#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jul n GLU 77 N 0.00 1.92 0.23 0.54 1.02 -1.26 -4.46 120.64 118.63 2jul n GLU 77 Ca 0.00 -1.78 0.08 0.00 -0.02 0.00 0.00 57.16 55.44 2jul n GLU 77 Cb 0.00 -1.71 0.54 0.00 -0.02 0.00 0.00 31.44 30.25 2jul n GLU 77 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2jul h GLY 78 N 2.51 0.00 0.02 0.62 0.00 -2.06 -2.54 103.07 101.62 2jul h GLY 78 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 2jul h GLY 78 CO 0.86 0.00 -0.01 -2.00 0.00 0.00 0.00 176.54 175.39 2jul h LEU 79 N 0.00 -0.02 -1.32 3.11 5.85 -2.01 -2.73 115.31 118.19 2jul h LEU 79 Ca -0.00 0.00 0.35 0.00 0.84 0.00 0.00 57.88 59.06 2jul h LEU 79 Cb 0.49 0.01 -0.12 0.00 0.37 0.00 0.00 40.66 41.40 2jul h LEU 79 CO 0.03 -0.00 0.73 -0.78 -0.34 0.00 0.00 178.44 178.07 2jul h ASP 80 N -0.04 0.37 0.06 1.25 3.58 -1.92 0.26 116.42 119.98 2jul h ASP 80 Ca -0.00 0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.58 2jul h ASP 80 Cb 0.02 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.13 2jul h ASP 80 CO 0.00 -0.06 -0.13 1.56 -2.88 0.00 0.00 179.24 177.73 2jul h GLN 81 N 0.25 -0.24 -0.09 0.28 1.08 -1.48 -0.91 115.11 114.00 2jul h GLN 81 Ca 0.71 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.95 2jul h GLN 81 Cb 1.98 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 29.46 2jul h GLN 81 CO -0.40 -0.16 0.07 1.25 -0.95 0.00 0.00 178.83 178.64 2jul h LEU 82 N -0.25 0.00 -0.57 1.46 6.46 -0.18 -1.34 115.31 120.89 2jul h LEU 82 Ca 0.03 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.75 2jul h LEU 82 Cb 0.27 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.18 2jul h LEU 82 CO -0.08 0.00 0.23 -0.61 -0.62 0.00 0.00 178.44 177.36 2jul h GLN 83 N 0.00 0.84 -0.10 1.25 -0.00 -0.54 -2.32 115.11 114.24 2jul h GLN 83 Ca 0.04 -0.15 -0.09 0.00 -0.00 0.00 0.00 58.65 58.45 2jul h GLN 83 Cb 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.51 2jul h GLN 83 CO -0.00 0.72 -0.36 0.00 0.00 0.00 0.00 178.83 179.20 2jul h ALA 84 N 1.08 1.22 -3.00 3.38 0.00 -0.83 -3.39 119.26 117.71 2jul h ALA 84 Ca 0.19 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jul h ALA 84 Cb 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jul h ALA 84 CO -0.02 0.53 0.00 1.04 0.00 0.00 0.00 179.25 180.81 2jul n GLN 85 N -4.08 0.00 -1.54 0.00 6.02 -0.91 -4.60 117.38 112.28 2jul n GLN 85 Ca -0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.79 2jul n GLN 85 Cb 0.43 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.58 2jul n GLN 85 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2jul n THR 86 N 0.00 -0.01 -1.53 5.09 -1.04 -1.00 -4.81 114.28 110.98 2jul n THR 86 Ca 0.00 -0.51 -0.53 0.00 -2.04 0.00 0.00 64.05 60.97 2jul n THR 86 Cb 0.00 -1.44 -0.06 0.00 -1.82 0.00 0.00 70.33 67.02 2jul n THR 86 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2jul n LYS 87 N 7.87 0.62 0.00 -2.82 4.76 -1.26 -4.73 118.16 122.60 2jul n LYS 87 Ca 0.53 0.22 0.00 0.00 -2.87 0.00 0.00 58.31 56.19 2jul n LYS 87 Cb 0.34 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 2jul n LYS 87 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2jul n PHE 88 N 1.63 0.00 -3.77 2.13 -0.00 -1.26 -5.08 117.46 111.11 2jul n PHE 88 Ca 0.18 0.00 -0.26 0.00 -0.00 0.00 0.00 57.45 57.37 2jul n PHE 88 Cb 0.17 0.00 -0.17 0.00 -0.00 0.00 0.00 39.48 39.48 2jul n PHE 88 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 2jul s THR 89 N 0.22 0.56 0.56 -2.13 -4.23 -1.26 -4.99 115.64 104.38 2jul s THR 89 Ca 0.00 -0.37 0.47 0.00 -1.18 0.00 0.00 61.69 60.61 2jul s THR 89 Cb 0.00 -0.92 0.69 0.00 1.34 0.00 0.00 72.50 73.61 2jul s THR 89 CO 0.00 -0.03 1.56 0.50 -0.54 0.00 0.00 174.62 176.11 2jul h LYS 90 N 8.25 0.00 0.47 3.99 3.64 -1.97 0.65 116.57 131.60 2jul h LYS 90 Ca -0.18 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.17 2jul h LYS 90 Cb 1.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2jul h LYS 90 CO 0.32 0.00 -0.22 -0.22 -2.27 0.00 0.00 179.45 177.06 2jul h LYS 91 N 0.00 -0.60 0.00 1.90 3.64 -2.00 -1.44 116.57 118.07 2jul h LYS 91 Ca 0.86 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 60.26 2jul h LYS 91 Cb 3.57 0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 35.52 2jul h LYS 91 CO -0.01 -0.40 -0.09 0.93 -2.27 0.00 0.00 179.45 177.60 2jul h GLU 92 N -1.04 0.00 -0.62 1.90 3.07 -0.96 -1.53 114.58 115.40 2jul h GLU 92 Ca -0.06 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.76 2jul h GLU 92 Cb 0.48 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.36 2jul h GLU 92 CO 0.11 0.09 0.23 1.25 -1.40 0.00 0.00 179.01 179.29 2jul h LEU 93 N 0.00 0.87 -0.85 1.33 6.46 0.15 -2.18 115.31 121.09 2jul h LEU 93 Ca -0.00 -0.18 0.01 0.00 -0.12 0.00 0.00 57.88 57.59 2jul h LEU 93 Cb 0.18 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 39.84 2jul h LEU 93 CO 0.01 0.81 0.56 -0.61 -0.62 0.00 0.00 178.44 178.60 2jul h GLN 94 N 0.87 1.12 -0.75 1.25 4.15 -0.21 -0.43 115.11 121.11 2jul h GLN 94 Ca 0.20 -0.07 0.02 0.00 0.77 0.00 0.00 58.65 59.58 2jul h GLN 94 Cb 0.22 -0.25 -0.04 0.00 0.21 0.00 0.00 27.48 27.62 2jul h GLN 94 CO -0.01 0.74 0.49 0.66 -1.93 0.00 0.00 178.83 178.78 2jul h SER 95 N 1.15 0.81 -0.20 -0.69 4.64 -1.17 0.16 113.55 118.25 2jul h SER 95 Ca 0.31 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.53 2jul h SER 95 Cb -0.13 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 61.76 2jul h SER 95 CO -0.07 0.57 -0.20 -0.07 -0.87 0.00 0.00 176.83 176.19 2jul h LEU 96 N 0.95 0.53 -1.58 5.97 3.38 -0.65 -2.68 115.31 121.23 2jul h LEU 96 Ca 0.29 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2jul h LEU 96 Cb -0.01 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2jul h LEU 96 CO -0.08 0.90 -0.17 0.22 0.09 0.00 0.00 178.44 179.40 2jul h TYR 97 N 0.17 0.06 0.03 1.13 3.20 -0.49 -2.09 116.97 118.99 2jul h TYR 97 Ca 0.03 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2jul h TYR 97 Cb 0.75 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.00 2jul h TYR 97 CO 0.08 0.23 -0.02 -0.09 -1.64 0.00 0.00 178.16 176.72 2jul h ARG 98 N 0.06 -0.04 -0.17 1.82 2.43 -0.48 0.12 114.38 118.11 2jul h ARG 98 Ca 0.01 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2jul h ARG 98 Cb 0.33 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2jul h ARG 98 CO 0.02 0.13 0.08 0.78 -1.51 0.00 0.00 179.97 179.48 2jul h GLY 99 N -0.21 0.22 1.41 2.80 0.00 -1.15 0.66 103.07 106.80 2jul h GLY 99 Ca -0.00 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.32 2jul h GLY 99 CO 0.01 0.05 0.27 -2.75 0.00 0.00 0.00 176.54 174.12 2jul h PHE 100 N 0.18 0.33 0.00 5.60 3.04 -1.25 0.72 116.94 125.55 2jul h PHE 100 Ca 0.07 0.01 -0.18 0.00 3.98 0.00 0.00 57.97 61.84 2jul h PHE 100 Cb 0.02 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.39 2jul h PHE 100 CO -0.09 0.18 -0.87 -0.22 -2.02 0.00 0.00 178.31 175.29 2jul h LYS 101 N 0.33 0.00 -0.30 1.11 3.64 0.56 -3.23 116.57 118.68 2jul h LYS 101 Ca 0.18 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.45 2jul h LYS 101 Cb 0.28 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2jul h LYS 101 CO -0.04 0.87 -0.25 -0.97 -2.27 0.00 0.00 179.45 176.79 2jul h ASN 102 N 0.00 0.61 -2.82 4.20 -0.00 0.26 -3.45 115.58 114.38 2jul h ASN 102 Ca -0.01 -0.22 -0.35 0.00 -0.00 0.00 0.00 56.30 55.73 2jul h ASN 102 Cb 1.66 -0.17 0.21 0.00 -0.00 0.00 0.00 38.32 40.02 2jul h ASN 102 CO 0.11 0.85 -0.17 -0.62 -0.00 0.00 0.00 177.43 177.60 2jul n GLU 103 N -4.11 -4.62 -1.71 6.67 -0.58 -0.55 -4.86 120.64 110.89 2jul n GLU 103 Ca -0.00 -1.37 -0.41 0.00 -0.42 0.00 0.00 57.16 54.96 2jul n GLU 103 Cb 0.43 -1.87 0.01 0.00 -0.57 0.00 0.00 31.44 29.44 2jul n GLU 103 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jul n PRO 105 N 0.09 1.83 -3.47 0.00 -0.04 -1.26 -4.91 135.00 127.23 2jul n PRO 105 Ca 0.06 0.50 -0.13 0.00 -0.04 0.00 0.00 63.50 63.89 2jul n PRO 105 Cb 0.39 -3.13 -0.03 0.00 -0.04 0.00 0.00 33.50 30.69 2jul n PRO 105 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2jul s THR 106 N 8.21 0.00 0.00 0.52 2.01 -1.26 -5.12 115.64 119.99 2jul s THR 106 Ca 1.02 0.00 0.00 0.00 0.31 0.00 0.00 61.69 63.02 2jul s THR 106 Cb -0.41 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.10 2jul s THR 106 CO 0.37 0.00 0.01 0.61 -0.69 0.00 0.00 174.62 174.92 2jul n GLY 107 N 0.06 1.27 3.90 4.40 0.00 -1.26 -4.94 105.19 108.62 2jul n GLY 107 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 2jul n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jul s LEU 108 N -0.15 3.89 0.12 0.99 1.43 -1.26 -4.89 118.68 118.81 2jul s LEU 108 Ca 0.00 0.82 -0.06 0.00 -1.03 0.00 0.00 54.13 53.86 2jul s LEU 108 Cb 0.00 -3.69 -0.06 0.00 0.03 0.00 0.00 46.19 42.47 2jul s LEU 108 CO 0.00 -0.35 0.38 0.54 0.23 0.00 0.00 176.35 177.15 2jul s VAL 109 N -2.35 5.15 0.15 -1.59 0.11 0.09 -4.92 120.40 117.03 2jul s VAL 109 Ca 0.46 0.16 0.04 0.00 -2.93 0.00 0.00 61.98 59.71 2jul s VAL 109 Cb -0.10 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.08 2jul s VAL 109 CO 0.35 0.12 -0.09 -0.62 -3.33 0.00 0.00 175.10 171.53 2jul s ASP 110 N -2.21 1.72 0.57 3.54 -1.08 -1.26 -0.69 116.67 117.25 2jul s ASP 110 Ca 0.38 -1.02 0.44 0.00 -0.52 0.00 0.00 52.55 51.83 2jul s ASP 110 Cb -0.13 0.00 1.58 0.00 -1.46 0.00 0.00 42.92 42.92 2jul s ASP 110 CO 0.22 -0.36 1.57 -0.08 0.52 0.00 0.00 175.17 177.05 2jul h GLU 111 N 2.78 0.00 0.73 4.34 4.81 -1.99 0.27 114.58 125.52 2jul h GLU 111 Ca -0.36 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.83 2jul h GLU 111 Cb 1.19 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.58 2jul h GLU 111 CO 0.64 0.00 -0.35 -0.44 -0.73 0.00 0.00 179.01 178.13 2jul h ASP 112 N 0.00 -0.82 -0.83 1.04 3.32 -1.95 0.14 116.42 117.32 2jul h ASP 112 Ca 0.80 0.01 0.08 0.00 0.02 0.00 0.00 57.03 57.94 2jul h ASP 112 Cb 3.37 0.21 -0.07 0.00 0.22 0.00 0.00 39.33 43.07 2jul h ASP 112 CO -0.01 -0.48 0.49 0.74 -1.72 0.00 0.00 179.24 178.26 2jul h THR 113 N -1.17 0.95 -0.42 0.35 2.02 -0.89 -0.14 112.91 113.61 2jul h THR 113 Ca -0.10 -0.29 0.04 0.00 0.77 0.00 0.00 66.41 66.84 2jul h THR 113 Cb 0.77 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 2jul h THR 113 CO 0.16 0.15 0.17 -0.26 0.37 0.00 0.00 175.52 176.12 2jul h PHE 114 N 0.84 0.31 0.08 3.16 -1.00 -1.21 0.11 116.94 119.23 2jul h PHE 114 Ca 0.39 0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.19 2jul h PHE 114 Cb 0.30 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 2jul h PHE 114 CO -0.05 0.14 -0.08 -0.22 -1.61 0.00 0.00 178.31 176.48 2jul h LYS 115 N 0.35 -0.18 -0.68 1.51 1.63 0.32 0.19 116.57 119.71 2jul h LYS 115 Ca 0.19 0.01 0.10 0.00 -0.85 0.00 0.00 60.65 60.10 2jul h LYS 115 Cb 0.14 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 31.74 2jul h LYS 115 CO -0.17 -0.12 0.32 1.25 -3.45 0.00 0.00 179.45 177.28 2jul h LEU 116 N -0.19 0.39 -0.80 5.20 5.85 -0.51 0.27 115.31 125.53 2jul h LEU 116 Ca 0.01 0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 2jul h LEU 116 Cb 0.18 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2jul h LEU 116 CO -0.03 0.22 -0.14 0.40 -0.34 0.00 0.00 178.44 178.55 2jul h ILE 117 N 0.54 1.26 0.00 4.05 2.04 -0.30 -1.64 117.51 123.46 2jul h ILE 117 Ca 0.34 -1.20 -0.03 0.00 1.00 0.00 0.00 64.86 64.97 2jul h ILE 117 Cb 0.39 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2jul h ILE 117 CO -0.29 0.41 -0.12 0.22 0.00 0.00 0.00 178.15 178.37 2jul h TYR 118 N 0.68 0.00 0.01 1.37 3.20 0.87 -2.46 116.97 120.64 2jul h TYR 118 Ca 0.11 0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.74 2jul h TYR 118 Cb 0.62 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 2jul h TYR 118 CO 0.03 0.12 -1.24 0.77 -1.64 0.00 0.00 178.16 176.20 2jul h SER 119 N 0.00 0.03 0.83 -2.11 0.02 0.01 -3.12 113.55 109.21 2jul h SER 119 Ca -0.00 -0.04 -0.20 0.00 -0.84 0.00 0.00 61.79 60.71 2jul h SER 119 Cb 0.73 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 2jul h SER 119 CO 0.02 1.03 -0.92 1.56 -1.14 0.00 0.00 176.83 177.37 2jul h GLN 120 N 0.00 0.05 0.05 3.45 7.50 -1.15 -3.32 115.11 121.70 2jul h GLN 120 Ca -0.11 -0.07 -0.00 0.00 0.50 0.00 0.00 58.65 58.97 2jul h GLN 120 Cb 1.86 0.02 0.00 0.00 0.05 0.00 0.00 27.48 29.41 2jul h GLN 120 CO 0.12 0.93 -0.02 0.35 -1.50 0.00 0.00 178.83 178.71 2jul h PHE 121 N 0.02 -0.06 -2.58 2.96 3.04 -1.53 -3.45 116.94 115.34 2jul h PHE 121 Ca -0.02 -0.00 -0.52 0.00 3.98 0.00 0.00 57.97 61.40 2jul h PHE 121 Cb 1.61 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 40.12 2jul h PHE 121 CO 0.01 0.43 -0.41 -0.06 -2.02 0.00 0.00 178.31 176.27 2jul s PHE 122 N -4.10 3.48 1.14 0.41 0.40 -1.18 -5.09 117.98 113.04 2jul s PHE 122 Ca -0.15 0.17 -0.16 0.00 -0.60 0.00 0.00 56.93 56.18 2jul s PHE 122 Cb 0.01 -1.71 0.23 0.00 0.51 0.00 0.00 43.02 42.06 2jul s PHE 122 CO 0.64 0.44 0.48 -2.30 0.70 0.00 0.00 175.22 175.17 2jul n PRO 123 N -0.82 -2.93 -0.46 0.24 -0.01 -1.26 -4.70 135.00 125.06 2jul n PRO 123 Ca -0.07 -0.87 -0.29 0.00 -0.01 0.00 0.00 63.50 62.27 2jul n PRO 123 Cb 0.55 -1.62 0.27 0.00 -0.01 0.00 0.00 33.50 32.69 2jul n PRO 123 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 175.50 174.84 2jul s GLN 124 N -3.90 -1.55 0.00 -0.52 -0.21 -1.26 -4.93 119.66 107.29 2jul s GLN 124 Ca 0.46 0.69 0.00 0.00 0.02 0.00 0.00 55.36 56.52 2jul s GLN 124 Cb -0.08 -1.49 0.00 0.00 1.00 0.00 0.00 33.01 32.43 2jul s GLN 124 CO 0.41 -4.10 0.00 0.41 -2.12 0.00 0.00 175.29 169.89 2jul n GLY 125 N 1.08 0.83 0.00 3.09 0.00 -1.26 -4.52 105.19 104.40 2jul n GLY 125 Ca 0.04 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.01 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 2.04 0.00 0.00 1.61 9.92 -1.26 -4.79 116.55 124.07 2jul n ASP 126 Ca 0.00 0.39 0.00 0.00 -0.53 0.00 0.00 54.79 54.65 2jul n ASP 126 Cb 0.00 -0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 2jul n ASP 126 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jul n ALA 127 N -0.72 0.00 0.14 2.24 0.00 -1.26 -4.73 120.51 116.18 2jul n ALA 127 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2jul n ALA 127 Cb 0.00 -0.87 0.17 0.00 0.00 0.00 0.00 19.45 18.75 2jul n ALA 127 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2jul h THR 128 N 0.00 1.18 0.31 0.00 1.35 -1.98 -2.50 112.91 111.27 2jul h THR 128 Ca 0.00 -2.11 -0.02 0.00 -0.55 0.00 0.00 66.41 63.73 2jul h THR 128 Cb 0.00 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.64 2jul h THR 128 CO 0.00 0.56 -0.15 0.74 -0.25 0.00 0.00 175.52 176.42 2jul h THR 129 N 0.00 0.00 -0.26 6.82 2.02 -1.97 -2.51 112.91 117.01 2jul h THR 129 Ca -0.01 -0.26 0.08 0.00 0.77 0.00 0.00 66.41 66.99 2jul h THR 129 Cb 1.17 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 2jul h THR 129 CO 0.07 0.00 0.27 0.22 0.37 0.00 0.00 175.52 176.45 2jul h TYR 130 N -0.67 0.00 -0.41 3.16 3.20 -1.91 -0.17 116.97 120.17 2jul h TYR 130 Ca -0.04 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 2jul h TYR 130 Cb 0.32 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 2jul h TYR 130 CO 0.05 0.00 0.10 0.00 -1.64 0.00 0.00 178.16 176.67 2jul h ALA 131 N 1.70 0.54 -0.17 1.82 0.00 -1.37 0.24 119.26 122.03 2jul h ALA 131 Ca 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2jul h ALA 131 Cb 0.67 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2jul h ALA 131 CO -0.00 0.22 0.09 1.25 0.00 0.00 0.00 179.25 180.81 2jul h HIS 132 N 0.52 0.25 -0.50 0.00 -0.00 -0.57 -2.00 115.15 112.84 2jul h HIS 132 Ca 0.13 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.47 2jul h HIS 132 Cb 0.32 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 2jul h HIS 132 CO 0.02 0.26 0.25 0.74 -0.00 0.00 0.00 177.93 179.21 2jul h PHE 133 N 0.16 0.71 -0.85 5.26 0.04 -1.36 -1.73 116.94 119.18 2jul h PHE 133 Ca 0.06 -0.03 0.18 0.00 2.80 0.00 0.00 57.97 60.98 2jul h PHE 133 Cb 0.11 -0.22 -0.06 0.00 2.20 0.00 0.00 35.95 37.97 2jul h PHE 133 CO -0.03 0.55 0.56 -0.07 -0.60 0.00 0.00 178.31 178.72 2jul h LEU 134 N 0.67 0.43 -0.57 1.54 3.38 -0.23 0.24 115.31 120.76 2jul h LEU 134 Ca 0.17 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.03 2jul h LEU 134 Cb 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2jul h LEU 134 CO -0.02 0.20 -0.54 0.15 0.09 0.00 0.00 178.44 178.32 2jul h PHE 135 N 0.44 0.61 0.00 1.13 3.04 -0.58 -2.64 116.94 118.94 2jul h PHE 135 Ca 0.43 -0.21 0.00 0.00 3.98 0.00 0.00 57.97 62.17 2jul h PHE 135 Cb 1.00 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.39 2jul h PHE 135 CO -0.00 0.92 0.00 -0.97 -2.02 0.00 0.00 178.31 176.24 2jul h ASN 136 N 0.38 0.00 0.00 0.41 -1.24 -0.05 -2.40 115.58 112.68 2jul h ASN 136 Ca 0.01 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.97 2jul h ASN 136 Cb 1.06 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.11 2jul h ASN 136 CO 0.10 0.00 -0.25 0.00 -1.29 0.00 0.00 177.43 175.99 2jul h ALA 137 N 2.04 0.05 0.09 1.57 0.00 -0.98 -3.40 119.26 118.62 2jul h ALA 137 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2jul h ALA 137 Cb 0.46 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2jul h ALA 137 CO 0.00 0.14 -0.04 0.74 0.00 0.00 0.00 179.25 180.09 2jul h PHE 138 N -1.00 -0.12 -2.46 0.00 0.04 -1.44 -3.44 116.94 108.52 2jul h PHE 138 Ca -0.07 -0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.12 2jul h PHE 138 Cb 1.03 0.04 0.19 0.00 2.20 0.00 0.00 35.95 39.41 2jul h PHE 138 CO 0.23 -0.07 -0.90 -3.47 -0.60 0.00 0.00 178.31 173.50 2jul n ASP 139 N -2.42 -2.80 0.00 2.17 2.03 -0.91 -4.95 116.55 109.67 2jul n ASP 139 Ca -0.02 0.62 0.00 0.00 0.52 0.00 0.00 54.79 55.91 2jul n ASP 139 Cb 0.05 -0.99 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 2jul n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jul n ALA 140 N -1.81 0.00 -1.00 -1.67 0.00 -1.26 -4.82 120.51 109.95 2jul n ALA 140 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2jul n ALA 140 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2jul n ALA 140 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2jul n ASP 141 N -0.14 0.00 0.00 0.00 9.92 -1.26 -4.99 116.55 120.08 2jul n ASP 141 Ca 0.00 0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 2jul n ASP 141 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2jul n ASP 141 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jul n GLY 142 N 2.14 0.00 0.13 0.44 0.00 -1.26 -5.02 105.19 101.62 2jul n GLY 142 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2jul n GLY 142 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jul h ASN 143 N 0.00 -0.27 0.00 1.61 -0.73 -1.97 -3.48 115.58 110.74 2jul h ASN 143 Ca 0.00 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.18 2jul h ASN 143 Cb 0.00 0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.66 2jul h ASN 143 CO 0.00 -0.17 0.00 0.61 -0.37 0.00 0.00 177.43 177.50 2jul n GLY 144 N -0.69 -0.93 3.20 1.57 0.00 -1.26 -5.13 105.19 101.95 2jul n GLY 144 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.94 0.43 4.61 0.00 -1.26 -4.38 121.76 120.21 2jul s ALA 145 Ca 0.00 1.35 0.08 0.00 0.00 0.00 0.00 51.96 53.39 2jul s ALA 145 Cb 0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.06 2jul s ALA 145 CO 0.00 -0.50 0.40 0.96 0.00 0.00 0.00 175.76 176.62 2jul s ILE 146 N 2.00 2.61 0.00 0.00 -4.36 0.13 -4.93 121.20 116.64 2jul s ILE 146 Ca -0.05 -1.32 0.00 0.00 -0.26 0.00 0.00 60.65 59.02 2jul s ILE 146 Cb -0.11 -2.93 0.00 0.00 1.25 0.00 0.00 42.46 40.67 2jul s ILE 146 CO -0.12 0.00 0.00 1.41 0.24 0.00 0.00 174.94 176.47 2jul n HIS 147 N -1.59 0.00 -0.09 1.37 8.25 -1.26 -0.73 115.22 121.16 2jul n HIS 147 Ca 0.04 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.28 2jul n HIS 147 Cb 0.62 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.61 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 1.04 -0.32 4.41 7.35 -1.26 -3.58 117.46 125.11 2jul n PHE 148 Ca 0.00 0.41 0.11 0.00 -0.76 0.00 0.00 57.45 57.21 2jul n PHE 148 Cb 0.00 -1.11 0.29 0.00 0.35 0.00 0.00 39.48 39.01 2jul n PHE 148 CO 0.00 0.00 0.00 1.05 -0.76 0.00 0.00 176.76 177.05 2jul h GLU 149 N -0.85 0.56 -0.31 -4.13 -0.00 -2.00 0.56 114.58 108.42 2jul h GLU 149 Ca -0.37 -0.03 -0.07 0.00 -0.00 0.00 0.00 59.36 58.89 2jul h GLU 149 Cb 1.42 -0.13 -0.02 0.00 -0.00 0.00 0.00 28.75 30.02 2jul h GLU 149 CO -0.17 0.37 -0.11 -0.44 -0.00 0.00 0.00 179.01 178.66 2jul h ASP 150 N 0.58 0.51 0.35 3.06 3.32 -1.99 -1.70 116.42 120.55 2jul h ASP 150 Ca 0.54 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.40 2jul h ASP 150 Cb 0.89 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 2jul h ASP 150 CO -0.43 0.65 -0.28 0.15 -1.72 0.00 0.00 179.24 177.61 2jul h PHE 151 N 0.49 0.00 -0.15 4.55 3.57 0.00 -2.73 116.94 122.66 2jul h PHE 151 Ca 0.09 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 2jul h PHE 151 Cb 0.48 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 2jul h PHE 151 CO 0.02 0.28 -0.25 0.28 -2.23 0.00 0.00 178.31 176.41 2jul h VAL 152 N 0.00 1.36 -0.75 1.41 2.07 -0.20 -2.72 116.25 117.41 2jul h VAL 152 Ca -0.00 -1.49 0.10 0.00 0.82 0.00 0.00 66.70 66.12 2jul h VAL 152 Cb 0.53 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 32.19 2jul h VAL 152 CO 0.04 0.44 0.40 0.58 0.02 0.00 0.00 177.57 179.04 2jul h VAL 153 N 0.05 0.86 -0.06 2.57 2.07 -1.18 -1.65 116.25 118.91 2jul h VAL 153 Ca 0.01 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2jul h VAL 153 Cb 0.83 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2jul h VAL 153 CO 0.06 0.12 0.04 1.23 0.02 0.00 0.00 177.57 179.03 2jul h GLY 154 N 0.66 0.09 -0.38 2.17 0.00 -1.45 -1.43 103.07 102.72 2jul h GLY 154 Ca 0.37 -0.03 0.32 0.00 0.00 0.00 0.00 47.33 47.99 2jul h GLY 154 CO -0.26 0.03 0.77 -2.00 0.00 0.00 0.00 176.54 175.08 2jul h LEU 155 N 0.05 0.25 -0.42 3.11 7.12 -0.99 1.00 115.31 125.43 2jul h LEU 155 Ca 0.02 0.06 -0.18 0.00 0.13 0.00 0.00 57.88 57.91 2jul h LEU 155 Cb 0.03 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.17 2jul h LEU 155 CO -0.00 0.02 -0.78 -1.28 -0.13 0.00 0.00 178.44 176.26 2jul h SER 156 N 0.20 0.22 0.90 1.25 0.87 -0.82 0.96 113.55 117.13 2jul h SER 156 Ca 0.62 -0.16 -0.15 0.00 -1.23 0.00 0.00 61.79 60.87 2jul h SER 156 Cb 1.96 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.83 2jul h SER 156 CO -0.20 0.92 -0.70 0.40 -0.53 0.00 0.00 176.83 176.71 2jul h ILE 157 N 0.11 1.38 0.12 2.23 2.04 0.15 0.94 117.51 124.48 2jul h ILE 157 Ca -0.03 -2.51 -0.36 0.00 1.00 0.00 0.00 64.86 62.96 2jul h ILE 157 Cb 1.37 2.40 -0.02 0.00 -0.74 0.00 0.00 36.82 39.83 2jul h ILE 157 CO 0.12 0.69 -1.98 0.18 0.00 0.00 0.00 178.15 177.15 2jul n LEU 158 N -3.53 2.63 -0.09 1.44 4.32 0.02 -3.51 117.00 118.27 2jul n LEU 158 Ca -0.00 0.21 -0.16 0.00 -0.02 0.00 0.00 56.01 56.05 2jul n LEU 158 Cb 0.73 -1.12 -0.08 0.00 -1.62 0.00 0.00 43.42 41.33 2jul n LEU 158 CO 0.43 0.84 -0.46 0.25 -1.22 0.00 0.00 177.39 177.23 2jul h LEU 159 N 0.05 0.00 -3.48 2.23 6.46 -0.90 -3.37 115.31 116.30 2jul h LEU 159 Ca -0.42 -0.32 -0.39 0.00 -0.12 0.00 0.00 57.88 56.63 2jul h LEU 159 Cb 2.02 0.00 -0.19 0.00 -0.73 0.00 0.00 40.66 41.76 2jul h LEU 159 CO 0.08 1.22 0.50 0.54 -0.62 0.00 0.00 178.44 180.16 2jul n ARG 160 N -4.50 1.95 -5.02 1.25 1.74 0.26 -4.88 116.66 107.46 2jul n ARG 160 Ca -0.23 -2.00 -0.32 0.00 -0.77 0.00 0.00 57.85 54.53 2jul n ARG 160 Cb 0.53 -1.78 -0.14 0.00 -1.02 0.00 0.00 32.46 30.04 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 -0.43 1.44 0.00 -0.13 0.00 -0.83 -4.71 107.32 102.66 2jul s GLY 161 Ca 0.39 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 44.10 2jul s GLY 161 CO 0.03 -0.71 0.00 -1.30 0.00 0.00 0.00 173.10 171.11 2jul n THR 162 N 2.58 0.00 0.06 0.90 -2.24 -1.26 -4.85 114.28 109.46 2jul n THR 162 Ca -0.17 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.64 2jul n THR 162 Cb 0.52 -1.47 0.40 0.00 -2.10 0.00 0.00 70.33 67.69 2jul n THR 162 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2jul h VAL 163 N -0.30 1.14 -0.10 2.28 2.07 -2.00 -2.37 116.25 116.97 2jul h VAL 163 Ca 0.00 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 2jul h VAL 163 Cb 0.00 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2jul h VAL 163 CO 0.00 0.17 0.02 0.45 0.02 0.00 0.00 177.57 178.23 2jul h HIS 164 N 0.39 0.18 -0.60 1.57 3.86 -2.00 -2.36 115.15 116.18 2jul h HIS 164 Ca 0.09 -0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.30 2jul h HIS 164 Cb 0.17 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 2jul h HIS 164 CO 0.00 0.36 0.40 0.93 0.86 0.00 0.00 177.93 180.48 2jul h GLU 165 N -0.06 0.74 -0.27 2.45 4.39 -1.83 -1.87 114.58 118.13 2jul h GLU 165 Ca 0.03 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2jul h GLU 165 Cb 0.28 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2jul h GLU 165 CO 0.00 0.49 0.12 0.87 -1.16 0.00 0.00 179.01 179.33 2jul h LYS 166 N 0.76 0.40 -0.24 2.33 1.79 -1.18 0.23 116.57 120.66 2jul h LYS 166 Ca 0.23 -0.07 -0.03 0.00 -2.18 0.00 0.00 60.65 58.60 2jul h LYS 166 Cb 0.00 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 2jul h LYS 166 CO -0.06 0.41 -0.00 -0.07 -1.08 0.00 0.00 179.45 178.65 2jul h LEU 167 N 0.29 0.33 -0.02 2.94 3.38 -0.89 0.46 115.31 121.81 2jul h LEU 167 Ca 0.09 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2jul h LEU 167 Cb 0.15 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2jul h LEU 167 CO -0.01 0.39 -0.21 0.50 0.09 0.00 0.00 178.44 179.21 2jul h LYS 168 N 0.35 0.17 0.00 1.13 3.11 -0.89 -1.37 116.57 119.07 2jul h LYS 168 Ca 0.08 -0.16 -0.07 0.00 -2.81 0.00 0.00 60.65 57.69 2jul h LYS 168 Cb 0.24 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.50 2jul h LYS 168 CO 0.01 0.86 -0.36 2.35 -2.81 0.00 0.00 179.45 179.50 2jul h TRP 169 N -0.47 0.00 -0.08 1.91 7.01 -0.32 -2.00 115.95 122.00 2jul h TRP 169 Ca -0.02 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 60.91 2jul h TRP 169 Cb 0.92 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.99 2jul h TRP 169 CO 0.17 0.36 -0.21 0.00 -2.79 0.00 0.00 178.44 175.96 2jul h ALA 170 N 1.64 0.13 0.00 2.65 0.00 -0.09 -1.51 119.26 122.09 2jul h ALA 170 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2jul h ALA 170 Cb 0.66 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2jul h ALA 170 CO 0.05 0.09 -0.08 0.35 0.00 0.00 0.00 179.25 179.66 2jul h PHE 171 N -0.19 0.00 0.01 0.00 3.04 -1.07 -1.99 116.94 116.74 2jul h PHE 171 Ca -0.00 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 61.85 2jul h PHE 171 Cb 0.81 0.00 0.01 0.00 2.56 0.00 0.00 35.95 39.33 2jul h PHE 171 CO 0.12 0.08 -0.40 -0.97 -2.02 0.00 0.00 178.31 175.11 2jul h ASN 172 N 0.00 0.33 -0.94 0.41 -0.00 -1.22 -2.68 115.58 111.48 2jul h ASN 172 Ca -0.00 -0.80 0.05 0.00 -0.00 0.00 0.00 56.30 55.55 2jul h ASN 172 Cb 0.17 -0.10 -0.06 0.00 -0.00 0.00 0.00 38.32 38.33 2jul h ASN 172 CO 0.01 1.09 0.61 0.25 -0.00 0.00 0.00 177.43 179.40 2jul h LEU 173 N -0.39 0.99 0.59 0.34 5.85 -0.82 -2.91 115.31 118.96 2jul h LEU 173 Ca -0.05 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2jul h LEU 173 Cb 1.17 -0.22 0.01 0.00 0.37 0.00 0.00 40.66 41.99 2jul h LEU 173 CO 0.08 0.66 -0.28 1.88 -0.34 0.00 0.00 178.44 180.43 2jul h TYR 174 N 1.13 -0.73 -0.85 1.25 -1.99 -1.43 -3.41 116.97 110.94 2jul h TYR 174 Ca 0.39 -0.02 -0.62 0.00 2.00 0.00 0.00 58.73 60.48 2jul h TYR 174 Cb 0.10 0.24 -0.03 0.00 2.00 0.00 0.00 36.73 39.04 2jul h TYR 174 CO -0.00 -0.40 1.50 -3.47 -0.00 0.00 0.00 178.16 175.79 2jul n ASP 175 N -5.34 1.69 -0.02 3.88 2.03 -1.01 -4.80 116.55 112.98 2jul n ASP 175 Ca -0.11 0.27 -0.12 0.00 0.52 0.00 0.00 54.79 55.35 2jul n ASP 175 Cb 0.34 -1.21 -0.07 0.00 -0.72 0.00 0.00 41.12 39.47 2jul n ASP 175 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2jul h ILE 176 N 7.32 1.20 -3.14 5.18 2.04 -1.83 -3.45 117.51 124.84 2jul h ILE 176 Ca -0.21 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2jul h ILE 176 Cb 1.32 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 38.85 2jul h ILE 176 CO 1.11 0.18 0.00 -0.46 0.00 0.00 0.00 178.15 178.98 2jul n ASN 177 N -4.87 0.00 -2.14 1.72 0.23 -1.26 -5.00 115.26 103.93 2jul n ASN 177 Ca -0.06 -0.82 -0.28 0.00 -0.53 0.00 0.00 54.58 52.89 2jul n ASN 177 Cb 0.16 0.00 0.10 0.00 -2.08 0.00 0.00 39.78 37.96 2jul n ASN 177 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 2jul n LYS 178 N -0.82 2.68 0.10 -3.83 2.85 -1.26 -4.55 118.16 113.34 2jul n LYS 178 Ca 0.00 -3.38 -0.22 0.00 -1.05 0.00 0.00 58.31 53.66 2jul n LYS 178 Cb 0.00 -2.22 -0.15 0.00 -0.65 0.00 0.00 35.03 32.01 2jul n LYS 178 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2jul h ASP 179 N 1.75 0.67 0.00 -5.58 3.32 -1.94 -3.47 116.42 111.16 2jul h ASP 179 Ca 0.54 -0.84 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2jul h ASP 179 Cb 1.39 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2jul h ASP 179 CO 1.25 1.68 0.00 0.61 -1.72 0.00 0.00 179.24 181.06 2jul n GLY 180 N 1.76 0.78 3.27 2.75 0.00 -1.26 -5.06 105.19 107.42 2jul n GLY 180 Ca -0.19 -0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 2jul n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jul s ILE 182 N -1.13 3.00 0.03 0.00 1.01 0.79 -4.88 121.20 120.02 2jul s ILE 182 Ca 0.06 -2.14 -0.19 0.00 0.00 0.00 0.00 60.65 58.37 2jul s ILE 182 Cb -0.10 -2.59 0.04 0.00 0.01 0.00 0.00 42.46 39.82 2jul s ILE 182 CO 0.04 -0.39 0.44 -0.89 0.00 0.00 0.00 174.94 174.14 2jul s THR 183 N -2.41 0.05 0.43 2.92 2.01 -1.26 0.37 115.64 117.75 2jul s THR 183 Ca 0.31 -0.39 0.26 0.00 0.31 0.00 0.00 61.69 62.18 2jul s THR 183 Cb -0.06 -0.91 0.46 0.00 0.01 0.00 0.00 72.50 72.00 2jul s THR 183 CO 0.18 -0.22 1.68 0.50 -0.69 0.00 0.00 174.62 176.07 2jul h LYS 184 N 3.10 0.18 -0.13 4.92 3.64 -1.99 0.41 116.57 126.71 2jul h LYS 184 Ca -0.31 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.02 2jul h LYS 184 Cb 1.20 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2jul h LYS 184 CO 0.42 0.12 -0.09 0.93 -2.27 0.00 0.00 179.45 178.56 2jul h GLU 185 N 0.19 0.29 -0.41 1.90 4.39 -2.00 -2.31 114.58 116.63 2jul h GLU 185 Ca 0.73 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 60.30 2jul h GLU 185 Cb 2.19 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.82 2jul h GLU 185 CO -0.35 0.66 0.27 1.49 -1.16 0.00 0.00 179.01 179.91 2jul h GLU 186 N -0.08 0.51 -0.17 2.33 4.81 -0.64 -1.31 114.58 120.04 2jul h GLU 186 Ca 0.02 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 2jul h GLU 186 Cb 0.59 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 2jul h GLU 186 CO 0.02 0.34 -0.46 0.52 -0.73 0.00 0.00 179.01 178.70 2jul h MET 187 N 0.53 0.42 -0.48 1.92 2.86 -0.97 -2.84 114.93 116.38 2jul h MET 187 Ca 0.15 -0.23 -0.07 0.00 -2.06 0.00 0.00 59.70 57.49 2jul h MET 187 Cb -0.03 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 2jul h MET 187 CO -0.03 0.80 0.00 1.25 1.06 0.00 0.00 176.91 179.99 2jul h LEU 188 N 0.34 0.75 -0.27 1.22 7.12 -0.68 -1.48 115.31 122.32 2jul h LEU 188 Ca 0.02 -0.18 -0.04 0.00 0.13 0.00 0.00 57.88 57.81 2jul h LEU 188 Cb 0.95 -0.20 -0.01 0.00 -0.53 0.00 0.00 40.66 40.87 2jul h LEU 188 CO 0.08 0.82 0.02 0.00 -0.13 0.00 0.00 178.44 179.24 2jul h ALA 189 N 1.26 0.36 -0.68 1.25 0.00 -1.28 -0.00 119.26 120.17 2jul h ALA 189 Ca 0.14 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2jul h ALA 189 Cb 0.45 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2jul h ALA 189 CO 0.02 0.07 0.29 0.82 0.00 0.00 0.00 179.25 180.45 2jul h ILE 190 N 0.26 1.24 -0.56 0.00 1.08 -1.32 -2.11 117.51 116.10 2jul h ILE 190 Ca 0.08 -0.73 -0.11 0.00 -0.39 0.00 0.00 64.86 63.71 2jul h ILE 190 Cb 0.37 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 2jul h ILE 190 CO 0.01 0.29 -0.07 -0.03 -0.69 0.00 0.00 178.15 177.66 2jul h MET 191 N 0.97 1.02 -0.08 2.37 4.05 -1.14 -2.54 114.93 119.57 2jul h MET 191 Ca 0.23 -0.35 -0.03 0.00 -0.28 0.00 0.00 59.70 59.27 2jul h MET 191 Cb 0.18 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 30.90 2jul h MET 191 CO -0.02 1.04 -0.07 -0.22 0.23 0.00 0.00 176.91 177.86 2jul h LYS 192 N 0.92 0.12 -0.07 0.39 3.64 -0.68 -0.93 116.57 119.96 2jul h LYS 192 Ca 0.15 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2jul h LYS 192 Cb 0.63 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2jul h LYS 192 CO 0.04 0.21 -0.02 1.03 -2.27 0.00 0.00 179.45 178.44 2jul h SER 193 N 0.12 0.14 -0.56 4.20 0.87 -0.97 -0.58 113.55 116.77 2jul h SER 193 Ca 0.03 -0.38 -0.05 0.00 -1.23 0.00 0.00 61.79 60.16 2jul h SER 193 Cb 0.21 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 2jul h SER 193 CO 0.01 0.49 0.16 0.40 -0.53 0.00 0.00 176.83 177.36 2jul h ILE 194 N -0.21 1.24 -0.25 2.23 2.04 -1.23 0.62 117.51 121.95 2jul h ILE 194 Ca 0.02 -0.84 -0.05 0.00 1.00 0.00 0.00 64.86 64.99 2jul h ILE 194 Cb 0.43 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2jul h ILE 194 CO 0.01 0.31 -0.08 1.88 0.00 0.00 0.00 178.15 180.27 2jul h TYR 195 N 0.79 0.42 0.00 1.37 -1.99 -1.15 -1.61 116.97 114.80 2jul h TYR 195 Ca 0.18 -0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.86 2jul h TYR 195 Cb 0.31 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 38.92 2jul h TYR 195 CO 0.02 0.48 -0.15 0.22 -0.00 0.00 0.00 178.16 178.73 2jul h ASP 196 N 0.38 0.00 0.57 3.88 3.58 -0.64 -3.24 116.42 120.95 2jul h ASP 196 Ca 0.08 -0.02 -0.23 0.00 0.42 0.00 0.00 57.03 57.28 2jul h ASP 196 Cb 0.38 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.43 2jul h ASP 196 CO 0.02 0.01 -1.01 0.24 -2.88 0.00 0.00 179.24 175.62 2jul h MET 197 N 0.00 0.25 -5.06 0.28 2.86 0.08 -3.43 114.93 109.91 2jul h MET 197 Ca 0.00 -0.33 -0.36 0.00 -2.06 0.00 0.00 59.70 56.95 2jul h MET 197 Cb 0.86 0.11 -0.09 0.00 0.06 0.00 0.00 31.60 32.54 2jul h MET 197 CO 0.00 1.07 1.74 -1.33 1.06 0.00 0.00 176.91 179.45 2jul n MET 198 N -3.62 0.11 -1.52 1.72 2.81 -0.95 -4.71 117.12 110.95 2jul n MET 198 Ca -0.05 -0.09 -0.32 0.00 -1.81 0.00 0.00 57.70 55.42 2jul n MET 198 Cb 0.89 -1.53 0.02 0.00 -0.71 0.00 0.00 33.22 31.89 2jul n MET 198 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jul n GLY 199 N 5.92 5.11 1.40 3.03 0.00 -1.26 -4.22 105.19 115.17 2jul n GLY 199 Ca 0.64 -2.09 0.04 0.00 0.00 0.00 0.00 46.02 44.61 2jul n GLY 199 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2jul n ARG 200 N -0.15 0.09 -3.47 1.61 1.85 -1.26 -4.77 116.66 110.57 2jul n ARG 200 Ca 0.51 -2.03 -0.17 0.00 -1.00 0.00 0.00 57.85 55.16 2jul n ARG 200 Cb 0.47 -0.11 -0.12 0.00 -1.05 0.00 0.00 32.46 31.64 2jul n ARG 200 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2jul s HIS 201 N -0.18 -0.34 -0.00 2.89 5.04 -1.26 -5.06 115.29 116.38 2jul s HIS 201 Ca 0.33 0.19 -0.03 0.00 -1.54 0.00 0.00 55.06 54.01 2jul s HIS 201 Cb 0.37 -0.35 -0.02 0.00 0.04 0.00 0.00 32.58 32.62 2jul s HIS 201 CO -0.16 -0.67 0.58 1.15 -2.34 0.00 0.00 174.74 173.31 2jul h THR 202 N 6.29 0.00 0.00 0.89 2.02 -1.95 -3.48 112.91 116.69 2jul h THR 202 Ca -0.17 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2jul h THR 202 Cb 1.14 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2jul h THR 202 CO 0.29 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.18 2jul n TYR 203 N -2.50 0.00 -0.25 3.16 9.36 -1.26 -5.16 117.16 120.51 2jul n TYR 203 Ca -0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.21 2jul n TYR 203 Cb 0.04 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.75 2jul n TYR 203 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 2jul n PRO 204 N 0.00 -1.21 0.00 2.98 -0.02 -1.26 -5.01 135.00 130.48 2jul n PRO 204 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2jul n PRO 204 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 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 -2.53 0.00 -2.97 4.25 -5.35 -1.26 -4.53 119.36 106.97 2jul n ILE 205 Ca 0.00 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.36 2jul n ILE 205 Cb 0.00 -0.03 0.05 0.00 -1.74 0.00 0.00 39.64 37.91 2jul n ILE 205 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2jul n LEU 206 N 0.00 -2.94 0.00 7.28 7.94 -1.26 -5.03 117.00 122.99 2jul n LEU 206 Ca 0.00 -0.32 0.00 0.00 -1.11 0.00 0.00 56.01 54.58 2jul n LEU 206 Cb 0.00 -1.94 0.00 0.00 0.53 0.00 0.00 43.42 42.01 2jul n LEU 206 CO 0.00 0.30 0.00 0.54 -1.11 0.00 0.00 177.39 177.12 2jul n ARG 207 N -2.89 0.00 -3.66 1.96 1.74 -1.26 -5.05 116.66 107.49 2jul n ARG 207 Ca -0.07 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.98 2jul n ARG 207 Cb 0.56 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.99 2jul n ARG 207 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2jul s GLU 208 N 3.16 0.82 0.00 5.56 1.03 -1.26 -5.17 118.70 122.84 2jul s GLU 208 Ca 0.00 -0.43 0.00 0.00 0.03 0.00 0.00 54.97 54.57 2jul s GLU 208 Cb 0.00 0.30 0.00 0.00 -0.80 0.00 0.00 34.13 33.63 2jul s GLU 208 CO 0.00 -0.37 0.00 -0.40 -1.33 0.00 0.00 175.26 173.16 2jul n ASP 209 N -0.41 0.00 -4.88 0.83 5.75 -1.26 -5.02 116.55 111.56 2jul n ASP 209 Ca -0.07 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.37 2jul n ASP 209 Cb 0.61 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.65 2jul n ASP 209 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jul s ALA 210 N -3.42 3.75 0.04 2.12 0.00 -1.26 -5.01 121.76 117.97 2jul s ALA 210 Ca 0.00 -0.44 -0.25 0.00 0.00 0.00 0.00 51.96 51.27 2jul s ALA 210 Cb 0.00 -2.22 -0.17 0.00 0.00 0.00 0.00 23.12 20.73 2jul s ALA 210 CO 0.00 0.60 1.47 -1.00 0.00 0.00 0.00 175.76 176.82 2jul h PRO 211 N 3.56 -0.22 0.00 0.00 0.13 -1.96 -2.76 132.00 130.75 2jul h PRO 211 Ca -0.49 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2jul h PRO 211 Cb 1.19 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2jul h PRO 211 CO 0.68 0.03 0.68 1.37 -0.23 0.00 0.00 178.00 180.52 2jul h LEU 212 N -0.44 0.00 0.35 1.56 8.10 -1.95 -0.85 115.31 122.08 2jul h LEU 212 Ca -0.02 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.95 2jul h LEU 212 Cb 0.34 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.57 2jul h LEU 212 CO 0.04 0.00 -0.17 -0.08 -4.11 0.00 0.00 178.44 174.12 2jul h GLU 213 N 0.00 -0.45 -0.89 0.17 4.22 -1.91 -1.58 114.58 114.13 2jul h GLU 213 Ca 0.00 0.03 0.07 0.00 0.08 0.00 0.00 59.36 59.54 2jul h GLU 213 Cb 1.36 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.64 2jul h GLU 213 CO 0.00 -0.30 0.55 1.25 -2.18 0.00 0.00 179.01 178.33 2jul h HIS 214 N -1.06 1.02 -0.88 0.92 2.76 -1.30 -1.36 115.15 115.26 2jul h HIS 214 Ca -0.05 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.13 2jul h HIS 214 Cb 0.36 -0.33 -0.04 0.00 1.55 0.00 0.00 27.41 28.95 2jul h HIS 214 CO 0.01 0.51 0.45 0.28 -1.30 0.00 0.00 177.93 177.87 2jul h VAL 215 N 1.00 1.26 -0.87 5.26 2.07 -1.56 -2.34 116.25 121.07 2jul h VAL 215 Ca 0.39 -0.69 0.06 0.00 0.82 0.00 0.00 66.70 67.28 2jul h VAL 215 Cb 0.20 0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.02 2jul h VAL 215 CO -0.18 0.30 0.54 -0.33 0.02 0.00 0.00 177.57 177.92 2jul h GLU 216 N 1.24 0.96 0.02 1.57 5.08 -0.20 -0.15 114.58 123.10 2jul h GLU 216 Ca 0.30 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2jul h GLU 216 Cb 0.08 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2jul h GLU 216 CO -0.04 0.63 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.50 2jul h ARG 217 N 0.99 -0.02 -0.70 2.33 1.12 -1.08 0.18 114.38 117.19 2jul h ARG 217 Ca 0.38 0.00 0.06 0.00 -1.11 0.00 0.00 59.98 59.31 2jul h ARG 217 Cb 0.17 0.01 -0.06 0.00 -0.01 0.00 0.00 29.97 30.08 2jul h ARG 217 CO -0.17 0.07 0.39 0.35 -3.11 0.00 0.00 179.97 177.50 2jul h PHE 218 N -0.11 0.72 -0.57 2.20 3.04 -1.06 -0.10 116.94 121.06 2jul h PHE 218 Ca -0.00 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.90 2jul h PHE 218 Cb 0.10 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.37 2jul h PHE 218 CO -0.05 0.34 0.08 0.35 -2.02 0.00 0.00 178.31 177.01 2jul h PHE 219 N 0.71 1.00 -0.74 0.41 3.57 -0.72 0.11 116.94 121.28 2jul h PHE 219 Ca 0.31 -0.14 0.02 0.00 3.53 0.00 0.00 57.97 61.69 2jul h PHE 219 Cb 0.20 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2jul h PHE 219 CO -0.07 0.88 0.48 0.37 -2.23 0.00 0.00 178.31 177.74 2jul h GLN 220 N 0.84 0.92 -0.32 1.11 4.15 0.32 -1.55 115.11 120.57 2jul h GLN 220 Ca 0.17 -0.06 -0.11 0.00 0.77 0.00 0.00 58.65 59.42 2jul h GLN 220 Cb 0.43 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2jul h GLN 220 CO 0.01 0.61 -0.27 0.87 -1.93 0.00 0.00 178.83 178.12 2jul h LYS 221 N 0.95 0.66 0.00 1.69 1.79 -0.74 -3.45 116.57 117.46 2jul h LYS 221 Ca 0.29 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2jul h LYS 221 Cb -0.03 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2jul h LYS 221 CO -0.09 0.86 0.00 -1.33 -1.08 0.00 0.00 179.45 177.81 2jul n MET 222 N -4.09 2.54 0.00 3.15 2.81 -0.00 -4.95 117.12 116.57 2jul n MET 222 Ca -0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2jul n MET 222 Cb 0.45 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.96 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 0.00 -2.92 7.83 2.03 -1.18 -4.89 116.55 117.42 2jul n ASP 223 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 2jul n ASP 223 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 2jul n ASP 223 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2jul n ARG 224 N 14.00 -2.33 -3.60 -0.67 0.00 -1.26 -5.00 116.66 117.80 2jul n ARG 224 Ca 0.00 2.00 0.01 0.00 -0.00 0.00 0.00 57.85 59.86 2jul n ARG 224 Cb 0.00 -2.79 -0.01 0.00 0.00 0.00 0.00 32.46 29.66 2jul n ARG 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2jul s ASN 225 N -0.70 -0.04 0.57 6.15 2.20 -1.26 -4.97 114.94 116.89 2jul s ASN 225 Ca -0.08 -0.04 0.37 0.00 -0.94 0.00 0.00 52.86 52.17 2jul s ASN 225 Cb 0.01 0.07 1.45 0.00 -2.00 0.00 0.00 41.25 40.77 2jul s ASN 225 CO 0.35 -0.12 1.64 1.56 -2.94 0.00 0.00 177.10 177.59 2jul h GLN 226 N 2.00 0.00 0.00 3.55 1.08 -2.00 -3.31 115.11 116.43 2jul h GLN 226 Ca -0.22 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 2jul h GLN 226 Cb 1.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 2jul h GLN 226 CO 0.26 0.00 0.00 -0.40 -0.95 0.00 0.00 178.83 177.74 2jul n ASP 227 N -3.82 0.00 0.00 1.46 5.75 -1.26 -5.07 116.55 113.61 2jul n ASP 227 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.05 2jul n ASP 227 Cb 1.42 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.51 2jul n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jul n GLY 228 N 4.24 0.18 3.87 6.12 0.00 -1.25 -5.00 105.19 113.36 2jul n GLY 228 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 4.76 -0.20 1.61 -7.23 -1.26 -4.63 120.40 113.46 2jul s VAL 229 Ca 0.00 0.66 -0.09 0.00 -1.81 0.00 0.00 61.98 60.74 2jul s VAL 229 Cb 0.00 -3.76 -0.05 0.00 0.56 0.00 0.00 36.38 33.13 2jul s VAL 229 CO 0.00 -0.64 0.10 0.54 -0.31 0.00 0.00 175.10 174.80 2jul s VAL 230 N -2.52 5.11 0.29 1.32 0.11 0.16 -4.88 120.40 120.00 2jul s VAL 230 Ca 0.52 0.08 0.11 0.00 -2.93 0.00 0.00 61.98 59.76 2jul s VAL 230 Cb -0.10 -3.33 -0.05 0.00 -1.53 0.00 0.00 36.38 31.37 2jul s VAL 230 CO 0.35 0.44 -0.12 0.42 -3.33 0.00 0.00 175.10 172.86 2jul s THR 231 N 0.45 2.70 0.58 5.04 -4.23 -1.26 0.28 115.64 119.20 2jul s THR 231 Ca 0.06 -2.23 0.36 0.00 -1.18 0.00 0.00 61.69 58.70 2jul s THR 231 Cb -0.12 -2.51 0.53 0.00 1.34 0.00 0.00 72.50 71.74 2jul s THR 231 CO -0.00 -0.35 1.39 -0.38 -0.54 0.00 0.00 174.62 174.74 2jul n ILE 232 N -0.74 0.00 0.20 2.99 5.41 -1.24 0.13 119.36 126.11 2jul n ILE 232 Ca -0.05 1.34 -0.09 0.00 1.00 0.00 0.00 62.75 64.96 2jul n ILE 232 Cb 0.60 -2.33 -0.04 0.00 -0.71 0.00 0.00 39.64 37.16 2jul n ILE 232 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2jul h ASP 233 N 0.00 -0.48 -0.74 4.38 5.19 -1.93 -0.25 116.42 122.59 2jul h ASP 233 Ca 0.68 0.02 0.21 0.00 -0.62 0.00 0.00 57.03 57.31 2jul h ASP 233 Cb 3.27 0.12 -0.03 0.00 0.18 0.00 0.00 39.33 42.88 2jul h ASP 233 CO -0.01 -0.10 0.53 -0.33 -3.12 0.00 0.00 179.24 176.21 2jul h GLU 234 N -1.04 0.02 0.49 3.56 5.08 -0.69 0.75 114.58 122.74 2jul h GLU 234 Ca -0.06 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2jul h GLU 234 Cb 0.43 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2jul h GLU 234 CO 0.09 0.01 -0.23 0.35 -1.00 0.00 0.00 179.01 178.23 2jul h PHE 235 N 0.02 -0.61 0.00 4.33 3.57 -1.10 0.15 116.94 123.31 2jul h PHE 235 Ca 0.35 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.79 2jul h PHE 235 Cb 1.38 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 40.31 2jul h PHE 235 CO -0.00 -0.38 -0.21 1.25 -2.23 0.00 0.00 178.31 176.74 2jul h LEU 236 N -1.16 0.00 -0.09 0.59 5.85 -0.27 0.34 115.31 120.57 2jul h LEU 236 Ca -0.07 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.43 2jul h LEU 236 Cb 0.50 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2jul h LEU 236 CO 0.11 0.21 -1.01 -0.33 -0.34 0.00 0.00 178.44 177.08 2jul h GLU 237 N 0.00 0.15 0.00 1.25 5.08 0.45 -2.38 114.58 119.14 2jul h GLU 237 Ca -0.00 -0.21 -0.16 0.00 -1.00 0.00 0.00 59.36 57.99 2jul h GLU 237 Cb 0.38 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2jul h GLU 237 CO 0.03 1.03 -1.10 1.15 -1.00 0.00 0.00 179.01 179.12 2jul h THR 238 N 0.06 0.73 0.00 1.13 2.02 -0.18 -2.68 112.91 113.99 2jul h THR 238 Ca -0.06 -2.22 -0.20 0.00 0.77 0.00 0.00 66.41 64.70 2jul h THR 238 Cb 1.71 2.24 -0.03 0.00 -1.74 0.00 0.00 68.15 70.33 2jul h THR 238 CO 0.15 0.42 -1.03 0.00 0.37 0.00 0.00 175.52 175.43 2jul h GLN 240 N 0.00 0.34 0.00 0.00 1.08 -1.53 -3.31 115.11 111.68 2jul h GLN 240 Ca -0.05 -0.57 0.00 0.00 -1.45 0.00 0.00 58.65 56.58 2jul h GLN 240 Cb 1.74 0.21 0.00 0.00 -0.05 0.00 0.00 27.48 29.39 2jul h GLN 240 CO 0.11 1.27 0.00 1.63 -0.95 0.00 0.00 178.83 180.90 2jul n LYS 241 N -3.76 0.00 -0.54 1.46 5.02 -1.01 -3.78 118.16 115.55 2jul n LYS 241 Ca -0.24 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 55.95 2jul n LYS 241 Cb 0.99 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.94 2jul n LYS 241 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2jul n ASP 242 N 0.00 3.09 -4.52 4.39 5.75 -1.25 -4.83 116.55 119.19 2jul n ASP 242 Ca 0.00 -2.07 -0.23 0.00 -0.01 0.00 0.00 54.79 52.48 2jul n ASP 242 Cb 0.00 -0.79 -0.18 0.00 -1.03 0.00 0.00 41.12 39.12 2jul n ASP 242 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 2jul n GLU 243 N 3.19 0.17 0.00 0.11 2.13 -1.25 -3.90 120.64 121.08 2jul n GLU 243 Ca 0.26 -0.18 0.00 0.00 0.66 0.00 0.00 57.16 57.90 2jul n GLU 243 Cb 0.36 -1.75 0.00 0.00 0.27 0.00 0.00 31.44 30.32 2jul n GLU 243 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2jul n ASN 244 N 9.46 0.00 -0.06 4.31 3.02 -1.26 -4.83 115.26 125.90 2jul n ASN 244 Ca 0.62 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 55.02 2jul n ASN 244 Cb 0.21 0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 39.70 2jul n ASN 244 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2jul h ILE 245 N 0.00 1.33 -0.08 2.41 6.09 -1.91 -2.97 117.51 122.37 2jul h ILE 245 Ca 0.00 -1.64 -0.06 0.00 -1.37 0.00 0.00 64.86 61.79 2jul h ILE 245 Cb 0.00 1.87 -0.01 0.00 0.47 0.00 0.00 36.82 39.15 2jul h ILE 245 CO 0.00 0.51 -0.22 0.24 -3.07 0.00 0.00 178.15 175.60 2jul h MET 246 N 0.30 0.14 -0.50 2.19 2.86 -1.88 -1.36 114.93 116.68 2jul h MET 246 Ca 0.00 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.66 2jul h MET 246 Cb 1.01 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.63 2jul h MET 246 CO 0.09 0.36 0.33 -0.91 1.06 0.00 0.00 176.91 177.84 2jul h ASN 247 N 0.13 0.42 -0.16 1.22 -0.26 -1.84 -0.95 115.58 114.13 2jul h ASN 247 Ca 0.02 -0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 2jul h ASN 247 Cb 0.47 -0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 37.64 2jul h ASN 247 CO 0.03 0.28 -0.05 -1.28 -1.06 0.00 0.00 177.43 175.35 2jul h SER 248 N 0.48 0.33 -0.89 5.81 0.87 -1.19 -2.04 113.55 116.92 2jul h SER 248 Ca 0.21 -0.38 0.16 0.00 -1.23 0.00 0.00 61.79 60.55 2jul h SER 248 Cb 0.23 -0.09 -0.10 0.00 -0.44 0.00 0.00 62.40 62.00 2jul h SER 248 CO -0.05 0.63 0.47 -0.03 -0.53 0.00 0.00 176.83 177.32 2jul h MET 249 N 0.02 0.62 -0.63 2.24 1.85 -1.00 0.22 114.93 118.25 2jul h MET 249 Ca 0.04 -0.04 -0.04 0.00 -0.61 0.00 0.00 59.70 59.05 2jul h MET 249 Cb 0.50 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 32.36 2jul h MET 249 CO 0.02 0.41 0.22 0.37 -0.40 0.00 0.00 176.91 177.53 2jul h GLN 250 N 0.64 0.96 -0.48 0.39 -0.00 -1.13 -1.95 115.11 113.55 2jul h GLN 250 Ca 0.49 -0.19 -0.03 0.00 -0.00 0.00 0.00 58.65 58.92 2jul h GLN 250 Cb 0.73 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 28.04 2jul h GLN 250 CO -0.38 0.83 0.18 1.25 0.00 0.00 0.00 178.83 180.71 2jul h LEU 251 N 0.89 0.63 -0.67 -2.39 5.85 0.04 -2.10 115.31 117.56 2jul h LEU 251 Ca 0.21 -0.08 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 2jul h LEU 251 Cb 0.26 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2jul h LEU 251 CO -0.01 0.58 0.07 0.15 -0.34 0.00 0.00 178.44 178.89 2jul h PHE 252 N 0.68 1.18 -0.88 1.25 3.57 -0.21 -2.74 116.94 119.79 2jul h PHE 252 Ca 0.16 -0.18 0.03 0.00 3.53 0.00 0.00 57.97 61.51 2jul h PHE 252 Cb 0.16 -0.32 -0.05 0.00 2.79 0.00 0.00 35.95 38.53 2jul h PHE 252 CO 0.01 1.00 0.57 0.93 -2.23 0.00 0.00 178.31 178.59 2jul h GLU 253 N 1.02 1.10 -6.11 1.11 4.39 -0.69 -3.34 114.58 112.06 2jul h GLU 253 Ca 0.19 -0.07 -0.57 0.00 0.34 0.00 0.00 59.36 59.25 2jul h GLU 253 Cb 0.48 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2jul h GLU 253 CO 0.02 0.73 1.39 1.21 -1.16 0.00 0.00 179.01 181.20 2jul s ASN 254 N -5.93 5.76 -0.48 1.42 2.47 -1.03 -3.51 114.94 113.63 2jul s ASN 254 Ca -0.13 1.96 -0.22 0.00 0.42 0.00 0.00 52.86 54.89 2jul s ASN 254 Cb 0.17 -2.52 0.03 0.00 -1.45 0.00 0.00 41.25 37.48 2jul s ASN 254 CO 0.80 -1.71 0.63 0.52 -3.72 0.00 0.00 177.10 173.62 2jul n VAL 255 N 7.19 -8.11 0.00 -5.21 0.31 -1.26 -4.99 118.33 106.26 2jul n VAL 255 Ca 0.26 0.47 0.00 0.00 -0.01 0.00 0.00 64.34 65.06 2jul n VAL 255 Cb 0.44 -5.73 0.00 0.00 -0.91 0.00 0.00 33.84 27.64 2jul n VAL 255 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51