#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jul n GLU 77 N 0.00 1.85 0.01 -0.52 1.02 -1.26 -4.21 120.64 117.53 2jul n GLU 77 Ca 0.00 -1.31 -0.07 0.00 -0.02 0.00 0.00 57.16 55.76 2jul n GLU 77 Cb 0.00 -1.32 -0.05 0.00 -0.02 0.00 0.00 31.44 30.05 2jul n GLU 77 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2jul h GLY 78 N 5.13 -0.15 -0.24 0.62 0.00 -2.05 -2.61 103.07 103.78 2jul h GLY 78 Ca 0.00 0.05 0.10 0.00 0.00 0.00 0.00 47.33 47.49 2jul h GLY 78 CO 0.00 -0.05 -0.24 1.41 0.00 0.00 0.00 176.54 177.65 2jul h LEU 79 N -0.98 -0.84 -0.29 3.11 -0.00 -2.00 0.38 115.31 114.69 2jul h LEU 79 Ca -0.01 0.19 0.02 0.00 -0.00 0.00 0.00 57.88 58.08 2jul h LEU 79 Cb 0.41 0.46 -0.02 0.00 -0.00 0.00 0.00 40.66 41.50 2jul h LEU 79 CO 0.02 -0.26 0.13 -0.78 -0.00 0.00 0.00 178.44 177.56 2jul h ASP 80 N -0.12 0.19 -0.99 -0.43 1.82 -1.79 0.06 116.42 115.17 2jul h ASP 80 Ca 0.24 0.02 0.05 0.00 -0.39 0.00 0.00 57.03 56.95 2jul h ASP 80 Cb 0.50 -0.02 -0.06 0.00 0.68 0.00 0.00 39.33 40.43 2jul h ASP 80 CO -0.61 0.15 0.64 1.56 -1.61 0.00 0.00 179.24 179.37 2jul h GLN 81 N 0.28 1.17 0.16 0.28 4.20 -0.62 -1.73 115.11 118.85 2jul h GLN 81 Ca 0.12 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2jul h GLN 81 Cb 0.05 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.57 2jul h GLN 81 CO -0.09 0.77 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.69 2jul h LEU 82 N 1.20 -0.19 -2.16 1.46 3.38 0.48 0.12 115.31 119.60 2jul h LEU 82 Ca 0.41 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.24 2jul h LEU 82 Cb 0.08 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2jul h LEU 82 CO -0.14 0.08 0.29 -0.61 0.09 0.00 0.00 178.44 178.15 2jul h GLN 83 N -0.47 0.00 0.04 1.13 -0.00 -0.60 0.55 115.11 115.77 2jul h GLN 83 Ca -0.02 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 58.31 2jul h GLN 83 Cb 0.36 0.00 -0.04 0.00 0.00 0.00 0.00 27.48 27.80 2jul h GLN 83 CO 0.04 0.00 -1.81 0.00 0.00 0.00 0.00 178.83 177.06 2jul n ALA 84 N -2.14 1.29 -0.04 3.38 0.00 -0.69 -4.26 120.51 118.05 2jul n ALA 84 Ca 0.01 -0.71 -0.05 0.00 0.00 0.00 0.00 53.44 52.69 2jul n ALA 84 Cb 0.39 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 19.04 2jul n ALA 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jul n GLN 85 N -3.19 0.29 0.00 0.00 6.02 0.36 -4.47 117.38 116.39 2jul n GLN 85 Ca -0.22 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 2jul n GLN 85 Cb 1.05 -0.97 0.00 0.00 1.02 0.00 0.00 30.24 31.34 2jul n GLN 85 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2jul n THR 86 N -3.74 0.00 0.00 5.09 -2.24 0.17 -4.85 114.28 108.72 2jul n THR 86 Ca -0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2jul n THR 86 Cb 0.28 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 2jul n THR 86 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2jul n LYS 87 N 0.36 0.00 0.00 -0.78 4.76 -1.15 -4.62 118.16 116.73 2jul n LYS 87 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2jul n LYS 87 Cb 0.03 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.22 2jul n LYS 87 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2jul n PHE 88 N 14.00 0.00 0.00 2.13 3.72 -1.26 -4.45 117.46 131.60 2jul n PHE 88 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2jul n PHE 88 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2jul n PHE 88 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2jul n THR 89 N 0.00 0.00 0.21 4.37 5.66 -1.26 -4.92 114.28 118.35 2jul n THR 89 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 2jul n THR 89 Cb 0.00 0.00 0.22 0.00 -1.55 0.00 0.00 70.33 69.00 2jul n THR 89 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 2jul h LYS 90 N 0.00 0.00 0.05 1.09 2.10 -1.89 0.97 116.57 118.89 2jul h LYS 90 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jul h LYS 90 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2jul h LYS 90 CO 0.00 0.00 -0.02 -0.22 -2.00 0.00 0.00 179.45 177.21 2jul h LYS 91 N 0.00 -0.06 -0.48 0.07 3.64 -1.97 -1.72 116.57 116.05 2jul h LYS 91 Ca 0.00 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 2jul h LYS 91 Cb 1.18 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 2jul h LYS 91 CO 0.00 -0.04 0.33 1.49 -2.27 0.00 0.00 179.45 178.96 2jul h GLU 92 N -0.40 0.14 -0.34 1.90 4.81 -1.46 0.46 114.58 119.70 2jul h GLU 92 Ca -0.01 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 2jul h GLU 92 Cb 0.05 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2jul h GLU 92 CO 0.01 0.09 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.26 2jul h LEU 93 N 0.14 0.63 -0.92 1.64 3.38 -0.98 -2.52 115.31 116.68 2jul h LEU 93 Ca 0.23 -0.34 0.22 0.00 0.09 0.00 0.00 57.88 58.07 2jul h LEU 93 Cb 0.71 -0.17 -0.12 0.00 0.09 0.00 0.00 40.66 41.16 2jul h LEU 93 CO -0.03 0.82 0.45 1.56 0.09 0.00 0.00 178.44 181.34 2jul h GLN 94 N 0.43 0.46 0.66 1.13 1.08 0.06 1.23 115.11 120.15 2jul h GLN 94 Ca 0.09 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.23 2jul h GLN 94 Cb 0.53 -0.10 0.01 0.00 -0.05 0.00 0.00 27.48 27.86 2jul h GLN 94 CO 0.03 0.30 -0.32 1.03 -0.95 0.00 0.00 178.83 178.91 2jul h SER 95 N 0.47 -0.77 -0.70 1.46 0.87 -1.24 0.37 113.55 114.00 2jul h SER 95 Ca 0.58 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 61.19 2jul h SER 95 Cb 1.08 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 63.20 2jul h SER 95 CO -0.50 -0.54 0.46 -0.07 -0.53 0.00 0.00 176.83 175.65 2jul h LEU 96 N -0.89 0.74 -1.08 2.23 3.38 -0.60 -0.27 115.31 118.82 2jul h LEU 96 Ca -0.09 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2jul h LEU 96 Cb 0.69 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2jul h LEU 96 CO 0.14 0.52 -0.07 0.22 0.09 0.00 0.00 178.44 179.33 2jul h TYR 97 N 0.86 0.60 -0.19 1.13 3.20 0.19 -2.67 116.97 120.10 2jul h TYR 97 Ca 0.28 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 62.08 2jul h TYR 97 Cb 0.03 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 2jul h TYR 97 CO -0.00 0.63 0.06 -0.09 -1.64 0.00 0.00 178.16 177.12 2jul h ARG 98 N 0.53 0.15 -0.81 1.82 2.43 0.15 0.95 114.38 119.60 2jul h ARG 98 Ca 0.10 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.32 2jul h ARG 98 Cb 0.45 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 2jul h ARG 98 CO 0.02 0.10 0.53 0.78 -1.51 0.00 0.00 179.97 179.89 2jul h GLY 99 N 0.15 1.14 2.00 2.80 0.00 -1.22 0.14 103.07 108.08 2jul h GLY 99 Ca 0.08 -0.37 -0.07 0.00 0.00 0.00 0.00 47.33 46.97 2jul h GLY 99 CO -0.09 0.28 -0.35 -2.75 0.00 0.00 0.00 176.54 173.63 2jul h PHE 100 N 0.91 0.00 0.00 5.60 3.57 -0.92 -2.53 116.94 123.57 2jul h PHE 100 Ca 0.35 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.69 2jul h PHE 100 Cb 0.19 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 2jul h PHE 100 CO -0.00 0.35 -0.72 -0.22 -2.23 0.00 0.00 178.31 175.49 2jul h LYS 101 N 0.00 0.00 -0.10 1.11 3.64 0.16 -3.19 116.57 118.19 2jul h LYS 101 Ca -0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2jul h LYS 101 Cb 0.71 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2jul h LYS 101 CO 0.05 0.72 -0.38 -0.97 -2.27 0.00 0.00 179.45 176.60 2jul h ASN 102 N 0.00 0.21 -3.40 4.20 -0.00 -0.67 -3.40 115.58 112.52 2jul h ASN 102 Ca -0.01 -0.08 -0.67 0.00 -0.00 0.00 0.00 56.30 55.55 2jul h ASN 102 Cb 1.48 -0.06 -0.16 0.00 -0.00 0.00 0.00 38.32 39.58 2jul h ASN 102 CO 0.09 0.57 0.11 -1.61 -0.00 0.00 0.00 177.43 176.60 2jul s GLU 103 N -4.20 3.20 0.59 6.67 0.41 -1.15 -4.90 118.70 119.32 2jul s GLU 103 Ca -0.04 -0.62 0.00 0.00 -0.41 0.00 0.00 54.97 53.90 2jul s GLU 103 Cb 0.14 -4.03 0.00 0.00 -1.78 0.00 0.00 34.13 28.46 2jul s GLU 103 CO 0.76 -1.14 0.00 0.00 -0.49 0.00 0.00 175.26 174.40 2jul n PRO 105 N -2.47 0.57 -1.24 0.00 -0.01 -1.26 -4.76 135.00 125.84 2jul n PRO 105 Ca 0.00 0.24 -0.38 0.00 -0.01 0.00 0.00 63.50 63.35 2jul n PRO 105 Cb 0.44 -2.08 0.03 0.00 -0.01 0.00 0.00 33.50 31.89 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 -2.20 0.76 0.00 3.45 -1.04 -1.26 -4.83 114.28 109.15 2jul n THR 106 Ca 0.13 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 2jul n THR 106 Cb 0.49 -0.28 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 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 2.35 0.98 3.91 3.41 0.00 -1.26 -5.11 105.19 109.48 2jul n GLY 107 Ca 0.07 -1.91 -0.27 0.00 0.00 0.00 0.00 46.02 43.92 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 3.82 0.27 0.99 1.43 -1.26 -4.80 118.68 119.13 2jul s LEU 108 Ca 0.00 0.77 0.09 0.00 -1.03 0.00 0.00 54.13 53.96 2jul s LEU 108 Cb 0.00 -3.67 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 2jul s LEU 108 CO 0.00 -0.42 0.01 0.54 0.23 0.00 0.00 176.35 176.71 2jul s VAL 109 N -2.49 3.54 0.06 -1.59 0.11 0.16 -4.99 120.40 115.20 2jul s VAL 109 Ca 0.45 -1.87 -0.02 0.00 -2.93 0.00 0.00 61.98 57.61 2jul s VAL 109 Cb -0.10 -2.90 -0.03 0.00 -1.53 0.00 0.00 36.38 31.82 2jul s VAL 109 CO 0.39 -0.37 0.01 -1.81 -3.33 0.00 0.00 175.10 169.99 2jul s ASP 110 N -3.69 0.42 0.27 3.54 1.01 -1.26 -1.59 116.67 115.36 2jul s ASP 110 Ca 0.32 -0.95 -0.04 0.00 0.71 0.00 0.00 52.55 52.58 2jul s ASP 110 Cb -0.07 0.23 0.54 0.00 1.01 0.00 0.00 42.92 44.64 2jul s ASP 110 CO 0.20 -0.63 1.62 -0.08 0.21 0.00 0.00 175.17 176.50 2jul h GLU 111 N 3.07 0.10 0.01 8.23 4.22 -1.99 0.52 114.58 128.74 2jul h GLU 111 Ca -0.34 -0.01 0.03 0.00 0.08 0.00 0.00 59.36 59.12 2jul h GLU 111 Cb 1.15 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.33 2jul h GLU 111 CO 0.64 0.07 -0.42 -0.44 -2.18 0.00 0.00 179.01 176.67 2jul h ASP 112 N 0.11 -1.28 -0.42 1.04 5.19 -1.96 -1.26 116.42 117.83 2jul h ASP 112 Ca 0.47 0.15 0.07 0.00 -0.62 0.00 0.00 57.03 57.10 2jul h ASP 112 Cb 0.88 0.50 -0.06 0.00 0.18 0.00 0.00 39.33 40.83 2jul h ASP 112 CO -0.72 -0.46 0.08 0.74 -3.12 0.00 0.00 179.24 175.76 2jul h THR 113 N -0.59 0.78 -0.97 0.35 2.02 -1.42 -0.42 112.91 112.66 2jul h THR 113 Ca 0.04 -0.07 0.30 0.00 0.77 0.00 0.00 66.41 67.45 2jul h THR 113 Cb 0.66 0.55 -0.15 0.00 -1.74 0.00 0.00 68.15 67.46 2jul h THR 113 CO -0.31 0.04 0.45 -0.26 0.37 0.00 0.00 175.52 175.81 2jul h PHE 114 N 0.21 0.72 -0.02 3.16 -1.00 0.12 0.75 116.94 120.87 2jul h PHE 114 Ca 0.20 0.04 -0.00 0.00 2.81 0.00 0.00 57.97 61.02 2jul h PHE 114 Cb 0.25 -0.16 -0.00 0.00 3.61 0.00 0.00 35.95 39.65 2jul h PHE 114 CO -0.21 -0.23 0.00 -0.22 -1.61 0.00 0.00 178.31 176.05 2jul h LYS 115 N 0.25 0.04 -0.46 1.51 3.64 -0.16 -1.32 116.57 120.06 2jul h LYS 115 Ca 0.69 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 60.04 2jul h LYS 115 Cb 1.55 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.35 2jul h LYS 115 CO -0.65 0.32 0.21 1.25 -2.27 0.00 0.00 179.45 178.31 2jul h LEU 116 N -0.26 0.57 -0.17 5.20 5.85 -0.04 -0.71 115.31 125.75 2jul h LEU 116 Ca 0.01 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2jul h LEU 116 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2jul h LEU 116 CO 0.00 0.50 0.04 0.40 -0.34 0.00 0.00 178.44 179.04 2jul h ILE 117 N 0.64 1.20 0.00 4.05 1.08 0.53 -2.19 117.51 122.82 2jul h ILE 117 Ca 0.16 -0.63 -0.06 0.00 -0.39 0.00 0.00 64.86 63.94 2jul h ILE 117 Cb 0.08 1.29 -0.01 0.00 -3.07 0.00 0.00 36.82 35.12 2jul h ILE 117 CO -0.02 0.19 -0.28 1.88 -0.69 0.00 0.00 178.15 179.23 2jul h TYR 118 N 0.08 0.00 -0.10 1.37 -1.99 -0.84 -1.42 116.97 114.08 2jul h TYR 118 Ca 0.05 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.68 2jul h TYR 118 Cb 0.25 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 2jul h TYR 118 CO 0.01 0.28 -0.42 1.03 -0.00 0.00 0.00 178.16 179.06 2jul h SER 119 N 0.00 0.24 0.83 3.88 0.87 -0.77 -2.75 113.55 115.84 2jul h SER 119 Ca -0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2jul h SER 119 Cb 0.60 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2jul h SER 119 CO 0.04 0.64 -0.81 -0.61 -0.53 0.00 0.00 176.83 175.55 2jul h GLN 120 N 0.19 0.00 0.00 2.24 5.75 -0.93 -3.33 115.11 119.02 2jul h GLN 120 Ca 0.02 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2jul h GLN 120 Cb 0.83 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.38 2jul h GLN 120 CO 0.06 0.00 -0.32 0.74 -2.65 0.00 0.00 178.83 176.66 2jul h PHE 121 N 0.00 0.00 -2.75 3.99 -1.00 -1.04 -3.40 116.94 112.73 2jul h PHE 121 Ca 0.00 0.00 -0.60 0.00 2.81 0.00 0.00 57.97 60.18 2jul h PHE 121 Cb 0.82 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 39.98 2jul h PHE 121 CO 0.00 0.02 -0.79 -0.06 -1.61 0.00 0.00 178.31 175.87 2jul s PHE 122 N -3.25 1.97 1.03 -0.55 0.40 -1.06 -5.09 117.98 111.44 2jul s PHE 122 Ca 0.05 -2.56 -0.13 0.00 -0.60 0.00 0.00 56.93 53.69 2jul s PHE 122 Cb 0.06 -1.67 0.21 0.00 0.51 0.00 0.00 43.02 42.13 2jul s PHE 122 CO 0.71 -0.74 1.08 -1.25 0.70 0.00 0.00 175.22 175.72 2jul s PRO 123 N -0.17 0.15 -1.04 0.24 0.05 -1.26 -4.14 135.00 128.83 2jul s PRO 123 Ca 0.25 0.55 -0.16 0.00 0.05 0.00 0.00 61.00 61.69 2jul s PRO 123 Cb -0.09 -1.70 0.00 0.00 0.05 0.00 0.00 34.50 32.76 2jul s PRO 123 CO -0.11 -2.93 0.74 1.04 0.05 0.00 0.00 177.00 175.78 2jul n GLN 124 N -4.32 -1.17 0.00 4.56 6.02 -1.26 -4.90 117.38 116.31 2jul n GLN 124 Ca 0.05 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.63 2jul n GLN 124 Cb 0.57 -3.79 0.00 0.00 1.02 0.00 0.00 30.24 28.04 2jul n GLN 124 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jul n GLY 125 N -1.74 4.51 3.85 1.08 0.00 -1.26 -4.51 105.19 107.13 2jul n GLY 125 Ca -0.12 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.57 2jul n GLY 125 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jul s ASP 126 N 0.00 6.81 0.00 1.61 1.11 -1.26 -4.89 116.67 120.05 2jul s ASP 126 Ca 0.00 1.24 0.00 0.00 0.18 0.00 0.00 52.55 53.97 2jul s ASP 126 Cb 0.00 -2.35 0.00 0.00 1.07 0.00 0.00 42.92 41.64 2jul s ASP 126 CO 0.00 -0.11 0.69 0.00 1.18 0.00 0.00 175.17 176.93 2jul n ALA 127 N -0.01 2.04 0.09 5.23 0.00 -1.26 -4.23 120.51 122.37 2jul n ALA 127 Ca 0.01 -0.38 -0.05 0.00 0.00 0.00 0.00 53.44 53.01 2jul n ALA 127 Cb 0.52 -0.19 0.09 0.00 0.00 0.00 0.00 19.45 19.88 2jul n ALA 127 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2jul h THR 128 N 5.71 1.44 0.86 0.00 1.35 -1.87 -3.09 112.91 117.30 2jul h THR 128 Ca -0.01 -2.22 -0.04 0.00 -0.55 0.00 0.00 66.41 63.58 2jul h THR 128 Cb 1.16 2.18 0.01 0.00 -1.73 0.00 0.00 68.15 69.76 2jul h THR 128 CO -0.00 0.65 -0.42 0.74 -0.25 0.00 0.00 175.52 176.24 2jul h THR 129 N 0.12 0.00 -0.97 6.82 2.02 -1.97 -2.04 112.91 116.89 2jul h THR 129 Ca -0.02 0.00 0.25 0.00 0.77 0.00 0.00 66.41 67.41 2jul h THR 129 Cb 1.23 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.58 2jul h THR 129 CO 0.10 0.00 0.66 0.22 0.37 0.00 0.00 175.52 176.87 2jul h TYR 130 N -1.16 0.41 -0.82 3.16 3.20 -1.93 0.39 116.97 120.23 2jul h TYR 130 Ca -0.12 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.73 2jul h TYR 130 Cb 0.89 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 39.00 2jul h TYR 130 CO 0.03 0.07 0.37 0.00 -1.64 0.00 0.00 178.16 177.00 2jul h ALA 131 N 1.58 1.10 0.41 1.82 0.00 -1.35 -0.32 119.26 122.50 2jul h ALA 131 Ca 0.51 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2jul h ALA 131 Cb 1.50 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2jul h ALA 131 CO -0.16 0.66 -0.20 1.25 0.00 0.00 0.00 179.25 180.80 2jul h HIS 132 N 1.18 -0.51 -0.82 0.00 -0.00 0.48 -0.98 115.15 114.50 2jul h HIS 132 Ca 0.28 -0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.68 2jul h HIS 132 Cb 0.15 0.17 -0.05 0.00 -0.00 0.00 0.00 27.41 27.68 2jul h HIS 132 CO 0.02 -0.30 0.51 0.74 -0.00 0.00 0.00 177.93 178.90 2jul h PHE 133 N -0.58 0.95 -0.69 5.26 0.04 -1.31 -1.61 116.94 119.01 2jul h PHE 133 Ca -0.06 0.03 0.07 0.00 2.80 0.00 0.00 57.97 60.81 2jul h PHE 133 Cb 0.44 -0.31 -0.06 0.00 2.20 0.00 0.00 35.95 38.22 2jul h PHE 133 CO -0.04 0.52 0.38 -0.07 -0.60 0.00 0.00 178.31 178.49 2jul h LEU 134 N 0.97 0.55 0.11 1.54 3.38 -0.74 -2.23 115.31 118.89 2jul h LEU 134 Ca 0.34 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.36 2jul h LEU 134 Cb 0.09 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2jul h LEU 134 CO -0.14 0.35 -0.19 0.15 0.09 0.00 0.00 178.44 178.69 2jul h PHE 135 N 0.68 -0.51 -0.85 1.13 3.04 -0.21 0.03 116.94 120.26 2jul h PHE 135 Ca 0.31 0.01 0.25 0.00 3.98 0.00 0.00 57.97 62.52 2jul h PHE 135 Cb 0.22 0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.91 2jul h PHE 135 CO -0.08 -0.29 0.65 -0.97 -2.02 0.00 0.00 178.31 175.61 2jul h ASN 136 N -0.38 0.00 1.54 0.41 -0.00 -1.00 1.05 115.58 117.21 2jul h ASN 136 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 2jul h ASN 136 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.71 2jul h ASN 136 CO -0.10 0.00 -0.32 0.00 -0.00 0.00 0.00 177.43 177.00 2jul h ALA 137 N 1.49 0.83 -3.00 1.57 0.00 -0.53 -3.41 119.26 116.20 2jul h ALA 137 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2jul h ALA 137 Cb 1.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.50 2jul h ALA 137 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 2jul n PHE 138 N -2.76 0.00 -1.60 0.00 3.72 0.36 -4.89 117.46 112.29 2jul n PHE 138 Ca 0.03 0.00 -0.58 0.00 -0.05 0.00 0.00 57.45 56.85 2jul n PHE 138 Cb 0.51 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.97 2jul n PHE 138 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2jul n ASP 139 N -0.69 1.04 0.00 4.37 -0.08 -0.87 -4.88 116.55 115.44 2jul n ASP 139 Ca 0.00 1.14 0.00 0.00 -1.51 0.00 0.00 54.79 54.42 2jul n ASP 139 Cb 0.00 -1.03 0.00 0.00 2.34 0.00 0.00 41.12 42.43 2jul n ASP 139 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jul n ALA 140 N 2.79 1.66 -3.14 -1.67 0.00 -1.26 -4.85 120.51 114.05 2jul n ALA 140 Ca 0.22 -0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.19 2jul n ALA 140 Cb 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.55 2jul n ALA 140 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jul n ASP 141 N -1.98 5.96 -3.64 0.00 2.03 -1.26 -4.95 116.55 112.71 2jul n ASP 141 Ca 0.00 -3.32 -0.10 0.00 0.52 0.00 0.00 54.79 51.89 2jul n ASP 141 Cb 0.00 -1.25 -0.07 0.00 -0.72 0.00 0.00 41.12 39.08 2jul n ASP 141 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2jul s GLY 142 N -1.07 -0.49 0.15 0.27 0.00 -1.26 -5.05 107.32 99.88 2jul s GLY 142 Ca 0.31 2.32 -0.18 0.00 0.00 0.00 0.00 44.72 47.17 2jul s GLY 142 CO 0.05 2.04 1.68 3.45 0.00 0.00 0.00 173.10 180.31 2jul h ASN 143 N 5.63 -0.31 0.00 1.64 7.08 -2.01 -3.41 115.58 124.20 2jul h ASN 143 Ca -0.29 0.10 -0.08 0.00 -3.08 0.00 0.00 56.30 52.94 2jul h ASN 143 Cb 1.19 0.20 -0.09 0.00 -2.08 0.00 0.00 38.32 37.54 2jul h ASN 143 CO 0.10 -0.11 0.19 0.61 -2.08 0.00 0.00 177.43 176.14 2jul n GLY 144 N -1.27 -1.10 3.19 9.14 0.00 -1.26 -5.14 105.19 108.76 2jul n GLY 144 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 46.02 46.21 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 0.02 -0.96 0.09 4.61 0.00 -1.26 -4.62 121.76 119.64 2jul s ALA 145 Ca 0.08 1.34 0.06 0.00 0.00 0.00 0.00 51.96 53.44 2jul s ALA 145 Cb 0.13 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 2jul s ALA 145 CO -0.08 -0.66 -0.05 0.96 0.00 0.00 0.00 175.76 175.93 2jul s ILE 146 N 2.41 3.71 0.18 0.00 -4.36 -0.62 -4.89 121.20 117.62 2jul s ILE 146 Ca -0.02 -1.11 0.01 0.00 -0.26 0.00 0.00 60.65 59.28 2jul s ILE 146 Cb -0.12 -2.75 -0.00 0.00 1.25 0.00 0.00 42.46 40.84 2jul s ILE 146 CO -0.11 0.13 0.04 1.57 0.24 0.00 0.00 174.94 176.81 2jul n HIS 147 N 0.67 0.17 0.01 1.37 -0.00 -1.26 -0.67 115.22 115.51 2jul n HIS 147 Ca -0.12 -1.05 -0.11 0.00 0.46 0.00 0.00 57.72 56.89 2jul n HIS 147 Cb 0.52 -0.04 0.02 0.00 -0.12 0.00 0.00 29.99 30.37 2jul n HIS 147 CO 0.00 0.00 0.00 0.35 0.46 0.00 0.00 176.34 177.15 2jul h PHE 148 N 1.23 0.74 0.15 1.57 3.57 -1.99 -2.71 116.94 119.51 2jul h PHE 148 Ca -0.14 -0.29 0.01 0.00 3.53 0.00 0.00 57.97 61.08 2jul h PHE 148 Cb 0.50 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 2jul h PHE 148 CO 0.00 1.06 -0.26 0.93 -2.23 0.00 0.00 178.31 177.80 2jul h GLU 149 N 0.41 -0.48 -0.82 1.11 5.08 -1.99 0.49 114.58 118.39 2jul h GLU 149 Ca -0.01 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2jul h GLU 149 Cb 1.22 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.53 2jul h GLU 149 CO 0.12 -0.32 0.54 0.22 -1.00 0.00 0.00 179.01 178.57 2jul h ASP 150 N -0.49 0.92 0.11 1.42 1.82 -1.97 -0.48 116.42 117.74 2jul h ASP 150 Ca 0.02 -0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.61 2jul h ASP 150 Cb 0.50 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 40.28 2jul h ASP 150 CO -0.13 0.66 -0.13 0.15 -1.61 0.00 0.00 179.24 178.18 2jul h PHE 151 N 1.08 0.06 -0.16 0.28 3.04 -0.99 -2.14 116.94 118.11 2jul h PHE 151 Ca 0.31 -0.00 -0.21 0.00 3.98 0.00 0.00 57.97 62.05 2jul h PHE 151 Cb -0.08 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.41 2jul h PHE 151 CO -0.00 0.19 -0.72 0.28 -2.02 0.00 0.00 178.31 176.04 2jul h VAL 152 N 0.06 1.30 -0.62 1.41 2.07 0.72 -2.52 116.25 118.66 2jul h VAL 152 Ca 0.01 -1.97 0.08 0.00 0.82 0.00 0.00 66.70 65.64 2jul h VAL 152 Cb 0.27 1.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 2jul h VAL 152 CO 0.02 0.62 0.29 0.58 0.02 0.00 0.00 177.57 179.10 2jul h VAL 153 N 0.49 0.86 -0.30 2.57 2.07 -0.78 -0.40 116.25 120.77 2jul h VAL 153 Ca -0.04 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 2jul h VAL 153 Cb 1.33 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2jul h VAL 153 CO 0.14 0.10 0.04 1.23 0.02 0.00 0.00 177.57 179.10 2jul h GLY 154 N 0.53 0.54 1.01 2.17 0.00 -1.45 -1.95 103.07 103.92 2jul h GLY 154 Ca 0.30 -0.37 0.14 0.00 0.00 0.00 0.00 47.33 47.40 2jul h GLY 154 CO -0.24 0.34 0.37 -2.00 0.00 0.00 0.00 176.54 175.01 2jul h LEU 155 N 0.32 0.00 -0.24 3.11 7.12 -0.86 0.36 115.31 125.13 2jul h LEU 155 Ca 0.09 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.89 2jul h LEU 155 Cb 0.36 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 2jul h LEU 155 CO 0.01 0.00 -0.91 0.28 -0.13 0.00 0.00 178.44 177.69 2jul h SER 156 N 0.00 0.36 -0.05 1.25 0.02 -0.38 -1.79 113.55 112.97 2jul h SER 156 Ca 0.22 -0.29 -0.22 0.00 -0.84 0.00 0.00 61.79 60.67 2jul h SER 156 Cb 0.95 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 63.40 2jul h SER 156 CO -0.00 1.09 -0.81 0.40 -1.14 0.00 0.00 176.83 176.37 2jul h ILE 157 N 0.15 1.32 -0.55 3.27 2.04 0.17 0.30 117.51 124.22 2jul h ILE 157 Ca -0.06 -2.09 -0.11 0.00 1.00 0.00 0.00 64.86 63.61 2jul h ILE 157 Cb 1.54 2.31 -0.02 0.00 -0.74 0.00 0.00 36.82 39.91 2jul h ILE 157 CO 0.15 0.64 -0.08 -0.07 0.00 0.00 0.00 178.15 178.79 2jul h LEU 158 N 0.28 1.01 0.00 1.44 4.07 -0.79 -3.30 115.31 118.03 2jul h LEU 158 Ca -0.09 -0.34 0.00 0.00 0.08 0.00 0.00 57.88 57.53 2jul h LEU 158 Cb 1.47 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.94 2jul h LEU 158 CO 0.16 1.11 0.00 0.18 -1.08 0.00 0.00 178.44 178.82 2jul n LEU 159 N -4.18 0.12 -3.33 1.67 4.77 -0.67 -4.49 117.00 110.88 2jul n LEU 159 Ca 0.02 0.22 -0.28 0.00 -0.03 0.00 0.00 56.01 55.93 2jul n LEU 159 Cb 0.38 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 2jul n LEU 159 CO 0.45 -0.46 2.07 -1.14 -1.33 0.00 0.00 177.39 176.98 2jul n ARG 160 N -2.16 1.53 -3.64 3.23 0.00 0.11 -4.70 116.66 111.03 2jul n ARG 160 Ca 0.00 -1.46 -0.07 0.00 -0.00 0.00 0.00 57.85 56.32 2jul n ARG 160 Cb 0.00 -2.57 -0.07 0.00 0.00 0.00 0.00 32.46 29.82 2jul n ARG 160 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2jul s GLY 161 N 4.35 -0.49 0.00 5.14 0.00 -1.24 -4.57 107.32 110.51 2jul s GLY 161 Ca 0.43 2.51 0.00 0.00 0.00 0.00 0.00 44.72 47.66 2jul s GLY 161 CO 0.05 2.32 0.00 -0.37 0.00 0.00 0.00 173.10 175.10 2jul n THR 162 N 3.89 0.00 0.01 0.90 5.66 -1.26 -4.69 114.28 118.79 2jul n THR 162 Ca -0.19 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.67 2jul n THR 162 Cb 0.58 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.22 2jul n THR 162 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 175.07 173.64 2jul h VAL 163 N 0.00 0.88 -0.74 1.08 3.04 -1.99 -3.27 116.25 115.26 2jul h VAL 163 Ca 0.00 -2.63 -0.03 0.00 -1.01 0.00 0.00 66.70 63.03 2jul h VAL 163 Cb 0.00 2.55 -0.03 0.00 -2.01 0.00 0.00 31.29 31.80 2jul h VAL 163 CO 0.00 0.73 0.34 0.45 -1.01 0.00 0.00 177.57 178.07 2jul h HIS 164 N 0.04 1.08 -0.35 3.17 3.86 -1.99 0.45 115.15 121.41 2jul h HIS 164 Ca -0.31 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 58.80 2jul h HIS 164 Cb 2.01 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 30.14 2jul h HIS 164 CO 0.04 0.80 0.07 0.93 0.86 0.00 0.00 177.93 180.64 2jul h GLU 165 N 1.04 0.57 -0.36 2.45 4.39 -1.88 -1.32 114.58 119.47 2jul h GLU 165 Ca 0.25 -0.14 -0.08 0.00 0.34 0.00 0.00 59.36 59.73 2jul h GLU 165 Cb 0.14 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2jul h GLU 165 CO -0.03 0.63 -0.09 0.87 -1.16 0.00 0.00 179.01 179.22 2jul h LYS 166 N 0.41 0.62 -0.47 2.33 1.57 -1.55 -1.59 116.57 117.89 2jul h LYS 166 Ca 0.11 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.60 2jul h LYS 166 Cb 0.32 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2jul h LYS 166 CO 0.00 0.70 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.39 2jul h LEU 167 N 0.57 0.87 -0.24 2.94 3.38 -0.64 0.76 115.31 122.95 2jul h LEU 167 Ca 0.11 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 2jul h LEU 167 Cb 0.50 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2jul h LEU 167 CO 0.03 1.01 -0.22 0.50 0.09 0.00 0.00 178.44 179.85 2jul h LYS 168 N 0.78 0.57 -0.36 1.13 3.64 -0.91 -2.21 116.57 119.22 2jul h LYS 168 Ca 0.12 -0.29 -0.10 0.00 -1.27 0.00 0.00 60.65 59.11 2jul h LYS 168 Cb 0.65 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 2jul h LYS 168 CO 0.05 0.88 -0.20 2.35 -2.27 0.00 0.00 179.45 180.26 2jul h TRP 169 N 0.28 0.76 -0.86 1.91 7.01 -1.20 -2.60 115.95 121.25 2jul h TRP 169 Ca 0.04 -0.16 -0.02 0.00 2.11 0.00 0.00 58.89 60.86 2jul h TRP 169 Cb 0.77 -0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 27.60 2jul h TRP 169 CO 0.07 0.83 0.47 0.00 -2.79 0.00 0.00 178.44 177.02 2jul h ALA 170 N 1.18 1.10 -0.27 2.65 0.00 -0.75 -2.49 119.26 120.67 2jul h ALA 170 Ca 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2jul h ALA 170 Cb 0.67 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2jul h ALA 170 CO 0.05 0.61 0.15 0.35 0.00 0.00 0.00 179.25 180.41 2jul h PHE 171 N 1.20 0.38 -0.96 0.00 3.04 -1.09 -2.37 116.94 117.13 2jul h PHE 171 Ca 0.30 -0.01 0.17 0.00 3.98 0.00 0.00 57.97 62.41 2jul h PHE 171 Cb 0.04 -0.12 -0.10 0.00 2.56 0.00 0.00 35.95 38.33 2jul h PHE 171 CO 0.01 0.31 0.57 -0.97 -2.02 0.00 0.00 178.31 176.21 2jul h ASN 172 N 0.33 0.74 0.90 0.41 -0.00 -1.09 0.34 115.58 117.21 2jul h ASN 172 Ca 0.10 0.09 -0.04 0.00 -0.00 0.00 0.00 56.30 56.44 2jul h ASN 172 Cb 0.06 -0.04 0.01 0.00 -0.00 0.00 0.00 38.32 38.35 2jul h ASN 172 CO -0.02 0.29 -0.43 0.25 -0.00 0.00 0.00 177.43 177.53 2jul h LEU 173 N 0.76 -1.02 -0.49 0.34 6.46 -1.05 -3.07 115.31 117.25 2jul h LEU 173 Ca 0.54 0.03 0.04 0.00 -0.12 0.00 0.00 57.88 58.36 2jul h LEU 173 Cb 0.77 0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 40.92 2jul h LEU 173 CO -0.36 -0.71 0.25 1.88 -0.62 0.00 0.00 178.44 178.88 2jul h TYR 174 N -1.24 0.47 -1.59 1.25 -1.99 -1.10 -3.40 116.97 109.37 2jul h TYR 174 Ca -0.12 0.02 -0.61 0.00 2.00 0.00 0.00 58.73 60.01 2jul h TYR 174 Cb 0.93 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 2jul h TYR 174 CO -0.01 0.24 1.48 -3.47 -0.00 0.00 0.00 178.16 176.40 2jul n ASP 175 N -4.88 2.73 -1.14 3.88 2.03 0.12 -4.92 116.55 114.37 2jul n ASP 175 Ca 0.04 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.58 2jul n ASP 175 Cb 0.12 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.08 2jul n ASP 175 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jul n ILE 176 N 7.57 0.00 -4.35 5.18 0.13 -1.26 -4.76 119.36 121.86 2jul n ILE 176 Ca 0.35 0.00 -0.34 0.00 -1.10 0.00 0.00 62.75 61.66 2jul n ILE 176 Cb 0.36 -0.32 -0.09 0.00 -0.84 0.00 0.00 39.64 38.76 2jul n ILE 176 CO 0.00 0.00 0.00 -0.46 2.80 0.00 0.00 176.55 178.89 2jul n ASN 177 N -0.93 -0.10 -0.02 9.51 0.23 -1.26 -4.53 115.26 118.16 2jul n ASN 177 Ca 0.00 -1.24 0.00 0.00 -0.53 0.00 0.00 54.58 52.81 2jul n ASN 177 Cb 0.00 -1.76 0.00 0.00 -2.08 0.00 0.00 39.78 35.94 2jul n ASN 177 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 2jul n LYS 178 N -4.42 0.00 -0.49 -3.83 4.81 -1.26 -4.92 118.16 108.05 2jul n LYS 178 Ca -0.19 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.32 2jul n LYS 178 Cb 0.62 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.65 2jul n LYS 178 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2jul n ASP 179 N -3.67 -6.43 -3.18 3.14 5.68 -1.26 -4.66 116.55 106.17 2jul n ASP 179 Ca 0.00 0.53 -0.18 0.00 -0.50 0.00 0.00 54.79 54.63 2jul n ASP 179 Cb 0.00 -1.48 -0.03 0.00 -1.14 0.00 0.00 41.12 38.47 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 -1.46 3.70 3.20 6.12 0.00 -1.26 -4.89 105.19 110.59 2jul n GLY 180 Ca 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.59 3.18 0.14 0.00 1.01 0.63 -4.75 121.20 119.83 2jul s ILE 182 Ca -0.12 -1.89 -0.17 0.00 0.00 0.00 0.00 60.65 58.47 2jul s ILE 182 Cb -0.05 -2.65 0.04 0.00 0.01 0.00 0.00 42.46 39.81 2jul s ILE 182 CO 0.02 -0.27 0.44 -0.89 0.00 0.00 0.00 174.94 174.24 2jul s THR 183 N -2.10 0.06 0.38 2.92 2.01 -1.26 -0.66 115.64 116.98 2jul s THR 183 Ca 0.28 -0.59 0.17 0.00 0.31 0.00 0.00 61.69 61.86 2jul s THR 183 Cb -0.07 -1.25 0.37 0.00 0.01 0.00 0.00 72.50 71.56 2jul s THR 183 CO 0.17 -0.25 1.75 0.11 -0.69 0.00 0.00 174.62 175.71 2jul h LYS 184 N 2.31 0.41 -0.08 4.92 1.79 -1.99 0.96 116.57 124.88 2jul h LYS 184 Ca -0.33 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.10 2jul h LYS 184 Cb 1.26 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2jul h LYS 184 CO 0.44 0.27 0.00 0.93 -1.08 0.00 0.00 179.45 180.02 2jul h GLU 185 N 0.42 0.15 -0.61 3.15 5.08 -1.99 -1.58 114.58 119.20 2jul h GLU 185 Ca 0.63 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.92 2jul h GLU 185 Cb 1.50 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.71 2jul h GLU 185 CO -0.36 0.41 0.32 0.93 -1.00 0.00 0.00 179.01 179.31 2jul h GLU 186 N -0.13 0.84 0.00 2.33 5.08 -1.29 -1.28 114.58 120.13 2jul h GLU 186 Ca 0.02 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2jul h GLU 186 Cb 0.34 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2jul h GLU 186 CO 0.00 0.63 -0.20 0.52 -1.00 0.00 0.00 179.01 178.97 2jul h MET 187 N 0.85 0.00 -0.13 2.33 2.86 -0.86 -2.77 114.93 117.21 2jul h MET 187 Ca 0.21 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.64 2jul h MET 187 Cb 0.05 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.71 2jul h MET 187 CO -0.03 0.20 -0.76 -0.07 1.06 0.00 0.00 176.91 177.30 2jul h LEU 188 N 0.00 0.80 -0.24 1.22 3.38 -0.20 -0.92 115.31 119.34 2jul h LEU 188 Ca -0.00 -0.52 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 2jul h LEU 188 Cb 0.78 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2jul h LEU 188 CO 0.03 1.31 -0.10 0.00 0.09 0.00 0.00 178.44 179.76 2jul h ALA 189 N 0.68 0.34 -0.47 1.53 0.00 -1.34 -1.16 119.26 118.84 2jul h ALA 189 Ca -0.05 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 2jul h ALA 189 Cb 1.37 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2jul h ALA 189 CO 0.15 0.19 0.08 0.82 0.00 0.00 0.00 179.25 180.48 2jul h ILE 190 N 0.23 1.25 -0.59 0.00 1.08 -1.52 -2.38 117.51 115.57 2jul h ILE 190 Ca 0.06 -0.91 -0.02 0.00 -0.39 0.00 0.00 64.86 63.60 2jul h ILE 190 Cb 0.60 0.93 -0.03 0.00 -3.07 0.00 0.00 36.82 35.24 2jul h ILE 190 CO 0.03 0.32 0.29 -0.03 -0.69 0.00 0.00 178.15 178.08 2jul h MET 191 N 0.65 0.82 -0.78 2.37 4.05 -1.10 -1.98 114.93 118.96 2jul h MET 191 Ca 0.14 -0.10 -0.04 0.00 -0.28 0.00 0.00 59.70 59.43 2jul h MET 191 Cb 0.39 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 30.99 2jul h MET 191 CO 0.01 0.62 0.33 -0.22 0.23 0.00 0.00 176.91 177.88 2jul h LYS 192 N 0.82 1.16 -0.15 0.39 3.11 -0.83 -1.69 116.57 119.39 2jul h LYS 192 Ca 0.21 -0.20 0.02 0.00 -2.81 0.00 0.00 60.65 57.87 2jul h LYS 192 Cb 0.06 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 31.08 2jul h LYS 192 CO -0.03 0.94 0.00 0.66 -2.81 0.00 0.00 179.45 178.21 2jul h SER 193 N 1.13 -0.05 -0.09 4.20 4.64 -0.87 0.27 113.55 122.78 2jul h SER 193 Ca 0.26 0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.62 2jul h SER 193 Cb 0.20 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 2jul h SER 193 CO -0.02 -0.00 0.03 0.40 -0.87 0.00 0.00 176.83 176.36 2jul h ILE 194 N 0.05 0.98 -0.67 0.95 5.03 -1.23 -0.91 117.51 121.71 2jul h ILE 194 Ca 0.07 -0.03 0.10 0.00 -0.12 0.00 0.00 64.86 64.88 2jul h ILE 194 Cb 0.08 0.90 -0.04 0.00 -3.03 0.00 0.00 36.82 34.73 2jul h ILE 194 CO -0.11 0.01 0.45 1.88 -0.68 0.00 0.00 178.15 179.70 2jul h TYR 195 N 0.07 0.56 0.00 1.37 -1.99 -0.95 0.13 116.97 116.17 2jul h TYR 195 Ca 0.04 0.02 -0.10 0.00 2.00 0.00 0.00 58.73 60.68 2jul h TYR 195 Cb 0.02 -0.18 -0.01 0.00 2.00 0.00 0.00 36.73 38.55 2jul h TYR 195 CO -0.10 0.26 -0.46 -0.44 -0.00 0.00 0.00 178.16 177.43 2jul h ASP 196 N 0.53 0.00 -0.51 3.88 3.32 -0.05 -3.10 116.42 120.49 2jul h ASP 196 Ca 0.31 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.24 2jul h ASP 196 Cb 0.51 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 2jul h ASP 196 CO -0.10 0.46 -0.16 -0.03 -1.72 0.00 0.00 179.24 177.70 2jul h MET 197 N 0.00 1.01 -5.72 3.56 4.05 0.59 -3.39 114.93 115.04 2jul h MET 197 Ca -0.00 -0.40 -0.41 0.00 -0.28 0.00 0.00 59.70 58.60 2jul h MET 197 Cb 1.01 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.74 2jul h MET 197 CO 0.06 1.08 1.31 -1.64 0.23 0.00 0.00 176.91 177.95 2jul s MET 198 N -4.77 2.25 0.10 0.39 -1.94 -1.01 -4.75 119.30 109.58 2jul s MET 198 Ca -0.11 0.91 0.25 0.00 -1.71 0.00 0.00 55.69 55.03 2jul s MET 198 Cb 0.13 -4.57 0.97 0.00 2.01 0.00 0.00 34.83 33.36 2jul s MET 198 CO 0.87 -3.23 1.77 0.41 -0.01 0.00 0.00 175.02 174.83 2jul n GLY 199 N 6.05 -1.44 3.88 -0.03 0.00 -1.26 -4.75 105.19 107.64 2jul n GLY 199 Ca 0.32 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 2jul n GLY 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jul s ARG 200 N -3.07 3.54 0.22 1.61 0.52 -1.26 -5.07 118.95 115.43 2jul s ARG 200 Ca 0.10 -0.10 -0.08 0.00 -0.52 0.00 0.00 55.73 55.13 2jul s ARG 200 Cb 0.14 -3.12 -0.02 0.00 0.52 0.00 0.00 34.95 32.47 2jul s ARG 200 CO 0.48 0.69 0.32 -3.38 0.02 0.00 0.00 175.30 173.44 2jul s HIS 201 N -1.21 0.65 0.00 -0.53 -3.43 -1.26 -5.16 115.29 104.34 2jul s HIS 201 Ca 0.24 -0.97 0.00 0.00 -0.80 0.00 0.00 55.06 53.53 2jul s HIS 201 Cb -0.13 -0.12 0.00 0.00 -1.43 0.00 0.00 32.58 30.90 2jul s HIS 201 CO 0.13 -0.82 0.00 2.41 -2.00 0.00 0.00 174.74 174.46 2jul n THR 202 N -0.32 0.00 -1.71 -5.38 -1.04 -1.26 -5.00 114.28 99.58 2jul n THR 202 Ca -0.01 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.57 2jul n THR 202 Cb 0.63 -0.80 -0.03 0.00 -1.82 0.00 0.00 70.33 68.31 2jul n THR 202 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2jul n TYR 203 N 0.00 2.68 0.13 -1.42 4.02 -1.26 -4.83 117.16 116.49 2jul n TYR 203 Ca 0.00 0.03 0.04 0.00 -0.01 0.00 0.00 57.90 57.96 2jul n TYR 203 Cb 0.00 -2.67 0.18 0.00 -0.02 0.00 0.00 39.34 36.83 2jul n TYR 203 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2jul n PRO 204 N 4.20 0.03 -1.47 -0.72 -0.04 -1.26 -4.79 135.00 130.95 2jul n PRO 204 Ca 0.16 0.48 -0.46 0.00 -0.04 0.00 0.00 63.50 63.65 2jul n PRO 204 Cb 0.35 -1.60 -0.02 0.00 -0.04 0.00 0.00 33.50 32.19 2jul n PRO 204 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2jul n ILE 205 N -1.67 1.93 -1.59 0.52 3.06 -1.26 -4.56 119.36 115.79 2jul n ILE 205 Ca 0.00 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.75 2jul n ILE 205 Cb 0.04 -0.41 0.00 0.00 0.54 0.00 0.00 39.64 39.82 2jul n ILE 205 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2jul n LEU 206 N 1.66 -1.81 -3.93 9.51 4.77 -1.26 -4.55 117.00 121.39 2jul n LEU 206 Ca 0.14 2.92 -0.43 0.00 -0.03 0.00 0.00 56.01 58.62 2jul n LEU 206 Cb 0.29 -3.13 0.00 0.00 -2.33 0.00 0.00 43.42 38.25 2jul n LEU 206 CO 0.57 -0.53 2.01 -1.14 -1.33 0.00 0.00 177.39 176.98 2jul n ARG 207 N -2.22 3.47 -0.12 3.23 0.63 -1.26 -4.81 116.66 115.58 2jul n ARG 207 Ca 0.00 -3.41 0.00 0.00 -0.92 0.00 0.00 57.85 53.52 2jul n ARG 207 Cb 0.37 -3.01 0.00 0.00 0.45 0.00 0.00 32.46 30.27 2jul n ARG 207 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jul n GLU 208 N 4.51 0.36 -2.97 -0.14 -0.58 -1.26 -4.60 120.64 115.97 2jul n GLU 208 Ca 0.42 0.00 -0.44 0.00 -0.42 0.00 0.00 57.16 56.72 2jul n GLU 208 Cb 0.38 -1.32 0.00 0.00 -0.57 0.00 0.00 31.44 29.93 2jul n GLU 208 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2jul n ASP 209 N 1.46 5.25 -2.72 1.62 8.00 -1.26 -4.67 116.55 124.23 2jul n ASP 209 Ca 0.00 -2.99 -0.08 0.00 0.71 0.00 0.00 54.79 52.43 2jul n ASP 209 Cb 0.18 -1.55 0.09 0.00 -0.02 0.00 0.00 41.12 39.82 2jul n ASP 209 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jul n ALA 210 N 5.31 -1.31 0.24 2.24 0.00 -1.26 -4.96 120.51 120.76 2jul n ALA 210 Ca 0.36 -1.25 0.01 0.00 0.00 0.00 0.00 53.44 52.56 2jul n ALA 210 Cb 0.42 -1.55 0.08 0.00 0.00 0.00 0.00 19.45 18.40 2jul n ALA 210 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jul n PRO 211 N 0.57 0.12 0.23 0.00 -0.04 -1.26 -2.40 135.00 132.22 2jul n PRO 211 Ca 0.04 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.65 2jul n PRO 211 Cb 0.70 -1.34 0.52 0.00 -0.04 0.00 0.00 33.50 33.34 2jul n PRO 211 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2jul h LEU 212 N 0.00 0.00 0.38 1.53 8.10 -1.97 -3.25 115.31 120.10 2jul h LEU 212 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 2jul h LEU 212 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.22 2jul h LEU 212 CO 0.00 0.00 -0.18 1.05 -4.11 0.00 0.00 178.44 175.20 2jul h GLU 213 N 0.00 -0.49 -0.39 0.17 4.11 -1.92 -2.18 114.58 113.88 2jul h GLU 213 Ca 0.00 0.03 0.08 0.00 0.07 0.00 0.00 59.36 59.54 2jul h GLU 213 Cb 0.61 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.90 2jul h GLU 213 CO 0.00 -0.19 -0.14 1.25 0.07 0.00 0.00 179.01 180.00 2jul h HIS 214 N -0.79 -0.32 -0.85 2.06 2.76 -1.82 0.45 115.15 116.64 2jul h HIS 214 Ca -0.05 0.04 0.15 0.00 -2.20 0.00 0.00 60.37 58.31 2jul h HIS 214 Cb 0.53 0.20 -0.09 0.00 1.55 0.00 0.00 27.41 29.59 2jul h HIS 214 CO 0.01 -0.21 0.43 0.28 -1.30 0.00 0.00 177.93 177.14 2jul h VAL 215 N -0.05 0.72 -0.99 5.26 2.07 -1.61 0.20 116.25 121.84 2jul h VAL 215 Ca 0.19 -0.21 0.12 0.00 0.82 0.00 0.00 66.70 67.63 2jul h VAL 215 Cb 0.35 0.05 -0.09 0.00 -1.52 0.00 0.00 31.29 30.08 2jul h VAL 215 CO -0.43 0.11 0.62 -0.08 0.02 0.00 0.00 177.57 177.81 2jul h GLU 216 N 0.61 0.93 0.65 1.57 4.81 -0.25 -0.56 114.58 122.35 2jul h GLU 216 Ca 0.47 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.61 2jul h GLU 216 Cb 0.67 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2jul h GLU 216 CO -0.37 0.62 -0.42 -0.09 -0.73 0.00 0.00 179.01 178.02 2jul h ARG 217 N 0.96 -0.98 -0.45 1.92 9.65 -0.15 0.94 114.38 126.27 2jul h ARG 217 Ca 0.50 0.07 0.13 0.00 -1.10 0.00 0.00 59.98 59.58 2jul h ARG 217 Cb 0.51 0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 29.30 2jul h ARG 217 CO -0.27 -0.65 0.35 0.35 2.80 0.00 0.00 179.97 182.54 2jul h PHE 218 N -1.02 0.00 0.00 2.20 3.04 -1.15 0.58 116.94 120.60 2jul h PHE 218 Ca -0.08 0.00 -0.08 0.00 3.98 0.00 0.00 57.97 61.79 2jul h PHE 218 Cb 0.83 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.33 2jul h PHE 218 CO -0.12 0.00 -0.54 0.35 -2.02 0.00 0.00 178.31 175.98 2jul h PHE 219 N 0.00 0.00 -0.23 0.41 3.57 0.07 -2.46 116.94 118.30 2jul h PHE 219 Ca 0.22 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.58 2jul h PHE 219 Cb 0.91 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2jul h PHE 219 CO 0.00 0.37 -0.43 0.37 -2.23 0.00 0.00 178.31 176.39 2jul h GLN 220 N 0.00 0.56 0.21 1.11 5.75 0.65 -3.20 115.11 120.20 2jul h GLN 220 Ca -0.02 -0.30 -0.34 0.00 -0.15 0.00 0.00 58.65 57.84 2jul h GLN 220 Cb 1.30 0.01 0.02 0.00 1.07 0.00 0.00 27.48 29.89 2jul h GLN 220 CO 0.04 0.89 -1.59 -0.22 -2.65 0.00 0.00 178.83 175.30 2jul h LYS 221 N 0.46 0.45 0.00 1.69 1.63 -1.43 -3.45 116.57 115.91 2jul h LYS 221 Ca 0.03 -0.77 0.00 0.00 -0.85 0.00 0.00 60.65 59.06 2jul h LYS 221 Cb 0.94 0.29 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 2jul h LYS 221 CO 0.08 1.36 0.00 -0.12 -3.45 0.00 0.00 179.45 177.32 2jul n MET 222 N -3.64 0.00 0.00 1.90 1.56 -0.93 -4.78 117.12 111.23 2jul n MET 222 Ca -0.20 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.23 2jul n MET 222 Cb 1.09 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.46 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 0.00 6.12 -0.08 -1.24 -4.82 116.55 116.53 2jul n ASP 223 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2jul n ASP 223 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2jul n ASP 223 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2jul n ARG 224 N 0.00 0.00 -0.04 -0.67 1.74 -1.26 -4.82 116.66 111.61 2jul n ARG 224 Ca 0.00 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.09 2jul n ARG 224 Cb 0.00 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.44 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 -3.14 -2.47 -0.20 0.55 0.23 -1.26 -3.89 115.26 105.08 2jul n ASN 225 Ca 0.00 0.04 0.06 0.00 -0.53 0.00 0.00 54.58 54.15 2jul n ASN 225 Cb 0.00 -0.13 -0.03 0.00 -2.08 0.00 0.00 39.78 37.54 2jul n ASN 225 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jul n GLN 226 N -0.88 2.15 0.15 -3.83 -0.00 -1.26 -4.41 117.38 109.31 2jul n GLN 226 Ca 0.00 -0.48 0.03 0.00 -0.00 0.00 0.00 57.00 56.55 2jul n GLN 226 Cb 0.02 -1.17 0.14 0.00 -0.00 0.00 0.00 30.24 29.23 2jul n GLN 226 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.06 177.44 2jul h ASP 227 N 0.99 0.00 0.00 2.61 2.03 -1.94 -3.46 116.42 116.65 2jul h ASP 227 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2jul h ASP 227 Cb 0.41 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.91 2jul h ASP 227 CO 0.00 0.51 0.00 0.61 -1.03 0.00 0.00 179.24 179.33 2jul n GLY 228 N 0.80 1.73 3.83 7.15 0.00 -1.25 -4.93 105.19 112.52 2jul n GLY 228 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2jul n GLY 228 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jul s VAL 229 N -0.30 4.60 -0.18 1.61 1.01 -1.26 -4.75 120.40 121.13 2jul s VAL 229 Ca 0.00 1.12 -0.05 0.00 0.00 0.00 0.00 61.98 63.06 2jul s VAL 229 Cb 0.00 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 2jul s VAL 229 CO 0.00 -0.08 -0.01 0.54 0.00 0.00 0.00 175.10 175.54 2jul s VAL 230 N -1.87 3.92 0.30 2.92 0.11 0.16 -4.87 120.40 121.09 2jul s VAL 230 Ca 0.52 -0.33 0.10 0.00 -2.93 0.00 0.00 61.98 59.34 2jul s VAL 230 Cb -0.12 -2.75 -0.05 0.00 -1.53 0.00 0.00 36.38 31.92 2jul s VAL 230 CO 0.18 0.45 -0.10 0.42 -3.33 0.00 0.00 175.10 172.73 2jul s THR 231 N 0.78 2.65 0.51 5.04 -4.23 -1.26 0.23 115.64 119.37 2jul s THR 231 Ca -0.00 -2.18 0.33 0.00 -1.18 0.00 0.00 61.69 58.66 2jul s THR 231 Cb -0.14 -2.58 0.49 0.00 1.34 0.00 0.00 72.50 71.61 2jul s THR 231 CO 0.02 -0.31 1.25 0.00 -0.54 0.00 0.00 174.62 175.04 2jul n ILE 232 N -0.78 0.00 0.22 2.99 0.13 -1.26 0.45 119.36 121.11 2jul n ILE 232 Ca -0.05 1.20 -0.09 0.00 -1.10 0.00 0.00 62.75 62.71 2jul n ILE 232 Cb 0.61 -2.08 -0.05 0.00 -0.84 0.00 0.00 39.64 37.28 2jul n ILE 232 CO 0.00 0.00 0.00 0.44 2.80 0.00 0.00 176.55 179.79 2jul h ASP 233 N 0.00 -0.52 -0.20 9.51 5.19 -1.94 -1.03 116.42 127.42 2jul h ASP 233 Ca 0.62 0.02 0.06 0.00 -0.62 0.00 0.00 57.03 57.11 2jul h ASP 233 Cb 2.94 0.14 -0.01 0.00 0.18 0.00 0.00 39.33 42.58 2jul h ASP 233 CO -0.01 -0.12 0.38 -0.33 -3.12 0.00 0.00 179.24 176.04 2jul h GLU 234 N -1.13 0.00 0.20 3.56 5.08 -0.37 0.40 114.58 122.32 2jul h GLU 234 Ca -0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2jul h GLU 234 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2jul h GLU 234 CO 0.10 0.00 -0.10 0.35 -1.00 0.00 0.00 179.01 178.37 2jul h PHE 235 N 0.00 -0.25 0.00 4.33 3.57 -1.13 -1.81 116.94 121.65 2jul h PHE 235 Ca 0.10 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2jul h PHE 235 Cb 0.85 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.66 2jul h PHE 235 CO 0.00 -0.15 -0.16 -0.07 -2.23 0.00 0.00 178.31 175.70 2jul h LEU 236 N -0.85 0.00 -0.35 0.59 -0.00 -0.46 -0.10 115.31 114.14 2jul h LEU 236 Ca -0.03 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.66 2jul h LEU 236 Cb 0.20 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.86 2jul h LEU 236 CO 0.04 0.16 -0.80 -0.08 -0.00 0.00 0.00 178.44 177.76 2jul h GLU 237 N 0.00 0.33 0.00 1.13 4.22 -0.31 -0.69 114.58 119.26 2jul h GLU 237 Ca -0.00 -0.30 -0.20 0.00 0.08 0.00 0.00 59.36 58.94 2jul h GLU 237 Cb 0.31 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 2jul h GLU 237 CO 0.02 0.97 -0.96 1.15 -2.18 0.00 0.00 179.01 178.00 2jul h THR 238 N 0.21 1.68 0.00 0.32 2.02 -0.67 -2.82 112.91 113.64 2jul h THR 238 Ca -0.04 -3.33 0.00 0.00 0.77 0.00 0.00 66.41 63.81 2jul h THR 238 Cb 1.39 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 70.61 2jul h THR 238 CO 0.13 0.94 -0.81 0.00 0.37 0.00 0.00 175.52 176.16 2jul h GLN 240 N 0.00 0.00 0.00 0.00 4.20 -1.18 -3.36 115.11 114.78 2jul h GLN 240 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2jul h GLN 240 Cb 0.94 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.72 2jul h GLN 240 CO 0.00 0.48 0.00 1.63 -0.67 0.00 0.00 178.83 180.27 2jul n LYS 241 N -4.54 0.70 -3.59 1.46 5.02 -1.07 -4.72 118.16 111.43 2jul n LYS 241 Ca -0.19 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 55.96 2jul n LYS 241 Cb 0.45 -1.24 -0.06 0.00 -0.02 0.00 0.00 35.03 34.16 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 -1.63 -0.64 -0.40 4.39 -1.08 -1.22 -5.05 116.67 111.04 2jul s ASP 242 Ca 0.16 1.02 0.08 0.00 -0.52 0.00 0.00 52.55 53.30 2jul s ASP 242 Cb 0.07 0.96 0.26 0.00 -1.46 0.00 0.00 42.92 42.76 2jul s ASP 242 CO 0.12 -0.37 0.56 -0.62 0.52 0.00 0.00 175.17 175.38 2jul n GLU 243 N 1.83 0.83 0.00 4.34 4.71 -1.26 -4.10 120.64 127.00 2jul n GLU 243 Ca -0.15 -3.31 0.00 0.00 -0.01 0.00 0.00 57.16 53.69 2jul n GLU 243 Cb 0.56 -1.32 0.00 0.00 -1.01 0.00 0.00 31.44 29.67 2jul n GLU 243 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 2jul n ASN 244 N 1.25 0.00 -0.02 1.62 2.04 -1.26 -4.67 115.26 114.22 2jul n ASN 244 Ca 0.22 0.01 -0.16 0.00 -0.44 0.00 0.00 54.58 54.21 2jul n ASN 244 Cb 0.54 0.01 -0.09 0.00 -2.53 0.00 0.00 39.78 37.71 2jul n ASN 244 CO 0.00 0.00 0.00 -0.29 -0.44 0.00 0.00 177.26 176.53 2jul h ILE 245 N 0.00 1.40 0.00 1.53 6.09 -1.93 -3.03 117.51 121.57 2jul h ILE 245 Ca 0.00 -1.84 -0.04 0.00 -1.37 0.00 0.00 64.86 61.61 2jul h ILE 245 Cb 0.17 2.31 -0.01 0.00 0.47 0.00 0.00 36.82 39.76 2jul h ILE 245 CO 0.00 0.54 -0.18 0.24 -3.07 0.00 0.00 178.15 175.68 2jul h MET 246 N -0.01 0.00 -1.00 2.19 2.86 -1.89 -1.54 114.93 115.54 2jul h MET 246 Ca -0.04 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.77 2jul h MET 246 Cb 1.12 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.69 2jul h MET 246 CO 0.09 0.18 0.62 -0.97 1.06 0.00 0.00 176.91 177.89 2jul h ASN 247 N 0.00 0.81 -0.35 1.22 -0.73 -1.80 0.35 115.58 115.09 2jul h ASN 247 Ca -0.00 0.08 -0.13 0.00 1.87 0.00 0.00 56.30 58.12 2jul h ASN 247 Cb 0.36 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 2jul h ASN 247 CO 0.02 0.34 -0.29 -1.28 -0.37 0.00 0.00 177.43 175.86 2jul h SER 248 N 0.82 0.85 -0.96 1.15 0.87 -1.35 -2.78 113.55 112.16 2jul h SER 248 Ca 0.54 -0.45 0.09 0.00 -1.23 0.00 0.00 61.79 60.74 2jul h SER 248 Cb 0.78 -0.24 -0.07 0.00 -0.44 0.00 0.00 62.40 62.43 2jul h SER 248 CO -0.33 1.13 0.62 -0.03 -0.53 0.00 0.00 176.83 177.69 2jul h MET 249 N 0.59 1.01 0.17 2.24 1.85 -0.26 -1.79 114.93 118.74 2jul h MET 249 Ca 0.06 -0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 2jul h MET 249 Cb 0.86 -0.23 0.00 0.00 0.43 0.00 0.00 31.60 32.67 2jul h MET 249 CO 0.07 0.67 -0.08 1.96 -0.40 0.00 0.00 176.91 179.13 2jul h GLN 250 N 1.04 -0.22 -0.35 0.39 4.20 -0.44 -0.96 115.11 118.76 2jul h GLN 250 Ca 0.44 0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.26 2jul h GLN 250 Cb 0.31 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2jul h GLN 250 CO -0.19 -0.15 0.37 -0.07 -0.67 0.00 0.00 178.83 178.12 2jul h LEU 251 N -0.24 0.00 -0.41 1.46 3.38 -1.09 0.24 115.31 118.66 2jul h LEU 251 Ca -0.02 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 2jul h LEU 251 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2jul h LEU 251 CO 0.04 0.00 -0.60 0.15 0.09 0.00 0.00 178.44 178.12 2jul h PHE 252 N 0.00 0.81 -0.04 1.13 3.57 -0.56 -3.08 116.94 118.77 2jul h PHE 252 Ca 0.16 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 2jul h PHE 252 Cb 0.89 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2jul h PHE 252 CO 0.00 1.08 -0.45 1.49 -2.23 0.00 0.00 178.31 178.20 2jul h GLU 253 N 0.47 0.10 0.00 1.11 4.81 -0.07 -2.77 114.58 118.24 2jul h GLU 253 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2jul h GLU 253 Cb 1.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2jul h GLU 253 CO 0.12 0.54 0.41 -0.91 -0.73 0.00 0.00 179.01 178.43 2jul h ASN 254 N 0.08 0.00 -2.15 1.04 4.21 -1.34 -3.37 115.58 114.05 2jul h ASN 254 Ca 0.00 0.00 0.09 0.00 1.21 0.00 0.00 56.30 57.60 2jul h ASN 254 Cb 0.83 0.00 -0.22 0.00 -1.12 0.00 0.00 38.32 37.81 2jul h ASN 254 CO 0.06 0.00 0.06 0.54 -1.29 0.00 0.00 177.43 176.80 2jul s VAL 255 N -3.66 -0.48 0.00 2.81 0.11 -1.04 -5.14 120.40 112.99 2jul s VAL 255 Ca -0.02 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 2jul s VAL 255 Cb 0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.90 2jul s VAL 255 CO 0.16 0.00 0.02 2.30 -3.33 0.00 0.00 175.10 174.25