#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 0.41 0.30 -0.52 -0.58 -1.26 -3.59 120.64 115.40 2jul n GLU 77 Ca 0.00 0.00 0.10 0.00 -0.42 0.00 0.00 57.16 56.84 2jul n GLU 77 Cb 0.00 -1.04 0.52 0.00 -0.57 0.00 0.00 31.44 30.35 2jul n GLU 77 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2jul h GLY 78 N 2.41 0.00 0.62 0.62 0.00 -2.05 -1.66 103.07 103.00 2jul h GLY 78 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2jul h GLY 78 CO 0.00 0.00 -0.30 -2.00 0.00 0.00 0.00 176.54 174.24 2jul h LEU 79 N 0.00 -0.70 -1.76 3.11 5.85 -2.00 0.19 115.31 119.99 2jul h LEU 79 Ca 0.00 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2jul h LEU 79 Cb 1.01 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 2jul h LEU 79 CO 0.00 -0.50 0.20 0.44 -0.34 0.00 0.00 178.44 178.23 2jul h ASP 80 N -0.83 0.27 -0.79 1.25 5.19 -1.65 -1.05 116.42 118.80 2jul h ASP 80 Ca -0.08 -0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.29 2jul h ASP 80 Cb 0.64 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 40.05 2jul h ASP 80 CO 0.14 0.19 0.38 -0.61 -3.12 0.00 0.00 179.24 176.22 2jul h GLN 81 N 0.32 1.14 -0.38 3.56 4.15 -1.18 -2.56 115.11 120.16 2jul h GLN 81 Ca 0.12 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 2jul h GLN 81 Cb 0.08 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 2jul h GLN 81 CO -0.02 0.88 0.16 -0.07 -1.93 0.00 0.00 178.83 177.85 2jul h LEU 82 N 1.12 0.52 -0.88 -2.39 3.38 0.69 -2.14 115.31 115.60 2jul h LEU 82 Ca 0.27 -0.15 0.21 0.00 0.09 0.00 0.00 57.88 58.30 2jul h LEU 82 Cb 0.12 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 40.61 2jul h LEU 82 CO -0.03 0.53 0.37 1.56 0.09 0.00 0.00 178.44 180.95 2jul h GLN 83 N 0.47 0.37 0.26 1.13 4.20 -1.10 0.69 115.11 121.14 2jul h GLN 83 Ca 0.13 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 2jul h GLN 83 Cb 0.16 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2jul h GLN 83 CO -0.01 0.25 -0.12 0.00 -0.67 0.00 0.00 178.83 178.27 2jul h ALA 84 N 1.70 -0.35 -3.00 3.87 0.00 -1.16 -3.40 119.26 116.92 2jul h ALA 84 Ca 0.55 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2jul h ALA 84 Cb 1.03 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2jul h ALA 84 CO -0.53 -0.61 0.00 1.04 0.00 0.00 0.00 179.25 179.15 2jul n GLN 85 N -5.17 0.00 -1.64 0.00 6.02 0.03 -4.78 117.38 111.84 2jul n GLN 85 Ca -0.10 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.45 2jul n GLN 85 Cb 0.21 -0.10 -0.02 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 0.00 1.43 0.00 5.09 -2.24 -0.01 -4.97 114.28 113.58 2jul n THR 86 Ca 0.00 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 2jul n THR 86 Cb 0.00 -1.25 0.00 0.00 -2.10 0.00 0.00 70.33 66.98 2jul n THR 86 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2jul n LYS 87 N 1.33 0.15 -1.56 -0.78 4.81 -1.26 -4.12 118.16 116.73 2jul n LYS 87 Ca 0.10 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.59 2jul n LYS 87 Cb 0.31 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.33 2jul n LYS 87 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2jul n PHE 88 N 0.00 -4.18 -3.13 5.64 3.72 -1.26 -4.74 117.46 113.52 2jul n PHE 88 Ca 0.00 2.28 -0.35 0.00 -0.05 0.00 0.00 57.45 59.33 2jul n PHE 88 Cb 0.00 -3.58 -0.06 0.00 -0.94 0.00 0.00 39.48 34.90 2jul n PHE 88 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2jul s THR 89 N -5.12 4.62 0.42 4.37 -4.23 -1.26 -4.77 115.64 109.67 2jul s THR 89 Ca 0.00 1.15 0.26 0.00 -1.18 0.00 0.00 61.69 61.92 2jul s THR 89 Cb 0.00 -3.77 0.45 0.00 1.34 0.00 0.00 72.50 70.52 2jul s THR 89 CO 0.00 0.09 1.66 0.50 -0.54 0.00 0.00 174.62 176.33 2jul h LYS 90 N 3.06 0.17 0.22 3.99 3.64 -1.97 1.36 116.57 127.03 2jul h LYS 90 Ca -0.48 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 2jul h LYS 90 Cb 1.19 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2jul h LYS 90 CO 0.65 0.11 -0.11 -0.22 -2.27 0.00 0.00 179.45 177.62 2jul h LYS 91 N 0.18 -0.28 -0.89 1.90 3.64 -1.99 -0.98 116.57 118.14 2jul h LYS 91 Ca 0.75 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 60.15 2jul h LYS 91 Cb 2.23 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 34.07 2jul h LYS 91 CO -0.40 0.08 0.56 1.49 -2.27 0.00 0.00 179.45 178.91 2jul h GLU 92 N -0.73 1.19 -0.80 1.90 4.81 -0.68 -0.46 114.58 119.81 2jul h GLU 92 Ca -0.03 -0.09 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2jul h GLU 92 Cb 0.49 -0.26 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 2jul h GLU 92 CO 0.05 0.81 0.52 1.25 -0.73 0.00 0.00 179.01 180.91 2jul h LEU 93 N 1.21 0.78 -0.74 1.64 6.46 0.16 0.52 115.31 125.34 2jul h LEU 93 Ca 0.32 0.00 0.07 0.00 -0.12 0.00 0.00 57.88 58.16 2jul h LEU 93 Cb -0.09 -0.17 -0.06 0.00 -0.73 0.00 0.00 40.66 39.61 2jul h LEU 93 CO -0.06 0.51 0.41 -0.61 -0.62 0.00 0.00 178.44 178.06 2jul h GLN 94 N 0.89 0.71 -0.13 1.25 5.75 0.33 0.55 115.11 124.47 2jul h GLN 94 Ca 0.34 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.84 2jul h GLN 94 Cb 0.20 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 28.53 2jul h GLN 94 CO -0.12 0.47 -0.29 1.03 -2.65 0.00 0.00 178.83 177.27 2jul h SER 95 N 0.73 -0.90 -0.81 -0.69 0.87 -0.59 0.66 113.55 112.81 2jul h SER 95 Ca 0.34 0.14 0.09 0.00 -1.23 0.00 0.00 61.79 61.13 2jul h SER 95 Cb 0.26 0.39 -0.07 0.00 -0.44 0.00 0.00 62.40 62.53 2jul h SER 95 CO -0.21 -0.33 0.46 -0.07 -0.53 0.00 0.00 176.83 176.14 2jul h LEU 96 N -0.36 0.65 -1.10 2.23 3.38 -1.03 0.16 115.31 119.24 2jul h LEU 96 Ca 0.10 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.14 2jul h LEU 96 Cb 0.51 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 2jul h LEU 96 CO -0.33 0.37 0.61 0.22 0.09 0.00 0.00 178.44 179.40 2jul h TYR 97 N 0.77 1.15 -0.42 1.13 5.03 0.14 -1.94 116.97 122.83 2jul h TYR 97 Ca 0.39 0.03 0.09 0.00 2.58 0.00 0.00 58.73 61.82 2jul h TYR 97 Cb 0.36 -0.39 -0.09 0.00 1.55 0.00 0.00 36.73 38.17 2jul h TYR 97 CO -0.07 0.69 -0.25 -0.09 -1.32 0.00 0.00 178.16 177.12 2jul h ARG 98 N 1.21 -0.17 -0.95 1.82 2.43 0.32 1.79 114.38 120.83 2jul h ARG 98 Ca 0.35 0.01 0.19 0.00 -0.81 0.00 0.00 59.98 59.73 2jul h ARG 98 Cb -0.06 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.44 2jul h ARG 98 CO -0.09 -0.11 0.61 0.78 -1.51 0.00 0.00 179.97 179.64 2jul h GLY 99 N -0.18 1.25 1.30 2.80 0.00 -1.11 0.42 103.07 107.56 2jul h GLY 99 Ca 0.19 -0.27 -0.21 0.00 0.00 0.00 0.00 47.33 47.05 2jul h GLY 99 CO -0.52 -0.01 -0.75 -2.75 0.00 0.00 0.00 176.54 172.51 2jul h PHE 100 N 0.58 0.92 -0.40 5.60 3.57 0.13 -3.01 116.94 124.33 2jul h PHE 100 Ca 0.51 -0.40 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2jul h PHE 100 Cb 1.03 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.60 2jul h PHE 100 CO -0.00 1.21 0.27 -0.22 -2.23 0.00 0.00 178.31 177.34 2jul h LYS 101 N 0.47 0.53 -0.88 1.11 3.64 0.65 0.07 116.57 122.16 2jul h LYS 101 Ca -0.04 -0.03 0.25 0.00 -1.27 0.00 0.00 60.65 59.56 2jul h LYS 101 Cb 1.36 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 33.03 2jul h LYS 101 CO 0.15 0.35 0.64 -0.97 -2.27 0.00 0.00 179.45 177.34 2jul h ASN 102 N 0.54 0.00 -0.12 4.20 -1.24 -0.73 2.19 115.58 120.42 2jul h ASN 102 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.16 2jul h ASN 102 Cb -0.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 38.99 2jul h ASN 102 CO -0.03 0.00 0.00 1.21 -1.29 0.00 0.00 177.43 177.32 2jul n GLU 103 N -4.26 1.29 -0.70 6.67 2.13 0.01 -5.00 120.64 120.79 2jul n GLU 103 Ca 0.18 -0.44 0.00 0.00 0.66 0.00 0.00 57.16 57.56 2jul n GLU 103 Cb 0.95 -1.10 0.00 0.00 0.27 0.00 0.00 31.44 31.56 2jul n GLU 103 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2jul n PRO 105 N -1.79 0.82 -0.00 0.00 -0.04 -1.26 -4.64 135.00 128.08 2jul n PRO 105 Ca 0.00 -0.22 0.02 0.00 -0.04 0.00 0.00 63.50 63.26 2jul n PRO 105 Cb 0.17 -3.31 -0.03 0.00 -0.04 0.00 0.00 33.50 30.30 2jul n PRO 105 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2jul n THR 106 N 8.10 0.00 0.00 0.52 -2.24 -1.26 -5.00 114.28 114.40 2jul n THR 106 Ca 0.42 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 2jul n THR 106 Cb 0.47 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 2jul n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jul n GLY 107 N 1.90 1.02 3.09 3.38 0.00 -1.26 -4.83 105.19 108.48 2jul n GLY 107 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 2jul n GLY 107 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2jul s LEU 108 N 0.00 1.72 -0.00 0.99 0.05 -1.26 -4.57 118.68 115.60 2jul s LEU 108 Ca 0.00 -0.32 -0.02 0.00 0.05 0.00 0.00 54.13 53.84 2jul s LEU 108 Cb 0.00 0.56 -0.04 0.00 -2.05 0.00 0.00 46.19 44.66 2jul s LEU 108 CO 0.00 -0.39 0.16 0.54 -0.55 0.00 0.00 176.35 176.12 2jul s VAL 109 N -1.64 5.28 0.27 1.48 0.11 0.15 -4.95 120.40 121.10 2jul s VAL 109 Ca -0.13 -0.23 0.11 0.00 -2.93 0.00 0.00 61.98 58.79 2jul s VAL 109 Cb -0.07 -3.47 -0.05 0.00 -1.53 0.00 0.00 36.38 31.27 2jul s VAL 109 CO -0.00 0.32 -0.08 -1.81 -3.33 0.00 0.00 175.10 170.19 2jul s ASP 110 N -1.94 4.16 0.39 3.54 1.01 -1.26 -1.78 116.67 120.78 2jul s ASP 110 Ca 0.27 -0.80 0.14 0.00 0.71 0.00 0.00 52.55 52.87 2jul s ASP 110 Cb -0.13 -0.62 0.97 0.00 1.01 0.00 0.00 42.92 44.15 2jul s ASP 110 CO 0.18 0.02 1.85 -0.33 0.21 0.00 0.00 175.17 177.10 2jul h GLU 111 N 2.04 0.51 0.36 8.23 5.08 -2.00 -1.95 114.58 126.85 2jul h GLU 111 Ca -0.42 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2jul h GLU 111 Cb 1.25 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 2jul h GLU 111 CO 0.60 0.34 -0.35 0.22 -1.00 0.00 0.00 179.01 178.81 2jul h ASP 112 N 0.52 -0.95 -0.73 1.42 3.58 -1.96 -1.44 116.42 116.85 2jul h ASP 112 Ca 0.47 0.08 0.16 0.00 0.42 0.00 0.00 57.03 58.16 2jul h ASP 112 Cb 1.00 0.32 -0.11 0.00 1.72 0.00 0.00 39.33 42.26 2jul h ASP 112 CO -0.20 -0.50 0.20 0.74 -2.88 0.00 0.00 179.24 176.60 2jul h THR 113 N -0.74 0.54 -0.21 2.25 2.02 -1.77 0.16 112.91 115.17 2jul h THR 113 Ca -0.03 -0.10 0.04 0.00 0.77 0.00 0.00 66.41 67.10 2jul h THR 113 Cb 0.66 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 2jul h THR 113 CO -0.06 0.05 -0.06 -0.26 0.37 0.00 0.00 175.52 175.57 2jul h PHE 114 N 0.29 -0.13 -0.29 3.16 -1.00 -1.18 0.43 116.94 118.22 2jul h PHE 114 Ca 0.41 0.02 -0.05 0.00 2.81 0.00 0.00 57.97 61.17 2jul h PHE 114 Cb 0.69 0.09 -0.02 0.00 3.61 0.00 0.00 35.95 40.33 2jul h PHE 114 CO -0.25 -0.10 -0.02 -0.22 -1.61 0.00 0.00 178.31 176.12 2jul h LYS 115 N -0.01 0.44 -0.19 1.51 3.64 -0.03 -0.58 116.57 121.35 2jul h LYS 115 Ca 0.10 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 2jul h LYS 115 Cb 0.17 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2jul h LYS 115 CO -0.22 0.48 -0.30 1.25 -2.27 0.00 0.00 179.45 178.39 2jul h LEU 116 N 0.42 0.60 -1.17 5.20 5.85 0.45 -2.35 115.31 124.31 2jul h LEU 116 Ca 0.09 -0.53 -0.08 0.00 0.84 0.00 0.00 57.88 58.20 2jul h LEU 116 Cb 0.31 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2jul h LEU 116 CO 0.01 1.01 -0.37 0.40 -0.34 0.00 0.00 178.44 179.15 2jul h ILE 117 N 0.21 1.28 -0.18 4.05 2.04 0.09 -2.09 117.51 122.91 2jul h ILE 117 Ca 0.02 -1.33 -0.14 0.00 1.00 0.00 0.00 64.86 64.40 2jul h ILE 117 Cb 0.89 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 2jul h ILE 117 CO 0.07 0.39 -0.48 1.88 0.00 0.00 0.00 178.15 180.00 2jul h TYR 118 N 0.06 0.58 0.00 1.37 -1.99 -1.02 -0.28 116.97 115.69 2jul h TYR 118 Ca 0.01 -0.19 -0.08 0.00 2.00 0.00 0.00 58.73 60.47 2jul h TYR 118 Cb 0.69 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.29 2jul h TYR 118 CO 0.00 0.87 -0.40 1.03 -0.00 0.00 0.00 178.16 179.66 2jul h SER 119 N 0.38 0.00 0.98 3.88 0.87 -1.09 -3.15 113.55 115.42 2jul h SER 119 Ca 0.02 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2jul h SER 119 Cb 0.99 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2jul h SER 119 CO 0.09 0.40 -1.03 -0.61 -0.53 0.00 0.00 176.83 175.15 2jul h GLN 120 N 0.00 0.00 0.00 2.24 4.15 -1.18 -3.40 115.11 116.92 2jul h GLN 120 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2jul h GLN 120 Cb 1.13 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.82 2jul h GLN 120 CO 0.05 0.04 0.00 0.34 -1.93 0.00 0.00 178.83 177.33 2jul n PHE 121 N -2.71 0.00 -2.41 3.99 -0.00 -0.13 -4.82 117.46 111.38 2jul n PHE 121 Ca -0.01 0.00 -0.36 0.00 -0.00 0.00 0.00 57.45 57.08 2jul n PHE 121 Cb 0.58 -0.47 -0.02 0.00 -0.00 0.00 0.00 39.48 39.57 2jul n PHE 121 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 2jul s PHE 122 N -1.60 2.95 -0.36 -5.13 0.08 -1.21 -4.90 117.98 107.81 2jul s PHE 122 Ca 0.00 1.57 -0.27 0.00 0.12 0.00 0.00 56.93 58.35 2jul s PHE 122 Cb 0.00 -3.21 -0.06 0.00 -0.57 0.00 0.00 43.02 39.18 2jul s PHE 122 CO 0.00 -1.13 2.32 -0.35 -0.10 0.00 0.00 175.22 175.96 2jul n PRO 123 N -0.73 1.48 0.00 0.24 -0.04 -1.26 -4.71 135.00 129.97 2jul n PRO 123 Ca 0.08 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 2jul n PRO 123 Cb 0.50 -3.31 0.00 0.00 -0.04 0.00 0.00 33.50 30.65 2jul n PRO 123 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2jul n GLN 124 N 8.87 0.00 -1.06 0.54 0.00 -1.26 -4.73 117.38 119.74 2jul n GLN 124 Ca 0.34 0.00 0.14 0.00 -0.00 0.00 0.00 57.00 57.48 2jul n GLN 124 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.67 2jul n GLN 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jul n GLY 125 N 0.00 -2.53 0.00 1.69 0.00 -1.26 -4.86 105.19 98.22 2jul n GLY 125 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2jul n GLY 125 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jul n ASP 126 N -3.82 0.00 0.00 1.61 8.00 -1.26 -4.88 116.55 116.19 2jul n ASP 126 Ca -0.03 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2jul n ASP 126 Cb 0.50 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 2jul n ASP 126 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jul n ALA 127 N -1.88 0.00 -0.24 2.24 0.00 -1.26 -4.73 120.51 114.63 2jul n ALA 127 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2jul n ALA 127 Cb 0.00 -0.40 0.17 0.00 0.00 0.00 0.00 19.45 19.23 2jul n ALA 127 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2jul h THR 128 N 0.00 0.56 0.25 0.00 2.02 -1.93 1.01 112.91 114.82 2jul h THR 128 Ca 0.00 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2jul h THR 128 Cb 0.00 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 2jul h THR 128 CO 0.00 0.06 -0.12 0.74 0.37 0.00 0.00 175.52 176.57 2jul h THR 129 N 0.31 0.80 -0.25 3.16 2.02 -1.97 -2.09 112.91 114.89 2jul h THR 129 Ca 0.40 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 67.27 2jul h THR 129 Cb 0.66 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 2jul h THR 129 CO -0.47 0.07 0.15 0.22 0.37 0.00 0.00 175.52 175.85 2jul h TYR 130 N -0.50 0.32 -0.81 3.16 3.20 -1.65 -1.48 116.97 119.22 2jul h TYR 130 Ca -0.03 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 2jul h TYR 130 Cb 0.37 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 2jul h TYR 130 CO -0.02 0.22 0.37 0.00 -1.64 0.00 0.00 178.16 177.09 2jul h ALA 131 N 1.82 1.12 -0.10 1.82 0.00 0.14 -0.55 119.26 123.52 2jul h ALA 131 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jul h ALA 131 Cb -0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2jul h ALA 131 CO -0.02 0.65 0.05 1.25 0.00 0.00 0.00 179.25 181.18 2jul h HIS 132 N 1.16 0.14 -0.31 0.00 -0.00 -0.59 -2.22 115.15 113.32 2jul h HIS 132 Ca 0.28 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.62 2jul h HIS 132 Cb 0.14 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 27.49 2jul h HIS 132 CO 0.02 0.19 0.10 0.74 -0.00 0.00 0.00 177.93 178.98 2jul h PHE 133 N 0.05 0.43 -0.24 5.26 0.04 -1.24 -1.97 116.94 119.26 2jul h PHE 133 Ca 0.03 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.81 2jul h PHE 133 Cb 0.10 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 2jul h PHE 133 CO -0.04 0.36 0.11 1.25 -0.60 0.00 0.00 178.31 179.40 2jul h LEU 134 N 0.43 0.16 -1.19 1.54 7.12 -0.53 -1.41 115.31 121.43 2jul h LEU 134 Ca 0.11 0.01 -0.05 0.00 0.13 0.00 0.00 57.88 58.08 2jul h LEU 134 Cb 0.13 -0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 40.22 2jul h LEU 134 CO -0.01 0.12 0.05 0.15 -0.13 0.00 0.00 178.44 178.63 2jul h PHE 135 N 0.24 0.63 0.00 1.25 3.04 -0.87 -1.51 116.94 119.72 2jul h PHE 135 Ca 0.10 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 61.97 2jul h PHE 135 Cb 0.04 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.36 2jul h PHE 135 CO -0.10 0.58 -0.08 -0.97 -2.02 0.00 0.00 178.31 175.71 2jul h ASN 136 N 0.59 0.00 0.00 0.41 -0.73 -0.62 -2.96 115.58 112.28 2jul h ASN 136 Ca 0.13 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.26 2jul h ASN 136 Cb 0.30 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.88 2jul h ASN 136 CO 0.00 0.08 -0.24 0.00 -0.37 0.00 0.00 177.43 176.91 2jul h ALA 137 N 1.92 0.05 0.12 1.57 0.00 -0.26 -3.29 119.26 119.37 2jul h ALA 137 Ca -0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.30 2jul h ALA 137 Cb 0.40 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2jul h ALA 137 CO 0.01 0.14 -0.18 0.74 0.00 0.00 0.00 179.25 179.96 2jul h PHE 138 N -1.00 -0.50 0.00 0.00 -1.00 -1.41 0.12 116.94 113.16 2jul h PHE 138 Ca -0.07 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.72 2jul h PHE 138 Cb 1.01 0.20 0.00 0.00 3.61 0.00 0.00 35.95 40.77 2jul h PHE 138 CO 0.23 -0.22 0.04 -0.40 -1.61 0.00 0.00 178.31 176.35 2jul n ASP 139 N -3.41 0.00 0.00 2.17 5.68 -1.12 -4.77 116.55 115.10 2jul n ASP 139 Ca -0.04 0.08 0.00 0.00 -0.50 0.00 0.00 54.79 54.33 2jul n ASP 139 Cb 0.15 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 2jul n ASP 139 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jul n ALA 140 N -0.95 0.00 -1.00 2.12 0.00 0.41 -3.02 120.51 118.07 2jul n ALA 140 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jul n ALA 140 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 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 6.11 0.00 -3.77 0.00 2.03 -1.26 -4.80 116.55 114.87 2jul n ASP 141 Ca 0.00 0.10 -0.25 0.00 0.52 0.00 0.00 54.79 55.16 2jul n ASP 141 Cb 0.00 0.00 0.19 0.00 -0.72 0.00 0.00 41.12 40.59 2jul n ASP 141 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jul n GLY 142 N 1.82 -2.75 0.00 0.27 0.00 -1.17 -5.04 105.19 98.33 2jul n GLY 142 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.49 0.00 0.00 1.61 4.13 -1.26 -4.65 115.26 112.60 2jul n ASN 143 Ca 0.06 -0.40 0.00 0.00 1.68 0.00 0.00 54.58 55.91 2jul n ASN 143 Cb 0.49 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.73 2jul n ASN 143 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jul n GLY 144 N 0.00 0.83 3.34 7.41 0.00 -1.26 -4.89 105.19 110.62 2jul n GLY 144 Ca 0.00 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 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 -1.00 2.50 0.43 4.61 0.00 -1.26 -4.36 121.76 122.68 2jul s ALA 145 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 51.96 51.11 2jul s ALA 145 Cb 0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.05 2jul s ALA 145 CO 0.00 0.30 0.43 0.96 0.00 0.00 0.00 175.76 177.45 2jul s ILE 146 N 0.19 2.61 0.00 0.00 -4.36 -0.73 -4.94 121.20 113.97 2jul s ILE 146 Ca -0.10 -1.28 0.00 0.00 -0.26 0.00 0.00 60.65 59.01 2jul s ILE 146 Cb -0.16 -2.89 0.00 0.00 1.25 0.00 0.00 42.46 40.66 2jul s ILE 146 CO 0.06 0.00 0.00 1.41 0.24 0.00 0.00 174.94 176.65 2jul n HIS 147 N -1.65 0.00 0.92 1.37 8.25 -1.26 -0.68 115.22 122.18 2jul n HIS 147 Ca 0.05 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.64 2jul n HIS 147 Cb 0.61 0.00 0.49 0.00 1.12 0.00 0.00 29.99 32.21 2jul n HIS 147 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2jul n PHE 148 N 0.00 0.17 0.10 4.41 7.35 -1.26 -3.87 117.46 124.36 2jul n PHE 148 Ca 0.00 0.05 -0.05 0.00 -0.76 0.00 0.00 57.45 56.69 2jul n PHE 148 Cb 0.00 -0.52 -0.02 0.00 0.35 0.00 0.00 39.48 39.29 2jul n PHE 148 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2jul h GLU 149 N 0.00 -0.29 -0.14 -4.13 4.22 -1.96 -2.13 114.58 110.15 2jul h GLU 149 Ca 0.00 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.50 2jul h GLU 149 Cb 0.55 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2jul h GLU 149 CO 0.00 -0.19 0.49 0.38 -2.18 0.00 0.00 179.01 177.50 2jul h ASP 150 N -0.58 0.00 0.08 1.04 3.04 -1.97 0.29 116.42 118.32 2jul h ASP 150 Ca -0.03 0.00 -0.21 0.00 -3.24 0.00 0.00 57.03 53.54 2jul h ASP 150 Cb 0.23 0.00 0.02 0.00 -1.04 0.00 0.00 39.33 38.54 2jul h ASP 150 CO 0.05 0.00 -0.89 0.15 -2.04 0.00 0.00 179.24 176.51 2jul h PHE 151 N 0.00 0.74 -0.43 4.15 3.57 -1.65 -2.49 116.94 120.83 2jul h PHE 151 Ca 0.07 -0.46 -0.11 0.00 3.53 0.00 0.00 57.97 61.00 2jul h PHE 151 Cb 1.04 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 2jul h PHE 151 CO 0.00 1.31 -0.16 0.28 -2.23 0.00 0.00 178.31 177.52 2jul h VAL 152 N -0.05 1.26 -0.33 1.41 2.07 0.22 -2.11 116.25 118.73 2jul h VAL 152 Ca -0.14 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.10 2jul h VAL 152 Cb 1.62 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2jul h VAL 152 CO 0.17 0.43 0.08 0.58 0.02 0.00 0.00 177.57 178.85 2jul h VAL 153 N 0.72 1.22 -0.59 2.57 2.07 -1.34 -2.77 116.25 118.14 2jul h VAL 153 Ca 0.11 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.91 2jul h VAL 153 Cb 0.66 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2jul h VAL 153 CO 0.05 0.25 0.36 1.23 0.02 0.00 0.00 177.57 179.48 2jul h GLY 154 N 0.37 0.84 -0.22 2.17 0.00 -1.29 -1.96 103.07 102.98 2jul h GLY 154 Ca 0.10 -0.28 0.11 0.00 0.00 0.00 0.00 47.33 47.26 2jul h GLY 154 CO 0.00 0.24 -0.22 -2.00 0.00 0.00 0.00 176.54 174.56 2jul h LEU 155 N 0.72 -0.79 -1.62 3.11 7.12 -1.12 1.07 115.31 123.81 2jul h LEU 155 Ca 0.23 0.19 0.04 0.00 0.13 0.00 0.00 57.88 58.48 2jul h LEU 155 Cb 0.00 0.44 -0.03 0.00 -0.53 0.00 0.00 40.66 40.55 2jul h LEU 155 CO -0.09 -0.25 0.32 -1.28 -0.13 0.00 0.00 178.44 177.01 2jul h SER 156 N -0.10 0.42 0.04 1.25 0.87 -1.12 -0.01 113.55 114.90 2jul h SER 156 Ca 0.25 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2jul h SER 156 Cb 0.49 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2jul h SER 156 CO -0.61 0.29 -0.02 0.40 -0.53 0.00 0.00 176.83 176.36 2jul h ILE 157 N 0.49 1.33 0.00 2.23 2.04 0.10 -1.78 117.51 121.92 2jul h ILE 157 Ca 0.20 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 64.34 2jul h ILE 157 Cb 0.19 2.39 -0.00 0.00 -0.74 0.00 0.00 36.82 38.65 2jul h ILE 157 CO -0.05 0.40 -0.00 -0.07 0.00 0.00 0.00 178.15 178.43 2jul h LEU 158 N -0.87 0.00 0.00 1.44 4.07 0.10 -3.31 115.31 116.74 2jul h LEU 158 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2jul h LEU 158 Cb 0.70 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.44 2jul h LEU 158 CO 0.01 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.55 2jul n LEU 159 N -3.19 1.47 -4.83 1.67 4.77 -0.04 -5.04 117.00 111.81 2jul n LEU 159 Ca -0.03 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.72 2jul n LEU 159 Cb 0.09 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 2jul n LEU 159 CO 0.22 -0.00 -0.05 0.00 -1.33 0.00 0.00 177.39 176.22 2jul s ARG 160 N -0.00 2.36 0.00 3.23 1.04 -0.67 -5.09 118.95 119.82 2jul s ARG 160 Ca 0.00 -1.75 0.00 0.00 -1.04 0.00 0.00 55.73 52.94 2jul s ARG 160 Cb 0.00 -2.17 0.00 0.00 -2.04 0.00 0.00 34.95 30.74 2jul s ARG 160 CO 0.00 -0.24 0.00 0.41 -0.04 0.00 0.00 175.30 175.43 2jul n GLY 161 N -1.46 1.05 3.92 3.88 0.00 -1.26 -4.03 105.19 107.28 2jul n GLY 161 Ca 0.01 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.78 2jul n GLY 161 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jul s THR 162 N -1.01 2.18 -0.43 2.61 -4.23 -1.26 -4.95 115.64 108.55 2jul s THR 162 Ca 0.00 -0.16 0.26 0.00 -1.18 0.00 0.00 61.69 60.61 2jul s THR 162 Cb 0.00 -3.00 0.29 0.00 1.34 0.00 0.00 72.50 71.13 2jul s THR 162 CO 0.00 -0.01 1.77 0.58 -0.54 0.00 0.00 174.62 176.43 2jul h VAL 163 N -0.77 0.00 -0.13 2.29 2.07 -2.01 -3.02 116.25 114.68 2jul h VAL 163 Ca -0.45 -0.40 -0.19 0.00 0.82 0.00 0.00 66.70 66.47 2jul h VAL 163 Cb 1.32 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2jul h VAL 163 CO 0.62 0.00 -0.70 -0.74 0.02 0.00 0.00 177.57 176.77 2jul h HIS 164 N 0.00 0.76 -0.15 1.57 -0.00 -1.99 -2.56 115.15 112.78 2jul h HIS 164 Ca 0.00 -0.32 -0.11 0.00 -0.00 0.00 0.00 60.37 59.94 2jul h HIS 164 Cb 0.53 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 2jul h HIS 164 CO 0.00 1.10 -0.38 0.93 -0.00 0.00 0.00 177.93 179.58 2jul h GLU 165 N 0.40 0.33 -0.23 5.26 4.39 -1.92 -1.36 114.58 121.45 2jul h GLU 165 Ca -0.03 -0.15 -0.13 0.00 0.34 0.00 0.00 59.36 59.39 2jul h GLU 165 Cb 1.29 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.93 2jul h GLU 165 CO 0.13 0.66 -0.36 0.87 -1.16 0.00 0.00 179.01 179.15 2jul h LYS 166 N 0.28 0.65 0.00 2.33 1.57 -1.58 -1.34 116.57 118.49 2jul h LYS 166 Ca 0.03 -0.39 -0.04 0.00 -1.87 0.00 0.00 60.65 58.37 2jul h LYS 166 Cb 0.80 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 2jul h LYS 166 CO 0.06 1.01 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.67 2jul h LEU 167 N 0.36 0.00 0.09 2.94 3.38 -1.36 -1.51 115.31 119.21 2jul h LEU 167 Ca 0.02 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.81 2jul h LEU 167 Cb 0.95 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.72 2jul h LEU 167 CO 0.08 0.21 -0.77 0.50 0.09 0.00 0.00 178.44 178.55 2jul h LYS 168 N 0.00 0.37 -0.16 1.13 3.64 -1.08 -1.87 116.57 118.60 2jul h LYS 168 Ca -0.00 -0.52 -0.11 0.00 -1.27 0.00 0.00 60.65 58.75 2jul h LYS 168 Cb 0.70 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2jul h LYS 168 CO 0.03 1.20 -0.40 2.35 -2.27 0.00 0.00 179.45 180.36 2jul h TRP 169 N -0.21 0.42 -0.17 1.91 7.01 -1.15 -1.76 115.95 122.00 2jul h TRP 169 Ca -0.12 -0.11 -0.21 0.00 2.11 0.00 0.00 58.89 60.55 2jul h TRP 169 Cb 1.54 -0.09 0.01 0.00 -2.10 0.00 0.00 29.16 28.52 2jul h TRP 169 CO 0.17 0.71 -0.73 0.00 -2.79 0.00 0.00 178.44 175.79 2jul h ALA 170 N 1.28 0.37 -0.40 2.65 0.00 -1.34 -2.43 119.26 119.39 2jul h ALA 170 Ca 0.03 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 2jul h ALA 170 Cb 0.84 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2jul h ALA 170 CO 0.07 0.69 -0.09 0.35 0.00 0.00 0.00 179.25 180.27 2jul h PHE 171 N 0.54 0.76 -0.17 0.00 3.04 -1.19 -2.48 116.94 117.44 2jul h PHE 171 Ca -0.04 -0.13 -0.12 0.00 3.98 0.00 0.00 57.97 61.67 2jul h PHE 171 Cb 1.35 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.65 2jul h PHE 171 CO 0.08 0.76 -0.40 -0.97 -2.02 0.00 0.00 178.31 175.77 2jul h ASN 172 N 0.64 0.39 0.13 0.41 -1.24 -1.27 -3.14 115.58 111.51 2jul h ASN 172 Ca 0.12 -0.17 -0.01 0.00 0.71 0.00 0.00 56.30 56.95 2jul h ASN 172 Cb 0.53 -0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.47 2jul h ASN 172 CO 0.03 0.75 -0.06 0.25 -1.29 0.00 0.00 177.43 177.11 2jul h LEU 173 N 0.31 -0.15 -7.30 0.34 5.85 -0.99 -3.32 115.31 110.05 2jul h LEU 173 Ca 0.03 -0.07 -0.42 0.00 0.84 0.00 0.00 57.88 58.25 2jul h LEU 173 Cb 0.84 0.04 0.05 0.00 0.37 0.00 0.00 40.66 41.96 2jul h LEU 173 CO 0.07 -0.02 1.24 -1.22 -0.34 0.00 0.00 178.44 178.17 2jul n TYR 174 N -5.13 1.22 -3.58 1.25 4.01 -1.04 -4.71 117.16 109.18 2jul n TYR 174 Ca -0.08 -0.95 -0.02 0.00 -0.16 0.00 0.00 57.90 56.69 2jul n TYR 174 Cb 0.13 -1.78 -0.06 0.00 -0.31 0.00 0.00 39.34 37.33 2jul n TYR 174 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jul s ASP 175 N 6.74 -0.71 -0.20 7.72 2.15 -1.25 -4.95 116.67 126.17 2jul s ASP 175 Ca 0.69 1.07 -0.17 0.00 0.43 0.00 0.00 52.55 54.57 2jul s ASP 175 Cb 0.07 1.54 -0.12 0.00 -0.30 0.00 0.00 42.92 44.11 2jul s ASP 175 CO 0.21 -0.16 -0.02 -0.38 -0.17 0.00 0.00 175.17 174.65 2jul n ILE 176 N 4.44 1.50 -3.12 4.11 -0.00 -1.26 -4.94 119.36 120.09 2jul n ILE 176 Ca -0.15 0.01 -0.32 0.00 -0.00 0.00 0.00 62.75 62.29 2jul n ILE 176 Cb 0.55 -2.15 -0.05 0.00 -0.00 0.00 0.00 39.64 37.99 2jul n ILE 176 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2jul s ASN 177 N -6.54 6.66 -0.80 4.38 2.20 -1.26 -4.96 114.94 114.61 2jul s ASN 177 Ca -0.26 1.14 -0.25 0.00 -0.94 0.00 0.00 52.86 52.55 2jul s ASN 177 Cb 0.06 -2.32 -0.04 0.00 -2.00 0.00 0.00 41.25 36.94 2jul s ASN 177 CO 0.46 -0.24 1.95 -0.75 -2.94 0.00 0.00 177.10 175.58 2jul s LYS 178 N -3.23 2.53 0.24 3.55 2.20 -1.26 -4.86 119.74 118.90 2jul s LYS 178 Ca 0.52 0.04 -0.22 0.00 -0.36 0.00 0.00 55.97 55.95 2jul s LYS 178 Cb -0.10 -4.84 0.04 0.00 -1.51 0.00 0.00 37.83 31.41 2jul s LYS 178 CO 0.23 -3.23 0.69 0.16 -0.36 0.00 0.00 175.35 172.83 2jul s ASP 179 N 8.26 -0.36 -0.66 1.43 -4.77 -1.26 -5.05 116.67 114.26 2jul s ASP 179 Ca 0.71 -0.40 -0.00 0.00 -3.30 0.00 0.00 52.55 49.55 2jul s ASP 179 Cb -0.09 0.68 0.42 0.00 -1.09 0.00 0.00 42.92 42.84 2jul s ASP 179 CO 0.07 -1.21 1.84 0.61 0.70 0.00 0.00 175.17 177.17 2jul n GLY 180 N -0.43 5.84 3.28 2.12 0.00 -1.26 -4.96 105.19 109.78 2jul n GLY 180 Ca -0.08 -2.45 -0.09 0.00 0.00 0.00 0.00 46.02 43.39 2jul n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jul s ILE 182 N -3.85 1.51 0.13 0.00 1.01 0.75 -4.94 121.20 115.80 2jul s ILE 182 Ca 0.06 -2.14 -0.14 0.00 0.00 0.00 0.00 60.65 58.43 2jul s ILE 182 Cb 0.03 -2.13 0.02 0.00 0.01 0.00 0.00 42.46 40.40 2jul s ILE 182 CO -0.10 -0.53 0.36 0.28 0.00 0.00 0.00 174.94 174.95 2jul s THR 183 N -3.11 0.08 0.41 2.92 -1.32 -1.26 -0.23 115.64 113.13 2jul s THR 183 Ca 0.24 -0.78 0.16 0.00 -1.21 0.00 0.00 61.69 60.10 2jul s THR 183 Cb 0.02 -1.29 0.37 0.00 -1.51 0.00 0.00 72.50 70.09 2jul s THR 183 CO 0.07 -0.37 1.87 0.50 -2.21 0.00 0.00 174.62 174.48 2jul h LYS 184 N 2.44 0.43 0.70 7.08 3.64 -1.96 -2.24 116.57 126.67 2jul h LYS 184 Ca -0.33 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.99 2jul h LYS 184 Cb 1.24 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2jul h LYS 184 CO 0.48 0.29 -0.38 1.49 -2.27 0.00 0.00 179.45 179.05 2jul h GLU 185 N 0.44 -0.97 -0.50 1.90 4.57 -2.00 -2.06 114.58 115.97 2jul h GLU 185 Ca 0.44 0.07 0.15 0.00 -1.18 0.00 0.00 59.36 58.83 2jul h GLU 185 Cb 1.04 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 2jul h GLU 185 CO -0.17 -0.65 0.41 0.93 -1.18 0.00 0.00 179.01 178.36 2jul h GLU 186 N -1.01 0.00 -0.41 1.92 5.08 -1.82 0.68 114.58 119.02 2jul h GLU 186 Ca -0.09 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.14 2jul h GLU 186 Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2jul h GLU 186 CO 0.12 0.00 -0.25 1.98 -1.00 0.00 0.00 179.01 179.86 2jul h MET 187 N 0.00 0.86 -0.17 2.33 4.05 -1.06 -1.75 114.93 119.19 2jul h MET 187 Ca 0.24 -0.37 -0.02 0.00 -0.28 0.00 0.00 59.70 59.27 2jul h MET 187 Cb 1.06 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 2jul h MET 187 CO -0.00 1.01 0.02 1.25 0.23 0.00 0.00 176.91 179.41 2jul h LEU 188 N 0.73 0.28 -0.97 3.39 7.12 -0.42 -1.88 115.31 123.56 2jul h LEU 188 Ca 0.09 -0.28 -0.02 0.00 0.13 0.00 0.00 57.88 57.80 2jul h LEU 188 Cb 0.79 -0.08 -0.04 0.00 -0.53 0.00 0.00 40.66 40.81 2jul h LEU 188 CO 0.07 0.49 0.43 0.00 -0.13 0.00 0.00 178.44 179.29 2jul h ALA 189 N 0.80 1.20 -0.67 1.25 0.00 -1.44 -1.84 119.26 118.57 2jul h ALA 189 Ca 0.05 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2jul h ALA 189 Cb 0.34 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2jul h ALA 189 CO 0.01 0.63 0.14 0.82 0.00 0.00 0.00 179.25 180.84 2jul h ILE 190 N 1.16 1.26 -0.55 0.00 1.08 -1.18 -2.59 117.51 116.69 2jul h ILE 190 Ca 0.29 -0.99 -0.06 0.00 -0.39 0.00 0.00 64.86 63.70 2jul h ILE 190 Cb 0.06 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.40 2jul h ILE 190 CO -0.04 0.37 0.09 0.24 -0.69 0.00 0.00 178.15 178.13 2jul h MET 191 N 1.01 0.90 -0.91 2.37 2.86 -0.93 -2.57 114.93 117.67 2jul h MET 191 Ca 0.21 -0.24 0.07 0.00 -2.06 0.00 0.00 59.70 57.68 2jul h MET 191 Cb 0.40 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.89 2jul h MET 191 CO 0.01 0.87 0.59 -0.22 1.06 0.00 0.00 176.91 179.22 2jul h LYS 192 N 0.79 0.98 0.47 1.72 3.64 -1.13 0.06 116.57 123.10 2jul h LYS 192 Ca 0.17 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 2jul h LYS 192 Cb 0.40 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2jul h LYS 192 CO 0.01 0.65 -0.23 0.77 -2.27 0.00 0.00 179.45 178.38 2jul h SER 193 N 1.01 -0.53 -0.93 4.20 0.02 -1.08 0.16 113.55 116.40 2jul h SER 193 Ca 0.40 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.39 2jul h SER 193 Cb 0.24 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.86 2jul h SER 193 CO -0.16 -0.34 0.59 0.40 -1.14 0.00 0.00 176.83 176.19 2jul h ILE 194 N -0.69 1.10 -0.47 3.27 5.03 -1.15 0.74 117.51 125.34 2jul h ILE 194 Ca -0.06 -0.38 -0.05 0.00 -0.12 0.00 0.00 64.86 64.25 2jul h ILE 194 Cb 0.51 -0.11 -0.02 0.00 -3.03 0.00 0.00 36.82 34.17 2jul h ILE 194 CO 0.11 0.20 0.08 1.88 -0.68 0.00 0.00 178.15 179.74 2jul h TYR 195 N 1.10 0.75 0.00 1.37 -1.99 -0.74 -1.40 116.97 116.07 2jul h TYR 195 Ca 0.39 -0.07 -0.09 0.00 2.00 0.00 0.00 58.73 60.96 2jul h TYR 195 Cb 0.11 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 38.61 2jul h TYR 195 CO -0.02 0.66 -0.84 -0.44 -0.00 0.00 0.00 178.16 177.52 2jul h ASP 196 N 0.69 0.00 1.50 3.88 5.19 0.12 -3.28 116.42 124.53 2jul h ASP 196 Ca 0.15 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 2jul h ASP 196 Cb 0.31 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 2jul h ASP 196 CO 0.00 0.37 -0.26 -0.03 -3.12 0.00 0.00 179.24 176.21 2jul h MET 197 N 0.00 0.00 -0.87 3.56 4.05 0.85 -3.30 114.93 119.22 2jul h MET 197 Ca -0.06 0.00 0.22 0.00 -0.28 0.00 0.00 59.70 59.58 2jul h MET 197 Cb 1.33 0.00 -0.16 0.00 -0.80 0.00 0.00 31.60 31.98 2jul h MET 197 CO 0.04 0.26 0.01 1.98 0.23 0.00 0.00 176.91 179.42 2jul h MET 198 N 0.00 0.07 0.00 0.39 -1.53 -1.33 -3.45 114.93 109.07 2jul h MET 198 Ca -0.00 -0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.25 2jul h MET 198 Cb 1.08 -0.01 0.00 0.00 -0.55 0.00 0.00 31.60 32.11 2jul h MET 198 CO 0.03 0.04 0.00 0.41 0.14 0.00 0.00 176.91 177.54 2jul n GLY 199 N -1.46 2.95 7.00 1.39 0.00 -1.24 -4.83 105.19 109.00 2jul n GLY 199 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2jul n GLY 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jul n ARG 200 N 13.39 0.00 -3.42 1.61 1.74 -1.26 -4.79 116.66 123.93 2jul n ARG 200 Ca 0.00 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 2jul n ARG 200 Cb 0.00 0.00 0.07 0.00 -1.02 0.00 0.00 32.46 31.51 2jul n ARG 200 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 2jul n HIS 201 N 0.00 -2.23 -0.02 -1.55 -0.00 -1.26 -4.92 115.22 105.23 2jul n HIS 201 Ca 0.00 0.87 0.02 0.00 0.46 0.00 0.00 57.72 59.07 2jul n HIS 201 Cb 0.00 -4.58 -0.09 0.00 -0.12 0.00 0.00 29.99 25.20 2jul n HIS 201 CO 0.00 0.00 0.00 -2.37 0.46 0.00 0.00 176.34 174.43 2jul n THR 202 N -3.84 0.30 -2.21 3.57 5.66 -1.26 -4.98 114.28 111.51 2jul n THR 202 Ca -0.21 -0.36 -0.41 0.00 -3.05 0.00 0.00 64.05 60.02 2jul n THR 202 Cb 0.65 -0.13 -0.03 0.00 -1.55 0.00 0.00 70.33 69.27 2jul n THR 202 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 2jul s TYR 203 N -2.65 3.25 0.23 1.09 5.04 -1.26 -4.94 117.35 118.11 2jul s TYR 203 Ca -0.05 1.22 -0.31 0.00 -2.44 0.00 0.00 57.07 55.49 2jul s TYR 203 Cb 0.06 -3.61 -0.12 0.00 0.35 0.00 0.00 41.96 38.65 2jul s TYR 203 CO 0.50 -1.89 1.68 -1.25 -1.34 0.00 0.00 175.55 173.25 2jul s PRO 204 N -0.13 4.13 0.15 4.97 0.04 -1.26 -4.47 135.00 138.42 2jul s PRO 204 Ca 0.57 2.58 0.00 0.00 0.04 0.00 0.00 61.00 64.19 2jul s PRO 204 Cb -0.37 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2jul s PRO 204 CO 0.38 -0.71 0.00 -0.89 0.04 0.00 0.00 177.00 175.82 2jul n ILE 205 N 3.48-12.50 -3.67 0.56 -0.00 -1.26 -5.04 119.36 100.93 2jul n ILE 205 Ca 0.14 3.12 -0.18 0.00 -0.00 0.00 0.00 62.75 65.82 2jul n ILE 205 Cb 0.36 -5.29 -0.16 0.00 -0.00 0.00 0.00 39.64 34.55 2jul n ILE 205 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 2jul s LEU 206 N -0.50 0.00 0.00 1.39 0.20 -1.26 -5.14 118.68 113.38 2jul s LEU 206 Ca 0.00 0.23 0.00 0.00 0.69 0.00 0.00 54.13 55.05 2jul s LEU 206 Cb 0.00 0.12 0.00 0.00 -0.43 0.00 0.00 46.19 45.88 2jul s LEU 206 CO 0.00 -0.25 0.00 0.54 -0.29 0.00 0.00 176.35 176.35 2jul n ARG 207 N 5.32 1.24 -1.69 1.98 1.74 -1.26 -5.09 116.66 118.90 2jul n ARG 207 Ca -0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 2jul n ARG 207 Cb 0.50 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.94 2jul n ARG 207 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2jul n GLU 208 N 0.00 -2.81 -3.62 5.56 0.00 -1.26 -5.10 120.64 113.41 2jul n GLU 208 Ca 0.00 2.27 -0.07 0.00 0.00 0.00 0.00 57.16 59.36 2jul n GLU 208 Cb 0.00 -2.73 -0.06 0.00 0.00 0.00 0.00 31.44 28.66 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 -0.32 -0.25 -0.31 4.31 -4.77 -1.26 -5.10 116.67 108.96 2jul s ASP 209 Ca 0.00 0.37 -0.01 0.00 -3.30 0.00 0.00 52.55 49.62 2jul s ASP 209 Cb 0.00 0.34 0.30 0.00 -1.09 0.00 0.00 42.92 42.46 2jul s ASP 209 CO 0.00 -0.17 1.33 0.00 0.70 0.00 0.00 175.17 177.03 2jul n ALA 210 N 1.19 -3.61 0.52 2.11 0.00 -1.26 -4.99 120.51 114.46 2jul n ALA 210 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2jul n ALA 210 Cb 0.57 -3.36 0.00 0.00 0.00 0.00 0.00 19.45 16.66 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 1.14 0.28 -0.09 0.00 -0.04 -1.26 -3.09 135.00 131.94 2jul n PRO 211 Ca -0.02 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.30 2jul n PRO 211 Cb 0.73 -1.02 -0.06 0.00 -0.04 0.00 0.00 33.50 33.10 2jul n PRO 211 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jul n LEU 212 N -0.35 1.84 0.03 1.53 7.99 -1.26 -3.92 117.00 122.86 2jul n LEU 212 Ca 0.00 0.52 -0.12 0.00 -0.01 0.00 0.00 56.01 56.40 2jul n LEU 212 Cb 0.01 -0.91 -0.08 0.00 -0.11 0.00 0.00 43.42 42.33 2jul n LEU 212 CO 0.00 -0.09 0.82 1.05 -1.51 0.00 0.00 177.39 177.66 2jul h GLU 213 N -1.00 -0.01 -0.79 3.23 4.11 -1.98 -2.33 114.58 115.81 2jul h GLU 213 Ca -0.18 0.00 0.18 0.00 0.07 0.00 0.00 59.36 59.43 2jul h GLU 213 Cb 0.92 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.05 2jul h GLU 213 CO -0.11 0.09 0.22 1.25 0.07 0.00 0.00 179.01 180.52 2jul h HIS 214 N -0.10 0.34 -0.69 2.06 2.76 -1.79 0.19 115.15 117.92 2jul h HIS 214 Ca -0.00 0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.14 2jul h HIS 214 Cb 0.10 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 2jul h HIS 214 CO -0.05 -0.10 0.16 0.28 -1.30 0.00 0.00 177.93 176.92 2jul h VAL 215 N 0.28 1.26 -0.14 5.26 2.07 -1.62 -2.15 116.25 121.20 2jul h VAL 215 Ca 0.46 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 2jul h VAL 215 Cb 0.83 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2jul h VAL 215 CO -0.55 0.37 -0.12 -0.33 0.02 0.00 0.00 177.57 176.96 2jul h GLU 216 N 1.05 0.22 -0.16 1.57 5.08 -0.16 -2.15 114.58 120.03 2jul h GLU 216 Ca 0.22 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 2jul h GLU 216 Cb 0.38 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 2jul h GLU 216 CO 0.00 0.35 -0.23 -0.09 -1.00 0.00 0.00 179.01 178.05 2jul h ARG 217 N 0.21 0.44 -0.44 2.33 1.12 -0.57 -2.00 114.38 115.47 2jul h ARG 217 Ca 0.04 -0.26 -0.01 0.00 -1.11 0.00 0.00 59.98 58.64 2jul h ARG 217 Cb 0.36 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 30.32 2jul h ARG 217 CO 0.02 0.84 0.23 0.35 -3.11 0.00 0.00 179.97 178.30 2jul h PHE 218 N 0.08 0.59 -0.21 2.20 3.04 -1.12 -1.22 116.94 120.30 2jul h PHE 218 Ca 0.02 -0.01 -0.16 0.00 3.98 0.00 0.00 57.97 61.80 2jul h PHE 218 Cb 0.79 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 39.11 2jul h PHE 218 CO 0.09 0.43 -0.50 0.35 -2.02 0.00 0.00 178.31 176.66 2jul h PHE 219 N 0.62 0.91 -0.13 0.41 3.57 -1.31 0.22 116.94 121.23 2jul h PHE 219 Ca 0.16 -0.35 -0.05 0.00 3.53 0.00 0.00 57.97 61.26 2jul h PHE 219 Cb 0.04 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2jul h PHE 219 CO 0.00 1.14 -0.15 0.37 -2.23 0.00 0.00 178.31 177.45 2jul h GLN 220 N 0.43 0.21 0.00 1.11 4.15 -0.91 -0.75 115.11 119.35 2jul h GLN 220 Ca -0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 2jul h GLN 220 Cb 1.11 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.78 2jul h GLN 220 CO 0.11 0.36 -0.72 1.17 -1.93 0.00 0.00 178.83 177.83 2jul n LYS 221 N -4.27 0.23 0.00 1.69 4.81 -0.50 -4.58 118.16 115.54 2jul n LYS 221 Ca -0.01 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 2jul n LYS 221 Cb 0.27 -1.62 0.00 0.00 0.02 0.00 0.00 35.03 33.70 2jul n LYS 221 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 2jul n MET 222 N -1.95 0.00 -1.48 1.64 1.56 0.77 -4.92 117.12 112.74 2jul n MET 222 Ca 0.03 0.07 -0.58 0.00 -0.27 0.00 0.00 57.70 56.95 2jul n MET 222 Cb 0.42 -0.39 -0.08 0.00 2.15 0.00 0.00 33.22 35.32 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 -1.70 -0.02 0.00 6.12 2.03 -0.37 -4.78 116.55 117.84 2jul n ASP 223 Ca 0.00 1.15 0.00 0.00 0.52 0.00 0.00 54.79 56.46 2jul n ASP 223 Cb 0.00 -0.91 0.00 0.00 -0.72 0.00 0.00 41.12 39.49 2jul n ASP 223 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2jul n ARG 224 N 1.48 0.97 0.00 -0.67 -4.01 -1.26 -4.84 116.66 108.33 2jul n ARG 224 Ca 0.20 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 57.01 2jul n ARG 224 Cb 0.08 -0.25 0.00 0.00 -3.04 0.00 0.00 32.46 29.25 2jul n ARG 224 CO 0.00 0.00 0.00 0.27 -3.04 0.00 0.00 177.63 174.86 2jul n ASN 225 N -0.34 0.07 0.00 2.89 6.94 -1.26 -4.71 115.26 118.84 2jul n ASN 225 Ca 0.00 -0.60 0.00 0.00 -0.02 0.00 0.00 54.58 53.96 2jul n ASN 225 Cb 0.00 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 2jul n ASN 225 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 2jul n GLN 226 N -0.31 0.00 0.27 -3.83 7.27 -1.26 -4.63 117.38 114.89 2jul n GLN 226 Ca 0.00 0.00 0.17 0.00 0.07 0.00 0.00 57.00 57.24 2jul n GLN 226 Cb 0.02 -3.65 0.75 0.00 2.41 0.00 0.00 30.24 29.77 2jul n GLN 226 CO 0.00 0.00 0.00 0.38 0.07 0.00 0.00 177.06 177.51 2jul h ASP 227 N 0.00 0.00 0.00 1.69 2.03 -1.99 -3.46 116.42 114.69 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 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2jul h ASP 227 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 2jul n GLY 228 N -0.18 2.79 3.87 7.15 0.00 -1.26 -5.02 105.19 112.54 2jul n GLY 228 Ca 0.00 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 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 0.00 4.73 0.17 1.61 -7.23 -1.26 -4.79 120.40 113.63 2jul s VAL 229 Ca 0.00 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 60.92 2jul s VAL 229 Cb 0.00 -3.72 -0.04 0.00 0.56 0.00 0.00 36.38 33.18 2jul s VAL 229 CO 0.00 -0.51 0.34 0.54 -0.31 0.00 0.00 175.10 175.16 2jul s VAL 230 N -2.36 5.26 0.08 1.32 0.11 0.69 -4.84 120.40 120.66 2jul s VAL 230 Ca 0.53 -0.44 -0.04 0.00 -2.93 0.00 0.00 61.98 59.10 2jul s VAL 230 Cb -0.10 -3.72 -0.03 0.00 -1.53 0.00 0.00 36.38 31.00 2jul s VAL 230 CO 0.30 -0.10 0.07 0.28 -3.33 0.00 0.00 175.10 172.31 2jul s THR 231 N -1.78 0.17 0.63 5.04 -1.32 -1.26 0.27 115.64 117.39 2jul s THR 231 Ca 0.37 -1.63 0.16 0.00 -1.21 0.00 0.00 61.69 59.38 2jul s THR 231 Cb -0.11 -1.59 0.23 0.00 -1.51 0.00 0.00 72.50 69.52 2jul s THR 231 CO 0.28 -0.76 1.18 -0.29 -2.21 0.00 0.00 174.62 172.83 2jul h ILE 232 N 2.95 0.00 0.21 5.08 2.10 -1.97 0.22 117.51 126.10 2jul h ILE 232 Ca -0.34 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.59 2jul h ILE 232 Cb 1.17 0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.91 2jul h ILE 232 CO 0.61 0.00 -0.10 0.44 -1.08 0.00 0.00 178.15 178.01 2jul h ASP 233 N 0.00 -0.24 0.00 2.19 3.32 -1.94 -2.66 116.42 117.09 2jul h ASP 233 Ca 0.29 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2jul h ASP 233 Cb 2.55 0.06 0.00 0.00 0.22 0.00 0.00 39.33 42.16 2jul h ASP 233 CO -0.00 0.14 0.15 -0.33 -1.72 0.00 0.00 179.24 177.47 2jul h GLU 234 N -0.91 0.00 0.16 3.56 5.08 -1.01 -0.70 114.58 120.76 2jul h GLU 234 Ca -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2jul h GLU 234 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2jul h GLU 234 CO 0.05 0.00 -0.08 0.35 -1.00 0.00 0.00 179.01 178.33 2jul h PHE 235 N 0.00 -0.20 -0.05 4.33 3.57 -1.18 -1.90 116.94 121.50 2jul h PHE 235 Ca 0.00 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 2jul h PHE 235 Cb 0.29 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2jul h PHE 235 CO 0.00 0.14 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.83 2jul h LEU 236 N -0.98 0.09 -0.64 0.59 4.07 -0.95 0.85 115.31 118.35 2jul h LEU 236 Ca -0.02 -0.03 -0.14 0.00 0.08 0.00 0.00 57.88 57.77 2jul h LEU 236 Cb 0.43 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 2jul h LEU 236 CO 0.04 0.40 -0.51 -0.08 -1.08 0.00 0.00 178.44 177.21 2jul h GLU 237 N 0.08 0.45 0.08 1.13 4.57 -1.24 -2.04 114.58 117.61 2jul h GLU 237 Ca 0.01 -0.27 -0.14 0.00 -1.18 0.00 0.00 59.36 57.78 2jul h GLU 237 Cb 0.59 0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.21 2jul h GLU 237 CO 0.04 0.86 -0.66 1.15 -1.18 0.00 0.00 179.01 179.22 2jul h THR 238 N 0.36 1.50 0.00 0.32 2.02 -0.92 -2.56 112.91 113.62 2jul h THR 238 Ca 0.01 -2.43 -0.02 0.00 0.77 0.00 0.00 66.41 64.75 2jul h THR 238 Cb 1.01 3.13 -0.00 0.00 -1.74 0.00 0.00 68.15 70.55 2jul h THR 238 CO 0.09 0.65 -0.08 0.00 0.37 0.00 0.00 175.52 176.55 2jul n GLN 240 N -3.59 0.32 -1.67 0.00 6.02 -0.77 -4.65 117.38 113.05 2jul n GLN 240 Ca -0.02 0.44 -0.43 0.00 -0.01 0.00 0.00 57.00 56.98 2jul n GLN 240 Cb 0.19 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 2jul n GLN 240 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2jul n LYS 241 N -3.94 2.76 0.00 -1.09 5.02 -0.97 -4.62 118.16 115.33 2jul n LYS 241 Ca -0.05 1.01 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 2jul n LYS 241 Cb 0.19 -2.94 0.00 0.00 -0.02 0.00 0.00 35.03 32.26 2jul n LYS 241 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jul n ASP 242 N 7.10 0.00 -0.35 4.39 9.92 -1.26 -4.60 116.55 131.74 2jul n ASP 242 Ca 0.20 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.44 2jul n ASP 242 Cb 0.39 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.85 2jul n ASP 242 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2jul n GLU 243 N 0.00 0.00 0.00 -1.24 4.71 -1.26 -4.69 120.64 118.16 2jul n GLU 243 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.16 57.28 2jul n GLU 243 Cb 0.00 -0.09 0.34 0.00 -1.01 0.00 0.00 31.44 30.68 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 0.53 2.06 -0.31 1.62 2.04 -1.26 -4.22 115.26 115.72 2jul n ASN 244 Ca 0.05 -1.66 0.14 0.00 -0.44 0.00 0.00 54.58 52.67 2jul n ASN 244 Cb 0.01 0.02 0.29 0.00 -2.53 0.00 0.00 39.78 37.58 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 3.19 0.20 -1.02 1.53 6.09 -1.91 1.47 117.51 127.06 2jul h ILE 245 Ca 0.00 -0.04 0.27 0.00 -1.37 0.00 0.00 64.86 63.72 2jul h ILE 245 Cb 0.70 0.07 -0.07 0.00 0.47 0.00 0.00 36.82 37.99 2jul h ILE 245 CO 0.00 0.02 0.68 0.24 -3.07 0.00 0.00 178.15 176.02 2jul h MET 246 N 0.11 0.28 -0.37 2.19 2.86 -1.89 0.95 114.93 119.06 2jul h MET 246 Ca 0.57 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 58.18 2jul h MET 246 Cb 1.18 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 2jul h MET 246 CO -0.76 0.19 0.15 -0.97 1.06 0.00 0.00 176.91 176.58 2jul h ASN 247 N 0.29 0.46 0.07 1.22 -0.73 0.18 -1.56 115.58 115.51 2jul h ASN 247 Ca 0.55 -0.04 -0.14 0.00 1.87 0.00 0.00 56.30 58.54 2jul h ASN 247 Cb 1.58 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 40.04 2jul h ASN 247 CO -0.19 0.42 -0.46 0.28 -0.37 0.00 0.00 177.43 177.11 2jul h SER 248 N 0.52 0.50 -0.83 1.15 0.02 0.97 -2.70 113.55 113.18 2jul h SER 248 Ca 0.13 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 2jul h SER 248 Cb 0.10 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 2jul h SER 248 CO -0.01 0.89 0.43 -0.03 -1.14 0.00 0.00 176.83 176.97 2jul h MET 249 N 0.37 1.17 -0.43 3.45 1.85 -0.85 0.07 114.93 120.57 2jul h MET 249 Ca 0.02 -0.15 -0.06 0.00 -0.61 0.00 0.00 59.70 58.90 2jul h MET 249 Cb 0.95 -0.22 -0.02 0.00 0.43 0.00 0.00 31.60 32.75 2jul h MET 249 CO 0.08 0.88 0.03 0.37 -0.40 0.00 0.00 176.91 177.87 2jul h GLN 250 N 1.16 0.75 -0.48 0.39 4.15 -1.31 0.25 115.11 120.02 2jul h GLN 250 Ca 0.29 -0.22 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 2jul h GLN 250 Cb 0.07 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2jul h GLN 250 CO -0.04 0.80 0.02 -0.07 -1.93 0.00 0.00 178.83 177.61 2jul h LEU 251 N 0.60 0.74 -0.25 -2.39 -0.00 -1.14 0.65 115.31 113.50 2jul h LEU 251 Ca 0.13 -0.17 -0.20 0.00 -0.00 0.00 0.00 57.88 57.64 2jul h LEU 251 Cb 0.44 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 40.89 2jul h LEU 251 CO 0.02 0.79 -0.89 0.15 -0.00 0.00 0.00 178.44 178.51 2jul h PHE 252 N 0.73 0.20 0.00 1.13 3.57 -0.74 -3.15 116.94 118.68 2jul h PHE 252 Ca 0.15 -0.12 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 2jul h PHE 252 Cb 0.41 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 2jul h PHE 252 CO 0.02 0.95 -0.10 1.49 -2.23 0.00 0.00 178.31 178.45 2jul h GLU 253 N 0.07 0.00 0.00 1.11 4.57 -0.16 0.38 114.58 120.55 2jul h GLU 253 Ca -0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2jul h GLU 253 Cb 1.54 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.13 2jul h GLU 253 CO 0.13 0.10 0.00 -1.71 -1.18 0.00 0.00 179.01 176.35 2jul n ASN 254 N -3.13 0.00 0.00 1.04 4.05 0.19 -3.09 115.26 114.32 2jul n ASN 254 Ca 0.03 0.42 0.00 0.00 0.45 0.00 0.00 54.58 55.49 2jul n ASN 254 Cb 0.55 -0.46 0.00 0.00 1.23 0.00 0.00 39.78 41.10 2jul n ASN 254 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2jul n VAL 255 N -1.46 0.00 0.00 3.44 0.24 -1.17 -5.10 118.33 114.28 2jul n VAL 255 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2jul n VAL 255 Cb 0.14 0.76 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 2jul n VAL 255 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99