -1.90 -1.49 116.97 117.96 2jul h TYR 130 Ca -0.12 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.69 2jul h TYR 130 Cb 0.87 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.11 2jul h TYR 130 CO -0.00 0.04 0.19 0.00 -1.64 0.00 0.00 178.16 176.75 2jul h ALA 131 N 1.96 0.90 -0.70 1.82 0.00 -0.24 -1.77 119.26 121.23 2jul h ALA 131 Ca -0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 2jul h ALA 131 Cb 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2jul h ALA 131 CO 0.01 0.60 0.22 1.25 0.00 0.00 0.00 179.25 181.33 2jul h HIS 132 N 1.01 1.13 -0.36 0.00 -0.00 -0.18 -2.71 115.15 114.04 2jul h HIS 132 Ca 0.22 -0.11 -0.00 0.00 -0.00 0.00 0.00 60.37 60.47 2jul h HIS 132 Cb 0.34 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 2jul h HIS 132 CO 0.03 0.90 0.23 0.74 -0.00 0.00 0.00 177.93 179.82 2jul h PHE 133 N 1.03 0.47 -0.63 5.26 -1.00 -1.17 -2.14 116.94 118.77 2jul h PHE 133 Ca 0.23 0.00 0.11 0.00 2.81 0.00 0.00 57.97 61.12 2jul h PHE 133 Cb 0.30 -0.16 -0.08 0.00 3.61 0.00 0.00 35.95 39.62 2jul h PHE 133 CO 0.02 0.33 0.18 -0.07 -1.61 0.00 0.00 178.31 177.16 2jul h LEU 134 N 0.48 0.10 -0.73 1.54 3.38 -1.04 -0.32 115.31 118.71 2jul h LEU 134 Ca 0.13 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 2jul h LEU 134 Cb -0.01 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2jul h LEU 134 CO -0.03 0.05 0.43 0.15 0.09 0.00 0.00 178.44 179.14 2jul h PHE 135 N 0.32 0.98 0.00 1.13 3.04 -1.16 -0.81 116.94 120.45 2jul h PHE 135 Ca 0.33 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.27 2jul h PHE 135 Cb 0.47 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 38.66 2jul h PHE 135 CO -0.22 0.67 -0.00 -0.97 -2.02 0.00 0.00 178.31 175.77 2jul h ASN 136 N 1.01 0.00 0.02 0.41 -1.24 -0.45 -2.21 115.58 113.12 2jul h ASN 136 Ca 0.26 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.24 2jul h ASN 136 Cb -0.01 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.04 2jul h ASN 136 CO -0.05 0.00 -0.14 0.00 -1.29 0.00 0.00 177.43 175.96 2jul h ALA 137 N 2.00 -0.02 0.24 1.57 0.00 -0.20 -3.39 119.26 119.45 2jul h ALA 137 Ca -0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2jul h ALA 137 Cb 0.13 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2jul h ALA 137 CO 0.00 0.06 -0.11 0.74 0.00 0.00 0.00 179.25 179.94 2jul h PHE 138 N -0.89 -0.30 -1.78 0.00 0.04 -1.12 -3.43 116.94 109.47 2jul h PHE 138 Ca -0.02 -0.01 -0.66 0.00 2.80 0.00 0.00 57.97 60.07 2jul h PHE 138 Cb 1.11 0.10 0.06 0.00 2.20 0.00 0.00 35.95 39.41 2jul h PHE 138 CO 0.27 -0.18 0.49 -3.47 -0.60 0.00 0.00 178.31 174.81 2jul n ASP 139 N -3.01 1.82 -0.04 2.17 -0.08 -0.86 -4.91 116.55 111.64 2jul n ASP 139 Ca -0.04 1.12 -0.02 0.00 -1.51 0.00 0.00 54.79 54.33 2jul n ASP 139 Cb 0.13 -1.22 -0.01 0.00 2.34 0.00 0.00 41.12 42.35 2jul n ASP 139 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jul h ALA 140 N 4.66 0.00 -0.55 -1.67 0.00 -1.87 -3.46 119.26 116.36 2jul h ALA 140 Ca -0.47 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.07 2jul h ALA 140 Cb 1.33 0.26 -0.17 0.00 0.00 0.00 0.00 17.79 19.21 2jul h ALA 140 CO 0.79 0.26 -0.28 0.16 0.00 0.00 0.00 179.25 180.18 2jul s ASP 141 N -4.82 -0.82 -0.39 0.00 -4.77 -1.26 -5.10 116.67 99.51 2jul s ASP 141 Ca -0.08 -0.76 0.07 0.00 -3.30 0.00 0.00 52.55 48.48 2jul s ASP 141 Cb 0.01 1.07 0.18 0.00 -1.09 0.00 0.00 42.92 43.08 2jul s ASP 141 CO 0.11 -0.05 0.57 -0.83 0.70 0.00 0.00 175.17 175.67 2jul s GLY 142 N 1.31 -0.97 0.00 2.12 0.00 -1.26 -5.05 107.32 103.47 2jul s GLY 142 Ca 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.92 2jul s GLY 142 CO -0.09 3.45 0.00 -2.01 0.00 0.00 0.00 173.10 174.44 2jul n ASN 143 N 4.43 0.00 -0.18 1.64 5.15 -1.26 -2.51 115.26 122.53 2jul n ASN 143 Ca 0.11 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2jul n ASN 143 Cb 0.54 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.79 2jul n ASN 143 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jul n GLY 144 N 0.00 0.22 3.21 8.20 0.00 -1.26 -5.13 105.19 110.42 2jul n GLY 144 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2jul n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jul s ALA 145 N 0.00 1.91 0.48 4.61 0.00 -1.05 -4.73 121.76 122.98 2jul s ALA 145 Ca 0.00 -0.89 0.09 0.00 0.00 0.00 0.00 51.96 51.16 2jul s ALA 145 Cb 0.00 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.53 2jul s ALA 145 CO 0.00 0.34 0.64 0.96 0.00 0.00 0.00 175.76 177.70 2jul s ILE 146 N 0.01 2.65 0.00 0.00 -4.36 -1.07 -4.85 121.20 113.59 2jul s ILE 146 Ca -0.06 -1.02 0.00 0.00 -0.26 0.00 0.00 60.65 59.31 2jul s ILE 146 Cb -0.14 -2.67 0.00 0.00 1.25 0.00 0.00 42.46 40.90 2jul s ILE 146 CO 0.04 0.00 0.00 0.00 0.24 0.00 0.00 174.94 175.22 2jul n HIS 147 N -1.98 0.00 0.53 1.37 1.44 -1.26 -1.76 115.22 113.55 2jul n HIS 147 Ca 0.11 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.94 2jul n HIS 147 Cb 0.60 0.00 0.25 0.00 0.12 0.00 0.00 29.99 30.96 2jul n HIS 147 CO 0.00 0.00 0.00 0.35 -2.81 0.00 0.00 176.34 173.88 2jul h PHE 148 N 0.39 0.00 0.01 -1.40 3.57 -1.98 -3.25 116.94 114.27 2jul h PHE 148 Ca 0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 2jul h PHE 148 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 2jul h PHE 148 CO 0.00 0.00 -0.00 0.93 -2.23 0.00 0.00 178.31 177.01 2jul h GLU 149 N 0.00 -0.01 -0.20 1.11 5.08 -1.99 -1.40 114.58 117.18 2jul h GLU 149 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2jul h GLU 149 Cb 0.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2jul h GLU 149 CO 0.00 -0.01 0.35 0.22 -1.00 0.00 0.00 179.01 178.57 2jul h ASP 150 N -0.02 0.00 0.50 1.42 1.82 -1.97 0.42 116.42 118.60 2jul h ASP 150 Ca -0.00 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.43 2jul h ASP 150 Cb 0.01 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.01 2jul h ASP 150 CO 0.00 0.00 -0.90 0.15 -1.61 0.00 0.00 179.24 176.88 2jul h PHE 151 N 0.00 0.39 -0.03 0.28 3.57 -1.58 -2.36 116.94 117.22 2jul h PHE 151 Ca 0.09 -0.22 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 2jul h PHE 151 Cb 0.79 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.49 2jul h PHE 151 CO 0.00 1.03 -0.07 0.28 -2.23 0.00 0.00 178.31 177.32 2jul h VAL 152 N 0.15 1.46 -0.54 1.41 2.07 0.98 -2.67 116.25 119.12 2jul h VAL 152 Ca -0.06 -1.47 0.03 0.00 0.82 0.00 0.00 66.70 66.03 2jul h VAL 152 Cb 1.53 2.38 -0.03 0.00 -1.52 0.00 0.00 31.29 33.65 2jul h VAL 152 CO 0.14 0.39 0.36 0.58 0.02 0.00 0.00 177.57 179.06 2jul h VAL 153 N -0.48 1.06 -0.01 2.57 2.07 -1.42 -2.13 116.25 117.92 2jul h VAL 153 Ca -0.00 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2jul h VAL 153 Cb 0.68 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2jul h VAL 153 CO 0.01 0.11 0.00 1.23 0.02 0.00 0.00 177.57 178.95 2jul h GLY 154 N 0.62 0.01 -0.22 2.17 0.00 -1.36 -1.03 103.07 103.26 2jul h GLY 154 Ca 0.21 -0.01 0.22 0.00 0.00 0.00 0.00 47.33 47.76 2jul h GLY 154 CO -0.06 0.01 0.38 1.41 0.00 0.00 0.00 176.54 178.28 2jul h LEU 155 N -0.13 0.30 -0.91 3.11 3.38 -1.03 0.81 115.31 120.84 2jul h LEU 155 Ca 0.00 0.16 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 2jul h LEU 155 Cb 0.15 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2jul h LEU 155 CO -0.00 -0.02 -0.38 0.77 0.09 0.00 0.00 178.44 178.90 2jul h SER 156 N 0.38 0.34 0.54 -0.43 4.64 -1.20 0.14 113.55 117.96 2jul h SER 156 Ca 0.56 -0.14 -0.10 0.00 -0.47 0.00 0.00 61.79 61.65 2jul h SER 156 Cb 1.07 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 2jul h SER 156 CO -0.54 0.69 -0.46 0.40 -0.87 0.00 0.00 176.83 176.05 2jul h ILE 157 N 0.28 1.24 0.11 0.95 2.04 0.18 0.53 117.51 122.84 2jul h ILE 157 Ca 0.03 -1.61 -0.33 0.00 1.00 0.00 0.00 64.86 63.95 2jul h ILE 157 Cb 0.79 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 2jul h ILE 157 CO 0.06 0.45 -1.74 -0.07 0.00 0.00 0.00 178.15 176.85 2jul h LEU 158 N 0.00 0.35 0.00 1.44 4.07 -0.51 -3.42 115.31 117.24 2jul h LEU 158 Ca -0.00 -0.62 0.00 0.00 0.08 0.00 0.00 57.88 57.34 2jul h LEU 158 Cb 0.85 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.48 2jul h LEU 158 CO 0.06 1.54 -0.31 -0.07 -1.08 0.00 0.00 178.44 178.57 2jul h LEU 159 N 0.06 0.00 0.00 1.67 3.38 -0.67 -3.49 115.31 116.26 2jul h LEU 159 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2jul h LEU 159 Cb 2.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.78 2jul h LEU 159 CO 0.12 0.50 0.00 -1.14 0.09 0.00 0.00 178.44 178.01 2jul n ARG 160 N -3.87 1.38 -1.04 1.13 3.00 0.18 -5.04 116.66 112.40 2jul n ARG 160 Ca -0.04 0.00 0.13 0.00 -0.00 0.00 0.00 57.85 57.93 2jul n ARG 160 Cb 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.56 2jul n ARG 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2jul n GLY 161 N 5.00 -2.96 3.99 5.14 0.00 -1.01 -4.57 105.19 110.78 2jul n GLY 161 Ca 0.00 -1.17 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 2jul n GLY 161 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jul s THR 162 N -3.62 2.35 0.55 2.61 -4.23 -1.26 -4.96 115.64 107.08 2jul s THR 162 Ca 0.00 -0.68 0.22 0.00 -1.18 0.00 0.00 61.69 60.04 2jul s THR 162 Cb 0.00 -2.67 0.31 0.00 1.34 0.00 0.00 72.50 71.48 2jul s THR 162 CO 0.00 0.00 2.18 -0.37 -0.54 0.00 0.00 174.62 175.89 2jul h VAL 163 N -0.19 0.80 0.18 2.29 -1.51 -1.99 -2.51 116.25 113.33 2jul h VAL 163 Ca -0.38 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.08 2jul h VAL 163 Cb 1.28 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 2jul h VAL 163 CO 0.45 0.00 -0.09 0.45 -1.23 0.00 0.00 177.57 177.15 2jul h HIS 164 N 0.00 -0.23 -0.45 5.19 3.86 -2.00 -2.27 115.15 119.26 2jul h HIS 164 Ca 0.02 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.33 2jul h HIS 164 Cb 0.08 0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 2jul h HIS 164 CO 0.00 -0.02 0.31 0.93 0.86 0.00 0.00 177.93 180.01 2jul h GLU 165 N -0.40 0.13 0.11 2.45 5.08 -1.83 -1.86 114.58 118.26 2jul h GLU 165 Ca -0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2jul h GLU 165 Cb 0.31 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2jul h GLU 165 CO 0.04 0.08 -0.05 0.87 -1.00 0.00 0.00 179.01 178.95 2jul h LYS 166 N 0.13 -0.14 -0.81 2.33 1.79 -1.29 -1.38 116.57 117.20 2jul h LYS 166 Ca 0.21 0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.77 2jul h LYS 166 Cb 0.66 0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.29 2jul h LYS 166 CO -0.03 0.18 0.53 -0.07 -1.08 0.00 0.00 179.45 178.99 2jul h LEU 167 N -0.47 0.75 -0.03 2.94 3.38 -0.81 0.13 115.31 121.19 2jul h LEU 167 Ca -0.01 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jul h LEU 167 Cb 0.39 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2jul h LEU 167 CO 0.02 0.47 0.01 0.11 0.09 0.00 0.00 178.44 179.14 2jul h LYS 168 N 0.84 0.05 -0.73 1.13 1.57 -1.20 0.25 116.57 118.48 2jul h LYS 168 Ca 0.36 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.14 2jul h LYS 168 Cb 0.31 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2jul h LYS 168 CO -0.13 0.27 0.48 2.35 -0.57 0.00 0.00 179.45 181.84 2jul h TRP 169 N -0.18 0.91 -0.48 -1.35 7.01 -0.51 -1.45 115.95 119.89 2jul h TRP 169 Ca 0.01 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.94 2jul h TRP 169 Cb 0.24 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.98 2jul h TRP 169 CO 0.01 0.57 -0.05 0.00 -2.79 0.00 0.00 178.44 176.18 2jul h ALA 170 N 1.27 0.66 0.00 2.65 0.00 -0.85 -1.25 119.26 121.73 2jul h ALA 170 Ca 0.27 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2jul h ALA 170 Cb -0.11 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2jul h ALA 170 CO -0.06 0.50 -0.03 0.35 0.00 0.00 0.00 179.25 180.02 2jul h PHE 171 N 0.74 0.00 0.04 0.00 3.57 0.02 -1.67 116.94 119.64 2jul h PHE 171 Ca 0.13 0.00 -0.28 0.00 3.53 0.00 0.00 57.97 61.35 2jul h PHE 171 Cb 0.58 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 2jul h PHE 171 CO 0.04 0.03 -1.51 -0.91 -2.23 0.00 0.00 178.31 173.73 2jul h ASN 172 N 0.00 0.13 0.13 0.41 2.35 -0.70 -3.28 115.58 114.62 2jul h ASN 172 Ca -0.00 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.54 2jul h ASN 172 Cb 0.09 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.42 2jul h ASN 172 CO 0.00 1.17 -0.06 0.25 -1.65 0.00 0.00 177.43 177.14 2jul h LEU 173 N 0.02 -0.15 -2.66 1.61 5.85 -0.29 -1.68 115.31 118.01 2jul h LEU 173 Ca -0.22 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 2jul h LEU 173 Cb 1.96 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 43.03 2jul h LEU 173 CO 0.11 -0.05 -0.00 1.88 -0.34 0.00 0.00 178.44 180.04 2jul h TYR 174 N -0.24 0.00 -3.21 1.25 -1.99 -1.64 -3.42 116.97 107.72 2jul h TYR 174 Ca -0.02 0.00 -0.58 0.00 2.00 0.00 0.00 58.73 60.13 2jul h TYR 174 Cb 0.19 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.88 2jul h TYR 174 CO -0.05 0.00 -0.09 0.34 -0.00 0.00 0.00 178.16 178.36 2jul s ASP 175 N -5.29 6.93 0.00 3.88 2.15 -0.63 -4.92 116.67 118.78 2jul s ASP 175 Ca -0.04 1.13 0.00 0.00 0.43 0.00 0.00 52.55 54.07 2jul s ASP 175 Cb 0.12 -2.31 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 2jul s ASP 175 CO 0.44 0.23 0.00 2.30 -0.17 0.00 0.00 175.17 177.97 2jul n ILE 176 N 1.44 0.00 -1.59 4.11 -0.00 -1.26 -4.84 119.36 117.21 2jul n ILE 176 Ca -0.09 -0.07 0.00 0.00 -0.00 0.00 0.00 62.75 62.58 2jul n ILE 176 Cb 0.51 0.84 0.00 0.00 -0.00 0.00 0.00 39.64 40.99 2jul n ILE 176 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 2jul n ASN 177 N -0.19 0.00 -1.18 7.28 2.04 -1.26 -5.00 115.26 116.95 2jul n ASN 177 Ca 0.00 -0.62 0.08 0.00 -0.44 0.00 0.00 54.58 53.60 2jul n ASN 177 Cb 0.00 0.00 0.30 0.00 -2.53 0.00 0.00 39.78 37.55 2jul n ASN 177 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2jul n LYS 178 N -0.62 3.48 0.00 -3.83 4.76 -1.26 -4.86 118.16 115.83 2jul n LYS 178 Ca 0.00 -2.85 0.00 0.00 -2.87 0.00 0.00 58.31 52.59 2jul n LYS 178 Cb 0.00 -1.90 0.00 0.00 -1.84 0.00 0.00 35.03 31.29 2jul n LYS 178 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2jul n ASP 179 N 0.03 0.00 0.00 4.39 5.68 -1.26 -5.06 116.55 120.33 2jul n ASP 179 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.51 2jul n ASP 179 Cb 0.92 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.90 2jul n ASP 179 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jul n GLY 180 N 4.46 0.00 3.26 6.12 0.00 -1.26 -5.16 105.19 112.61 2jul n GLY 180 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2jul n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jul s ILE 182 N -3.21 4.40 -0.02 0.00 1.01 0.88 -4.88 121.20 119.37 2jul s ILE 182 Ca 0.17 -1.39 -0.21 0.00 0.00 0.00 0.00 60.65 59.21 2jul s ILE 182 Cb 0.02 -3.40 0.04 0.00 0.01 0.00 0.00 42.46 39.13 2jul s ILE 182 CO 0.01 -0.34 0.46 0.28 0.00 0.00 0.00 174.94 175.36 2jul s THR 183 N -2.14 0.03 0.18 2.92 -1.32 -1.26 0.11 115.64 114.16 2jul s THR 183 Ca 0.34 -0.28 0.08 0.00 -1.21 0.00 0.00 61.69 60.61 2jul s THR 183 Cb -0.08 -0.78 0.08 0.00 -1.51 0.00 0.00 72.50 70.21 2jul s THR 183 CO 0.25 -0.16 1.09 0.50 -2.21 0.00 0.00 174.62 174.10 2jul h LYS 184 N 3.48 0.00 0.00 7.08 3.64 -1.98 -1.10 116.57 127.68 2jul h LYS 184 Ca -0.29 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2jul h LYS 184 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2jul h LYS 184 CO 0.40 0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.97 2jul n GLU 185 N -1.97 0.00 0.19 1.90 -0.58 -1.26 -2.37 120.64 116.55 2jul n GLU 185 Ca -0.01 0.48 0.12 0.00 -0.42 0.00 0.00 57.16 57.33 2jul n GLU 185 Cb 0.51 -1.06 0.65 0.00 -0.57 0.00 0.00 31.44 30.97 2jul n GLU 185 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 2jul h GLU 186 N 0.00 0.00 -0.02 3.49 4.11 -1.78 -0.85 114.58 119.53 2jul h GLU 186 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 2jul h GLU 186 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2jul h GLU 186 CO 0.00 0.00 -0.54 0.52 0.07 0.00 0.00 179.01 179.06 2jul h MET 187 N 0.00 0.40 -0.61 1.06 2.86 -1.29 -2.46 114.93 114.89 2jul h MET 187 Ca 0.00 -0.41 -0.00 0.00 -2.06 0.00 0.00 59.70 57.23 2jul h MET 187 Cb 0.07 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 2jul h MET 187 CO 0.00 1.07 0.36 1.25 1.06 0.00 0.00 176.91 180.65 2jul h LEU 188 N -0.10 0.74 -0.91 1.22 7.12 -0.77 -1.29 115.31 121.32 2jul h LEU 188 Ca -0.06 -0.06 0.02 0.00 0.13 0.00 0.00 57.88 57.90 2jul h LEU 188 Cb 1.24 -0.19 -0.05 0.00 -0.53 0.00 0.00 40.66 41.14 2jul h LEU 188 CO 0.11 0.59 0.59 0.00 -0.13 0.00 0.00 178.44 179.60 2jul h ALA 189 N 1.18 1.17 0.01 1.25 0.00 -1.53 0.18 119.26 121.51 2jul h ALA 189 Ca 0.22 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2jul h ALA 189 Cb -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.43 2jul h ALA 189 CO -0.04 0.51 -0.00 0.82 0.00 0.00 0.00 179.25 180.53 2jul h ILE 190 N 1.19 1.07 -0.04 0.00 1.08 -0.88 -1.93 117.51 118.00 2jul h ILE 190 Ca 0.34 -0.22 -0.01 0.00 -0.39 0.00 0.00 64.86 64.58 2jul h ILE 190 Cb -0.08 1.22 -0.00 0.00 -3.07 0.00 0.00 36.82 34.88 2jul h ILE 190 CO -0.09 0.06 -0.04 0.24 -0.69 0.00 0.00 178.15 177.62 2jul h MET 191 N -0.10 0.05 -0.66 2.37 2.86 -0.84 -1.64 114.93 116.97 2jul h MET 191 Ca -0.00 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 2jul h MET 191 Cb 0.10 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 2jul h MET 191 CO 0.00 0.10 0.09 0.87 1.06 0.00 0.00 176.91 179.04 2jul h LYS 192 N 0.05 1.11 -0.52 1.72 1.57 -0.31 -2.50 116.57 117.70 2jul h LYS 192 Ca 0.01 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.41 2jul h LYS 192 Cb 0.12 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 2jul h LYS 192 CO 0.01 1.03 0.03 1.03 -0.57 0.00 0.00 179.45 180.97 2jul h SER 193 N 1.03 0.82 -0.09 0.86 0.87 -0.58 -2.24 113.55 114.22 2jul h SER 193 Ca 0.20 -0.19 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2jul h SER 193 Cb 0.46 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2jul h SER 193 CO 0.02 0.86 -0.02 0.40 -0.53 0.00 0.00 176.83 177.56 2jul h ILE 194 N 0.80 0.91 -0.85 2.23 1.08 -1.04 0.73 117.51 121.37 2jul h ILE 194 Ca 0.16 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.65 2jul h ILE 194 Cb 0.44 0.91 -0.05 0.00 -3.07 0.00 0.00 36.82 35.05 2jul h ILE 194 CO 0.02 0.00 0.56 1.88 -0.69 0.00 0.00 178.15 179.92 2jul h TYR 195 N -0.00 1.05 -0.24 1.37 -1.99 -1.25 -1.43 116.97 114.48 2jul h TYR 195 Ca 0.04 0.03 -0.16 0.00 2.00 0.00 0.00 58.73 60.63 2jul h TYR 195 Cb 0.07 -0.35 -0.00 0.00 2.00 0.00 0.00 36.73 38.44 2jul h TYR 195 CO -0.14 0.63 -0.52 -0.44 -0.00 0.00 0.00 178.16 177.69 2jul h ASP 196 N 1.10 0.75 -0.94 3.88 3.32 -0.73 -2.99 116.42 120.82 2jul h ASP 196 Ca 0.33 -0.39 0.07 0.00 0.02 0.00 0.00 57.03 57.06 2jul h ASP 196 Cb -0.04 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.23 2jul h ASP 196 CO -0.09 1.13 0.61 -0.03 -1.72 0.00 0.00 179.24 179.14 2jul h MET 197 N 0.53 1.04 -0.84 3.56 4.05 0.15 0.10 114.93 123.50 2jul h MET 197 Ca 0.02 -0.06 0.24 0.00 -0.28 0.00 0.00 59.70 59.62 2jul h MET 197 Cb 1.08 -0.23 -0.03 0.00 -0.80 0.00 0.00 31.60 31.61 2jul h MET 197 CO 0.11 0.68 0.61 1.98 0.23 0.00 0.00 176.91 180.52 2jul h MET 198 N 1.07 0.00 -1.32 0.39 1.85 -1.21 -3.42 114.93 112.28 2jul h MET 198 Ca 0.41 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.50 2jul h MET 198 Cb 0.21 -0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.24 2jul h MET 198 CO -0.16 0.00 -0.33 0.41 -0.40 0.00 0.00 176.91 176.43 2jul n GLY 199 N -1.70 -3.42 0.44 1.39 0.00 0.02 -4.22 105.19 97.69 2jul n GLY 199 Ca 0.17 -1.07 0.16 0.00 0.00 0.00 0.00 46.02 45.28 2jul n GLY 199 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jul h ARG 200 N 0.34 0.00 -5.08 1.61 9.65 -1.91 -3.32 114.38 115.68 2jul h ARG 200 Ca 0.00 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.73 2jul h ARG 200 Cb 0.16 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 28.77 2jul h ARG 200 CO 0.00 0.00 0.37 0.72 2.80 0.00 0.00 179.97 183.86 2jul n HIS 201 N -2.96 0.84 -3.70 2.20 8.25 -1.26 -4.73 115.22 113.85 2jul n HIS 201 Ca 0.12 -0.33 -0.06 0.00 -0.26 0.00 0.00 57.72 57.19 2jul n HIS 201 Cb 1.22 -2.23 -0.02 0.00 1.12 0.00 0.00 29.99 30.08 2jul n HIS 201 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2jul s THR 202 N 14.88 0.00 -0.48 1.59 -1.32 -1.25 -5.05 115.64 124.01 2jul s THR 202 Ca 0.78 -0.58 0.06 0.00 -1.21 0.00 0.00 61.69 60.75 2jul s THR 202 Cb -0.00 -1.71 0.24 0.00 -1.51 0.00 0.00 72.50 69.51 2jul s THR 202 CO 0.22 0.00 0.85 0.00 -2.21 0.00 0.00 174.62 173.48 2jul n TYR 203 N -0.42 -3.09 -2.21 9.09 4.11 -1.26 -5.11 117.16 118.27 2jul n TYR 203 Ca -0.07 -1.91 -0.43 0.00 -0.00 0.00 0.00 57.90 55.49 2jul n TYR 203 Cb 0.61 1.39 -0.02 0.00 -0.00 0.00 0.00 39.34 41.31 2jul n TYR 203 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 2jul s PRO 204 N 0.53 3.90 -0.09 -3.48 0.04 -1.26 -4.87 135.00 129.77 2jul s PRO 204 Ca 0.32 1.61 0.15 0.00 0.04 0.00 0.00 61.00 63.13 2jul s PRO 204 Cb 0.22 -3.97 0.53 0.00 0.04 0.00 0.00 34.50 31.33 2jul s PRO 204 CO -0.23 -1.15 1.45 0.44 0.04 0.00 0.00 177.00 177.55 2jul n ILE 205 N 6.17 1.67 -0.14 0.56 -0.00 -1.26 -4.98 119.36 121.37 2jul n ILE 205 Ca 0.17 -1.31 0.00 0.00 -0.00 0.00 0.00 62.75 61.61 2jul n ILE 205 Cb 0.45 0.16 0.00 0.00 -0.00 0.00 0.00 39.64 40.25 2jul n ILE 205 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2jul n LEU 206 N 0.50 0.00 -4.43 7.28 4.77 -1.26 -4.95 117.00 118.92 2jul n LEU 206 Ca 0.20 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.74 2jul n LEU 206 Cb 0.74 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.77 2jul n LEU 206 CO 0.16 -0.29 0.36 -0.13 -1.33 0.00 0.00 177.39 176.16 2jul s ARG 207 N -0.62 3.10 0.43 3.23 0.52 -1.26 -4.94 118.95 119.40 2jul s ARG 207 Ca 0.00 -1.01 0.00 0.00 -0.52 0.00 0.00 55.73 54.20 2jul s ARG 207 Cb 0.00 -4.15 0.00 0.00 0.52 0.00 0.00 34.95 31.32 2jul s ARG 207 CO 0.00 -1.32 0.00 -1.91 0.02 0.00 0.00 175.30 172.09 2jul n GLU 208 N 6.24 -2.90 -3.76 3.54 4.07 -1.26 -4.98 120.64 121.60 2jul n GLU 208 Ca -0.07 2.12 -0.13 0.00 -0.06 0.00 0.00 57.16 59.01 2jul n GLU 208 Cb 0.45 -3.50 -0.09 0.00 -0.06 0.00 0.00 31.44 28.23 2jul n GLU 208 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 2jul s ASP 209 N -6.89 -0.25 -0.30 4.31 -4.77 -1.26 -5.06 116.67 102.44 2jul s ASP 209 Ca 0.00 0.29 -0.17 0.00 -3.30 0.00 0.00 52.55 49.37 2jul s ASP 209 Cb 0.00 0.44 0.18 0.00 -1.09 0.00 0.00 42.92 42.45 2jul s ASP 209 CO 0.00 -0.34 1.17 0.00 0.70 0.00 0.00 175.17 176.69 2jul s ALA 210 N -0.84 -3.46 0.34 2.11 0.00 -1.26 -5.03 121.76 113.62 2jul s ALA 210 Ca -0.09 1.56 0.05 0.00 0.00 0.00 0.00 51.96 53.47 2jul s ALA 210 Cb -0.04 -2.43 0.60 0.00 0.00 0.00 0.00 23.12 21.25 2jul s ALA 210 CO 0.03 -1.27 1.86 -1.00 0.00 0.00 0.00 175.76 175.38 2jul h PRO 211 N 7.67 0.47 -0.70 0.00 0.13 -2.01 -2.79 132.00 134.77 2jul h PRO 211 Ca -0.13 -0.11 0.20 0.00 -0.87 0.00 0.00 66.00 65.10 2jul h PRO 211 Cb 1.16 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 2jul h PRO 211 CO -0.07 0.55 1.07 1.25 -0.23 0.00 0.00 178.00 180.56 2jul h LEU 212 N 0.45 0.00 -0.36 1.56 5.85 -1.96 1.00 115.31 121.84 2jul h LEU 212 Ca 0.09 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.67 2jul h LEU 212 Cb 0.38 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2jul h LEU 212 CO 0.02 0.00 -0.34 -0.08 -0.34 0.00 0.00 178.44 177.70 2jul h GLU 213 N 0.00 0.87 -0.10 1.25 4.81 -1.93 -1.94 114.58 117.54 2jul h GLU 213 Ca 0.33 -0.45 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 2jul h GLU 213 Cb 2.47 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.86 2jul h GLU 213 CO -0.00 1.09 0.03 1.25 -0.73 0.00 0.00 179.01 180.65 2jul h HIS 214 N 0.67 0.15 -0.67 0.92 2.76 0.84 -2.33 115.15 117.50 2jul h HIS 214 Ca 0.06 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2jul h HIS 214 Cb 0.92 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.81 2jul h HIS 214 CO 0.07 0.30 0.41 0.28 -1.30 0.00 0.00 177.93 177.69 2jul h VAL 215 N -0.04 1.18 -0.74 5.26 2.07 -1.55 -1.78 116.25 120.65 2jul h VAL 215 Ca 0.03 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2jul h VAL 215 Cb 0.22 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 2jul h VAL 215 CO -0.00 0.19 0.48 -0.08 0.02 0.00 0.00 177.57 178.18 2jul h GLU 216 N 0.91 0.99 -0.23 1.57 4.81 -1.07 0.80 114.58 122.36 2jul h GLU 216 Ca 0.24 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.31 2jul h GLU 216 Cb -0.05 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.10 2jul h GLU 216 CO -0.05 0.67 -0.25 -0.09 -0.73 0.00 0.00 179.01 178.56 2jul h ARG 217 N 1.01 0.44 -0.10 1.92 2.43 -0.83 0.62 114.38 119.88 2jul h ARG 217 Ca 0.27 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2jul h ARG 217 Cb -0.09 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 2jul h ARG 217 CO -0.06 0.67 -0.09 0.35 -1.51 0.00 0.00 179.97 179.33 2jul h PHE 218 N 0.39 0.29 0.00 2.20 3.04 -0.53 -2.46 116.94 119.88 2jul h PHE 218 Ca 0.06 -0.09 -0.06 0.00 3.98 0.00 0.00 57.97 61.86 2jul h PHE 218 Cb 0.65 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.09 2jul h PHE 218 CO 0.02 0.66 -0.28 0.35 -2.02 0.00 0.00 178.31 177.03 2jul h PHE 219 N -0.16 0.00 -0.63 0.41 3.57 -0.77 0.38 116.94 119.75 2jul h PHE 219 Ca 0.02 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 2jul h PHE 219 Cb 0.60 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 2jul h PHE 219 CO 0.08 0.28 0.05 0.37 -2.23 0.00 0.00 178.31 176.87 2jul h GLN 220 N 0.00 1.07 0.00 1.11 5.75 -0.71 -2.48 115.11 119.85 2jul h GLN 220 Ca -0.00 -0.31 0.00 0.00 -0.15 0.00 0.00 58.65 58.19 2jul h GLN 220 Cb 0.71 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.14 2jul h GLN 220 CO 0.04 1.01 -0.56 0.87 -2.65 0.00 0.00 178.83 177.54 2jul h LYS 221 N 0.99 0.00 0.00 1.69 1.57 -1.09 -3.46 116.57 116.27 2jul h LYS 221 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2jul h LYS 221 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2jul h LYS 221 CO 0.02 0.00 0.00 -0.12 -0.57 0.00 0.00 179.45 178.78 2jul n MET 222 N -2.26 2.07 0.00 3.15 1.56 0.09 -4.85 117.12 116.89 2jul n MET 222 Ca 0.03 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.46 2jul n MET 222 Cb 0.46 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.83 2jul n MET 222 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2jul n ASP 223 N 0.00 0.00 -2.83 6.12 2.03 -1.24 -4.90 116.55 115.73 2jul n ASP 223 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 2jul n ASP 223 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 2jul n ASP 223 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2jul n ARG 224 N 8.36 -2.90 -2.17 -0.67 1.74 -1.26 -5.01 116.66 114.74 2jul n ARG 224 Ca 0.00 2.39 0.00 0.00 -0.77 0.00 0.00 57.85 59.47 2jul n ARG 224 Cb 0.00 -3.79 0.00 0.00 -1.02 0.00 0.00 32.46 27.65 2jul n ARG 224 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2jul n ASN 225 N 1.39 -0.13 0.00 0.55 0.23 -1.26 -4.94 115.26 111.10 2jul n ASN 225 Ca -0.13 -1.01 0.00 0.00 -0.53 0.00 0.00 54.58 52.91 2jul n ASN 225 Cb 0.29 0.20 0.00 0.00 -2.08 0.00 0.00 39.78 38.19 2jul n ASN 225 CO 0.00 0.00 0.00 1.67 -0.93 0.00 0.00 177.26 178.00 2jul n GLN 226 N -0.11 0.00 0.00 -3.83 -0.06 -1.26 -4.57 117.38 107.54 2jul n GLN 226 Ca 0.01 0.01 0.00 0.00 -2.00 0.00 0.00 57.00 55.01 2jul n GLN 226 Cb 0.07 -1.50 0.00 0.00 -4.06 0.00 0.00 30.24 24.75 2jul n GLN 226 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 2jul n ASP 227 N -0.89 1.26 0.00 1.69 5.68 -1.26 -5.07 116.55 117.96 2jul n ASP 227 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2jul n ASP 227 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2jul n ASP 227 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jul n GLY 228 N 0.00 0.18 3.87 6.12 0.00 -1.26 -4.60 105.19 109.50 2jul n GLY 228 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2jul n GLY 228 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jul s VAL 229 N -0.38 4.74 -0.21 1.61 -7.23 -1.26 -4.69 120.40 112.99 2jul s VAL 229 Ca 0.00 0.74 -0.14 0.00 -1.81 0.00 0.00 61.98 60.77 2jul s VAL 229 Cb 0.00 -3.70 -0.04 0.00 0.56 0.00 0.00 36.38 33.20 2jul s VAL 229 CO 0.00 -0.44 0.29 0.54 -0.31 0.00 0.00 175.10 175.19 2jul s VAL 230 N -2.28 5.28 0.29 1.32 0.11 0.30 -4.84 120.40 120.58 2jul s VAL 230 Ca 0.52 0.49 0.08 0.00 -2.93 0.00 0.00 61.98 60.15 2jul s VAL 230 Cb -0.10 -3.63 -0.04 0.00 -1.53 0.00 0.00 36.38 31.08 2jul s VAL 230 CO 0.27 0.31 0.10 -0.89 -3.33 0.00 0.00 175.10 171.57 2jul s THR 231 N 1.03 3.60 0.48 5.04 2.01 -1.26 0.30 115.64 126.84 2jul s THR 231 Ca 0.15 -1.69 0.07 0.00 0.31 0.00 0.00 61.69 60.52 2jul s THR 231 Cb -0.14 -3.04 0.07 0.00 0.01 0.00 0.00 72.50 69.40 2jul s THR 231 CO 0.06 -0.31 1.14 -0.29 -0.69 0.00 0.00 174.62 174.53 2jul h ILE 232 N 1.66 0.00 0.13 1.82 2.10 -1.99 0.22 117.51 121.45 2jul h ILE 232 Ca -0.45 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.48 2jul h ILE 232 Cb 1.25 0.16 0.00 0.00 -1.09 0.00 0.00 36.82 37.14 2jul h ILE 232 CO 0.61 0.00 -0.06 -0.78 -1.08 0.00 0.00 178.15 176.84 2jul h ASP 233 N 0.00 -0.15 -0.01 2.19 1.82 -1.95 -2.26 116.42 116.07 2jul h ASP 233 Ca 0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2jul h ASP 233 Cb 1.43 0.04 -0.00 0.00 0.68 0.00 0.00 39.33 41.47 2jul h ASP 233 CO 0.00 0.28 0.05 -0.33 -1.61 0.00 0.00 179.24 177.63 2jul h GLU 234 N -0.94 0.00 0.12 0.28 5.08 -1.02 -0.45 114.58 117.66 2jul h GLU 234 Ca -0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2jul h GLU 234 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2jul h GLU 234 CO 0.03 0.00 -0.06 0.35 -1.00 0.00 0.00 179.01 178.33 2jul h PHE 235 N 0.00 -0.15 -0.27 4.33 3.57 -1.07 -0.85 116.94 122.51 2jul h PHE 235 Ca 0.01 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 2jul h PHE 235 Cb 0.11 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2jul h PHE 235 CO 0.00 0.33 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.04 2jul h LEU 236 N -0.78 0.56 -0.85 0.59 4.07 -0.75 -0.73 115.31 117.43 2jul h LEU 236 Ca -0.02 -0.22 -0.11 0.00 0.08 0.00 0.00 57.88 57.62 2jul h LEU 236 Cb 0.55 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 2jul h LEU 236 CO 0.03 0.84 -0.52 -0.08 -1.08 0.00 0.00 178.44 177.62 2jul h GLU 237 N 0.47 0.00 0.03 1.13 4.81 -1.17 -1.25 114.58 118.61 2jul h GLU 237 Ca 0.06 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.17 2jul h GLU 237 Cb 0.77 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.16 2jul h GLU 237 CO 0.06 0.52 -0.48 1.15 -0.73 0.00 0.00 179.01 179.54 2jul h THR 238 N 0.00 1.52 0.00 0.32 2.02 -0.80 -2.80 112.91 113.17 2jul h THR 238 Ca -0.01 -2.17 -0.05 0.00 0.77 0.00 0.00 66.41 64.96 2jul h THR 238 Cb 1.01 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 70.28 2jul h THR 238 CO 0.07 0.61 -0.24 0.00 0.37 0.00 0.00 175.52 176.33 2jul h GLN 240 N 0.00 -0.19 0.00 0.00 1.08 -1.24 -2.87 115.11 111.89 2jul h GLN 240 Ca -0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2jul h GLN 240 Cb 0.55 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 2jul h GLN 240 CO 0.03 0.22 0.00 1.63 -0.95 0.00 0.00 178.83 179.76 2jul n LYS 241 N -4.97 0.00 -3.32 1.46 5.02 -1.06 -3.17 118.16 112.12 2jul n LYS 241 Ca -0.09 0.77 -0.45 0.00 -2.02 0.00 0.00 58.31 56.53 2jul n LYS 241 Cb 0.26 -1.41 -0.00 0.00 -0.02 0.00 0.00 35.03 33.85 2jul n LYS 241 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2jul s ASP 242 N -2.71 7.29 -0.10 4.39 -1.08 -1.21 -4.91 116.67 118.34 2jul s ASP 242 Ca 0.00 -3.52 -0.02 0.00 -0.52 0.00 0.00 52.55 48.48 2jul s ASP 242 Cb 0.00 -2.22 -0.08 0.00 -1.46 0.00 0.00 42.92 39.16 2jul s ASP 242 CO 0.00 -0.33 1.60 1.21 0.52 0.00 0.00 175.17 178.17 2jul n GLU 243 N 2.92 0.80 0.00 4.34 2.13 -1.08 -2.32 120.64 127.42 2jul n GLU 243 Ca 0.24 -0.48 0.00 0.00 0.66 0.00 0.00 57.16 57.58 2jul n GLU 243 Cb 0.40 -1.78 0.00 0.00 0.27 0.00 0.00 31.44 30.33 2jul n GLU 243 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2jul n ASN 244 N 3.13 0.00 -0.03 4.31 3.02 -1.26 -4.80 115.26 119.63 2jul n ASN 244 Ca 0.17 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.57 2jul n ASN 244 Cb 0.27 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.33 2jul n ASN 244 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2jul h ILE 245 N 0.00 1.58 0.00 2.41 6.09 -1.82 -3.11 117.51 122.66 2jul h ILE 245 Ca 0.00 -2.04 -0.04 0.00 -1.37 0.00 0.00 64.86 61.41 2jul h ILE 245 Cb 0.00 2.89 -0.01 0.00 0.47 0.00 0.00 36.82 40.17 2jul h ILE 245 CO 0.00 0.56 -0.17 0.24 -3.07 0.00 0.00 178.15 175.71 2jul h MET 246 N -0.56 0.00 -0.25 2.19 2.86 -1.90 -1.09 114.93 116.18 2jul h MET 246 Ca -0.04 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 2jul h MET 246 Cb 1.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 2jul h MET 246 CO 0.05 0.17 -0.02 -0.97 1.06 0.00 0.00 176.91 177.20 2jul h ASN 247 N 0.00 0.35 -0.25 1.22 -1.24 -1.86 -1.31 115.58 112.49 2jul h ASN 247 Ca -0.00 -0.06 -0.15 0.00 0.71 0.00 0.00 56.30 56.80 2jul h ASN 247 Cb 0.49 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.44 2jul h ASN 247 CO 0.02 0.43 -0.40 0.77 -1.29 0.00 0.00 177.43 176.97 2jul h SER 248 N 0.37 0.85 -0.44 1.15 4.64 -1.14 -2.23 113.55 116.75 2jul h SER 248 Ca 0.08 -0.39 0.08 0.00 -0.47 0.00 0.00 61.79 61.09 2jul h SER 248 Cb 0.28 -0.24 -0.07 0.00 -0.31 0.00 0.00 62.40 62.07 2jul h SER 248 CO 0.01 1.14 0.05 -0.03 -0.87 0.00 0.00 176.83 177.13 2jul h MET 249 N 0.65 0.17 -0.22 4.77 1.85 -1.01 1.97 114.93 123.10 2jul h MET 249 Ca 0.05 -0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.11 2jul h MET 249 Cb 0.96 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 32.95 2jul h MET 249 CO 0.09 0.11 0.05 0.37 -0.40 0.00 0.00 176.91 177.13 2jul h GLN 250 N 0.17 0.36 -0.32 0.39 5.75 -1.35 -0.62 115.11 119.49 2jul h GLN 250 Ca 0.22 -0.09 -0.08 0.00 -0.15 0.00 0.00 58.65 58.55 2jul h GLN 250 Cb 0.30 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 2jul h GLN 250 CO -0.32 0.48 -0.13 1.25 -2.65 0.00 0.00 178.83 177.45 2jul h LEU 251 N 0.18 0.54 -1.00 -2.39 5.85 -0.73 -1.21 115.31 116.55 2jul h LEU 251 Ca 0.07 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2jul h LEU 251 Cb 0.28 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2jul h LEU 251 CO 0.00 0.70 0.00 0.15 -0.34 0.00 0.00 178.44 178.95 2jul h PHE 252 N 0.51 0.00 0.00 1.25 3.57 0.34 -2.81 116.94 119.80 2jul h PHE 252 Ca 0.09 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.38 2jul h PHE 252 Cb 0.53 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.24 2jul h PHE 252 CO 0.02 0.00 -1.46 1.49 -2.23 0.00 0.00 178.31 176.13 2jul h GLU 253 N 0.00 0.00 -0.14 1.11 4.57 -0.08 -3.39 114.58 116.65 2jul h GLU 253 Ca 0.00 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.19 2jul h GLU 253 Cb 0.55 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.12 2jul h GLU 253 CO 0.00 0.39 -0.12 -0.97 -1.18 0.00 0.00 179.01 177.13 2jul h ASN 254 N 0.00 -0.41 -5.01 1.04 -0.00 -0.98 -3.45 115.58 106.76 2jul h ASN 254 Ca -0.19 0.06 -0.01 0.00 -0.00 0.00 0.00 56.30 56.16 2jul h ASN 254 Cb 1.73 0.17 -0.11 0.00 -0.00 0.00 0.00 38.32 40.11 2jul h ASN 254 CO 0.06 -0.07 0.19 0.54 -0.00 0.00 0.00 177.43 178.15 2jul s VAL 255 N -3.53 0.01 0.00 2.57 0.11 -1.26 -5.14 120.40 113.16 2jul s VAL 255 Ca -0.03 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 2jul s VAL 255 Cb 0.02 -1.23 0.00 0.00 -1.53 0.00 0.00 36.38 33.64 2jul s VAL 255 CO 0.13 -0.03 0.00 0.00 -3.33 0.00 0.00 175.10 171.87