#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 0.53 0.13 0.54 4.07 -1.26 -3.48 120.64 121.18 2jul n GLU 77 Ca 0.00 0.00 -0.13 0.00 -0.06 0.00 0.00 57.16 56.97 2jul n GLU 77 Cb 0.00 -1.10 -0.08 0.00 -0.06 0.00 0.00 31.44 30.20 2jul n GLU 77 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 2jul h GLY 78 N 3.11 -0.35 0.73 8.31 0.00 -2.06 -1.47 103.07 111.34 2jul h GLY 78 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 2jul h GLY 78 CO 0.00 -0.13 -0.24 -2.00 0.00 0.00 0.00 176.54 174.18 2jul h LEU 79 N -0.65 -0.56 -1.41 3.11 5.85 -2.00 -2.24 115.31 117.40 2jul h LEU 79 Ca -0.03 -0.07 0.27 0.00 0.84 0.00 0.00 57.88 58.88 2jul h LEU 79 Cb 0.46 0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.55 2jul h LEU 79 CO 0.06 -0.21 0.67 -0.78 -0.34 0.00 0.00 178.44 177.84 2jul h ASP 80 N -0.94 0.42 -0.27 1.25 1.82 -1.74 0.17 116.42 117.12 2jul h ASP 80 Ca -0.07 0.08 -0.04 0.00 -0.39 0.00 0.00 57.03 56.61 2jul h ASP 80 Cb 0.60 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.61 2jul h ASP 80 CO 0.11 0.09 0.01 1.56 -1.61 0.00 0.00 179.24 179.39 2jul h GLN 81 N 0.37 0.48 -0.69 0.28 1.08 -1.06 -2.26 115.11 113.30 2jul h GLN 81 Ca 0.58 -0.15 0.03 0.00 -1.45 0.00 0.00 58.65 57.66 2jul h GLN 81 Cb 1.53 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.87 2jul h GLN 81 CO -0.27 0.63 0.46 1.25 -0.95 0.00 0.00 178.83 179.95 2jul h LEU 82 N 0.27 0.73 0.00 1.46 7.12 -0.10 -1.13 115.31 123.67 2jul h LEU 82 Ca 0.08 -0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.08 2jul h LEU 82 Cb 0.41 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 40.37 2jul h LEU 82 CO 0.01 0.51 -0.00 -0.61 -0.13 0.00 0.00 178.44 178.22 2jul h GLN 83 N 0.85 -0.01 -0.77 1.25 5.75 -0.98 -2.42 115.11 118.78 2jul h GLN 83 Ca 0.27 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.77 2jul h GLN 83 Cb 0.03 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.55 2jul h GLN 83 CO -0.07 0.19 0.46 0.00 -2.65 0.00 0.00 178.83 176.76 2jul h ALA 84 N 0.80 0.98 -3.00 3.38 0.00 -0.96 -3.36 119.26 117.10 2jul h ALA 84 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2jul h ALA 84 Cb 0.20 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2jul h ALA 84 CO 0.00 0.45 0.00 1.04 0.00 0.00 0.00 179.25 180.74 2jul n GLN 85 N -4.49 0.00 -2.09 0.00 1.13 -0.47 -4.51 117.38 106.95 2jul n GLN 85 Ca 0.07 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.73 2jul n GLN 85 Cb 0.06 -0.28 -0.03 0.00 0.11 0.00 0.00 30.24 30.09 2jul n GLN 85 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2jul s THR 86 N 0.00 3.46 -0.20 5.09 2.01 -0.92 -4.90 115.64 120.17 2jul s THR 86 Ca 0.00 0.36 -0.35 0.00 0.31 0.00 0.00 61.69 62.01 2jul s THR 86 Cb 0.00 -3.96 -0.12 0.00 0.01 0.00 0.00 72.50 68.43 2jul s THR 86 CO 0.00 -0.83 1.97 0.29 -0.69 0.00 0.00 174.62 175.36 2jul n LYS 87 N 8.90 1.69 -3.61 4.92 5.02 -1.26 -4.62 118.16 129.21 2jul n LYS 87 Ca 0.20 0.58 -0.02 0.00 -2.02 0.00 0.00 58.31 57.05 2jul n LYS 87 Cb 0.50 -2.55 -0.06 0.00 -0.02 0.00 0.00 35.03 32.90 2jul n LYS 87 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2jul s PHE 88 N 5.20 -0.57 -0.44 2.13 5.36 -1.26 -4.97 117.98 123.43 2jul s PHE 88 Ca 0.99 1.11 -0.39 0.00 -0.96 0.00 0.00 56.93 57.68 2jul s PHE 88 Cb -0.77 0.34 -0.17 0.00 -0.34 0.00 0.00 43.02 42.08 2jul s PHE 88 CO 0.52 -0.28 1.76 -2.37 -1.46 0.00 0.00 175.22 173.39 2jul n THR 89 N 3.88 0.00 -0.46 0.12 5.66 -1.26 -4.64 114.28 117.58 2jul n THR 89 Ca -0.17 0.00 0.38 0.00 -3.05 0.00 0.00 64.05 61.21 2jul n THR 89 Cb 0.57 -0.44 0.68 0.00 -1.55 0.00 0.00 70.33 69.59 2jul n THR 89 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 2jul h LYS 90 N 7.04 0.10 0.34 1.09 3.64 -1.97 0.40 116.57 127.22 2jul h LYS 90 Ca -0.16 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2jul h LYS 90 Cb 1.23 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2jul h LYS 90 CO 0.93 0.06 -0.16 0.87 -2.27 0.00 0.00 179.45 178.88 2jul h LYS 91 N 0.10 -0.44 -0.31 1.90 1.57 -2.01 -1.25 116.57 116.13 2jul h LYS 91 Ca 0.77 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 59.67 2jul h LYS 91 Cb 2.59 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 34.99 2jul h LYS 91 CO -0.25 -0.29 0.27 0.93 -0.57 0.00 0.00 179.45 179.53 2jul h GLU 92 N -0.52 0.00 -0.47 3.15 4.39 -1.50 0.63 114.58 120.26 2jul h GLU 92 Ca -0.05 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 2jul h GLU 92 Cb 0.35 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2jul h GLU 92 CO 0.08 0.00 0.28 1.25 -1.16 0.00 0.00 179.01 179.46 2jul h LEU 93 N 0.00 0.56 -1.19 1.33 6.46 0.06 -1.04 115.31 121.49 2jul h LEU 93 Ca 0.15 -0.05 0.01 0.00 -0.12 0.00 0.00 57.88 57.86 2jul h LEU 93 Cb 0.69 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 40.44 2jul h LEU 93 CO -0.00 0.45 0.53 -0.61 -0.62 0.00 0.00 178.44 178.18 2jul h GLN 94 N 0.62 1.07 -0.19 1.25 -0.00 0.34 -1.56 115.11 116.64 2jul h GLN 94 Ca 0.17 -0.07 -0.00 0.00 -0.00 0.00 0.00 58.65 58.75 2jul h GLN 94 Cb -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 27.48 27.22 2jul h GLN 94 CO -0.03 0.72 0.12 1.03 0.00 0.00 0.00 178.83 180.66 2jul h SER 95 N 1.10 0.23 -0.92 -0.69 0.87 -1.05 -1.26 113.55 111.82 2jul h SER 95 Ca 0.30 -0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.88 2jul h SER 95 Cb -0.11 -0.06 -0.07 0.00 -0.44 0.00 0.00 62.40 61.72 2jul h SER 95 CO -0.06 0.21 0.58 -0.07 -0.53 0.00 0.00 176.83 176.95 2jul h LEU 96 N 0.23 0.91 -1.37 2.23 3.38 -0.54 0.44 115.31 120.59 2jul h LEU 96 Ca 0.07 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2jul h LEU 96 Cb 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2jul h LEU 96 CO -0.01 0.56 0.10 0.22 0.09 0.00 0.00 178.44 179.40 2jul h TYR 97 N 1.03 0.53 -0.27 1.13 3.20 -0.69 -2.42 116.97 119.48 2jul h TYR 97 Ca 0.41 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.28 2jul h TYR 97 Cb 0.22 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 2jul h TYR 97 CO -0.02 0.45 0.11 -0.09 -1.64 0.00 0.00 178.16 176.97 2jul h ARG 98 N 0.52 0.24 -0.61 1.82 1.12 0.25 0.31 114.38 118.02 2jul h ARG 98 Ca 0.12 -0.01 -0.00 0.00 -1.11 0.00 0.00 59.98 58.98 2jul h ARG 98 Cb 0.18 -0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 30.06 2jul h ARG 98 CO -0.01 0.16 0.38 0.78 -3.11 0.00 0.00 179.97 178.17 2jul h GLY 99 N 0.24 0.88 2.00 2.80 0.00 -1.14 0.05 103.07 107.90 2jul h GLY 99 Ca 0.12 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 2jul h GLY 99 CO -0.10 0.34 -0.24 -2.75 0.00 0.00 0.00 176.54 173.78 2jul h PHE 100 N 0.84 0.00 0.00 5.60 3.57 -0.86 -2.65 116.94 123.44 2jul h PHE 100 Ca 0.22 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 2jul h PHE 100 Cb -0.05 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2jul h PHE 100 CO 0.00 0.24 -0.33 -0.22 -2.23 0.00 0.00 178.31 175.78 2jul h LYS 101 N 0.00 0.00 0.00 1.11 3.11 0.15 -3.01 116.57 117.93 2jul h LYS 101 Ca -0.00 0.00 -0.04 0.00 -2.81 0.00 0.00 60.65 57.79 2jul h LYS 101 Cb 0.86 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.08 2jul h LYS 101 CO 0.03 0.33 -0.20 -0.97 -2.81 0.00 0.00 179.45 175.82 2jul h ASN 102 N 0.00 0.00 -2.61 4.20 -1.24 -0.98 -3.43 115.58 111.52 2jul h ASN 102 Ca -0.00 0.00 -0.56 0.00 0.71 0.00 0.00 56.30 56.44 2jul h ASN 102 Cb 1.07 0.00 0.07 0.00 0.73 0.00 0.00 38.32 40.19 2jul h ASN 102 CO 0.04 0.20 0.81 -0.62 -1.29 0.00 0.00 177.43 176.57 2jul n GLU 103 N -4.19 2.33 -0.01 6.67 4.71 -1.14 -4.90 120.64 124.11 2jul n GLU 103 Ca -0.02 0.84 0.03 0.00 -0.01 0.00 0.00 57.16 57.99 2jul n GLU 103 Cb 0.27 -2.60 -0.12 0.00 -1.01 0.00 0.00 31.44 27.98 2jul n GLU 103 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2jul n PRO 105 N -2.60 0.00 -4.02 0.00 -0.02 -1.26 -5.00 135.00 122.09 2jul n PRO 105 Ca -0.12 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.26 2jul n PRO 105 Cb 0.79 -0.72 -0.06 0.00 -0.02 0.00 0.00 33.50 33.49 2jul n PRO 105 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2jul s THR 106 N -0.49 0.01 0.00 3.45 -4.23 -1.26 -5.00 115.64 108.12 2jul s THR 106 Ca 0.00 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2jul s THR 106 Cb 0.00 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.67 2jul s THR 106 CO 0.00 -0.06 0.86 0.61 -0.54 0.00 0.00 174.62 175.50 2jul n GLY 107 N -0.33 1.50 3.16 3.99 0.00 -1.26 -4.71 105.19 107.54 2jul n GLY 107 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 1.86 0.17 0.99 2.96 -1.26 -4.75 118.68 118.64 2jul s LEU 108 Ca 0.00 -0.81 0.06 0.00 -0.22 0.00 0.00 54.13 53.16 2jul s LEU 108 Cb 0.00 0.68 -0.04 0.00 0.50 0.00 0.00 46.19 47.33 2jul s LEU 108 CO 0.00 -0.68 -0.13 0.54 -1.32 0.00 0.00 176.35 174.76 2jul s VAL 109 N -3.89 1.43 0.11 1.68 0.11 -0.50 -5.03 120.40 114.30 2jul s VAL 109 Ca 0.07 -2.07 -0.10 0.00 -2.93 0.00 0.00 61.98 56.94 2jul s VAL 109 Cb 0.06 -1.88 0.01 0.00 -1.53 0.00 0.00 36.38 33.04 2jul s VAL 109 CO -0.10 -0.63 0.25 1.51 -3.33 0.00 0.00 175.10 172.79 2jul s ASP 110 N -3.12 0.03 0.37 3.54 1.47 -1.26 -1.67 116.67 116.04 2jul s ASP 110 Ca 0.18 -0.61 0.21 0.00 1.18 0.00 0.00 52.55 53.51 2jul s ASP 110 Cb 0.00 0.38 1.34 0.00 -0.34 0.00 0.00 42.92 44.30 2jul s ASP 110 CO 0.03 -0.78 1.58 -0.08 0.68 0.00 0.00 175.17 176.61 2jul h GLU 111 N 2.64 0.02 -0.43 2.11 4.81 -1.99 1.21 114.58 122.94 2jul h GLU 111 Ca -0.34 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 58.92 2jul h GLU 111 Cb 1.22 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 2jul h GLU 111 CO 0.53 0.01 0.24 0.22 -0.73 0.00 0.00 179.01 179.28 2jul h ASP 112 N 0.02 0.38 -0.52 1.04 1.82 -1.95 -0.55 116.42 116.66 2jul h ASP 112 Ca 0.84 0.01 -0.07 0.00 -0.39 0.00 0.00 57.03 57.42 2jul h ASP 112 Cb 2.24 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 42.16 2jul h ASP 112 CO -0.75 0.27 0.03 0.74 -1.61 0.00 0.00 179.24 177.93 2jul h THR 113 N 0.48 1.26 -0.59 2.25 2.02 0.10 -2.08 112.91 116.36 2jul h THR 113 Ca 0.18 -1.03 0.07 0.00 0.77 0.00 0.00 66.41 66.40 2jul h THR 113 Cb 0.04 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 2jul h THR 113 CO -0.10 0.37 0.39 -0.26 0.37 0.00 0.00 175.52 176.29 2jul h PHE 114 N 0.76 0.51 -0.19 3.16 -1.00 -0.51 -0.37 116.94 119.31 2jul h PHE 114 Ca 0.15 0.01 -0.17 0.00 2.81 0.00 0.00 57.97 60.77 2jul h PHE 114 Cb 0.48 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.87 2jul h PHE 114 CO 0.04 0.26 -0.59 -0.22 -1.61 0.00 0.00 178.31 176.18 2jul h LYS 115 N 0.50 0.63 -0.55 1.51 3.64 -0.58 -2.25 116.57 119.46 2jul h LYS 115 Ca 0.26 -0.42 -0.09 0.00 -1.27 0.00 0.00 60.65 59.13 2jul h LYS 115 Cb 0.38 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2jul h LYS 115 CO -0.07 1.04 -0.02 1.25 -2.27 0.00 0.00 179.45 179.37 2jul h LEU 116 N 0.47 0.94 -0.28 5.20 5.85 -0.46 0.11 115.31 127.14 2jul h LEU 116 Ca -0.00 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 2jul h LEU 116 Cb 1.16 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2jul h LEU 116 CO 0.12 1.01 -0.06 0.40 -0.34 0.00 0.00 178.44 179.56 2jul h ILE 117 N 0.88 1.28 -0.40 4.05 2.04 -1.15 -1.80 117.51 122.41 2jul h ILE 117 Ca 0.16 -1.08 -0.11 0.00 1.00 0.00 0.00 64.86 64.82 2jul h ILE 117 Cb 0.55 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 2jul h ILE 117 CO 0.03 0.34 -0.20 0.22 0.00 0.00 0.00 178.15 178.55 2jul h TYR 118 N 0.29 0.88 0.00 1.37 3.20 -1.26 0.13 116.97 121.58 2jul h TYR 118 Ca 0.07 -0.19 -0.05 0.00 3.14 0.00 0.00 58.73 61.70 2jul h TYR 118 Cb 0.54 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2jul h TYR 118 CO 0.05 0.91 -0.25 0.77 -1.64 0.00 0.00 178.16 178.01 2jul h SER 119 N 0.69 0.00 0.91 -2.11 0.02 -0.68 -0.26 113.55 112.12 2jul h SER 119 Ca 0.10 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 2jul h SER 119 Cb 0.70 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 2jul h SER 119 CO 0.05 0.25 -1.12 0.00 -1.14 0.00 0.00 176.83 174.87 2jul n GLN 120 N -3.86 0.61 0.04 3.45 1.13 -0.69 -3.18 117.38 114.88 2jul n GLN 120 Ca -0.02 0.15 0.12 0.00 -1.94 0.00 0.00 57.00 55.31 2jul n GLN 120 Cb 0.34 -1.82 0.13 0.00 0.11 0.00 0.00 30.24 28.99 2jul n GLN 120 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 2jul n PHE 121 N -2.73 0.33 -3.07 1.08 3.01 -0.00 -4.45 117.46 111.63 2jul n PHE 121 Ca -0.03 0.10 -0.16 0.00 1.01 0.00 0.00 57.45 58.37 2jul n PHE 121 Cb 0.63 -0.48 -0.00 0.00 -0.01 0.00 0.00 39.48 39.61 2jul n PHE 121 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2jul n PHE 122 N -1.93 -0.73 0.39 1.38 3.72 -0.15 -4.93 117.46 115.21 2jul n PHE 122 Ca 0.03 -3.32 0.00 0.00 -0.05 0.00 0.00 57.45 54.12 2jul n PHE 122 Cb 0.42 0.14 0.00 0.00 -0.94 0.00 0.00 39.48 39.10 2jul n PHE 122 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2jul n PRO 123 N 0.49 0.22 0.00 -1.08 -0.04 -1.19 -4.26 135.00 129.14 2jul n PRO 123 Ca 0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2jul n PRO 123 Cb 0.65 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.09 2jul n PRO 123 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2jul n GLN 124 N -0.31 0.00 0.00 0.54 1.13 -1.26 -4.97 117.38 112.50 2jul n GLN 124 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2jul n GLN 124 Cb 0.01 -0.28 0.00 0.00 0.11 0.00 0.00 30.24 30.08 2jul n GLN 124 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jul n GLY 125 N 0.00 1.20 3.86 1.08 0.00 -1.26 -5.07 105.19 104.99 2jul n GLY 125 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2jul n GLY 125 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jul s ASP 126 N 0.32 5.74 0.00 1.61 1.01 -1.26 -4.98 116.67 119.11 2jul s ASP 126 Ca 0.00 -0.13 0.00 0.00 0.71 0.00 0.00 52.55 53.13 2jul s ASP 126 Cb 0.00 -1.54 0.00 0.00 1.01 0.00 0.00 42.92 42.39 2jul s ASP 126 CO 0.00 -0.01 0.00 0.00 0.21 0.00 0.00 175.17 175.37 2jul n ALA 127 N -0.97 0.00 -0.27 5.23 0.00 -1.26 -4.44 120.51 118.80 2jul n ALA 127 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.44 2jul n ALA 127 Cb 0.57 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.23 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 0.52 0.46 0.71 0.00 2.02 -1.96 1.39 112.91 116.05 2jul h THR 128 Ca 0.00 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 2jul h THR 128 Cb 0.26 0.17 0.01 0.00 -1.74 0.00 0.00 68.15 66.84 2jul h THR 128 CO 0.00 0.05 -0.34 0.74 0.37 0.00 0.00 175.52 176.34 2jul h THR 129 N 0.27 0.22 0.00 3.16 2.02 -2.00 -1.94 112.91 114.64 2jul h THR 129 Ca 0.46 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.47 2jul h THR 129 Cb 0.84 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2jul h THR 129 CO -0.55 0.02 -0.00 0.22 0.37 0.00 0.00 175.52 175.57 2jul h TYR 130 N -1.08 0.00 -0.45 3.16 3.20 -1.69 -0.98 116.97 119.14 2jul h TYR 130 Ca -0.10 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.69 2jul h TYR 130 Cb 0.75 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 2jul h TYR 130 CO -0.01 0.00 -0.04 0.00 -1.64 0.00 0.00 178.16 176.47 2jul h ALA 131 N 2.00 1.09 -0.45 1.82 0.00 0.22 -0.50 119.26 123.44 2jul h ALA 131 Ca -0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 2jul h ALA 131 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2jul h ALA 131 CO 0.00 0.57 -0.18 1.25 0.00 0.00 0.00 179.25 180.89 2jul h HIS 132 N 0.70 1.05 -0.31 0.00 -0.00 -0.41 -2.01 115.15 114.18 2jul h HIS 132 Ca 0.13 -0.25 -0.04 0.00 -0.00 0.00 0.00 60.37 60.21 2jul h HIS 132 Cb 0.49 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.64 2jul h HIS 132 CO 0.02 1.04 0.03 0.74 -0.00 0.00 0.00 177.93 179.76 2jul h PHE 133 N 0.76 0.56 -0.79 5.26 0.04 -1.21 -2.29 116.94 119.27 2jul h PHE 133 Ca 0.11 -0.09 0.04 0.00 2.80 0.00 0.00 57.97 60.83 2jul h PHE 133 Cb 0.74 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.69 2jul h PHE 133 CO 0.05 0.63 0.49 -0.07 -0.60 0.00 0.00 178.31 178.81 2jul h LEU 134 N 0.33 0.79 -0.82 1.54 3.38 -1.01 -1.46 115.31 118.05 2jul h LEU 134 Ca 0.09 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2jul h LEU 134 Cb 0.39 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2jul h LEU 134 CO 0.01 0.53 0.53 0.15 0.09 0.00 0.00 178.44 179.75 2jul h PHE 135 N 0.93 1.05 -0.98 1.13 3.57 -1.17 -1.44 116.94 120.03 2jul h PHE 135 Ca 0.33 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.98 2jul h PHE 135 Cb 0.08 -0.35 -0.08 0.00 2.79 0.00 0.00 35.95 38.38 2jul h PHE 135 CO -0.04 0.67 0.62 -0.97 -2.23 0.00 0.00 178.31 176.36 2jul h ASN 136 N 1.12 0.86 0.31 0.41 -1.24 -0.69 0.92 115.58 117.27 2jul h ASN 136 Ca 0.30 0.05 -0.09 0.00 0.71 0.00 0.00 56.30 57.27 2jul h ASN 136 Cb -0.11 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 2jul h ASN 136 CO -0.06 0.43 -0.39 0.00 -1.29 0.00 0.00 177.43 176.12 2jul h ALA 137 N 1.57 1.25 0.01 1.57 0.00 -0.91 -2.95 119.26 119.80 2jul h ALA 137 Ca 0.50 -0.37 -0.25 0.00 0.00 0.00 0.00 54.91 54.78 2jul h ALA 137 Cb 0.59 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2jul h ALA 137 CO -0.27 0.53 -1.33 0.74 0.00 0.00 0.00 179.25 178.92 2jul h PHE 138 N 0.09 0.05 -3.95 0.00 0.04 -0.05 -3.46 116.94 109.67 2jul h PHE 138 Ca 0.01 -0.04 -0.52 0.00 2.80 0.00 0.00 57.97 60.22 2jul h PHE 138 Cb 0.73 -0.00 0.08 0.00 2.20 0.00 0.00 35.95 38.96 2jul h PHE 138 CO 0.01 1.04 0.58 0.16 -0.60 0.00 0.00 178.31 179.50 2jul s ASP 139 N -6.50 6.32 -0.24 2.17 1.47 0.29 -4.81 116.67 115.36 2jul s ASP 139 Ca -0.02 2.58 0.03 0.00 1.18 0.00 0.00 52.55 56.32 2jul s ASP 139 Cb 0.09 -2.63 -0.17 0.00 -0.34 0.00 0.00 42.92 39.87 2jul s ASP 139 CO 0.83 -0.83 -0.19 0.00 0.68 0.00 0.00 175.17 175.65 2jul n ALA 140 N 0.07 1.47 -2.85 2.11 0.00 -1.26 -4.93 120.51 115.12 2jul n ALA 140 Ca 0.04 -1.07 -0.27 0.00 0.00 0.00 0.00 53.44 52.13 2jul n ALA 140 Cb 0.44 -0.08 -0.05 0.00 0.00 0.00 0.00 19.45 19.77 2jul n ALA 140 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2jul s ASP 141 N -6.30 5.83 0.00 0.00 -4.77 -1.26 -4.97 116.67 105.20 2jul s ASP 141 Ca -0.31 0.01 0.00 0.00 -3.30 0.00 0.00 52.55 48.95 2jul s ASP 141 Cb 0.08 -1.63 0.00 0.00 -1.09 0.00 0.00 42.92 40.28 2jul s ASP 141 CO 0.59 0.09 0.85 0.61 0.70 0.00 0.00 175.17 178.01 2jul n GLY 142 N -0.23 1.54 0.00 2.12 0.00 -1.26 -4.24 105.19 103.11 2jul n GLY 142 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.81 0.00 0.00 1.61 5.03 -1.26 -5.06 115.26 116.39 2jul n ASN 143 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2jul n ASN 143 Cb 0.36 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.12 2jul n ASN 143 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jul n GLY 144 N 2.91 0.00 3.71 7.41 0.00 -1.26 -5.13 105.19 112.83 2jul n GLY 144 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2jul n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jul s ALA 145 N 0.00 3.61 0.19 4.61 0.00 -1.26 -3.70 121.76 125.21 2jul s ALA 145 Ca 0.00 -0.56 0.11 0.00 0.00 0.00 0.00 51.96 51.50 2jul s ALA 145 Cb 0.00 -2.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.70 2jul s ALA 145 CO 0.00 0.02 -0.19 0.96 0.00 0.00 0.00 175.76 176.54 2jul s ILE 146 N 0.64 2.62 0.00 0.00 -4.36 -0.67 -4.88 121.20 114.55 2jul s ILE 146 Ca 0.14 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.60 2jul s ILE 146 Cb -0.13 -2.28 0.00 0.00 1.25 0.00 0.00 42.46 41.31 2jul s ILE 146 CO 0.03 -0.13 0.00 1.41 0.24 0.00 0.00 174.94 176.50 2jul n HIS 147 N 0.15 0.00 0.39 1.37 8.25 -1.26 -1.41 115.22 122.71 2jul n HIS 147 Ca -0.12 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.47 2jul n HIS 147 Cb 0.56 0.00 0.28 0.00 1.12 0.00 0.00 29.99 31.95 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 0.00 0.00 0.28 4.41 3.57 -1.99 -3.26 116.94 119.95 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 0.00 -0.14 0.93 -2.23 0.00 0.00 178.31 176.87 2jul h GLU 149 N 0.00 -0.36 -1.28 1.11 5.08 -1.98 -1.38 114.58 115.76 2jul h GLU 149 Ca 0.00 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 58.75 2jul h GLU 149 Cb 0.88 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 30.16 2jul h GLU 149 CO 0.00 -0.24 0.92 -0.44 -1.00 0.00 0.00 179.01 178.24 2jul h ASP 150 N -0.72 0.01 0.18 1.42 5.19 -1.90 0.65 116.42 121.24 2jul h ASP 150 Ca -0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 2jul h ASP 150 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 2jul h ASP 150 CO 0.06 0.00 -0.09 0.15 -3.12 0.00 0.00 179.24 176.25 2jul h PHE 151 N 0.00 -0.23 -0.02 4.55 3.57 -1.57 -2.25 116.94 120.99 2jul h PHE 151 Ca 0.61 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 62.04 2jul h PHE 151 Cb 2.43 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 41.24 2jul h PHE 151 CO -0.00 0.17 -0.28 0.28 -2.23 0.00 0.00 178.31 176.25 2jul h VAL 152 N -0.73 1.21 -0.50 1.41 2.07 0.62 -2.37 116.25 117.97 2jul h VAL 152 Ca -0.03 -1.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.41 2jul h VAL 152 Cb 0.50 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 2jul h VAL 152 CO 0.04 0.29 0.03 0.58 0.02 0.00 0.00 177.57 178.54 2jul h VAL 153 N 0.04 1.24 0.19 2.57 2.07 0.16 -2.13 116.25 120.38 2jul h VAL 153 Ca 0.00 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 2jul h VAL 153 Cb 0.52 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2jul h VAL 153 CO 0.04 0.34 -0.09 1.23 0.02 0.00 0.00 177.57 179.11 2jul h GLY 154 N 0.97 -0.26 0.30 2.17 0.00 -0.87 -1.28 103.07 104.09 2jul h GLY 154 Ca 0.15 0.10 0.23 0.00 0.00 0.00 0.00 47.33 47.81 2jul h GLY 154 CO 0.01 -0.10 0.60 1.41 0.00 0.00 0.00 176.54 178.47 2jul h LEU 155 N -0.58 0.21 -0.46 3.11 3.38 -1.39 0.49 115.31 120.06 2jul h LEU 155 Ca -0.03 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 2jul h LEU 155 Cb 0.43 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2jul h LEU 155 CO 0.04 0.08 -0.70 0.28 0.09 0.00 0.00 178.44 178.23 2jul h SER 156 N 0.20 0.42 0.72 -0.43 0.02 -0.99 -1.04 113.55 112.46 2jul h SER 156 Ca 0.44 -0.27 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 2jul h SER 156 Cb 1.40 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2jul h SER 156 CO -0.10 0.99 -0.48 0.40 -1.14 0.00 0.00 176.83 176.50 2jul h ILE 157 N 0.25 1.15 0.00 3.27 2.04 0.11 -2.14 117.51 122.19 2jul h ILE 157 Ca -0.02 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.05 2jul h ILE 157 Cb 1.26 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 39.36 2jul h ILE 157 CO 0.12 0.48 -0.62 -0.07 0.00 0.00 0.00 178.15 178.05 2jul h LEU 158 N 0.00 0.00 0.00 1.44 4.07 -0.95 -3.32 115.31 116.55 2jul h LEU 158 Ca -0.00 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.77 2jul h LEU 158 Cb 0.98 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.72 2jul h LEU 158 CO 0.06 0.09 0.00 0.18 -1.08 0.00 0.00 178.44 177.69 2jul n LEU 159 N -2.19 0.45 -3.89 1.67 4.77 -0.41 -4.62 117.00 112.79 2jul n LEU 159 Ca 0.03 0.20 -0.42 0.00 -0.03 0.00 0.00 56.01 55.78 2jul n LEU 159 Cb 0.45 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2jul n LEU 159 CO 0.36 -0.36 1.50 0.54 -1.33 0.00 0.00 177.39 178.10 2jul n ARG 160 N -1.88 4.34 -3.39 3.23 1.74 -0.83 -4.86 116.66 115.01 2jul n ARG 160 Ca 0.00 -4.18 -0.16 0.00 -0.77 0.00 0.00 57.85 52.74 2jul n ARG 160 Cb 0.00 -2.64 -0.09 0.00 -1.02 0.00 0.00 32.46 28.71 2jul n ARG 160 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2jul s GLY 161 N -0.82 -0.20 1.45 -0.13 0.00 -1.25 -4.85 107.32 101.52 2jul s GLY 161 Ca 0.36 -0.13 -0.24 0.00 0.00 0.00 0.00 44.72 44.71 2jul s GLY 161 CO 0.04 2.66 0.92 -0.51 0.00 0.00 0.00 173.10 176.21 2jul s THR 162 N 2.39 1.11 0.49 0.90 -4.23 -1.26 -4.35 115.64 110.69 2jul s THR 162 Ca 0.09 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 60.91 2jul s THR 162 Cb -0.14 -2.07 0.50 0.00 1.34 0.00 0.00 72.50 72.13 2jul s THR 162 CO -0.30 0.00 1.78 0.58 -0.54 0.00 0.00 174.62 176.14 2jul h VAL 163 N -3.52 0.42 0.95 2.29 2.07 -2.00 -0.30 116.25 116.15 2jul h VAL 163 Ca -0.41 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 2jul h VAL 163 Cb 1.34 0.27 0.01 0.00 -1.52 0.00 0.00 31.29 31.38 2jul h VAL 163 CO 0.26 0.03 -0.46 -0.74 0.02 0.00 0.00 177.57 176.67 2jul h HIS 164 N 0.14 -1.18 -0.69 1.57 -0.00 -2.00 0.23 115.15 113.22 2jul h HIS 164 Ca 0.60 -0.03 0.11 0.00 -0.00 0.00 0.00 60.37 61.05 2jul h HIS 164 Cb 2.06 0.39 -0.04 0.00 -0.00 0.00 0.00 27.41 29.82 2jul h HIS 164 CO -0.00 -0.73 0.46 0.93 -0.00 0.00 0.00 177.93 178.58 2jul h GLU 165 N -1.31 0.49 0.03 5.26 5.08 -1.37 -1.54 114.58 121.22 2jul h GLU 165 Ca -0.13 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2jul h GLU 165 Cb 0.98 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.12 2jul h GLU 165 CO 0.21 0.32 -0.01 0.87 -1.00 0.00 0.00 179.01 179.40 2jul h LYS 166 N 0.50 -0.04 -1.00 2.33 1.57 -0.80 -2.41 116.57 116.72 2jul h LYS 166 Ca 0.32 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.37 2jul h LYS 166 Cb 0.58 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.84 2jul h LYS 166 CO -0.10 0.24 0.68 -0.07 -0.57 0.00 0.00 179.45 179.63 2jul h LEU 167 N -0.32 0.24 -0.31 2.94 3.38 0.46 0.42 115.31 122.12 2jul h LEU 167 Ca -0.00 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2jul h LEU 167 Cb 0.30 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2jul h LEU 167 CO 0.01 0.07 -0.22 0.50 0.09 0.00 0.00 178.44 178.88 2jul h LYS 168 N 0.23 0.71 -0.28 1.13 3.11 -1.02 -0.48 116.57 119.96 2jul h LYS 168 Ca 0.52 -0.34 -0.04 0.00 -2.81 0.00 0.00 60.65 57.97 2jul h LYS 168 Cb 1.61 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.83 2jul h LYS 168 CO -0.14 0.95 0.02 2.35 -2.81 0.00 0.00 179.45 179.81 2jul h TRP 169 N 0.47 0.53 -0.83 1.91 7.01 0.18 -1.99 115.95 123.21 2jul h TRP 169 Ca 0.06 -0.09 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 2jul h TRP 169 Cb 0.78 -0.14 -0.04 0.00 -2.10 0.00 0.00 29.16 27.66 2jul h TRP 169 CO 0.07 0.62 0.38 0.00 -2.79 0.00 0.00 178.44 176.71 2jul h ALA 170 N 0.84 1.07 -0.52 2.65 0.00 -0.85 -1.79 119.26 120.66 2jul h ALA 170 Ca 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2jul h ALA 170 Cb 0.40 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2jul h ALA 170 CO 0.01 0.66 0.30 0.35 0.00 0.00 0.00 179.25 180.57 2jul h PHE 171 N 1.19 0.69 -0.14 0.00 3.57 -0.88 -1.40 116.94 119.96 2jul h PHE 171 Ca 0.28 -0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.66 2jul h PHE 171 Cb 0.15 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 2jul h PHE 171 CO 0.02 0.47 -0.46 -0.97 -2.23 0.00 0.00 178.31 175.14 2jul h ASN 172 N 0.72 0.38 -0.89 0.41 -0.00 -0.59 -2.98 115.58 112.63 2jul h ASN 172 Ca 0.19 -0.18 -0.02 0.00 -0.00 0.00 0.00 56.30 56.29 2jul h ASN 172 Cb -0.00 -0.11 -0.04 0.00 -0.00 0.00 0.00 38.32 38.17 2jul h ASN 172 CO -0.03 0.79 0.49 0.25 -0.00 0.00 0.00 177.43 178.93 2jul h LEU 173 N 0.29 1.11 -7.22 0.34 5.85 -0.50 -3.26 115.31 111.91 2jul h LEU 173 Ca 0.02 -0.10 -0.76 0.00 0.84 0.00 0.00 57.88 57.89 2jul h LEU 173 Cb 0.92 -0.28 -0.19 0.00 0.37 0.00 0.00 40.66 41.48 2jul h LEU 173 CO 0.08 0.89 1.43 -1.22 -0.34 0.00 0.00 178.44 179.28 2jul n TYR 174 N -4.33 4.13 0.00 1.25 4.01 -1.04 -4.22 117.16 116.96 2jul n TYR 174 Ca 0.09 -3.17 0.00 0.00 -0.16 0.00 0.00 57.90 54.66 2jul n TYR 174 Cb 0.10 -1.98 0.00 0.00 -0.31 0.00 0.00 39.34 37.14 2jul n TYR 174 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2jul n ASP 175 N 4.38 0.00 0.00 7.72 2.03 -1.23 -4.64 116.55 124.80 2jul n ASP 175 Ca 0.35 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.66 2jul n ASP 175 Cb 0.39 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.79 2jul n ASP 175 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2jul n ILE 176 N -0.49 0.00 -0.81 5.18 5.41 -1.26 -4.63 119.36 122.76 2jul n ILE 176 Ca 0.00 0.00 -0.34 0.00 1.00 0.00 0.00 62.75 63.41 2jul n ILE 176 Cb 0.00 0.00 0.11 0.00 -0.71 0.00 0.00 39.64 39.04 2jul n ILE 176 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2jul n ASN 177 N 7.41 -2.83 -4.63 4.38 6.94 -1.26 -4.84 115.26 120.43 2jul n ASN 177 Ca 0.00 0.19 -0.43 0.00 -0.02 0.00 0.00 54.58 54.32 2jul n ASN 177 Cb 0.00 -1.04 -0.02 0.00 -2.36 0.00 0.00 39.78 36.36 2jul n ASN 177 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2jul s LYS 178 N -3.25 3.99 0.00 -3.83 3.01 -1.26 -4.57 119.74 113.84 2jul s LYS 178 Ca 0.53 0.97 0.00 0.00 -1.01 0.00 0.00 55.97 56.45 2jul s LYS 178 Cb -0.17 -3.78 0.00 0.00 -1.01 0.00 0.00 37.83 32.88 2jul s LYS 178 CO 0.70 -1.01 0.00 -0.40 0.51 0.00 0.00 175.35 175.15 2jul n ASP 179 N 7.09 0.00 -2.00 2.83 5.68 -1.26 -5.01 116.55 123.89 2jul n ASP 179 Ca 0.12 0.00 -0.16 0.00 -0.50 0.00 0.00 54.79 54.25 2jul n ASP 179 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 2jul n ASP 179 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jul n GLY 180 N 0.00 -0.27 3.26 6.12 0.00 -1.26 -4.98 105.19 108.06 2jul n GLY 180 Ca 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.81 2.39 0.12 0.00 1.01 0.27 -4.72 121.20 116.45 2jul s ILE 182 Ca 0.04 -2.31 -0.15 0.00 0.00 0.00 0.00 60.65 58.22 2jul s ILE 182 Cb 0.03 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 40.07 2jul s ILE 182 CO -0.11 -0.31 0.39 -0.89 0.00 0.00 0.00 174.94 174.01 2jul s THR 183 N -2.55 0.07 0.36 2.92 2.01 -1.26 -1.01 115.64 116.18 2jul s THR 183 Ca 0.31 -0.63 0.13 0.00 0.31 0.00 0.00 61.69 61.81 2jul s THR 183 Cb -0.02 -1.19 0.35 0.00 0.01 0.00 0.00 72.50 71.65 2jul s THR 183 CO 0.16 -0.34 1.80 0.50 -0.69 0.00 0.00 174.62 176.05 2jul h LYS 184 N 2.39 0.54 0.73 4.92 3.64 -1.97 -1.19 116.57 125.64 2jul h LYS 184 Ca -0.34 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 58.97 2jul h LYS 184 Cb 1.25 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.96 2jul h LYS 184 CO 0.47 0.36 -0.35 1.49 -2.27 0.00 0.00 179.45 179.15 2jul h GLU 185 N 0.56 -0.95 -0.27 1.90 4.22 -2.00 -1.75 114.58 116.29 2jul h GLU 185 Ca 0.55 0.06 0.08 0.00 0.08 0.00 0.00 59.36 60.13 2jul h GLU 185 Cb 1.13 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2jul h GLU 185 CO -0.29 -0.63 0.41 0.93 -2.18 0.00 0.00 179.01 177.24 2jul h GLU 186 N -1.03 0.00 -0.13 1.92 5.08 -1.81 0.88 114.58 119.48 2jul h GLU 186 Ca -0.10 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.05 2jul h GLU 186 Cb 0.75 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.02 2jul h GLU 186 CO 0.17 0.00 -0.72 1.98 -1.00 0.00 0.00 179.01 179.43 2jul h MET 187 N 0.00 0.72 -0.66 2.33 4.05 -0.65 -1.58 114.93 119.13 2jul h MET 187 Ca 0.13 -0.60 -0.04 0.00 -0.28 0.00 0.00 59.70 58.91 2jul h MET 187 Cb 0.94 0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 31.84 2jul h MET 187 CO -0.00 1.21 0.26 1.25 0.23 0.00 0.00 176.91 179.86 2jul h LEU 188 N 0.42 0.92 -0.87 3.39 7.12 0.03 0.29 115.31 126.60 2jul h LEU 188 Ca -0.05 -0.17 -0.12 0.00 0.13 0.00 0.00 57.88 57.67 2jul h LEU 188 Cb 1.36 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 41.24 2jul h LEU 188 CO 0.15 0.84 -0.43 0.00 -0.13 0.00 0.00 178.44 178.86 2jul h ALA 189 N 1.11 1.04 -0.05 1.25 0.00 -1.48 0.07 119.26 121.20 2jul h ALA 189 Ca 0.22 -0.43 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 2jul h ALA 189 Cb 0.21 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.92 2jul h ALA 189 CO -0.02 0.61 -0.61 0.82 0.00 0.00 0.00 179.25 180.06 2jul h ILE 190 N 0.23 1.38 -0.18 0.00 1.08 -0.76 -2.58 117.51 116.68 2jul h ILE 190 Ca 0.02 -1.98 -0.12 0.00 -0.39 0.00 0.00 64.86 62.39 2jul h ILE 190 Cb 0.86 2.38 -0.01 0.00 -3.07 0.00 0.00 36.82 36.98 2jul h ILE 190 CO 0.07 0.59 -0.39 -0.03 -0.69 0.00 0.00 178.15 177.69 2jul h MET 191 N 0.06 0.40 -0.70 2.37 4.05 -0.37 -2.67 114.93 118.07 2jul h MET 191 Ca -0.06 -0.19 -0.07 0.00 -0.28 0.00 0.00 59.70 59.10 2jul h MET 191 Cb 1.28 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 32.05 2jul h MET 191 CO 0.12 0.73 0.16 -0.22 0.23 0.00 0.00 176.91 177.94 2jul h LYS 192 N 0.33 1.12 -0.28 0.39 3.64 -0.99 -2.61 116.57 118.17 2jul h LYS 192 Ca 0.03 -0.27 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 2jul h LYS 192 Cb 0.84 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2jul h LYS 192 CO 0.07 0.98 0.17 0.66 -2.27 0.00 0.00 179.45 179.07 2jul h SER 193 N 1.06 0.33 -0.53 4.20 4.64 -1.19 0.14 113.55 122.21 2jul h SER 193 Ca 0.22 -0.04 0.10 0.00 -0.47 0.00 0.00 61.79 61.60 2jul h SER 193 Cb 0.37 -0.08 -0.08 0.00 -0.31 0.00 0.00 62.40 62.30 2jul h SER 193 CO 0.00 0.27 0.04 0.40 -0.87 0.00 0.00 176.83 176.67 2jul h ILE 194 N 0.36 0.62 -0.54 0.95 1.08 -1.20 0.85 117.51 119.62 2jul h ILE 194 Ca 0.10 -0.05 -0.09 0.00 -0.39 0.00 0.00 64.86 64.42 2jul h ILE 194 Cb -0.00 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 2jul h ILE 194 CO -0.02 0.03 -0.02 1.88 -0.69 0.00 0.00 178.15 179.33 2jul h TYR 195 N 0.16 1.06 -0.31 1.37 -1.99 -1.08 -2.72 116.97 113.46 2jul h TYR 195 Ca 0.27 -0.19 -0.07 0.00 2.00 0.00 0.00 58.73 60.73 2jul h TYR 195 Cb 0.40 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.84 2jul h TYR 195 CO -0.29 0.97 -0.12 0.22 -0.00 0.00 0.00 178.16 178.94 2jul h ASP 196 N 0.85 0.51 -0.36 3.88 3.58 0.79 -2.89 116.42 122.77 2jul h ASP 196 Ca 0.15 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 2jul h ASP 196 Cb 0.56 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 2jul h ASP 196 CO 0.03 0.66 0.20 -0.03 -2.88 0.00 0.00 179.24 177.23 2jul h MET 197 N 0.48 0.50 -6.09 0.28 4.05 0.95 -3.39 114.93 111.71 2jul h MET 197 Ca 0.09 -0.05 -0.60 0.00 -0.28 0.00 0.00 59.70 58.85 2jul h MET 197 Cb 0.50 -0.10 -0.10 0.00 -0.80 0.00 0.00 31.60 31.10 2jul h MET 197 CO 0.03 0.40 0.56 -1.64 0.23 0.00 0.00 176.91 176.49 2jul s MET 198 N -5.90 3.61 0.38 0.39 -1.94 -1.06 -4.44 119.30 110.34 2jul s MET 198 Ca -0.13 0.25 -0.27 0.00 -1.71 0.00 0.00 55.69 53.83 2jul s MET 198 Cb 0.10 -3.89 -0.10 0.00 2.01 0.00 0.00 34.83 32.95 2jul s MET 198 CO 0.73 -1.13 1.37 0.20 -0.01 0.00 0.00 175.02 176.18 2jul s GLY 199 N 2.14 2.95 -0.35 -0.03 0.00 -1.26 -4.82 107.32 105.95 2jul s GLY 199 Ca 0.36 1.36 -0.35 0.00 0.00 0.00 0.00 44.72 46.10 2jul s GLY 199 CO 0.24 2.00 2.20 0.54 0.00 0.00 0.00 173.10 178.07 2jul n ARG 200 N 0.38 1.08 -3.23 2.90 1.74 -1.26 -4.86 116.66 113.40 2jul n ARG 200 Ca 0.02 0.29 -0.46 0.00 -0.77 0.00 0.00 57.85 56.93 2jul n ARG 200 Cb 0.42 -2.48 -0.02 0.00 -1.02 0.00 0.00 32.46 29.36 2jul n ARG 200 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2jul s HIS 201 N 7.43 3.67 0.00 -1.55 3.76 -1.26 -5.01 115.29 122.33 2jul s HIS 201 Ca 1.10 -1.94 0.00 0.00 -0.15 0.00 0.00 55.06 54.07 2jul s HIS 201 Cb -0.84 -3.94 0.00 0.00 1.11 0.00 0.00 32.58 28.91 2jul s HIS 201 CO 0.48 -1.11 0.00 -2.37 -0.85 0.00 0.00 174.74 170.90 2jul n THR 202 N 4.19 0.00 -2.93 1.30 5.66 -1.26 -4.02 114.28 117.23 2jul n THR 202 Ca 0.18 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.76 2jul n THR 202 Cb 0.47 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.20 2jul n THR 202 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 2jul s TYR 203 N 0.00 3.23 0.00 1.09 1.51 -1.26 -5.05 117.35 116.87 2jul s TYR 203 Ca 0.00 0.90 0.00 0.00 -1.01 0.00 0.00 57.07 56.96 2jul s TYR 203 Cb 0.00 -3.18 0.00 0.00 -0.11 0.00 0.00 41.96 38.67 2jul s TYR 203 CO 0.00 -0.53 0.00 -2.30 -1.11 0.00 0.00 175.55 171.61 2jul n PRO 204 N 6.16 -0.07 -0.05 -1.71 -0.02 -1.26 -4.96 135.00 133.09 2jul n PRO 204 Ca 0.04 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.44 2jul n PRO 204 Cb 0.48 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.81 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 -1.69 1.45 -2.79 4.25 -5.35 -1.26 -4.95 119.36 109.03 2jul n ILE 205 Ca 0.00 -0.81 -0.23 0.00 -0.27 0.00 0.00 62.75 61.44 2jul n ILE 205 Cb 0.00 -0.74 0.02 0.00 -1.74 0.00 0.00 39.64 37.19 2jul n ILE 205 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2jul s LEU 206 N -5.77 3.45 -0.06 7.28 2.96 -1.26 -5.06 118.68 120.23 2jul s LEU 206 Ca -0.07 0.22 -0.04 0.00 -0.22 0.00 0.00 54.13 54.02 2jul s LEU 206 Cb 0.07 -3.09 -0.01 0.00 0.50 0.00 0.00 46.19 43.66 2jul s LEU 206 CO 0.83 -0.92 -0.07 -1.14 -1.32 0.00 0.00 176.35 173.73 2jul n ARG 207 N -2.24 0.18 -3.55 1.98 3.00 -1.26 -4.95 116.66 109.82 2jul n ARG 207 Ca 0.04 0.35 -0.33 0.00 -0.00 0.00 0.00 57.85 57.91 2jul n ARG 207 Cb 0.58 -1.11 -0.05 0.00 0.00 0.00 0.00 32.46 31.88 2jul n ARG 207 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.63 175.80 2jul s GLU 208 N -1.49 3.75 -0.30 -0.14 -1.05 -1.26 -5.07 118.70 113.14 2jul s GLU 208 Ca -0.06 0.16 -0.17 0.00 -0.15 0.00 0.00 54.97 54.75 2jul s GLU 208 Cb 0.01 -2.89 0.20 0.00 -0.44 0.00 0.00 34.13 31.02 2jul s GLU 208 CO 0.09 0.48 1.27 0.16 0.95 0.00 0.00 175.26 178.21 2jul s ASP 209 N -2.04 -0.07 -0.07 0.83 -4.77 -1.26 -5.17 116.67 104.12 2jul s ASP 209 Ca 0.38 0.11 -0.05 0.00 -3.30 0.00 0.00 52.55 49.69 2jul s ASP 209 Cb -0.13 1.05 0.02 0.00 -1.09 0.00 0.00 42.92 42.78 2jul s ASP 209 CO 0.20 -0.02 0.17 0.00 0.70 0.00 0.00 175.17 176.22 2jul s ALA 210 N 1.43 -0.39 0.03 2.11 0.00 -1.26 -5.06 121.76 118.62 2jul s ALA 210 Ca -0.05 0.57 -0.26 0.00 0.00 0.00 0.00 51.96 52.22 2jul s ALA 210 Cb -0.02 -0.35 -0.17 0.00 0.00 0.00 0.00 23.12 22.58 2jul s ALA 210 CO -0.12 -0.11 1.43 -1.00 0.00 0.00 0.00 175.76 175.96 2jul h PRO 211 N 6.33 -0.24 -0.92 0.00 0.13 -2.00 -2.95 132.00 132.35 2jul h PRO 211 Ca -0.31 0.02 0.24 0.00 -0.87 0.00 0.00 66.00 65.08 2jul h PRO 211 Cb 1.18 0.06 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 2jul h PRO 211 CO 0.41 0.02 0.43 -0.07 -0.23 0.00 0.00 178.00 178.56 2jul h LEU 212 N -0.50 0.37 -1.10 1.56 4.07 -1.97 0.43 115.31 118.19 2jul h LEU 212 Ca -0.03 0.16 -0.05 0.00 0.08 0.00 0.00 57.88 58.04 2jul h LEU 212 Cb 0.38 0.13 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 2jul h LEU 212 CO 0.04 -0.02 0.09 -0.33 -1.08 0.00 0.00 178.44 177.15 2jul h GLU 213 N 0.40 0.74 0.39 1.13 5.08 -1.97 -2.04 114.58 118.32 2jul h GLU 213 Ca 0.59 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.78 2jul h GLU 213 Cb 1.16 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2jul h GLU 213 CO -0.54 0.68 -0.19 1.25 -1.00 0.00 0.00 179.01 179.21 2jul h HIS 214 N 0.71 -0.49 -0.10 4.33 2.76 0.00 -2.20 115.15 120.17 2jul h HIS 214 Ca 0.16 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.34 2jul h HIS 214 Cb 0.30 0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.41 2jul h HIS 214 CO 0.02 -0.18 0.15 0.28 -1.30 0.00 0.00 177.93 176.89 2jul h VAL 215 N -0.77 0.34 0.05 5.26 2.07 -1.25 0.33 116.25 122.28 2jul h VAL 215 Ca -0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 2jul h VAL 215 Cb 0.52 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2jul h VAL 215 CO 0.09 0.00 -0.02 -0.08 0.02 0.00 0.00 177.57 177.57 2jul h GLU 216 N 0.00 -0.07 -0.16 1.57 4.22 -0.97 -0.21 114.58 118.97 2jul h GLU 216 Ca 0.05 0.00 -0.10 0.00 0.08 0.00 0.00 59.36 59.39 2jul h GLU 216 Cb 0.35 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2jul h GLU 216 CO -0.00 0.52 -0.36 -0.09 -2.18 0.00 0.00 179.01 176.90 2jul h ARG 217 N -0.72 0.33 -0.30 1.92 9.65 -0.79 0.42 114.38 124.90 2jul h ARG 217 Ca -0.01 -0.15 -0.17 0.00 -1.10 0.00 0.00 59.98 58.56 2jul h ARG 217 Cb 0.61 -0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.18 2jul h ARG 217 CO 0.01 0.65 -0.47 0.35 2.80 0.00 0.00 179.97 183.31 2jul h PHE 218 N 0.29 1.06 0.00 2.20 3.57 -1.00 0.34 116.94 123.40 2jul h PHE 218 Ca 0.03 -0.36 -0.10 0.00 3.53 0.00 0.00 57.97 61.07 2jul h PHE 218 Cb 0.76 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 2jul h PHE 218 CO 0.02 1.18 -0.50 0.35 -2.23 0.00 0.00 178.31 177.13 2jul h PHE 219 N 0.64 0.00 -0.09 0.41 3.57 -0.84 -2.88 116.94 117.75 2jul h PHE 219 Ca 0.03 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.36 2jul h PHE 219 Cb 1.08 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.83 2jul h PHE 219 CO 0.07 0.48 -0.58 0.37 -2.23 0.00 0.00 178.31 176.42 2jul h GLN 220 N 0.00 0.55 -0.43 1.11 4.15 -0.02 -3.21 115.11 117.26 2jul h GLN 220 Ca -0.01 -0.47 -0.01 0.00 0.77 0.00 0.00 58.65 58.93 2jul h GLN 220 Cb 1.37 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 29.15 2jul h GLN 220 CO 0.06 1.10 0.23 0.87 -1.93 0.00 0.00 178.83 179.16 2jul h LYS 221 N 0.15 0.60 0.00 1.69 1.57 -0.97 -3.42 116.57 116.19 2jul h LYS 221 Ca -0.05 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2jul h LYS 221 Cb 1.23 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2jul h LYS 221 CO 0.12 0.49 0.00 -1.33 -0.57 0.00 0.00 179.45 178.16 2jul n MET 222 N -4.70 1.05 -2.10 3.15 2.81 -1.09 -4.44 117.12 111.80 2jul n MET 222 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2jul n MET 222 Cb 0.09 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.60 2jul n MET 222 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2jul n ASP 223 N 0.00 -0.78 -4.48 7.83 2.03 -1.23 -4.76 116.55 115.16 2jul n ASP 223 Ca 0.00 0.39 -0.43 0.00 0.52 0.00 0.00 54.79 55.26 2jul n ASP 223 Cb 0.00 -0.83 -0.01 0.00 -0.72 0.00 0.00 41.12 39.56 2jul n ASP 223 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2jul s ARG 224 N -4.10 3.83 0.01 -0.67 3.52 -1.26 -4.84 118.95 115.44 2jul s ARG 224 Ca 0.00 -2.03 -0.29 0.00 -0.13 0.00 0.00 55.73 53.28 2jul s ARG 224 Cb 0.00 -5.10 0.11 0.00 -1.56 0.00 0.00 34.95 28.40 2jul s ARG 224 CO 0.00 -1.88 1.25 0.54 -0.81 0.00 0.00 175.30 174.40 2jul s ASN 225 N 3.55 -0.04 0.23 -2.12 2.20 -1.26 -4.95 114.94 112.56 2jul s ASN 225 Ca 0.41 -0.21 -0.07 0.00 -0.94 0.00 0.00 52.86 52.04 2jul s ASN 225 Cb -0.02 0.20 0.28 0.00 -2.00 0.00 0.00 41.25 39.71 2jul s ASN 225 CO -0.04 -0.39 1.86 -0.61 -2.94 0.00 0.00 177.10 174.98 2jul h GLN 226 N 2.00 0.94 0.00 3.55 4.15 -1.98 -3.41 115.11 120.36 2jul h GLN 226 Ca -0.28 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.09 2jul h GLN 226 Cb 1.20 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 28.68 2jul h GLN 226 CO 0.30 0.62 0.00 -0.40 -1.93 0.00 0.00 178.83 177.42 2jul n ASP 227 N -4.61 0.00 0.00 -0.69 5.68 -1.26 -5.04 116.55 110.63 2jul n ASP 227 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.40 2jul n ASP 227 Cb 0.13 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2jul n ASP 227 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jul n GLY 228 N 2.68 0.00 3.90 6.12 0.00 -1.26 -5.01 105.19 111.62 2jul n GLY 228 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 4.65 -0.06 1.61 -7.23 -1.26 -4.72 120.40 113.09 2jul s VAL 229 Ca 0.00 0.30 -0.12 0.00 -1.81 0.00 0.00 61.98 60.35 2jul s VAL 229 Cb 0.00 -3.79 -0.05 0.00 0.56 0.00 0.00 36.38 33.10 2jul s VAL 229 CO 0.00 -0.84 0.30 0.54 -0.31 0.00 0.00 175.10 174.79 2jul s VAL 230 N -2.87 5.24 0.24 1.32 0.11 -0.18 -4.78 120.40 119.47 2jul s VAL 230 Ca 0.50 0.58 0.08 0.00 -2.93 0.00 0.00 61.98 60.21 2jul s VAL 230 Cb -0.10 -3.59 -0.05 0.00 -1.53 0.00 0.00 36.38 31.10 2jul s VAL 230 CO 0.47 0.57 -0.13 0.42 -3.33 0.00 0.00 175.10 173.10 2jul s THR 231 N -0.85 1.83 0.39 5.04 -4.23 -1.26 -0.57 115.64 115.99 2jul s THR 231 Ca 0.20 -2.22 0.23 0.00 -1.18 0.00 0.00 61.69 58.72 2jul s THR 231 Cb -0.15 -2.20 0.39 0.00 1.34 0.00 0.00 72.50 71.88 2jul s THR 231 CO 0.09 -0.48 1.59 -0.29 -0.54 0.00 0.00 174.62 174.99 2jul h ILE 232 N 2.43 0.03 0.69 2.99 6.09 -1.98 0.43 117.51 128.19 2jul h ILE 232 Ca -0.39 -0.01 -0.03 0.00 -1.37 0.00 0.00 64.86 63.06 2jul h ILE 232 Cb 1.23 -0.00 0.01 0.00 0.47 0.00 0.00 36.82 38.52 2jul h ILE 232 CO 0.63 0.01 -0.33 -0.78 -3.07 0.00 0.00 178.15 174.61 2jul h ASP 233 N 0.03 -0.78 -0.55 2.19 1.82 -1.97 0.53 116.42 117.68 2jul h ASP 233 Ca 0.85 0.03 0.16 0.00 -0.39 0.00 0.00 57.03 57.67 2jul h ASP 233 Cb 2.35 0.20 -0.02 0.00 0.68 0.00 0.00 39.33 42.54 2jul h ASP 233 CO -0.68 -0.41 0.48 -0.08 -1.61 0.00 0.00 179.24 176.95 2jul h GLU 234 N -1.22 0.00 0.02 0.28 4.81 -1.08 1.15 114.58 118.53 2jul h GLU 234 Ca -0.09 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 2jul h GLU 234 Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 2jul h GLU 234 CO 0.15 0.00 -0.19 0.35 -0.73 0.00 0.00 179.01 178.60 2jul h PHE 235 N 0.00 0.16 -0.14 0.92 3.57 0.04 -2.42 116.94 119.07 2jul h PHE 235 Ca 0.26 -0.10 -0.12 0.00 3.53 0.00 0.00 57.97 61.54 2jul h PHE 235 Cb 1.23 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 2jul h PHE 235 CO 0.00 0.97 -0.45 1.25 -2.23 0.00 0.00 178.31 177.86 2jul h LEU 236 N -0.70 0.36 -0.60 0.59 5.85 0.21 -1.46 115.31 119.56 2jul h LEU 236 Ca -0.03 -0.16 -0.11 0.00 0.84 0.00 0.00 57.88 58.41 2jul h LEU 236 Cb 1.04 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2jul h LEU 236 CO 0.04 0.76 -0.11 -0.08 -0.34 0.00 0.00 178.44 178.70 2jul h GLU 237 N 0.28 0.99 -0.15 1.25 4.81 0.12 0.93 114.58 122.81 2jul h GLU 237 Ca 0.02 -0.37 -0.08 0.00 -0.13 0.00 0.00 59.36 58.81 2jul h GLU 237 Cb 0.90 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 2jul h GLU 237 CO 0.07 1.04 -0.21 1.15 -0.73 0.00 0.00 179.01 180.34 2jul h THR 238 N 0.88 1.36 0.00 0.32 2.02 -1.25 -0.39 112.91 115.85 2jul h THR 238 Ca 0.14 -1.43 -0.03 0.00 0.77 0.00 0.00 66.41 65.86 2jul h THR 238 Cb 0.67 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 2jul h THR 238 CO 0.05 0.42 -0.13 0.00 0.37 0.00 0.00 175.52 176.23 2jul h GLN 240 N 0.00 0.09 0.00 0.00 4.20 -0.73 -3.48 115.11 115.20 2jul h GLN 240 Ca -0.00 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.55 2jul h GLN 240 Cb 0.63 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.47 2jul h GLN 240 CO 0.02 1.07 0.00 1.63 -0.67 0.00 0.00 178.83 180.88 2jul n LYS 241 N -4.17 0.01 0.00 1.46 5.02 -0.16 -4.99 118.16 115.32 2jul n LYS 241 Ca -0.30 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.99 2jul n LYS 241 Cb 0.78 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.79 2jul n LYS 241 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jul n ASP 242 N -1.06 0.00 -0.33 4.39 -0.08 -1.26 -4.91 116.55 113.30 2jul n ASP 242 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2jul n ASP 242 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2jul n ASP 242 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2jul n GLU 243 N 0.00 0.00 0.00 -0.67 -0.58 -1.26 -4.87 120.64 113.25 2jul n GLU 243 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2jul n GLU 243 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2jul n GLU 243 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2jul n ASN 244 N -3.52 0.00 0.00 1.62 6.94 -1.26 -4.98 115.26 114.06 2jul n ASN 244 Ca 0.00 -0.32 -0.16 0.00 -0.02 0.00 0.00 54.58 54.08 2jul n ASN 244 Cb 0.00 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.37 2jul n ASN 244 CO 0.00 0.00 0.00 -0.29 -1.03 0.00 0.00 177.26 175.94 2jul h ILE 245 N 0.55 1.30 -0.49 1.53 6.09 -1.93 -3.21 117.51 121.35 2jul h ILE 245 Ca 0.00 -2.06 -0.00 0.00 -1.37 0.00 0.00 64.86 61.42 2jul h ILE 245 Cb 0.22 2.08 -0.02 0.00 0.47 0.00 0.00 36.82 39.56 2jul h ILE 245 CO 0.00 0.64 0.30 0.24 -3.07 0.00 0.00 178.15 176.26 2jul h MET 246 N 0.46 0.67 -0.86 2.19 2.86 -1.93 -2.00 114.93 116.30 2jul h MET 246 Ca -0.06 -0.06 0.18 0.00 -2.06 0.00 0.00 59.70 57.70 2jul h MET 246 Cb 1.44 -0.14 -0.11 0.00 0.06 0.00 0.00 31.60 32.85 2jul h MET 246 CO 0.16 0.48 0.41 -0.97 1.06 0.00 0.00 176.91 178.05 2jul h ASN 247 N 0.66 0.42 -0.47 1.22 -1.24 -1.93 0.53 115.58 114.77 2jul h ASN 247 Ca 0.18 0.12 -0.04 0.00 0.71 0.00 0.00 56.30 57.27 2jul h ASN 247 Cb -0.01 0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.08 2jul h ASN 247 CO -0.03 0.11 0.17 0.28 -1.29 0.00 0.00 177.43 176.67 2jul h SER 248 N 0.51 0.72 -0.32 1.15 0.02 -1.38 -2.54 113.55 111.70 2jul h SER 248 Ca 0.50 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.33 2jul h SER 248 Cb 0.84 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 2jul h SER 248 CO -0.44 0.68 0.14 -0.03 -1.14 0.00 0.00 176.83 176.03 2jul h MET 249 N 0.76 0.47 -0.71 3.45 1.85 0.49 -1.23 114.93 120.01 2jul h MET 249 Ca 0.18 -0.08 0.11 0.00 -0.61 0.00 0.00 59.70 59.30 2jul h MET 249 Cb 0.22 -0.08 -0.08 0.00 0.43 0.00 0.00 31.60 32.09 2jul h MET 249 CO -0.01 0.46 0.32 0.37 -0.40 0.00 0.00 176.91 177.64 2jul h GLN 250 N 0.37 0.50 -0.51 0.39 4.15 -0.80 0.72 115.11 119.93 2jul h GLN 250 Ca 0.11 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.45 2jul h GLN 250 Cb 0.16 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 2jul h GLN 250 CO -0.01 0.33 0.15 1.25 -1.93 0.00 0.00 178.83 178.62 2jul h LEU 251 N 0.52 0.76 -0.97 -2.39 5.85 -1.18 -1.89 115.31 116.00 2jul h LEU 251 Ca 0.37 -0.21 -0.09 0.00 0.84 0.00 0.00 57.88 58.78 2jul h LEU 251 Cb 0.46 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2jul h LEU 251 CO -0.32 0.77 -0.28 0.15 -0.34 0.00 0.00 178.44 178.42 2jul h PHE 252 N 0.71 0.46 0.00 1.25 3.04 0.06 -2.46 116.94 119.99 2jul h PHE 252 Ca 0.17 -0.10 -0.06 0.00 3.98 0.00 0.00 57.97 61.96 2jul h PHE 252 Cb 0.29 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.68 2jul h PHE 252 CO 0.02 0.65 -0.26 1.49 -2.02 0.00 0.00 178.31 178.18 2jul h GLU 253 N 0.36 0.00 0.00 1.11 4.22 0.81 -2.72 114.58 118.36 2jul h GLU 253 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.49 2jul h GLU 253 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2jul h GLU 253 CO 0.05 0.26 0.36 -1.71 -2.18 0.00 0.00 179.01 175.79 2jul n ASN 254 N -3.75 0.11 0.00 1.04 5.15 -0.75 -4.14 115.26 112.91 2jul n ASN 254 Ca -0.01 0.32 0.00 0.00 -0.60 0.00 0.00 54.58 54.29 2jul n ASN 254 Cb 0.37 -0.27 0.00 0.00 -0.53 0.00 0.00 39.78 39.35 2jul n ASN 254 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2jul n VAL 255 N -1.54 0.00 0.00 3.44 0.31 -1.03 -5.14 118.33 114.37 2jul n VAL 255 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2jul n VAL 255 Cb 0.36 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.29 2jul n VAL 255 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81