#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 1.99 0.10 0.54 1.02 -1.26 -4.89 120.64 118.14 2jul n GLU 77 Ca 0.00 0.70 -0.12 0.00 -0.02 0.00 0.00 57.16 57.72 2jul n GLU 77 Cb 0.00 -2.26 -0.08 0.00 -0.02 0.00 0.00 31.44 29.08 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 2.72 -0.30 0.85 0.62 0.00 -2.04 -1.44 103.07 103.48 2jul h GLY 78 Ca -0.45 0.11 0.01 0.00 0.00 0.00 0.00 47.33 47.00 2jul h GLY 78 CO 0.64 -0.11 -0.08 -2.00 0.00 0.00 0.00 176.54 174.99 2jul h LEU 79 N -0.76 -0.23 0.04 3.11 5.85 -1.98 0.57 115.31 121.90 2jul h LEU 79 Ca -0.03 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2jul h LEU 79 Cb 0.51 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 2jul h LEU 79 CO 0.05 -0.13 -0.27 -0.78 -0.34 0.00 0.00 178.44 176.97 2jul h ASP 80 N -0.17 -0.79 -0.43 1.25 1.82 -1.95 0.69 116.42 116.84 2jul h ASP 80 Ca 0.02 0.10 0.03 0.00 -0.39 0.00 0.00 57.03 56.79 2jul h ASP 80 Cb 0.18 0.32 -0.04 0.00 0.68 0.00 0.00 39.33 40.47 2jul h ASP 80 CO -0.05 -0.34 0.22 -0.61 -1.61 0.00 0.00 179.24 176.85 2jul h GLN 81 N -0.43 0.43 -0.92 0.28 4.15 -1.03 -0.41 115.11 117.17 2jul h GLN 81 Ca 0.05 -0.03 0.18 0.00 0.77 0.00 0.00 58.65 59.63 2jul h GLN 81 Cb 0.50 -0.10 -0.08 0.00 0.21 0.00 0.00 27.48 28.02 2jul h GLN 81 CO -0.21 0.28 0.59 1.25 -1.93 0.00 0.00 178.83 178.82 2jul h LEU 82 N 0.44 0.58 -0.16 -2.39 5.85 0.89 0.33 115.31 120.85 2jul h LEU 82 Ca 0.18 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2jul h LEU 82 Cb 0.08 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2jul h LEU 82 CO -0.12 0.25 0.04 -0.61 -0.34 0.00 0.00 178.44 177.66 2jul h GLN 83 N 0.59 0.11 -0.23 1.25 4.15 0.86 0.19 115.11 122.02 2jul h GLN 83 Ca 0.49 -0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.96 2jul h GLN 83 Cb 0.95 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.55 2jul h GLN 83 CO -0.23 0.07 -0.17 0.00 -1.93 0.00 0.00 178.83 176.56 2jul h ALA 84 N 1.11 -0.02 0.04 3.38 0.00 -0.66 -2.68 119.26 120.43 2jul h ALA 84 Ca 0.07 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jul h ALA 84 Cb 0.06 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jul h ALA 84 CO -0.09 -0.59 -0.02 0.37 0.00 0.00 0.00 179.25 178.92 2jul h GLN 85 N -0.17 -0.05 -5.09 0.00 5.75 -1.08 -3.34 115.11 111.14 2jul h GLN 85 Ca 0.13 0.00 -0.71 0.00 -0.15 0.00 0.00 58.65 57.93 2jul h GLN 85 Cb 0.37 0.01 -0.16 0.00 1.07 0.00 0.00 27.48 28.77 2jul h GLN 85 CO -0.33 -0.03 1.40 0.95 -2.65 0.00 0.00 178.83 178.16 2jul s THR 86 N -2.79 4.74 -0.44 2.39 -4.23 0.63 -4.96 115.64 110.98 2jul s THR 86 Ca -0.01 -2.17 -0.44 0.00 -1.18 0.00 0.00 61.69 57.89 2jul s THR 86 Cb 0.00 -4.94 -0.18 0.00 1.34 0.00 0.00 72.50 68.72 2jul s THR 86 CO 0.02 -1.69 1.79 0.29 -0.54 0.00 0.00 174.62 174.50 2jul n LYS 87 N 6.51 0.35 -3.42 3.99 4.76 -1.01 -4.54 118.16 124.81 2jul n LYS 87 Ca 0.36 0.12 0.02 0.00 -2.87 0.00 0.00 58.31 55.94 2jul n LYS 87 Cb 0.45 -1.71 -0.05 0.00 -1.84 0.00 0.00 35.03 31.88 2jul n LYS 87 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2jul s PHE 88 N 4.09 -0.25 0.01 2.13 0.08 -1.26 -5.09 117.98 117.69 2jul s PHE 88 Ca 1.07 0.46 -0.38 0.00 0.12 0.00 0.00 56.93 58.20 2jul s PHE 88 Cb -1.35 0.15 -0.18 0.00 -0.57 0.00 0.00 43.02 41.07 2jul s PHE 88 CO 0.72 -0.12 1.28 2.41 -0.10 0.00 0.00 175.22 179.41 2jul n THR 89 N 4.08 0.02 -0.28 0.64 -1.04 -1.26 -4.54 114.28 111.90 2jul n THR 89 Ca -0.12 -0.00 0.34 0.00 -2.04 0.00 0.00 64.05 62.23 2jul n THR 89 Cb 0.55 -0.55 0.69 0.00 -1.82 0.00 0.00 70.33 69.20 2jul n THR 89 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2jul h LYS 90 N 4.21 0.00 0.34 -2.82 3.64 -1.97 0.39 116.57 120.36 2jul h LYS 90 Ca -0.49 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2jul h LYS 90 Cb 1.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2jul h LYS 90 CO 0.75 0.00 -0.17 0.87 -2.27 0.00 0.00 179.45 178.64 2jul h LYS 91 N 0.00 -0.45 -0.49 1.90 1.57 -2.00 -0.51 116.57 116.60 2jul h LYS 91 Ca 0.53 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.46 2jul h LYS 91 Cb 2.45 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 34.84 2jul h LYS 91 CO -0.01 -0.30 0.34 0.93 -0.57 0.00 0.00 179.45 179.85 2jul h GLU 92 N -0.79 0.16 -0.31 3.15 4.39 -1.38 0.26 114.58 120.06 2jul h GLU 92 Ca -0.05 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 2jul h GLU 92 Cb 0.35 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2jul h GLU 92 CO 0.08 0.11 0.09 1.25 -1.16 0.00 0.00 179.01 179.38 2jul h LEU 93 N 0.17 0.46 -0.68 1.33 6.46 -0.26 -2.66 115.31 120.13 2jul h LEU 93 Ca 0.23 -0.21 0.14 0.00 -0.12 0.00 0.00 57.88 57.92 2jul h LEU 93 Cb 0.69 -0.12 -0.10 0.00 -0.73 0.00 0.00 40.66 40.40 2jul h LEU 93 CO -0.03 0.55 0.16 -0.61 -0.62 0.00 0.00 178.44 177.88 2jul h GLN 94 N 0.34 0.27 -0.09 1.25 4.15 0.77 0.67 115.11 122.47 2jul h GLN 94 Ca 0.10 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.54 2jul h GLN 94 Cb 0.26 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 27.84 2jul h GLN 94 CO -0.00 0.18 -0.19 1.03 -1.93 0.00 0.00 178.83 177.91 2jul h SER 95 N 0.28 -0.59 -0.46 -0.69 0.87 -1.22 0.60 113.55 112.34 2jul h SER 95 Ca 0.37 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 61.02 2jul h SER 95 Cb 0.58 0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.79 2jul h SER 95 CO -0.45 -0.25 0.26 -0.07 -0.53 0.00 0.00 176.83 175.79 2jul h LEU 96 N -0.27 0.56 -0.88 2.23 3.38 -0.81 -2.13 115.31 117.40 2jul h LEU 96 Ca 0.09 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.06 2jul h LEU 96 Cb 0.39 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 2jul h LEU 96 CO -0.24 0.48 0.54 0.22 0.09 0.00 0.00 178.44 179.52 2jul h TYR 97 N 0.60 0.99 -0.17 1.13 5.03 0.11 -1.79 116.97 122.88 2jul h TYR 97 Ca 0.16 0.03 0.02 0.00 2.58 0.00 0.00 58.73 61.52 2jul h TYR 97 Cb 0.03 -0.32 -0.02 0.00 1.55 0.00 0.00 36.73 37.97 2jul h TYR 97 CO -0.02 0.47 0.03 -0.09 -1.32 0.00 0.00 178.16 177.22 2jul h ARG 98 N 0.95 0.09 -0.76 1.82 2.43 0.81 0.95 114.38 120.67 2jul h ARG 98 Ca 0.40 -0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.74 2jul h ARG 98 Cb 0.26 -0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 29.67 2jul h ARG 98 CO -0.20 0.06 0.13 0.78 -1.51 0.00 0.00 179.97 179.22 2jul h GLY 99 N 0.09 1.01 0.95 2.80 0.00 -0.83 1.17 103.07 108.26 2jul h GLY 99 Ca 0.08 0.01 -0.08 0.00 0.00 0.00 0.00 47.33 47.34 2jul h GLY 99 CO -0.11 -0.26 -0.09 -2.75 0.00 0.00 0.00 176.54 173.34 2jul h PHE 100 N 0.20 0.79 -0.51 5.60 3.57 -1.06 -2.87 116.94 122.66 2jul h PHE 100 Ca 0.43 -0.17 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 2jul h PHE 100 Cb 0.78 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2jul h PHE 100 CO -0.32 0.85 0.12 -0.22 -2.23 0.00 0.00 178.31 176.51 2jul h LYS 101 N 0.50 0.78 -0.11 1.11 3.64 0.18 -1.56 116.57 121.11 2jul h LYS 101 Ca 0.09 -0.16 0.03 0.00 -1.27 0.00 0.00 60.65 59.35 2jul h LYS 101 Cb 0.59 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2jul h LYS 101 CO 0.04 0.71 0.12 -0.97 -2.27 0.00 0.00 179.45 177.08 2jul h ASN 102 N 0.76 0.00 -2.62 4.20 -0.73 0.15 -3.16 115.58 114.16 2jul h ASN 102 Ca 0.17 0.00 -0.79 0.00 1.87 0.00 0.00 56.30 57.55 2jul h ASN 102 Cb 0.29 0.00 -0.24 0.00 0.27 0.00 0.00 38.32 38.64 2jul h ASN 102 CO -0.00 0.00 1.06 1.21 -0.37 0.00 0.00 177.43 179.32 2jul n GLU 103 N -3.85 4.02 -1.07 6.67 4.07 -0.59 -4.88 120.64 125.02 2jul n GLU 103 Ca -0.00 -4.25 0.00 0.00 -0.06 0.00 0.00 57.16 52.85 2jul n GLU 103 Cb 0.23 -2.66 0.00 0.00 -0.06 0.00 0.00 31.44 28.95 2jul n GLU 103 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jul n PRO 105 N 0.59 0.06 -2.73 0.00 -0.01 -1.25 -4.70 135.00 126.96 2jul n PRO 105 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 63.50 63.20 2jul n PRO 105 Cb 0.00 -1.06 -0.02 0.00 -0.01 0.00 0.00 33.50 32.41 2jul n PRO 105 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 175.50 176.44 2jul s THR 106 N -0.88 4.82 -1.70 3.45 -4.23 -1.26 -4.97 115.64 110.87 2jul s THR 106 Ca 0.00 0.50 0.21 0.00 -1.18 0.00 0.00 61.69 61.22 2jul s THR 106 Cb 0.00 -3.78 0.67 0.00 1.34 0.00 0.00 72.50 70.72 2jul s THR 106 CO 0.00 -0.66 1.56 0.61 -0.54 0.00 0.00 174.62 175.59 2jul n GLY 107 N -1.69 2.48 2.98 3.99 0.00 -1.26 -4.90 105.19 106.78 2jul n GLY 107 Ca 0.02 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 2jul n GLY 107 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jul s LEU 108 N -1.29 2.17 0.15 0.99 2.96 -1.26 -4.53 118.68 117.87 2jul s LEU 108 Ca 0.49 -0.37 0.06 0.00 -0.22 0.00 0.00 54.13 54.09 2jul s LEU 108 Cb 0.28 -0.03 -0.04 0.00 0.50 0.00 0.00 46.19 46.90 2jul s LEU 108 CO 0.30 -0.18 -0.13 0.54 -1.32 0.00 0.00 176.35 175.56 2jul s VAL 109 N -1.02 1.37 0.10 1.68 0.11 -0.45 -5.03 120.40 117.17 2jul s VAL 109 Ca -0.09 -1.94 0.02 0.00 -2.93 0.00 0.00 61.98 57.04 2jul s VAL 109 Cb -0.07 -1.74 -0.04 0.00 -1.53 0.00 0.00 36.38 32.99 2jul s VAL 109 CO -0.00 -0.56 -0.06 -0.62 -3.33 0.00 0.00 175.10 170.53 2jul s ASP 110 N -2.87 1.11 0.40 3.54 2.15 -1.26 -2.28 116.67 117.47 2jul s ASP 110 Ca 0.14 -1.02 0.07 0.00 0.43 0.00 0.00 52.55 52.17 2jul s ASP 110 Cb -0.02 0.10 0.40 0.00 -0.30 0.00 0.00 42.92 43.10 2jul s ASP 110 CO 0.03 -0.48 1.08 -0.08 -0.17 0.00 0.00 175.17 175.55 2jul h GLU 111 N 2.95 0.00 0.71 4.34 4.81 -1.99 -0.75 114.58 124.65 2jul h GLU 111 Ca -0.35 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 2jul h GLU 111 Cb 1.17 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.55 2jul h GLU 111 CO 0.65 0.00 -0.34 0.22 -0.73 0.00 0.00 179.01 178.80 2jul h ASP 112 N 0.00 -0.81 -0.94 1.04 3.58 -1.98 -2.27 116.42 115.04 2jul h ASP 112 Ca 0.00 0.03 0.15 0.00 0.42 0.00 0.00 57.03 57.63 2jul h ASP 112 Cb 1.18 0.21 -0.08 0.00 1.72 0.00 0.00 39.33 42.36 2jul h ASP 112 CO 0.00 -0.52 0.60 0.71 -2.88 0.00 0.00 179.24 177.15 2jul h THR 113 N -1.07 0.82 -0.99 2.25 1.35 -1.54 0.63 112.91 114.36 2jul h THR 113 Ca -0.10 -0.26 0.09 0.00 -0.55 0.00 0.00 66.41 65.59 2jul h THR 113 Cb 0.73 0.00 -0.07 0.00 -1.73 0.00 0.00 68.15 67.08 2jul h THR 113 CO 0.16 0.14 0.63 -0.26 -0.25 0.00 0.00 175.52 175.94 2jul h PHE 114 N 0.75 1.15 -0.27 4.73 -1.00 -1.49 -1.23 116.94 119.59 2jul h PHE 114 Ca 0.48 0.03 -0.07 0.00 2.81 0.00 0.00 57.97 61.22 2jul h PHE 114 Cb 0.73 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2jul h PHE 114 CO -0.00 0.54 -0.12 -0.22 -1.61 0.00 0.00 178.31 176.89 2jul h LYS 115 N 1.07 0.55 -0.42 1.51 3.64 -0.29 -2.29 116.57 120.34 2jul h LYS 115 Ca 0.45 -0.24 0.06 0.00 -1.27 0.00 0.00 60.65 59.65 2jul h LYS 115 Cb 0.31 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 2jul h LYS 115 CO -0.20 0.80 0.28 -0.07 -2.27 0.00 0.00 179.45 177.99 2jul h LEU 116 N 0.29 0.29 0.26 5.20 3.38 -0.86 0.76 115.31 124.63 2jul h LEU 116 Ca 0.06 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2jul h LEU 116 Cb 0.63 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2jul h LEU 116 CO 0.04 0.19 -0.13 0.40 0.09 0.00 0.00 178.44 179.03 2jul h ILE 117 N 0.33 0.63 0.00 1.22 2.04 -1.01 0.13 117.51 120.86 2jul h ILE 117 Ca 0.18 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 2jul h ILE 117 Cb 0.30 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2jul h ILE 117 CO -0.04 0.14 -0.21 1.88 0.00 0.00 0.00 178.15 179.93 2jul h TYR 118 N -0.89 0.00 0.00 1.37 0.05 -1.06 -2.13 116.97 114.30 2jul h TYR 118 Ca -0.04 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.56 2jul h TYR 118 Cb 0.51 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.22 2jul h TYR 118 CO 0.05 0.21 -0.90 0.77 -1.05 0.00 0.00 178.16 177.24 2jul h SER 119 N 0.00 0.00 0.02 3.88 0.02 0.56 -2.69 113.55 115.34 2jul h SER 119 Ca -0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 2jul h SER 119 Cb 0.44 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2jul h SER 119 CO 0.03 0.90 -0.42 -0.61 -1.14 0.00 0.00 176.83 175.59 2jul h GLN 120 N 0.00 0.50 0.04 3.45 4.15 -0.07 -3.24 115.11 119.93 2jul h GLN 120 Ca -0.01 -0.25 -0.10 0.00 0.77 0.00 0.00 58.65 59.05 2jul h GLN 120 Cb 1.68 0.01 0.01 0.00 0.21 0.00 0.00 27.48 29.39 2jul h GLN 120 CO 0.12 0.83 -0.43 0.74 -1.93 0.00 0.00 178.83 178.16 2jul h PHE 121 N 0.41 0.36 -3.69 3.99 -1.00 -1.52 -3.43 116.94 112.07 2jul h PHE 121 Ca 0.03 -0.22 -0.64 0.00 2.81 0.00 0.00 57.97 59.95 2jul h PHE 121 Cb 0.90 -0.03 -0.15 0.00 3.61 0.00 0.00 35.95 40.28 2jul h PHE 121 CO 0.03 1.09 -0.22 -0.06 -1.61 0.00 0.00 178.31 177.54 2jul s PHE 122 N -2.82 3.23 0.00 -0.55 0.08 -1.02 -5.01 117.98 111.89 2jul s PHE 122 Ca -0.15 0.26 0.00 0.00 0.12 0.00 0.00 56.93 57.16 2jul s PHE 122 Cb 0.01 -2.66 0.00 0.00 -0.57 0.00 0.00 43.02 39.80 2jul s PHE 122 CO 0.77 -0.34 0.41 -2.30 -0.10 0.00 0.00 175.22 173.67 2jul n PRO 123 N 5.42 0.00 -3.66 0.24 -0.02 -1.26 -4.63 135.00 131.09 2jul n PRO 123 Ca -0.08 0.01 -0.36 0.00 -2.02 0.00 0.00 63.50 61.05 2jul n PRO 123 Cb 0.50 -0.91 -0.08 0.00 -0.02 0.00 0.00 33.50 33.00 2jul n PRO 123 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 2jul s GLN 124 N -0.82 4.18 0.00 -0.52 0.74 -1.26 -5.00 119.66 116.98 2jul s GLN 124 Ca 0.00 -0.08 0.00 0.00 0.05 0.00 0.00 55.36 55.33 2jul s GLN 124 Cb 0.00 -3.41 0.00 0.00 1.10 0.00 0.00 33.01 30.70 2jul s GLN 124 CO 0.00 0.30 0.00 0.41 -0.55 0.00 0.00 175.29 175.45 2jul n GLY 125 N 3.38 2.76 2.52 2.59 0.00 -1.26 -4.69 105.19 110.48 2jul n GLY 125 Ca -0.14 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2jul n GLY 125 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jul n ASP 126 N 0.00 2.86 0.22 1.61 2.03 -1.26 -4.46 116.55 117.55 2jul n ASP 126 Ca 0.00 -2.07 0.15 0.00 0.52 0.00 0.00 54.79 53.39 2jul n ASP 126 Cb 0.00 -0.76 0.78 0.00 -0.72 0.00 0.00 41.12 40.42 2jul n ASP 126 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jul h ALA 127 N 5.83 1.00 -1.29 -1.67 0.00 -1.87 -2.65 119.26 118.61 2jul h ALA 127 Ca 0.22 0.00 0.38 0.00 0.00 0.00 0.00 54.91 55.51 2jul h ALA 127 Cb 0.35 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 2jul h ALA 127 CO 0.87 0.00 0.88 0.00 0.00 0.00 0.00 179.25 181.00 2jul h THR 128 N 0.00 0.30 0.32 0.00 1.03 -1.95 0.47 112.91 113.08 2jul h THR 128 Ca 0.00 -0.05 -0.02 0.00 -0.01 0.00 0.00 66.41 66.34 2jul h THR 128 Cb 0.02 0.15 0.00 0.00 -1.07 0.00 0.00 68.15 67.25 2jul h THR 128 CO 0.00 0.02 -0.15 0.74 -0.01 0.00 0.00 175.52 176.12 2jul h THR 129 N 0.13 0.00 -0.19 0.00 2.02 -1.87 -0.87 112.91 112.15 2jul h THR 129 Ca 0.70 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.81 2jul h THR 129 Cb 2.35 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 2jul h THR 129 CO -0.21 0.00 0.22 0.22 0.37 0.00 0.00 175.52 176.11 2jul h TYR 130 N -0.56 0.00 -0.39 3.16 3.20 -1.45 0.66 116.97 121.60 2jul h TYR 130 Ca -0.04 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.68 2jul h TYR 130 Cb 0.33 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2jul h TYR 130 CO 0.09 0.00 -0.31 0.00 -1.64 0.00 0.00 178.16 176.31 2jul h ALA 131 N 1.74 0.57 -0.90 1.82 0.00 0.08 -2.12 119.26 120.44 2jul h ALA 131 Ca 0.09 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2jul h ALA 131 Cb 0.52 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2jul h ALA 131 CO -0.00 0.61 0.59 1.25 0.00 0.00 0.00 179.25 181.71 2jul h HIS 132 N 0.72 1.12 -0.27 0.00 -0.00 0.61 -1.03 115.15 116.28 2jul h HIS 132 Ca 0.07 0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.43 2jul h HIS 132 Cb 0.89 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.92 2jul h HIS 132 CO 0.06 0.67 0.03 0.74 -0.00 0.00 0.00 177.93 179.43 2jul h PHE 133 N 1.17 0.50 -0.97 5.26 0.04 -1.36 -1.92 116.94 119.66 2jul h PHE 133 Ca 0.35 -0.08 0.10 0.00 2.80 0.00 0.00 57.97 61.14 2jul h PHE 133 Cb -0.06 -0.13 -0.07 0.00 2.20 0.00 0.00 35.95 37.89 2jul h PHE 133 CO -0.01 0.58 0.62 1.25 -0.60 0.00 0.00 178.31 180.15 2jul h LEU 134 N 0.27 0.92 -0.29 1.54 7.12 -0.84 -0.73 115.31 123.30 2jul h LEU 134 Ca 0.08 0.03 -0.02 0.00 0.13 0.00 0.00 57.88 58.10 2jul h LEU 134 Cb 0.37 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.33 2jul h LEU 134 CO 0.01 0.53 0.09 0.15 -0.13 0.00 0.00 178.44 179.08 2jul h PHE 135 N 1.01 0.47 -0.64 1.25 3.04 -0.88 -2.50 116.94 118.69 2jul h PHE 135 Ca 0.46 -0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.38 2jul h PHE 135 Cb 0.39 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 2jul h PHE 135 CO -0.00 0.50 0.42 -0.91 -2.02 0.00 0.00 178.31 176.30 2jul h ASN 136 N 0.31 0.69 -0.40 0.41 -0.26 -0.47 -1.65 115.58 114.20 2jul h ASN 136 Ca 0.09 -0.01 0.04 0.00 -0.56 0.00 0.00 56.30 55.86 2jul h ASN 136 Cb 0.26 -0.16 -0.04 0.00 -1.06 0.00 0.00 38.32 37.31 2jul h ASN 136 CO -0.00 0.48 0.16 0.00 -1.06 0.00 0.00 177.43 177.01 2jul h ALA 137 N 1.62 0.48 0.25 -0.83 0.00 -0.73 -3.22 119.26 116.82 2jul h ALA 137 Ca 0.25 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2jul h ALA 137 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jul h ALA 137 CO -0.06 -0.22 -0.12 0.74 0.00 0.00 0.00 179.25 179.58 2jul h PHE 138 N 0.33 -0.31 -2.52 0.00 0.04 -1.14 -3.45 116.94 109.89 2jul h PHE 138 Ca 0.18 -0.01 -0.59 0.00 2.80 0.00 0.00 57.97 60.36 2jul h PHE 138 Cb 0.14 0.10 0.18 0.00 2.20 0.00 0.00 35.95 38.57 2jul h PHE 138 CO -0.13 -0.19 -0.78 -3.47 -0.60 0.00 0.00 178.31 173.14 2jul n ASP 139 N -3.38 -2.38 -1.82 2.17 2.03 -0.69 -4.76 116.55 107.72 2jul n ASP 139 Ca -0.04 0.67 -0.09 0.00 0.52 0.00 0.00 54.79 55.85 2jul n ASP 139 Cb 0.13 -1.02 -0.05 0.00 -0.72 0.00 0.00 41.12 39.46 2jul n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jul n ALA 140 N -1.68 5.15 -2.30 -1.67 0.00 -1.26 -4.68 120.51 114.07 2jul n ALA 140 Ca 0.09 -1.15 -0.17 0.00 0.00 0.00 0.00 53.44 52.22 2jul n ALA 140 Cb 0.48 -1.57 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 2jul n ALA 140 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jul n ASP 141 N 1.53 -4.93 0.00 0.00 8.00 -1.26 -4.94 116.55 114.94 2jul n ASP 141 Ca 0.23 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.86 2jul n ASP 141 Cb 0.64 -4.18 0.00 0.00 -0.02 0.00 0.00 41.12 37.57 2jul n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jul n GLY 142 N -0.84 1.23 0.00 0.44 0.00 -1.26 -5.08 105.19 99.68 2jul n GLY 142 Ca -0.20 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2jul n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jul n ASN 143 N 0.00 0.00 -2.73 1.61 3.02 -1.26 -4.98 115.26 110.92 2jul n ASN 143 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.47 2jul n ASN 143 Cb 0.00 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.25 2jul n ASN 143 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jul n GLY 144 N 2.74 0.30 3.21 7.41 0.00 -1.26 -5.10 105.19 112.50 2jul n GLY 144 Ca 0.00 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 0.34 -0.91 0.25 4.61 0.00 -1.26 -4.72 121.76 120.07 2jul s ALA 145 Ca 0.24 1.36 0.10 0.00 0.00 0.00 0.00 51.96 53.67 2jul s ALA 145 Cb 0.28 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 2jul s ALA 145 CO -0.10 -0.24 -0.18 0.96 0.00 0.00 0.00 175.76 176.20 2jul s ILE 146 N 1.32 2.17 0.00 0.00 -4.36 -0.97 -4.96 121.20 114.40 2jul s ILE 146 Ca -0.09 -2.32 0.00 0.00 -0.26 0.00 0.00 60.65 57.98 2jul s ILE 146 Cb -0.09 -2.18 0.00 0.00 1.25 0.00 0.00 42.46 41.44 2jul s ILE 146 CO -0.11 -0.47 0.00 1.41 0.24 0.00 0.00 174.94 176.00 2jul n HIS 147 N -0.49 0.00 0.11 1.37 8.25 -1.26 -1.34 115.22 121.85 2jul n HIS 147 Ca -0.06 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.46 2jul n HIS 147 Cb 0.60 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.72 2jul n HIS 147 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2jul h PHE 148 N 0.62 0.00 0.28 4.41 3.57 -1.98 -3.25 116.94 120.58 2jul h PHE 148 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 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 0.25 -0.13 0.93 -2.23 0.00 0.00 178.31 177.12 2jul h GLU 149 N 0.00 -0.36 -0.58 1.11 5.08 -1.96 -1.88 114.58 115.99 2jul h GLU 149 Ca -0.05 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.51 2jul h GLU 149 Cb 1.23 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 2jul h GLU 149 CO 0.02 -0.24 0.54 0.22 -1.00 0.00 0.00 179.01 178.55 2jul h ASP 150 N -0.68 0.00 -0.19 1.42 3.58 -1.99 0.24 116.42 118.80 2jul h ASP 150 Ca -0.04 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.34 2jul h ASP 150 Cb 0.29 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 2jul h ASP 150 CO 0.06 0.00 -0.16 0.15 -2.88 0.00 0.00 179.24 176.41 2jul h PHE 151 N 0.00 0.53 -0.42 0.28 3.57 -1.57 -2.46 116.94 116.87 2jul h PHE 151 Ca 0.28 -0.15 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2jul h PHE 151 Cb 1.36 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 2jul h PHE 151 CO 0.00 0.79 -0.04 0.28 -2.23 0.00 0.00 178.31 177.12 2jul h VAL 152 N 0.12 1.24 -0.63 1.41 2.07 0.27 -2.61 116.25 118.12 2jul h VAL 152 Ca 0.03 -1.01 0.02 0.00 0.82 0.00 0.00 66.70 66.57 2jul h VAL 152 Cb 0.69 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 2jul h VAL 152 CO 0.04 0.35 0.41 0.58 0.02 0.00 0.00 177.57 178.97 2jul h VAL 153 N 0.66 1.13 0.31 2.57 2.07 -1.08 -2.35 116.25 119.55 2jul h VAL 153 Ca 0.13 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2jul h VAL 153 Cb 0.46 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2jul h VAL 153 CO 0.02 0.15 -0.20 1.23 0.02 0.00 0.00 177.57 178.79 2jul h GLY 154 N 0.82 -0.52 -0.67 2.17 0.00 -1.08 -0.55 103.07 103.25 2jul h GLY 154 Ca 0.24 0.23 0.37 0.00 0.00 0.00 0.00 47.33 48.16 2jul h GLY 154 CO -0.07 -0.20 0.83 -2.00 0.00 0.00 0.00 176.54 175.09 2jul h LEU 155 N -0.50 0.25 -0.47 3.11 7.12 -1.18 1.50 115.31 125.15 2jul h LEU 155 Ca -0.03 0.08 -0.17 0.00 0.13 0.00 0.00 57.88 57.89 2jul h LEU 155 Cb 0.42 0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.60 2jul h LEU 155 CO 0.02 -0.03 -0.64 0.28 -0.13 0.00 0.00 178.44 177.93 2jul h SER 156 N 0.18 0.54 0.02 1.25 0.02 -0.62 -1.94 113.55 112.99 2jul h SER 156 Ca 0.70 -0.32 -0.19 0.00 -0.84 0.00 0.00 61.79 61.13 2jul h SER 156 Cb 2.21 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 64.59 2jul h SER 156 CO -0.26 1.04 -0.69 -0.29 -1.14 0.00 0.00 176.83 175.49 2jul h ILE 157 N 0.34 1.32 0.00 3.27 2.10 0.30 0.37 117.51 125.22 2jul h ILE 157 Ca -0.01 -1.97 -0.10 0.00 1.08 0.00 0.00 64.86 63.86 2jul h ILE 157 Cb 1.20 1.95 -0.01 0.00 -1.09 0.00 0.00 36.82 38.86 2jul h ILE 157 CO 0.11 0.61 -0.47 -0.07 -1.08 0.00 0.00 178.15 177.26 2jul h LEU 158 N 0.44 0.00 0.00 2.19 4.07 -0.63 -3.35 115.31 118.03 2jul h LEU 158 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2jul h LEU 158 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 2jul h LEU 158 CO 0.13 0.47 -0.29 0.25 -1.08 0.00 0.00 178.44 177.93 2jul h LEU 159 N 0.00 0.00 -9.95 1.67 6.46 -1.23 -3.48 115.31 108.77 2jul h LEU 159 Ca -0.00 0.00 -0.56 0.00 -0.12 0.00 0.00 57.88 57.19 2jul h LEU 159 Cb 0.86 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.75 2jul h LEU 159 CO 0.06 0.46 -0.50 -0.13 -0.62 0.00 0.00 178.44 177.71 2jul s ARG 160 N -1.74 3.30 0.00 1.25 0.52 0.13 -5.06 118.95 117.35 2jul s ARG 160 Ca -0.08 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2jul s ARG 160 Cb 0.01 -2.89 0.00 0.00 0.52 0.00 0.00 34.95 32.59 2jul s ARG 160 CO 0.12 0.53 0.00 0.41 0.02 0.00 0.00 175.30 176.38 2jul n GLY 161 N -0.36 4.69 1.50 -3.53 0.00 -1.26 -3.99 105.19 102.23 2jul n GLY 161 Ca -0.07 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 2jul n GLY 161 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jul n THR 162 N -1.89 0.00 0.13 2.61 -2.24 -1.26 -4.89 114.28 106.74 2jul n THR 162 Ca 0.00 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2jul n THR 162 Cb 0.00 -0.67 0.06 0.00 -2.10 0.00 0.00 70.33 67.62 2jul n THR 162 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2jul h VAL 163 N -2.52 1.17 0.02 2.28 -1.51 -2.01 -3.29 116.25 110.38 2jul h VAL 163 Ca -0.18 -2.41 -0.00 0.00 -1.23 0.00 0.00 66.70 62.87 2jul h VAL 163 Cb 0.59 2.42 0.00 0.00 -2.13 0.00 0.00 31.29 32.17 2jul h VAL 163 CO 0.11 0.62 -0.01 0.45 -1.23 0.00 0.00 177.57 177.51 2jul h HIS 164 N 0.00 -0.02 -0.81 5.19 3.86 -2.00 -2.79 115.15 118.58 2jul h HIS 164 Ca -0.01 -0.00 0.20 0.00 -1.16 0.00 0.00 60.37 59.41 2jul h HIS 164 Cb 1.37 0.01 -0.05 0.00 1.06 0.00 0.00 27.41 29.80 2jul h HIS 164 CO 0.00 0.31 0.56 0.93 0.86 0.00 0.00 177.93 180.59 2jul h GLU 165 N -0.35 0.21 0.29 2.45 5.08 -1.92 -1.40 114.58 118.94 2jul h GLU 165 Ca -0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2jul h GLU 165 Cb 0.34 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2jul h GLU 165 CO 0.00 0.14 -0.14 0.87 -1.00 0.00 0.00 179.01 178.88 2jul h LYS 166 N 0.22 -0.38 0.00 2.33 1.57 -1.57 -2.25 116.57 116.49 2jul h LYS 166 Ca 0.41 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 2jul h LYS 166 Cb 1.26 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.65 2jul h LYS 166 CO -0.09 -0.05 0.02 -0.07 -0.57 0.00 0.00 179.45 178.69 2jul h LEU 167 N -0.75 0.00 0.10 2.94 3.38 -1.04 -1.69 115.31 118.25 2jul h LEU 167 Ca -0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2jul h LEU 167 Cb 0.50 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.26 2jul h LEU 167 CO 0.07 0.00 -0.64 0.11 0.09 0.00 0.00 178.44 178.06 2jul h LYS 168 N 0.00 0.21 -0.32 1.13 1.57 -0.89 -2.10 116.57 116.16 2jul h LYS 168 Ca 0.00 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.41 2jul h LYS 168 Cb 0.04 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2jul h LYS 168 CO 0.00 1.17 0.11 2.35 -0.57 0.00 0.00 179.45 182.51 2jul h TRP 169 N -0.56 0.44 -0.00 -1.35 7.01 -0.74 0.50 115.95 121.26 2jul h TRP 169 Ca -0.12 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.86 2jul h TRP 169 Cb 1.47 -0.14 0.00 0.00 -2.10 0.00 0.00 29.16 28.39 2jul h TRP 169 CO 0.21 0.37 -0.02 0.00 -2.79 0.00 0.00 178.44 176.21 2jul h ALA 170 N 1.68 0.00 0.00 2.65 0.00 -1.56 -1.18 119.26 120.85 2jul h ALA 170 Ca 0.11 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 2jul h ALA 170 Cb 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2jul h ALA 170 CO -0.01 -0.09 -0.15 0.35 0.00 0.00 0.00 179.25 179.36 2jul h PHE 171 N -0.76 0.00 0.00 0.00 3.04 -1.15 -1.80 116.94 116.27 2jul h PHE 171 Ca -0.00 0.00 -0.17 0.00 3.98 0.00 0.00 57.97 61.78 2jul h PHE 171 Cb 0.81 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.29 2jul h PHE 171 CO 0.20 0.15 -0.91 -0.97 -2.02 0.00 0.00 178.31 174.75 2jul h ASN 172 N 0.00 0.00 -0.40 0.41 -0.73 0.02 -3.31 115.58 111.57 2jul h ASN 172 Ca -0.00 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 58.10 2jul h ASN 172 Cb 0.35 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.93 2jul h ASN 172 CO 0.02 0.73 -0.01 0.25 -0.37 0.00 0.00 177.43 178.05 2jul h LEU 173 N 0.00 0.69 0.00 0.34 6.46 -0.33 -2.02 115.31 120.46 2jul h LEU 173 Ca -0.05 -0.31 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2jul h LEU 173 Cb 1.60 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 41.35 2jul h LEU 173 CO 0.09 0.84 0.02 -1.22 -0.62 0.00 0.00 178.44 177.54 2jul n TYR 174 N -4.44 0.00 -3.21 1.25 4.02 -1.07 -4.41 117.16 109.30 2jul n TYR 174 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.47 2jul n TYR 174 Cb 0.29 -0.38 -0.07 0.00 -0.02 0.00 0.00 39.34 39.16 2jul n TYR 174 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2jul s ASP 175 N -2.74 6.40 -0.14 7.72 2.15 -0.76 -4.90 116.67 124.40 2jul s ASP 175 Ca 0.00 0.26 -0.03 0.00 0.43 0.00 0.00 52.55 53.21 2jul s ASP 175 Cb 0.00 -2.29 -0.08 0.00 -0.30 0.00 0.00 42.92 40.25 2jul s ASP 175 CO 0.00 -0.42 -0.15 2.30 -0.17 0.00 0.00 175.17 176.72 2jul n ILE 176 N 5.35 0.80 -2.20 4.11 -5.35 -1.26 -4.89 119.36 115.91 2jul n ILE 176 Ca -0.04 -0.26 -0.32 0.00 -0.27 0.00 0.00 62.75 61.87 2jul n ILE 176 Cb 0.49 -1.32 -0.01 0.00 -1.74 0.00 0.00 39.64 37.06 2jul n ILE 176 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2jul s ASN 177 N -5.80 6.36 -0.89 7.28 4.22 -1.26 -4.88 114.94 119.98 2jul s ASN 177 Ca -0.20 1.58 -0.26 0.00 -2.14 0.00 0.00 52.86 51.84 2jul s ASN 177 Cb 0.06 -2.50 -0.17 0.00 1.28 0.00 0.00 41.25 39.92 2jul s ASN 177 CO 0.29 -0.77 2.32 0.29 -2.04 0.00 0.00 177.10 177.19 2jul n LYS 178 N -1.96 0.40 -3.83 3.55 4.01 -1.26 -4.76 118.16 114.31 2jul n LYS 178 Ca 0.07 -1.13 -0.07 0.00 -0.51 0.00 0.00 58.31 56.67 2jul n LYS 178 Cb 0.54 -3.77 0.02 0.00 -0.51 0.00 0.00 35.03 31.31 2jul n LYS 178 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2jul s ASP 179 N 10.08 -0.02 -0.07 4.39 2.15 -1.26 -5.05 116.67 126.88 2jul s ASP 179 Ca 0.89 -0.98 0.16 0.00 0.43 0.00 0.00 52.55 53.05 2jul s ASP 179 Cb -0.11 0.75 0.32 0.00 -0.30 0.00 0.00 42.92 43.59 2jul s ASP 179 CO 0.12 -1.49 1.15 0.61 -0.17 0.00 0.00 175.17 175.39 2jul n GLY 180 N -0.56 2.54 3.05 2.66 0.00 -1.26 -4.97 105.19 106.64 2jul n GLY 180 Ca -0.07 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.23 4.09 0.13 0.00 1.01 0.18 -4.88 121.20 119.49 2jul s ILE 182 Ca -0.09 -1.52 -0.15 0.00 0.00 0.00 0.00 60.65 58.90 2jul s ILE 182 Cb -0.04 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.21 2jul s ILE 182 CO -0.03 -0.33 0.37 -0.89 0.00 0.00 0.00 174.94 174.06 2jul s THR 183 N -2.20 0.08 0.64 2.92 2.01 -1.26 0.11 115.64 117.93 2jul s THR 183 Ca 0.34 -0.72 0.32 0.00 0.31 0.00 0.00 61.69 61.93 2jul s THR 183 Cb -0.07 -1.26 0.35 0.00 0.01 0.00 0.00 72.50 71.53 2jul s THR 183 CO 0.24 -0.35 2.02 0.50 -0.69 0.00 0.00 174.62 176.33 2jul h LYS 184 N 2.42 0.00 0.23 4.92 3.64 -1.95 -0.70 116.57 125.12 2jul h LYS 184 Ca -0.33 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 2jul h LYS 184 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 2jul h LYS 184 CO 0.48 0.00 -0.11 1.49 -2.27 0.00 0.00 179.45 179.04 2jul h GLU 185 N 0.00 -0.30 -0.04 1.90 4.81 -1.99 -2.47 114.58 116.49 2jul h GLU 185 Ca 0.05 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2jul h GLU 185 Cb 0.62 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 2jul h GLU 185 CO -0.00 -0.10 0.05 0.93 -0.73 0.00 0.00 179.01 179.16 2jul h GLU 186 N -1.05 0.00 -0.21 1.92 5.08 -1.80 -1.19 114.58 117.34 2jul h GLU 186 Ca -0.03 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.12 2jul h GLU 186 Cb 0.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.59 2jul h GLU 186 CO 0.05 0.00 -0.68 1.98 -1.00 0.00 0.00 179.01 179.36 2jul h MET 187 N 0.00 0.83 -0.78 2.33 4.05 -1.17 -2.10 114.93 118.09 2jul h MET 187 Ca 0.02 -0.61 -0.02 0.00 -0.28 0.00 0.00 59.70 58.81 2jul h MET 187 Cb 0.12 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 30.99 2jul h MET 187 CO -0.00 1.23 0.42 -0.07 0.23 0.00 0.00 176.91 178.72 2jul h LEU 188 N 0.60 0.98 -0.99 3.39 3.38 -0.73 -0.16 115.31 121.78 2jul h LEU 188 Ca -0.02 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 2jul h LEU 188 Cb 1.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2jul h LEU 188 CO 0.14 0.81 -0.47 0.00 0.09 0.00 0.00 178.44 179.02 2jul h ALA 189 N 1.22 1.16 -0.19 1.53 0.00 -1.46 -0.91 119.26 120.61 2jul h ALA 189 Ca 0.27 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 2jul h ALA 189 Cb 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2jul h ALA 189 CO -0.04 0.60 -0.29 0.82 0.00 0.00 0.00 179.25 180.34 2jul h ILE 190 N 0.07 1.34 -0.39 0.00 1.08 -0.64 -2.05 117.51 116.92 2jul h ILE 190 Ca 0.00 -1.50 -0.09 0.00 -0.39 0.00 0.00 64.86 62.88 2jul h ILE 190 Cb 0.85 1.85 -0.01 0.00 -3.07 0.00 0.00 36.82 36.44 2jul h ILE 190 CO 0.06 0.46 -0.12 -0.03 -0.69 0.00 0.00 178.15 177.83 2jul h MET 191 N 0.19 0.77 -0.57 2.37 4.05 -0.94 -2.52 114.93 118.28 2jul h MET 191 Ca 0.02 -0.31 0.02 0.00 -0.28 0.00 0.00 59.70 59.15 2jul h MET 191 Cb 0.87 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.60 2jul h MET 191 CO 0.07 0.92 0.38 0.87 0.23 0.00 0.00 176.91 179.38 2jul h LYS 192 N 0.58 0.70 -0.56 0.39 1.57 -1.16 -1.56 116.57 116.53 2jul h LYS 192 Ca 0.10 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 2jul h LYS 192 Cb 0.65 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2jul h LYS 192 CO 0.04 0.46 0.01 0.77 -0.57 0.00 0.00 179.45 180.17 2jul h SER 193 N 0.72 0.95 -0.96 0.86 0.02 -1.07 -1.54 113.55 112.53 2jul h SER 193 Ca 0.22 -0.30 0.06 0.00 -0.84 0.00 0.00 61.79 60.93 2jul h SER 193 Cb 0.01 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 62.23 2jul h SER 193 CO -0.05 1.02 0.63 0.40 -1.14 0.00 0.00 176.83 177.68 2jul h ILE 194 N 0.86 1.10 -0.26 3.27 1.08 -0.87 0.59 117.51 123.28 2jul h ILE 194 Ca 0.16 -0.39 -0.17 0.00 -0.39 0.00 0.00 64.86 64.07 2jul h ILE 194 Cb 0.52 -0.14 -0.00 0.00 -3.07 0.00 0.00 36.82 34.13 2jul h ILE 194 CO 0.03 0.21 -0.52 1.88 -0.69 0.00 0.00 178.15 179.06 2jul h TYR 195 N 1.13 0.92 -0.02 1.37 -1.99 -1.13 -2.60 116.97 114.66 2jul h TYR 195 Ca 0.41 -0.31 -0.15 0.00 2.00 0.00 0.00 58.73 60.67 2jul h TYR 195 Cb 0.15 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 2jul h TYR 195 CO -0.00 1.10 -0.69 0.22 -0.00 0.00 0.00 178.16 178.79 2jul h ASP 196 N 0.57 0.11 -0.42 3.88 3.58 -0.29 -2.67 116.42 121.17 2jul h ASP 196 Ca 0.02 -0.07 -0.11 0.00 0.42 0.00 0.00 57.03 57.29 2jul h ASP 196 Cb 1.09 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.09 2jul h ASP 196 CO 0.11 0.76 -0.14 -0.03 -2.88 0.00 0.00 179.24 177.06 2jul h MET 197 N 0.06 0.90 -0.04 0.28 4.05 0.26 -2.10 114.93 118.34 2jul h MET 197 Ca -0.01 -0.33 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 2jul h MET 197 Cb 1.22 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 2jul h MET 197 CO 0.10 0.98 0.00 -1.33 0.23 0.00 0.00 176.91 176.88 2jul n MET 198 N -4.14 1.30 0.00 0.39 2.81 -0.99 -4.80 117.12 111.69 2jul n MET 198 Ca 0.01 -0.44 0.00 0.00 -1.81 0.00 0.00 57.70 55.46 2jul n MET 198 Cb 0.40 -1.42 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 2jul n MET 198 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jul n GLY 199 N 1.01 1.41 3.57 3.03 0.00 -0.79 -3.29 105.19 110.13 2jul n GLY 199 Ca 0.18 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 1.43 0.31 1.61 1.81 -1.26 -4.82 118.95 118.03 2jul s ARG 200 Ca 0.00 -0.27 -0.05 0.00 -1.72 0.00 0.00 55.73 53.69 2jul s ARG 200 Cb 0.00 -4.96 0.08 0.00 -0.45 0.00 0.00 34.95 29.62 2jul s ARG 200 CO 0.00 -5.06 0.19 -2.39 -0.68 0.00 0.00 175.30 167.35 2jul n HIS 201 N 18.84 -2.46 -1.83 -0.53 1.44 -1.21 -4.80 115.22 124.68 2jul n HIS 201 Ca 0.43 -0.18 -0.43 0.00 -2.01 0.00 0.00 57.72 55.54 2jul n HIS 201 Cb 0.46 -0.26 -0.03 0.00 0.12 0.00 0.00 29.99 30.28 2jul n HIS 201 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 2jul s THR 202 N -1.25 3.28 -0.00 0.61 -4.23 -1.26 -4.30 115.64 108.49 2jul s THR 202 Ca 0.14 0.32 -0.00 0.00 -1.18 0.00 0.00 61.69 60.97 2jul s THR 202 Cb -0.02 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.52 2jul s THR 202 CO 0.12 -0.13 0.00 -1.22 -0.54 0.00 0.00 174.62 172.85 2jul n TYR 203 N 9.38 -0.01 -0.08 3.99 4.02 -1.26 -4.91 117.16 128.29 2jul n TYR 203 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 2jul n TYR 203 Cb 0.44 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.53 2jul n TYR 203 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 2jul n PRO 204 N 0.67 0.03 -0.47 -0.72 -0.02 -1.26 -4.86 135.00 128.37 2jul n PRO 204 Ca -0.00 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.53 2jul n PRO 204 Cb 0.12 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 33.83 2jul n PRO 204 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2jul n ILE 205 N -1.54 1.42 0.00 4.25 -0.00 -1.26 -4.91 119.36 117.31 2jul n ILE 205 Ca 0.00 -0.78 0.00 0.00 -0.00 0.00 0.00 62.75 61.97 2jul n ILE 205 Cb 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 39.64 39.40 2jul n ILE 205 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.55 176.44 2jul n LEU 206 N 0.45 0.00 -4.84 7.28 0.00 -1.26 -4.84 117.00 113.79 2jul n LEU 206 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 56.01 55.88 2jul n LEU 206 Cb 0.72 0.00 0.11 0.00 0.00 0.00 0.00 43.42 44.25 2jul n LEU 206 CO 0.17 0.00 0.75 0.00 0.00 0.00 0.00 177.39 178.32 2jul s ARG 207 N 0.00 1.57 0.42 1.96 1.70 -1.26 -4.95 118.95 118.39 2jul s ARG 207 Ca 0.00 0.21 -0.23 0.00 -0.47 0.00 0.00 55.73 55.24 2jul s ARG 207 Cb 0.00 -1.90 -0.12 0.00 -0.57 0.00 0.00 34.95 32.36 2jul s ARG 207 CO 0.00 -1.89 0.64 -0.85 -1.08 0.00 0.00 175.30 172.12 2jul n GLU 208 N -3.54 0.70 -0.53 3.89 -0.00 -1.26 -4.90 120.64 115.01 2jul n GLU 208 Ca 0.07 0.26 -0.29 0.00 -0.00 0.00 0.00 57.16 57.20 2jul n GLU 208 Cb 0.60 -1.61 0.25 0.00 -0.00 0.00 0.00 31.44 30.68 2jul n GLU 208 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 2jul s ASP 209 N -0.92 1.12 -0.42 -1.84 -4.77 -1.26 -4.97 116.67 103.60 2jul s ASP 209 Ca 0.64 1.63 0.08 0.00 -3.30 0.00 0.00 52.55 51.60 2jul s ASP 209 Cb -0.59 -2.36 0.33 0.00 -1.09 0.00 0.00 42.92 39.21 2jul s ASP 209 CO 0.57 -4.13 0.98 0.00 0.70 0.00 0.00 175.17 173.29 2jul n ALA 210 N -4.88 0.36 0.32 2.11 0.00 -1.26 -4.95 120.51 112.21 2jul n ALA 210 Ca 0.04 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 51.28 2jul n ALA 210 Cb 0.54 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 0.30 0.32 0.00 0.00 -0.04 -1.26 -3.79 135.00 130.54 2jul n PRO 211 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2jul n PRO 211 Cb 0.69 -1.17 0.00 0.00 -0.04 0.00 0.00 33.50 32.98 2jul n PRO 211 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2jul n LEU 212 N 0.37 0.09 -0.68 1.53 -0.00 -1.26 -2.89 117.00 114.17 2jul n LEU 212 Ca 0.00 0.58 0.51 0.00 -0.00 0.00 0.00 56.01 57.10 2jul n LEU 212 Cb 0.08 -0.48 0.80 0.00 -0.00 0.00 0.00 43.42 43.82 2jul n LEU 212 CO 0.00 -0.48 1.44 -0.62 -0.00 0.00 0.00 177.39 177.73 2jul n GLU 213 N -1.94 -0.00 0.13 1.96 4.71 -1.25 0.18 120.64 124.42 2jul n GLU 213 Ca 0.00 1.07 -0.06 0.00 -0.01 0.00 0.00 57.16 58.17 2jul n GLU 213 Cb 0.00 -2.45 -0.03 0.00 -1.01 0.00 0.00 31.44 27.95 2jul n GLU 213 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 2jul h HIS 214 N 0.00 -0.36 0.00 -0.32 2.76 -1.81 -1.97 115.15 113.46 2jul h HIS 214 Ca 0.92 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 59.08 2jul h HIS 214 Cb 3.64 0.12 0.00 0.00 1.55 0.00 0.00 27.41 32.72 2jul h HIS 214 CO -0.00 -0.22 0.00 0.28 -1.30 0.00 0.00 177.93 176.69 2jul n VAL 215 N -4.25 1.29 -0.02 5.26 0.31 0.20 -2.19 118.33 118.94 2jul n VAL 215 Ca -0.05 0.48 -0.16 0.00 -0.01 0.00 0.00 64.34 64.60 2jul n VAL 215 Cb 0.15 -1.42 -0.14 0.00 -0.91 0.00 0.00 33.84 31.52 2jul n VAL 215 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2jul h GLU 216 N 0.00 0.13 0.00 5.55 4.22 -0.21 -2.75 114.58 121.52 2jul h GLU 216 Ca 0.00 -0.21 -0.06 0.00 0.08 0.00 0.00 59.36 59.17 2jul h GLU 216 Cb 0.11 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2jul h GLU 216 CO 0.00 1.10 -0.28 -0.09 -2.18 0.00 0.00 179.01 177.56 2jul h ARG 217 N -0.73 0.00 0.05 1.92 2.43 -0.86 -0.27 114.38 116.93 2jul h ARG 217 Ca -0.06 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2jul h ARG 217 Cb 1.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2jul h ARG 217 CO 0.06 0.28 -0.03 0.35 -1.51 0.00 0.00 179.97 179.13 2jul h PHE 218 N 0.00 -0.07 -0.36 2.20 3.04 -1.51 -2.13 116.94 118.11 2jul h PHE 218 Ca -0.00 -0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.86 2jul h PHE 218 Cb 0.52 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.03 2jul h PHE 218 CO 0.00 0.29 -0.13 0.35 -2.02 0.00 0.00 178.31 176.80 2jul h PHE 219 N -0.44 0.69 -0.59 0.41 3.57 -1.27 0.15 116.94 119.45 2jul h PHE 219 Ca -0.01 -0.12 0.02 0.00 3.53 0.00 0.00 57.97 61.39 2jul h PHE 219 Cb 0.39 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 2jul h PHE 219 CO 0.05 0.74 0.39 0.37 -2.23 0.00 0.00 178.31 177.63 2jul h GLN 220 N 0.58 0.71 0.00 1.11 4.15 -0.95 -0.29 115.11 120.41 2jul h GLN 220 Ca 0.10 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2jul h GLN 220 Cb 0.56 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.09 2jul h GLN 220 CO 0.04 0.47 -0.60 -0.22 -1.93 0.00 0.00 178.83 176.59 2jul h LYS 221 N 0.73 0.00 0.00 1.69 1.63 -0.85 -3.46 116.57 116.32 2jul h LYS 221 Ca 0.23 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2jul h LYS 221 Cb 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2jul h LYS 221 CO -0.06 0.00 0.00 -0.12 -3.45 0.00 0.00 179.45 175.82 2jul n MET 222 N -2.54 3.80 -3.36 1.90 1.56 -0.01 -4.89 117.12 113.58 2jul n MET 222 Ca 0.02 0.00 -0.29 0.00 -0.27 0.00 0.00 57.70 57.16 2jul n MET 222 Cb 0.50 0.00 0.03 0.00 2.15 0.00 0.00 33.22 35.90 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 -5.54 -0.08 6.12 2.03 -1.25 -4.93 116.55 112.90 2jul n ASP 223 Ca 0.00 -0.03 -0.13 0.00 0.52 0.00 0.00 54.79 55.15 2jul n ASP 223 Cb 0.00 -1.53 -0.08 0.00 -0.72 0.00 0.00 41.12 38.79 2jul n ASP 223 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2jul n ARG 224 N 0.17 0.41 -0.53 -0.67 0.00 -1.26 -4.99 116.66 109.80 2jul n ARG 224 Ca -0.07 0.11 -0.25 0.00 -0.00 0.00 0.00 57.85 57.64 2jul n ARG 224 Cb 0.62 -1.31 0.18 0.00 0.00 0.00 0.00 32.46 31.96 2jul n ARG 224 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2jul n ASN 225 N -3.10 -2.92 0.09 6.15 2.04 -1.26 -4.91 115.26 111.36 2jul n ASN 225 Ca -0.30 -0.37 -0.17 0.00 -0.44 0.00 0.00 54.58 53.30 2jul n ASN 225 Cb 0.81 -0.89 -0.10 0.00 -2.53 0.00 0.00 39.78 37.07 2jul n ASN 225 CO 0.00 0.00 0.00 -0.61 -0.44 0.00 0.00 177.26 176.21 2jul h GLN 226 N -2.63 0.41 -0.07 -3.83 5.75 -1.95 -3.35 115.11 109.43 2jul h GLN 226 Ca -0.39 -0.56 0.01 0.00 -0.15 0.00 0.00 58.65 57.56 2jul h GLN 226 Cb 1.09 0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.80 2jul h GLN 226 CO 0.26 1.23 -0.18 0.38 -2.65 0.00 0.00 178.83 177.87 2jul h ASP 227 N 0.17 -0.57 0.00 -0.69 3.04 -2.00 -3.46 116.42 112.91 2jul h ASP 227 Ca -0.13 0.07 0.00 0.00 -3.24 0.00 0.00 57.03 53.73 2jul h ASP 227 Cb 1.83 0.23 0.00 0.00 -1.04 0.00 0.00 39.33 40.35 2jul h ASP 227 CO 0.20 -0.15 0.00 0.61 -2.04 0.00 0.00 179.24 177.86 2jul n GLY 228 N -1.13 1.26 3.86 7.15 0.00 -1.26 -5.12 105.19 109.95 2jul n GLY 228 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.29 4.70 -0.06 1.61 -7.23 -1.26 -4.72 120.40 113.15 2jul s VAL 229 Ca 0.00 0.84 -0.20 0.00 -1.81 0.00 0.00 61.98 60.81 2jul s VAL 229 Cb 0.00 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 2jul s VAL 229 CO 0.00 -0.40 0.57 0.54 -0.31 0.00 0.00 175.10 175.50 2jul s VAL 230 N -2.24 5.05 0.28 1.32 0.11 0.29 -4.77 120.40 120.44 2jul s VAL 230 Ca 0.54 1.18 0.10 0.00 -2.93 0.00 0.00 61.98 60.87 2jul s VAL 230 Cb -0.10 -3.91 -0.05 0.00 -1.53 0.00 0.00 36.38 30.78 2jul s VAL 230 CO 0.25 0.35 -0.16 0.42 -3.33 0.00 0.00 175.10 172.63 2jul s THR 231 N 0.33 2.25 0.48 5.04 -4.23 -1.26 0.49 115.64 118.74 2jul s THR 231 Ca 0.31 -2.31 0.42 0.00 -1.18 0.00 0.00 61.69 58.93 2jul s THR 231 Cb -0.17 -2.36 0.62 0.00 1.34 0.00 0.00 72.50 71.93 2jul s THR 231 CO 0.15 -0.37 1.41 -0.38 -0.54 0.00 0.00 174.62 174.89 2jul n ILE 232 N -0.63 -0.05 0.18 2.99 5.41 -1.26 -0.35 119.36 125.64 2jul n ILE 232 Ca -0.05 1.42 -0.07 0.00 1.00 0.00 0.00 62.75 65.04 2jul n ILE 232 Cb 0.61 -2.35 -0.03 0.00 -0.71 0.00 0.00 39.64 37.16 2jul n ILE 232 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2jul h ASP 233 N 0.00 -0.40 -0.05 4.38 3.32 -1.98 0.53 116.42 122.22 2jul h ASP 233 Ca 0.84 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.92 2jul h ASP 233 Cb 3.23 0.10 -0.00 0.00 0.22 0.00 0.00 39.33 42.88 2jul h ASP 233 CO -0.11 -0.19 0.09 -0.33 -1.72 0.00 0.00 179.24 176.98 2jul h GLU 234 N -0.66 0.00 0.02 3.56 5.08 -1.12 0.64 114.58 122.09 2jul h GLU 234 Ca -0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2jul h GLU 234 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2jul h GLU 234 CO 0.08 0.00 -0.01 0.35 -1.00 0.00 0.00 179.01 178.43 2jul h PHE 235 N 0.00 -0.02 -0.24 4.33 3.57 -0.55 -2.44 116.94 121.59 2jul h PHE 235 Ca 0.03 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 2jul h PHE 235 Cb 0.20 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 2jul h PHE 235 CO 0.00 0.73 -0.14 1.25 -2.23 0.00 0.00 178.31 177.92 2jul h LEU 236 N -0.84 0.38 -0.47 0.59 5.85 0.83 -0.82 115.31 120.84 2jul h LEU 236 Ca -0.00 -0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 2jul h LEU 236 Cb 0.76 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 2jul h LEU 236 CO 0.00 0.55 -0.26 -0.33 -0.34 0.00 0.00 178.44 178.06 2jul h GLU 237 N 0.37 0.98 -0.15 1.25 5.08 -0.97 -1.77 114.58 119.37 2jul h GLU 237 Ca 0.07 -0.45 -0.17 0.00 -1.00 0.00 0.00 59.36 57.82 2jul h GLU 237 Cb 0.47 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.70 2jul h GLU 237 CO 0.03 1.12 -0.55 1.15 -1.00 0.00 0.00 179.01 179.76 2jul h THR 238 N 0.84 1.33 0.49 1.13 2.02 -1.13 -2.43 112.91 115.15 2jul h THR 238 Ca 0.10 -1.81 -0.02 0.00 0.77 0.00 0.00 66.41 65.45 2jul h THR 238 Cb 0.85 2.02 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 2jul h THR 238 CO 0.07 0.56 -0.24 0.00 0.37 0.00 0.00 175.52 176.29 2jul h GLN 240 N -0.85 0.30 -6.19 0.00 5.75 -1.43 -3.44 115.11 109.25 2jul h GLN 240 Ca -0.07 -0.02 -0.57 0.00 -0.15 0.00 0.00 58.65 57.85 2jul h GLN 240 Cb 0.58 -0.07 0.21 0.00 1.07 0.00 0.00 27.48 29.27 2jul h GLN 240 CO 0.11 0.20 -1.22 1.17 -2.65 0.00 0.00 178.83 176.43 2jul n LYS 241 N -4.46 0.05 -0.33 1.69 4.81 -0.92 -4.77 118.16 114.23 2jul n LYS 241 Ca 0.08 0.03 0.14 0.00 -0.87 0.00 0.00 58.31 57.69 2jul n LYS 241 Cb 0.35 -1.23 0.33 0.00 0.02 0.00 0.00 35.03 34.49 2jul n LYS 241 CO 0.00 0.00 0.00 0.22 1.17 0.00 0.00 177.40 178.79 2jul h ASP 242 N -0.56 0.58 -1.55 3.14 1.82 -1.86 -3.42 116.42 114.58 2jul h ASP 242 Ca -0.43 0.13 -0.67 0.00 -0.39 0.00 0.00 57.03 55.67 2jul h ASP 242 Cb 1.36 0.04 0.09 0.00 0.68 0.00 0.00 39.33 41.51 2jul h ASP 242 CO 0.34 0.12 -0.12 1.21 -1.61 0.00 0.00 179.24 179.18 2jul n GLU 243 N -4.91 0.57 -0.22 0.28 2.13 -1.26 -4.84 120.64 112.39 2jul n GLU 243 Ca 0.24 0.20 0.12 0.00 0.66 0.00 0.00 57.16 58.38 2jul n GLU 243 Cb 0.65 -1.47 0.25 0.00 0.27 0.00 0.00 31.44 31.15 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 1.76 3.35 -0.26 4.31 4.13 -1.26 -4.48 115.26 122.81 2jul n ASN 244 Ca 0.16 -1.97 0.07 0.00 1.68 0.00 0.00 54.58 54.51 2jul n ASN 244 Cb 0.24 -0.29 0.19 0.00 -1.54 0.00 0.00 39.78 38.38 2jul n ASN 244 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2jul h ILE 245 N 4.14 0.39 0.00 2.41 2.10 -1.93 0.95 117.51 125.57 2jul h ILE 245 Ca 0.00 -0.06 -0.06 0.00 1.08 0.00 0.00 64.86 65.82 2jul h ILE 245 Cb 0.92 0.20 -0.01 0.00 -1.09 0.00 0.00 36.82 36.84 2jul h ILE 245 CO 0.00 0.03 -0.27 0.24 -1.08 0.00 0.00 178.15 177.07 2jul h MET 246 N 0.17 0.00 -0.56 2.19 2.86 -1.88 -2.27 114.93 115.44 2jul h MET 246 Ca 0.44 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 58.01 2jul h MET 246 Cb 0.81 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 2jul h MET 246 CO -0.62 0.27 0.07 -0.97 1.06 0.00 0.00 176.91 176.73 2jul h ASN 247 N 0.00 0.87 -0.54 1.22 -0.00 0.61 -2.44 115.58 115.29 2jul h ASN 247 Ca -0.00 -0.20 -0.09 0.00 -0.00 0.00 0.00 56.30 56.01 2jul h ASN 247 Cb 0.60 -0.23 -0.02 0.00 -0.00 0.00 0.00 38.32 38.67 2jul h ASN 247 CO 0.04 0.89 -0.00 0.28 -0.00 0.00 0.00 177.43 178.63 2jul h SER 248 N 0.86 0.94 -0.68 1.15 0.02 -0.72 -2.71 113.55 112.41 2jul h SER 248 Ca 0.17 -0.31 0.13 0.00 -0.84 0.00 0.00 61.79 60.95 2jul h SER 248 Cb 0.41 -0.25 -0.09 0.00 0.14 0.00 0.00 62.40 62.60 2jul h SER 248 CO 0.01 1.02 0.20 -0.03 -1.14 0.00 0.00 176.83 176.89 2jul h MET 249 N 0.84 0.32 -0.46 3.45 1.85 -1.17 0.09 114.93 119.84 2jul h MET 249 Ca 0.15 -0.02 -0.00 0.00 -0.61 0.00 0.00 59.70 59.22 2jul h MET 249 Cb 0.54 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.48 2jul h MET 249 CO 0.03 0.21 0.28 1.96 -0.40 0.00 0.00 176.91 178.98 2jul h GLN 250 N 0.33 0.63 -0.27 0.39 4.20 -1.21 -1.70 115.11 117.49 2jul h GLN 250 Ca 0.37 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 59.04 2jul h GLN 250 Cb 0.57 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2jul h GLN 250 CO -0.42 0.47 0.18 1.25 -0.67 0.00 0.00 178.83 179.63 2jul h LEU 251 N 0.61 0.23 -0.47 1.46 5.85 -0.76 0.67 115.31 122.91 2jul h LEU 251 Ca 0.17 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 2jul h LEU 251 Cb 0.00 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2jul h LEU 251 CO -0.03 0.16 0.06 0.15 -0.34 0.00 0.00 178.44 178.44 2jul h PHE 252 N 0.27 0.85 0.00 1.25 3.04 -0.16 -2.95 116.94 119.23 2jul h PHE 252 Ca 0.11 -0.12 -0.00 0.00 3.98 0.00 0.00 57.97 61.93 2jul h PHE 252 Cb 0.10 -0.23 -0.00 0.00 2.56 0.00 0.00 35.95 38.38 2jul h PHE 252 CO -0.00 0.79 -0.63 0.93 -2.02 0.00 0.00 178.31 177.38 2jul h GLU 253 N 0.66 0.00 -0.72 1.11 4.39 -0.96 -3.36 114.58 115.70 2jul h GLU 253 Ca 0.14 0.00 0.14 0.00 0.34 0.00 0.00 59.36 59.98 2jul h GLU 253 Cb 0.41 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.93 2jul h GLU 253 CO 0.01 0.01 -0.25 -0.97 -1.16 0.00 0.00 179.01 176.65 2jul h ASN 254 N 0.00 -0.89 0.29 1.42 -0.73 0.51 0.38 115.58 116.56 2jul h ASN 254 Ca -0.00 0.23 -0.12 0.00 1.87 0.00 0.00 56.30 58.28 2jul h ASN 254 Cb 1.01 0.52 -0.01 0.00 0.27 0.00 0.00 38.32 40.11 2jul h ASN 254 CO 0.00 -0.27 -0.46 0.58 -0.37 0.00 0.00 177.43 176.91 2jul h VAL 255 N -0.05 1.33 -0.02 2.57 2.07 -1.71 -3.51 116.25 116.93 2jul h VAL 255 Ca 0.32 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.19 2jul h VAL 255 Cb 0.55 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2jul h VAL 255 CO -0.76 0.49 0.00 -0.38 0.02 0.00 0.00 177.57 176.94