#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 0.33 -0.21 -0.52 -0.58 -1.26 -3.69 120.64 114.71 2jul n GLU 77 Ca 0.00 0.00 0.26 0.00 -0.42 0.00 0.00 57.16 57.00 2jul n GLU 77 Cb 0.00 -1.10 0.66 0.00 -0.57 0.00 0.00 31.44 30.42 2jul n GLU 77 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2jul h GLY 78 N 2.19 0.30 0.65 0.62 0.00 -2.06 -1.97 103.07 102.81 2jul h GLY 78 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 2jul h GLY 78 CO 0.00 -0.01 -0.31 -2.00 0.00 0.00 0.00 176.54 174.21 2jul h LEU 79 N 0.13 -0.74 -0.82 3.11 5.85 -2.01 -2.28 115.31 118.55 2jul h LEU 79 Ca 0.45 0.03 0.20 0.00 0.84 0.00 0.00 57.88 59.40 2jul h LEU 79 Cb 1.57 0.19 -0.14 0.00 0.37 0.00 0.00 40.66 42.66 2jul h LEU 79 CO -0.07 -0.42 0.15 -0.78 -0.34 0.00 0.00 178.44 176.98 2jul h ASP 80 N -1.10 -0.12 -0.70 1.25 3.58 -1.70 0.51 116.42 118.14 2jul h ASP 80 Ca -0.09 0.19 0.09 0.00 0.42 0.00 0.00 57.03 57.64 2jul h ASP 80 Cb 0.67 0.29 -0.07 0.00 1.72 0.00 0.00 39.33 41.94 2jul h ASP 80 CO 0.15 -0.15 0.34 -0.61 -2.88 0.00 0.00 179.24 176.09 2jul h GLN 81 N 0.18 0.57 0.11 0.28 4.15 -1.36 -1.91 115.11 117.13 2jul h GLN 81 Ca 0.49 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.88 2jul h GLN 81 Cb 0.93 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.48 2jul h GLN 81 CO -0.65 0.38 -0.12 1.25 -1.93 0.00 0.00 178.83 177.75 2jul h LEU 82 N 0.58 -0.33 -1.99 -2.39 7.12 0.59 -0.93 115.31 117.96 2jul h LEU 82 Ca 0.34 0.04 0.26 0.00 0.13 0.00 0.00 57.88 58.65 2jul h LEU 82 Cb 0.37 0.12 -0.04 0.00 -0.53 0.00 0.00 40.66 40.58 2jul h LEU 82 CO -0.27 -0.19 0.65 -0.61 -0.13 0.00 0.00 178.44 177.89 2jul h GLN 83 N -0.27 0.01 0.07 1.25 4.15 -0.57 0.10 115.11 119.85 2jul h GLN 83 Ca 0.01 -0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.20 2jul h GLN 83 Cb 0.26 -0.00 0.02 0.00 0.21 0.00 0.00 27.48 27.97 2jul h GLN 83 CO -0.04 0.01 -0.92 0.00 -1.93 0.00 0.00 178.83 175.94 2jul h ALA 84 N 1.55 0.02 0.00 3.38 0.00 -0.63 -2.83 119.26 120.75 2jul h ALA 84 Ca 0.43 -0.68 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2jul h ALA 84 Cb 1.71 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.58 2jul h ALA 84 CO -0.01 0.51 -0.07 1.96 0.00 0.00 0.00 179.25 181.64 2jul h GLN 85 N 0.04 0.00 -2.31 0.00 4.20 0.31 -3.31 115.11 114.05 2jul h GLN 85 Ca -0.13 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.99 2jul h GLN 85 Cb 1.63 0.00 -0.38 0.00 0.30 0.00 0.00 27.48 29.02 2jul h GLN 85 CO 0.18 0.07 -0.99 2.41 -0.67 0.00 0.00 178.83 179.83 2jul n THR 86 N -3.55 -1.00 -1.74 -0.54 -1.04 -0.47 -5.05 114.28 100.90 2jul n THR 86 Ca -0.02 -3.60 -0.65 0.00 -2.04 0.00 0.00 64.05 57.74 2jul n THR 86 Cb 0.19 -1.73 -0.09 0.00 -1.82 0.00 0.00 70.33 66.88 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 2.51 0.31 0.00 -2.82 5.02 -1.07 -4.53 118.16 117.57 2jul n LYS 87 Ca 0.28 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 2jul n LYS 87 Cb 0.49 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2jul n LYS 87 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2jul n PHE 88 N 4.35 -0.59 -3.87 2.13 7.35 -1.26 -5.08 117.46 120.48 2jul n PHE 88 Ca 0.30 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 57.01 2jul n PHE 88 Cb -0.01 0.12 0.01 0.00 0.35 0.00 0.00 39.48 39.95 2jul n PHE 88 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 2jul s THR 89 N -0.42 0.00 -0.12 -2.13 -1.32 -1.26 -5.07 115.64 105.33 2jul s THR 89 Ca 0.00 -0.18 0.03 0.00 -1.21 0.00 0.00 61.69 60.34 2jul s THR 89 Cb 0.00 -2.67 -0.09 0.00 -1.51 0.00 0.00 72.50 68.23 2jul s THR 89 CO 0.00 0.00 -0.07 1.17 -2.21 0.00 0.00 174.62 173.51 2jul n LYS 90 N -0.78 0.95 0.10 7.08 4.81 -1.26 -4.24 118.16 124.82 2jul n LYS 90 Ca -0.00 0.05 -0.04 0.00 -0.87 0.00 0.00 58.31 57.45 2jul n LYS 90 Cb 0.60 -1.25 -0.02 0.00 0.02 0.00 0.00 35.03 34.38 2jul n LYS 90 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2jul h LYS 91 N 0.00 -0.25 -0.19 1.64 3.64 -2.01 -2.07 116.57 117.32 2jul h LYS 91 Ca -0.27 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.18 2jul h LYS 91 Cb 1.48 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.35 2jul h LYS 91 CO -0.03 -0.17 0.33 0.93 -2.27 0.00 0.00 179.45 178.24 2jul h GLU 92 N -0.32 0.00 -0.11 1.90 5.08 -1.99 0.46 114.58 119.60 2jul h GLU 92 Ca -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2jul h GLU 92 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2jul h GLU 92 CO 0.04 0.00 0.04 1.25 -1.00 0.00 0.00 179.01 179.35 2jul h LEU 93 N 0.00 0.16 -1.06 1.33 6.46 -1.67 0.32 115.31 120.85 2jul h LEU 93 Ca 0.09 -0.18 0.04 0.00 -0.12 0.00 0.00 57.88 57.72 2jul h LEU 93 Cb 0.74 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 40.57 2jul h LEU 93 CO -0.00 0.29 0.63 -0.61 -0.62 0.00 0.00 178.44 178.13 2jul h GLN 94 N 0.02 1.16 0.63 1.25 4.15 -0.20 0.40 115.11 122.52 2jul h GLN 94 Ca 0.04 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.36 2jul h GLN 94 Cb 0.18 -0.26 0.01 0.00 0.21 0.00 0.00 27.48 27.62 2jul h GLN 94 CO -0.00 0.77 -0.31 0.77 -1.93 0.00 0.00 178.83 178.13 2jul h SER 95 N 1.20 -0.72 -0.99 -0.69 0.02 -1.20 0.25 113.55 111.42 2jul h SER 95 Ca 0.40 -0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.42 2jul h SER 95 Cb 0.06 0.19 -0.07 0.00 0.14 0.00 0.00 62.40 62.71 2jul h SER 95 CO -0.13 -0.45 0.63 -0.07 -1.14 0.00 0.00 176.83 175.66 2jul h LEU 96 N -0.95 0.99 -1.28 5.07 3.38 -0.55 0.12 115.31 122.10 2jul h LEU 96 Ca -0.09 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2jul h LEU 96 Cb 0.68 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 2jul h LEU 96 CO 0.14 0.60 0.15 0.22 0.09 0.00 0.00 178.44 179.65 2jul h TYR 97 N 1.11 0.65 -0.41 1.13 5.03 0.12 -2.26 116.97 122.33 2jul h TYR 97 Ca 0.44 -0.03 0.07 0.00 2.58 0.00 0.00 58.73 61.79 2jul h TYR 97 Cb 0.25 -0.20 -0.06 0.00 1.55 0.00 0.00 36.73 38.27 2jul h TYR 97 CO -0.01 0.53 0.06 -0.09 -1.32 0.00 0.00 178.16 177.34 2jul h ARG 98 N 0.64 0.18 -0.49 1.82 2.43 0.23 0.56 114.38 119.74 2jul h ARG 98 Ca 0.15 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2jul h ARG 98 Cb 0.18 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 2jul h ARG 98 CO -0.01 0.12 0.26 0.78 -1.51 0.00 0.00 179.97 179.61 2jul h GLY 99 N 0.19 0.69 1.68 2.80 0.00 -1.16 -0.84 103.07 106.43 2jul h GLY 99 Ca 0.20 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 2jul h GLY 99 CO -0.28 0.13 -0.07 -2.75 0.00 0.00 0.00 176.54 173.58 2jul h PHE 100 N 0.52 0.41 0.00 5.60 3.57 -0.91 -1.50 116.94 124.63 2jul h PHE 100 Ca 0.21 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2jul h PHE 100 Cb 0.09 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 2jul h PHE 100 CO -0.09 0.47 -0.23 -0.22 -2.23 0.00 0.00 178.31 176.01 2jul h LYS 101 N 0.38 0.00 -0.96 1.11 3.64 0.14 -2.46 116.57 118.42 2jul h LYS 101 Ca 0.08 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 2jul h LYS 101 Cb 0.36 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 2jul h LYS 101 CO 0.02 0.23 0.60 -0.97 -2.27 0.00 0.00 179.45 177.05 2jul h ASN 102 N 0.00 0.92 -2.84 4.20 -1.24 -0.31 -3.43 115.58 112.88 2jul h ASN 102 Ca -0.00 0.03 -0.44 0.00 0.71 0.00 0.00 56.30 56.60 2jul h ASN 102 Cb 0.45 -0.16 0.23 0.00 0.73 0.00 0.00 38.32 39.57 2jul h ASN 102 CO 0.03 0.54 -0.39 1.21 -1.29 0.00 0.00 177.43 177.53 2jul n GLU 103 N -4.60 -2.32 -2.58 6.67 4.07 -0.93 -4.95 120.64 116.00 2jul n GLU 103 Ca 0.16 -0.65 -0.33 0.00 -0.06 0.00 0.00 57.16 56.28 2jul n GLU 103 Cb 0.26 -2.00 -0.05 0.00 -0.06 0.00 0.00 31.44 29.59 2jul n GLU 103 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jul n PRO 105 N -1.07 2.54 0.00 0.00 -0.04 -1.26 -4.65 135.00 130.51 2jul n PRO 105 Ca 0.08 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 2jul n PRO 105 Cb 0.54 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 2jul n PRO 105 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 2jul n THR 106 N 4.39 0.00 0.00 0.52 5.66 -1.26 -5.06 114.28 118.53 2jul n THR 106 Ca 0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.18 2jul n THR 106 Cb 0.34 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.12 2jul n THR 106 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jul n GLY 107 N 0.00 2.00 3.94 1.09 0.00 -1.26 -4.81 105.19 106.15 2jul n GLY 107 Ca 0.00 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2jul n GLY 107 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2jul s LEU 108 N 0.00 3.90 0.26 0.99 2.34 -1.26 -4.65 118.68 120.26 2jul s LEU 108 Ca 0.00 0.54 0.08 0.00 0.06 0.00 0.00 54.13 54.80 2jul s LEU 108 Cb 0.00 -3.42 -0.04 0.00 -0.56 0.00 0.00 46.19 42.17 2jul s LEU 108 CO 0.00 -0.39 0.15 0.54 -1.06 0.00 0.00 176.35 175.59 2jul s VAL 109 N -2.43 4.12 0.14 1.48 0.11 0.62 -4.98 120.40 119.47 2jul s VAL 109 Ca 0.42 -1.54 0.09 0.00 -2.93 0.00 0.00 61.98 58.02 2jul s VAL 109 Cb -0.10 -3.25 -0.04 0.00 -1.53 0.00 0.00 36.38 31.47 2jul s VAL 109 CO 0.38 -0.34 -0.13 1.51 -3.33 0.00 0.00 175.10 173.18 2jul s ASP 110 N -3.81 4.10 0.55 3.54 -4.77 -1.26 -2.66 116.67 112.37 2jul s ASP 110 Ca 0.33 -0.55 0.24 0.00 -3.30 0.00 0.00 52.55 49.27 2jul s ASP 110 Cb -0.07 -0.65 1.30 0.00 -1.09 0.00 0.00 42.92 42.41 2jul s ASP 110 CO 0.24 0.14 1.70 1.05 0.70 0.00 0.00 175.17 179.01 2jul h GLU 111 N 3.35 0.00 0.16 2.11 9.09 -1.98 -0.86 114.58 126.44 2jul h GLU 111 Ca -0.48 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 58.92 2jul h GLU 111 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.29 2jul h GLU 111 CO 0.50 0.00 -0.08 -0.44 0.05 0.00 0.00 179.01 179.05 2jul h ASP 112 N 0.00 -0.18 -0.89 3.06 5.19 -1.99 -2.69 116.42 118.92 2jul h ASP 112 Ca 0.00 -0.16 0.10 0.00 -0.62 0.00 0.00 57.03 56.36 2jul h ASP 112 Cb 0.66 0.05 -0.07 0.00 0.18 0.00 0.00 39.33 40.15 2jul h ASP 112 CO 0.00 0.05 0.58 0.74 -3.12 0.00 0.00 179.24 177.49 2jul h THR 113 N -0.42 0.95 -0.40 0.35 2.02 -1.56 -1.27 112.91 112.57 2jul h THR 113 Ca -0.02 -0.30 0.07 0.00 0.77 0.00 0.00 66.41 66.93 2jul h THR 113 Cb 0.33 0.01 -0.06 0.00 -1.74 0.00 0.00 68.15 66.69 2jul h THR 113 CO 0.04 0.16 0.06 -0.26 0.37 0.00 0.00 175.52 175.89 2jul h PHE 114 N 0.86 0.10 -0.21 3.16 -1.00 -1.47 0.18 116.94 118.56 2jul h PHE 114 Ca 0.42 0.03 0.03 0.00 2.81 0.00 0.00 57.97 61.25 2jul h PHE 114 Cb 0.45 0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.00 2jul h PHE 114 CO -0.00 -0.01 0.03 -0.22 -1.61 0.00 0.00 178.31 176.50 2jul h LYS 115 N 0.19 0.11 -0.84 1.51 1.63 -0.93 0.52 116.57 118.75 2jul h LYS 115 Ca 0.20 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.97 2jul h LYS 115 Cb 0.25 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.82 2jul h LYS 115 CO -0.27 0.07 0.42 -0.07 -3.45 0.00 0.00 179.45 176.15 2jul h LEU 116 N 0.11 1.07 -0.45 5.20 3.38 -1.07 0.17 115.31 123.72 2jul h LEU 116 Ca 0.10 -0.11 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 2jul h LEU 116 Cb 0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2jul h LEU 116 CO -0.13 0.89 -0.62 0.40 0.09 0.00 0.00 178.44 179.06 2jul h ILE 117 N 1.18 1.33 0.00 1.22 2.04 -0.09 -2.46 117.51 120.74 2jul h ILE 117 Ca 0.29 -1.91 -0.09 0.00 1.00 0.00 0.00 64.86 64.15 2jul h ILE 117 Cb 0.08 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 2jul h ILE 117 CO -0.04 0.59 -0.41 0.22 0.00 0.00 0.00 178.15 178.51 2jul h TYR 118 N 0.40 0.00 0.02 1.37 3.20 0.42 -1.86 116.97 120.52 2jul h TYR 118 Ca -0.01 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.64 2jul h TYR 118 Cb 1.18 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.45 2jul h TYR 118 CO 0.05 0.41 -0.97 1.03 -1.64 0.00 0.00 178.16 177.04 2jul h SER 119 N 0.00 0.43 0.87 -2.11 0.87 -0.55 -3.18 113.55 109.89 2jul h SER 119 Ca -0.00 -0.36 -0.23 0.00 -1.23 0.00 0.00 61.79 59.96 2jul h SER 119 Cb 1.08 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.89 2jul h SER 119 CO 0.05 1.18 -1.12 -0.61 -0.53 0.00 0.00 176.83 175.80 2jul h GLN 120 N 0.17 0.06 0.00 2.24 4.15 -1.40 -3.15 115.11 117.17 2jul h GLN 120 Ca -0.08 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.25 2jul h GLN 120 Cb 1.62 0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.34 2jul h GLN 120 CO 0.16 1.00 0.00 0.34 -1.93 0.00 0.00 178.83 178.40 2jul n PHE 121 N -3.36 0.00 -3.47 3.99 7.35 -0.71 -4.25 117.46 117.01 2jul n PHE 121 Ca -0.03 0.00 -0.28 0.00 -0.76 0.00 0.00 57.45 56.38 2jul n PHE 121 Cb 0.97 -0.09 -0.12 0.00 0.35 0.00 0.00 39.48 40.58 2jul n PHE 121 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2jul s PHE 122 N -2.18 0.50 -2.00 -5.13 0.40 -1.19 -4.96 117.98 103.41 2jul s PHE 122 Ca 0.29 -1.32 0.03 0.00 -0.60 0.00 0.00 56.93 55.33 2jul s PHE 122 Cb 0.15 -0.86 0.19 0.00 0.51 0.00 0.00 43.02 43.01 2jul s PHE 122 CO 0.28 -0.84 0.53 -2.30 0.70 0.00 0.00 175.22 173.58 2jul n PRO 123 N 4.43 0.18 -0.03 0.24 -0.02 -1.26 -4.63 135.00 133.91 2jul n PRO 123 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2jul n PRO 123 Cb 0.39 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 2jul n PRO 123 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2jul n GLN 124 N -0.77 1.63 -0.67 -0.52 6.02 -1.26 -5.03 117.38 116.78 2jul n GLN 124 Ca 0.02 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.69 2jul n GLN 124 Cb 0.01 0.00 0.17 0.00 1.02 0.00 0.00 30.24 31.45 2jul n GLN 124 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jul n GLY 125 N 5.00 -2.39 0.00 1.08 0.00 -1.19 -4.92 105.19 102.76 2jul n GLY 125 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.94 -1.05 -1.57 1.61 8.00 -1.26 -4.80 116.55 115.55 2jul n ASP 126 Ca 0.02 -0.17 -0.05 0.00 0.71 0.00 0.00 54.79 55.30 2jul n ASP 126 Cb 0.61 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.71 2jul n ASP 126 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jul n ALA 127 N -3.00 2.89 -0.06 2.24 0.00 -1.26 -4.56 120.51 116.75 2jul n ALA 127 Ca 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 53.44 52.64 2jul n ALA 127 Cb 0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 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 4.12 0.85 0.32 0.00 2.02 -1.96 2.09 112.91 120.35 2jul h THR 128 Ca -0.47 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 2jul h THR 128 Cb 1.30 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 2jul h THR 128 CO -0.22 0.02 -0.15 0.74 0.37 0.00 0.00 175.52 176.27 2jul h THR 129 N 0.11 0.71 0.00 3.16 2.02 -1.97 -1.41 112.91 115.53 2jul h THR 129 Ca 0.12 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 2jul h THR 129 Cb 0.14 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2jul h THR 129 CO -0.18 0.06 -0.22 0.22 0.37 0.00 0.00 175.52 175.76 2jul h TYR 130 N -0.58 0.00 -0.67 3.16 3.20 -1.85 -2.32 116.97 117.91 2jul h TYR 130 Ca -0.04 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.76 2jul h TYR 130 Cb 0.43 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 2jul h TYR 130 CO -0.02 0.22 0.15 0.00 -1.64 0.00 0.00 178.16 176.88 2jul h ALA 131 N 1.78 0.88 -0.34 1.82 0.00 0.38 0.19 119.26 123.96 2jul h ALA 131 Ca -0.00 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2jul h ALA 131 Cb 0.45 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2jul h ALA 131 CO 0.03 0.61 -0.30 1.25 0.00 0.00 0.00 179.25 180.84 2jul h HIS 132 N 1.00 0.83 -0.41 0.00 -0.00 -0.75 -1.34 115.15 114.49 2jul h HIS 132 Ca 0.21 -0.21 -0.12 0.00 -0.00 0.00 0.00 60.37 60.24 2jul h HIS 132 Cb 0.39 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.60 2jul h HIS 132 CO 0.03 0.93 -0.23 0.74 -0.00 0.00 0.00 177.93 179.40 2jul h PHE 133 N 0.61 1.02 -0.30 5.26 -1.00 -1.06 -2.52 116.94 118.95 2jul h PHE 133 Ca 0.07 -0.26 -0.01 0.00 2.81 0.00 0.00 57.97 60.58 2jul h PHE 133 Cb 0.81 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 40.13 2jul h PHE 133 CO 0.04 1.05 0.16 -0.07 -1.61 0.00 0.00 178.31 177.88 2jul h LEU 134 N 0.69 0.38 -1.33 1.54 3.38 -0.46 -2.03 115.31 117.48 2jul h LEU 134 Ca 0.09 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.04 2jul h LEU 134 Cb 0.80 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 2jul h LEU 134 CO 0.07 0.37 0.51 0.15 0.09 0.00 0.00 178.44 179.63 2jul h PHE 135 N 0.36 0.81 -0.45 1.13 3.04 -1.16 0.11 116.94 120.77 2jul h PHE 135 Ca 0.10 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.04 2jul h PHE 135 Cb 0.08 -0.27 -0.02 0.00 2.56 0.00 0.00 35.95 38.30 2jul h PHE 135 CO -0.03 0.40 0.15 -0.97 -2.02 0.00 0.00 178.31 175.85 2jul h ASN 136 N 0.78 0.60 -0.23 0.41 -0.00 -0.93 0.35 115.58 116.55 2jul h ASN 136 Ca 0.35 -0.08 -0.13 0.00 -0.00 0.00 0.00 56.30 56.44 2jul h ASN 136 Cb 0.34 -0.15 -0.00 0.00 -0.00 0.00 0.00 38.32 38.51 2jul h ASN 136 CO -0.13 0.57 -0.37 0.00 -0.00 0.00 0.00 177.43 177.50 2jul h ALA 137 N 1.52 0.36 0.00 1.57 0.00 -0.33 -3.05 119.26 119.33 2jul h ALA 137 Ca 0.15 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2jul h ALA 137 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2jul h ALA 137 CO -0.01 0.43 -0.37 0.74 0.00 0.00 0.00 179.25 180.05 2jul h PHE 138 N 0.37 0.00 -3.74 0.00 0.04 -0.81 -3.40 116.94 109.39 2jul h PHE 138 Ca 0.02 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.11 2jul h PHE 138 Cb 0.96 0.00 -0.33 0.00 2.20 0.00 0.00 35.95 38.78 2jul h PHE 138 CO 0.08 0.37 -0.69 0.34 -0.60 0.00 0.00 178.31 177.81 2jul s ASP 139 N -6.40 4.93 0.00 2.17 -1.08 0.12 -4.89 116.67 111.51 2jul s ASP 139 Ca 0.01 -1.35 0.00 0.00 -0.52 0.00 0.00 52.55 50.69 2jul s ASP 139 Cb 0.10 -1.72 0.00 0.00 -1.46 0.00 0.00 42.92 39.84 2jul s ASP 139 CO 0.69 -0.29 0.00 0.00 0.52 0.00 0.00 175.17 176.09 2jul n ALA 140 N 4.62 0.00 -1.00 3.66 0.00 -1.26 -4.57 120.51 121.96 2jul n ALA 140 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2jul n ALA 140 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 0.00 -0.06 0.00 8.00 -1.26 -4.89 116.55 118.34 2jul n ASP 141 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2jul n ASP 141 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2jul n ASP 141 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jul n GLY 142 N 1.58 -0.40 0.00 0.44 0.00 -1.26 -4.89 105.19 100.65 2jul n GLY 142 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.48 0.00 -4.39 1.61 4.13 -1.26 -4.99 115.26 108.88 2jul n ASN 143 Ca 0.00 0.00 -0.45 0.00 1.68 0.00 0.00 54.58 55.81 2jul n ASN 143 Cb 0.00 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2jul n ASN 143 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2jul s GLY 144 N -0.51 2.87 -0.18 7.41 0.00 -1.26 -4.93 107.32 110.72 2jul s GLY 144 Ca 0.00 -3.63 -0.05 0.00 0.00 0.00 0.00 44.72 41.04 2jul s GLY 144 CO 0.00 1.64 0.35 0.00 0.00 0.00 0.00 173.10 175.09 2jul s ALA 145 N -0.00 -0.89 0.07 3.20 0.00 -1.26 -4.73 121.76 118.14 2jul s ALA 145 Ca 0.36 1.16 0.09 0.00 0.00 0.00 0.00 51.96 53.57 2jul s ALA 145 Cb -0.07 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 2jul s ALA 145 CO -0.05 -0.80 -0.23 0.96 0.00 0.00 0.00 175.76 175.65 2jul s ILE 146 N 2.52 2.44 0.25 0.00 -4.36 -1.09 -5.00 121.20 115.97 2jul s ILE 146 Ca 0.02 -1.40 0.10 0.00 -0.26 0.00 0.00 60.65 59.11 2jul s ILE 146 Cb -0.13 -2.02 -0.05 0.00 1.25 0.00 0.00 42.46 41.51 2jul s ILE 146 CO -0.12 0.28 -0.18 -1.00 0.24 0.00 0.00 174.94 174.17 2jul s HIS 147 N -0.92 2.09 0.65 1.37 3.76 -1.26 -0.28 115.29 120.69 2jul s HIS 147 Ca 0.14 -0.42 0.27 0.00 -0.15 0.00 0.00 55.06 54.90 2jul s HIS 147 Cb -0.10 -0.93 1.45 0.00 1.11 0.00 0.00 32.58 34.11 2jul s HIS 147 CO 0.05 0.59 1.83 0.35 -0.85 0.00 0.00 174.74 176.70 2jul h PHE 148 N 2.37 0.00 0.38 1.40 3.57 -1.98 -2.00 116.94 120.68 2jul h PHE 148 Ca -0.39 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 2jul h PHE 148 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2jul h PHE 148 CO 0.78 0.00 -0.18 1.49 -2.23 0.00 0.00 178.31 178.16 2jul h GLU 149 N 0.00 -0.50 -1.03 1.11 4.22 -1.98 -1.57 114.58 114.83 2jul h GLU 149 Ca 0.05 0.03 0.29 0.00 0.08 0.00 0.00 59.36 59.82 2jul h GLU 149 Cb 0.92 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 30.23 2jul h GLU 149 CO -0.00 -0.33 0.74 -0.44 -2.18 0.00 0.00 179.01 176.79 2jul h ASP 150 N -0.77 0.05 0.08 1.04 5.19 -1.76 0.90 116.42 121.14 2jul h ASP 150 Ca -0.05 0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.23 2jul h ASP 150 Cb 0.40 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.89 2jul h ASP 150 CO 0.09 0.01 -0.46 0.15 -3.12 0.00 0.00 179.24 175.91 2jul h PHE 151 N 0.05 0.55 -0.26 4.55 3.04 -1.34 -2.63 116.94 120.89 2jul h PHE 151 Ca 0.50 -0.17 -0.15 0.00 3.98 0.00 0.00 57.97 62.13 2jul h PHE 151 Cb 1.92 -0.11 -0.00 0.00 2.56 0.00 0.00 35.95 40.31 2jul h PHE 151 CO -0.00 0.83 -0.41 0.28 -2.02 0.00 0.00 178.31 176.99 2jul h VAL 152 N 0.37 1.30 -0.94 1.41 2.07 0.18 -2.80 116.25 117.84 2jul h VAL 152 Ca 0.02 -1.61 0.05 0.00 0.82 0.00 0.00 66.70 65.98 2jul h VAL 152 Cb 0.95 1.69 -0.06 0.00 -1.52 0.00 0.00 31.29 32.35 2jul h VAL 152 CO 0.08 0.51 0.61 0.58 0.02 0.00 0.00 177.57 179.37 2jul h VAL 153 N 0.48 1.12 0.45 2.57 2.07 -1.16 -1.53 116.25 120.25 2jul h VAL 153 Ca 0.02 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2jul h VAL 153 Cb 1.01 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2jul h VAL 153 CO 0.09 0.21 -0.22 1.23 0.02 0.00 0.00 177.57 178.91 2jul h GLY 154 N 1.15 -0.63 -0.09 2.17 0.00 -1.38 -0.67 103.07 103.62 2jul h GLY 154 Ca 0.39 0.23 0.24 0.00 0.00 0.00 0.00 47.33 48.20 2jul h GLY 154 CO -0.14 -0.23 0.63 -2.00 0.00 0.00 0.00 176.54 174.80 2jul h LEU 155 N -0.68 0.59 -1.07 3.11 7.12 -1.20 0.95 115.31 124.14 2jul h LEU 155 Ca -0.06 0.11 -0.09 0.00 0.13 0.00 0.00 57.88 57.97 2jul h LEU 155 Cb 0.50 0.01 -0.01 0.00 -0.53 0.00 0.00 40.66 40.63 2jul h LEU 155 CO 0.10 0.12 -0.30 0.28 -0.13 0.00 0.00 178.44 178.51 2jul h SER 156 N 0.53 0.28 0.08 1.25 0.02 -0.59 0.11 113.55 115.23 2jul h SER 156 Ca 0.61 -0.10 -0.22 0.00 -0.84 0.00 0.00 61.79 61.24 2jul h SER 156 Cb 1.29 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.76 2jul h SER 156 CO -0.38 0.58 -0.86 0.40 -1.14 0.00 0.00 176.83 175.44 2jul h ILE 157 N 0.25 1.33 0.00 3.27 2.04 0.23 -1.83 117.51 122.80 2jul h ILE 157 Ca 0.03 -2.17 -0.13 0.00 1.00 0.00 0.00 64.86 63.60 2jul h ILE 157 Cb 0.66 2.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.91 2jul h ILE 157 CO 0.05 0.67 -0.60 -0.07 0.00 0.00 0.00 178.15 178.20 2jul h LEU 158 N 0.38 0.00 0.00 1.44 4.07 -0.66 -3.34 115.31 117.20 2jul h LEU 158 Ca -0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.89 2jul h LEU 158 Cb 1.48 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.22 2jul h LEU 158 CO 0.16 0.60 0.00 -0.11 -1.08 0.00 0.00 178.44 178.01 2jul n LEU 159 N -3.39 1.07 -4.24 1.67 7.94 0.35 -4.76 117.00 115.64 2jul n LEU 159 Ca 0.01 0.28 -0.41 0.00 -1.11 0.00 0.00 56.01 54.77 2jul n LEU 159 Cb 0.71 -0.30 -0.08 0.00 0.53 0.00 0.00 43.42 44.27 2jul n LEU 159 CO 0.41 -0.30 -0.02 0.00 -1.11 0.00 0.00 177.39 176.36 2jul s ARG 160 N -0.61 2.57 -0.16 1.96 1.70 -0.69 -5.04 118.95 118.68 2jul s ARG 160 Ca 0.00 -1.68 -0.12 0.00 -0.47 0.00 0.00 55.73 53.46 2jul s ARG 160 Cb 0.00 -3.94 0.05 0.00 -0.57 0.00 0.00 34.95 30.49 2jul s ARG 160 CO 0.00 -1.15 0.42 0.20 -1.08 0.00 0.00 175.30 173.69 2jul s GLY 161 N 2.64 -0.32 0.94 3.88 0.00 -1.25 -4.53 107.32 108.67 2jul s GLY 161 Ca 0.05 1.35 -0.11 0.00 0.00 0.00 0.00 44.72 46.01 2jul s GLY 161 CO 0.01 1.32 1.11 -1.59 0.00 0.00 0.00 173.10 173.94 2jul s THR 162 N 0.73 2.30 0.29 0.90 2.01 -1.26 -4.61 115.64 116.00 2jul s THR 162 Ca -0.04 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.09 2jul s THR 162 Cb -0.05 -2.24 0.28 0.00 0.01 0.00 0.00 72.50 70.49 2jul s THR 162 CO -0.05 -0.13 1.74 0.58 -0.69 0.00 0.00 174.62 176.07 2jul h VAL 163 N -1.88 0.62 -0.50 3.82 2.07 -2.01 0.10 116.25 118.48 2jul h VAL 163 Ca -0.47 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 66.77 2jul h VAL 163 Cb 1.28 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 2jul h VAL 163 CO 0.46 0.11 0.01 0.45 0.02 0.00 0.00 177.57 178.61 2jul h HIS 164 N 0.58 0.95 -0.42 1.57 3.86 -1.99 -1.90 115.15 117.80 2jul h HIS 164 Ca 0.54 -0.16 -0.03 0.00 -1.16 0.00 0.00 60.37 59.56 2jul h HIS 164 Cb 0.90 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.10 2jul h HIS 164 CO -0.07 0.89 0.13 0.93 0.86 0.00 0.00 177.93 180.66 2jul h GLU 165 N 0.74 0.60 0.03 2.45 4.39 -1.20 -0.33 114.58 121.27 2jul h GLU 165 Ca 0.14 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 2jul h GLU 165 Cb 0.51 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 2jul h GLU 165 CO 0.02 0.53 -0.02 0.87 -1.16 0.00 0.00 179.01 179.26 2jul h LYS 166 N 0.59 -0.04 0.00 2.33 1.79 -0.72 -2.59 116.57 117.93 2jul h LYS 166 Ca 0.14 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.60 2jul h LYS 166 Cb 0.18 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2jul h LYS 166 CO -0.01 0.38 -0.08 -0.07 -1.08 0.00 0.00 179.45 178.59 2jul h LEU 167 N -0.47 0.00 -0.27 2.94 3.38 -1.15 -2.36 115.31 117.38 2jul h LEU 167 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2jul h LEU 167 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2jul h LEU 167 CO 0.01 0.08 -0.18 0.50 0.09 0.00 0.00 178.44 178.94 2jul h LYS 168 N 0.00 0.60 -0.19 1.13 1.63 -0.82 -0.79 116.57 118.13 2jul h LYS 168 Ca -0.00 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.51 2jul h LYS 168 Cb 0.28 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 2jul h LYS 168 CO 0.01 0.86 0.08 2.35 -3.45 0.00 0.00 179.45 179.30 2jul h TRP 169 N 0.33 0.29 -0.72 1.91 7.01 -1.04 0.18 115.95 123.91 2jul h TRP 169 Ca 0.06 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2jul h TRP 169 Cb 0.71 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.65 2jul h TRP 169 CO 0.07 0.34 0.36 0.00 -2.79 0.00 0.00 178.44 176.42 2jul h ALA 170 N 0.92 1.29 -0.01 2.65 0.00 -1.48 -1.48 119.26 121.16 2jul h ALA 170 Ca 0.06 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2jul h ALA 170 Cb 0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2jul h ALA 170 CO -0.01 0.56 -0.46 0.35 0.00 0.00 0.00 179.25 179.69 2jul h PHE 171 N 1.01 0.02 0.00 0.00 3.04 -0.80 -2.54 116.94 117.67 2jul h PHE 171 Ca 0.25 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 62.10 2jul h PHE 171 Cb 0.07 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.57 2jul h PHE 171 CO 0.01 0.48 -0.44 -0.97 -2.02 0.00 0.00 178.31 175.36 2jul h ASN 172 N 0.01 0.00 -0.02 0.41 -0.73 0.04 -3.21 115.58 112.09 2jul h ASN 172 Ca -0.00 0.00 -0.06 0.00 1.87 0.00 0.00 56.30 58.10 2jul h ASN 172 Cb 0.82 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.42 2jul h ASN 172 CO 0.06 0.44 -0.24 0.25 -0.37 0.00 0.00 177.43 177.58 2jul h LEU 173 N 0.00 0.24 -0.40 0.34 5.85 -0.98 -3.03 115.31 117.32 2jul h LEU 173 Ca -0.00 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 57.98 2jul h LEU 173 Cb 0.94 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.90 2jul h LEU 173 CO 0.06 0.93 0.00 -1.22 -0.34 0.00 0.00 178.44 177.87 2jul n TYR 174 N -4.52 0.00 -3.85 1.25 4.01 -1.04 -4.28 117.16 108.73 2jul n TYR 174 Ca -0.09 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.35 2jul n TYR 174 Cb 0.48 -0.01 -0.15 0.00 -0.31 0.00 0.00 39.34 39.35 2jul n TYR 174 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2jul s ASP 175 N -1.31 3.99 -0.85 7.72 1.01 -1.15 -4.93 116.67 121.16 2jul s ASP 175 Ca 0.00 -1.51 0.01 0.00 0.71 0.00 0.00 52.55 51.76 2jul s ASP 175 Cb 0.00 -1.07 0.30 0.00 1.01 0.00 0.00 42.92 43.16 2jul s ASP 175 CO 0.00 -0.34 1.25 -0.38 0.21 0.00 0.00 175.17 175.91 2jul n ILE 176 N 4.70 4.25 -0.25 0.77 -0.00 -1.26 -4.39 119.36 123.19 2jul n ILE 176 Ca -0.05 -5.69 0.00 0.00 -0.00 0.00 0.00 62.75 57.02 2jul n ILE 176 Cb 0.43 -1.83 0.00 0.00 -0.00 0.00 0.00 39.64 38.24 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 0.56 0.00 -0.24 4.38 2.04 -1.26 -4.96 115.26 115.78 2jul n ASN 177 Ca 0.33 -0.08 -0.03 0.00 -0.44 0.00 0.00 54.58 54.35 2jul n ASN 177 Cb 0.35 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.59 2jul n ASN 177 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99 2jul n LYS 178 N 0.00 -1.57 0.31 -3.83 0.00 -1.26 -4.80 118.16 107.01 2jul n LYS 178 Ca 0.00 0.54 0.20 0.00 0.00 0.00 0.00 58.31 59.05 2jul n LYS 178 Cb 0.02 -4.78 0.96 0.00 0.00 0.00 0.00 35.03 31.23 2jul n LYS 178 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 2jul h ASP 179 N 0.00 0.00 -0.21 3.14 3.04 -1.93 -3.45 116.42 117.01 2jul h ASP 179 Ca -0.06 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.63 2jul h ASP 179 Cb 0.88 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.14 2jul h ASP 179 CO 0.09 0.00 -0.08 0.61 -2.04 0.00 0.00 179.24 177.82 2jul n GLY 180 N -0.52 0.72 3.26 7.15 0.00 -1.26 -5.00 105.19 109.54 2jul n GLY 180 Ca -0.01 -0.70 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.38 2.81 0.14 0.00 1.01 0.67 -4.93 121.20 117.51 2jul s ILE 182 Ca 0.01 -2.15 -0.16 0.00 0.00 0.00 0.00 60.65 58.35 2jul s ILE 182 Cb 0.02 -2.59 0.03 0.00 0.01 0.00 0.00 42.46 39.93 2jul s ILE 182 CO -0.09 -0.34 0.42 0.28 0.00 0.00 0.00 174.94 175.21 2jul s THR 183 N -2.46 0.06 0.31 2.92 -1.32 -1.26 -0.98 115.64 112.91 2jul s THR 183 Ca 0.32 -0.64 0.08 0.00 -1.21 0.00 0.00 61.69 60.23 2jul s THR 183 Cb -0.04 -1.26 0.30 0.00 -1.51 0.00 0.00 72.50 69.99 2jul s THR 183 CO 0.18 -0.28 1.71 0.11 -2.21 0.00 0.00 174.62 174.12 2jul h LYS 184 N 2.34 0.47 0.70 7.08 1.57 -1.98 -0.63 116.57 126.13 2jul h LYS 184 Ca -0.33 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.39 2jul h LYS 184 Cb 1.26 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2jul h LYS 184 CO 0.45 0.31 -0.47 0.93 -0.57 0.00 0.00 179.45 180.10 2jul h GLU 185 N 0.49 -1.07 -0.36 3.15 3.07 -2.00 -0.44 114.58 117.41 2jul h GLU 185 Ca 0.62 0.07 0.11 0.00 -0.50 0.00 0.00 59.36 59.66 2jul h GLU 185 Cb 1.19 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 29.33 2jul h GLU 185 CO -0.51 -0.71 0.28 0.93 -1.40 0.00 0.00 179.01 177.60 2jul h GLU 186 N -1.11 0.00 0.00 2.33 5.08 -1.74 0.15 114.58 119.29 2jul h GLU 186 Ca -0.09 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 2jul h GLU 186 Cb 0.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 2jul h GLU 186 CO 0.07 0.00 -0.51 0.52 -1.00 0.00 0.00 179.01 178.08 2jul h MET 187 N 0.00 0.00 -0.11 2.33 2.86 -0.40 -2.51 114.93 117.10 2jul h MET 187 Ca 0.17 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.68 2jul h MET 187 Cb 0.73 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.40 2jul h MET 187 CO -0.00 0.51 -0.46 1.25 1.06 0.00 0.00 176.91 179.27 2jul h LEU 188 N 0.00 0.59 -0.90 1.22 6.46 0.93 -2.57 115.31 121.04 2jul h LEU 188 Ca -0.01 -0.63 -0.10 0.00 -0.12 0.00 0.00 57.88 57.03 2jul h LEU 188 Cb 1.06 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.80 2jul h LEU 188 CO 0.07 1.12 -0.21 0.00 -0.62 0.00 0.00 178.44 178.79 2jul h ALA 189 N 0.48 1.07 -0.62 1.25 0.00 -1.47 -2.53 119.26 117.44 2jul h ALA 189 Ca -0.03 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 2jul h ALA 189 Cb 1.10 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2jul h ALA 189 CO 0.10 0.57 0.02 0.82 0.00 0.00 0.00 179.25 180.75 2jul h ILE 190 N 0.50 1.27 -0.34 0.00 1.08 -1.45 -2.04 117.51 116.52 2jul h ILE 190 Ca 0.08 -1.14 -0.03 0.00 -0.39 0.00 0.00 64.86 63.37 2jul h ILE 190 Cb 0.65 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 35.15 2jul h ILE 190 CO 0.05 0.42 0.08 -0.03 -0.69 0.00 0.00 178.15 177.97 2jul h MET 191 N 0.99 0.55 -0.12 2.37 4.05 -1.24 -1.75 114.93 119.78 2jul h MET 191 Ca 0.18 -0.14 -0.03 0.00 -0.28 0.00 0.00 59.70 59.44 2jul h MET 191 Cb 0.54 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 2jul h MET 191 CO 0.03 0.61 -0.04 0.87 0.23 0.00 0.00 176.91 178.61 2jul h LYS 192 N 0.40 0.18 -0.14 0.39 1.57 -1.34 -1.79 116.57 115.84 2jul h LYS 192 Ca 0.11 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2jul h LYS 192 Cb 0.31 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 2jul h LYS 192 CO 0.00 0.23 -0.10 0.77 -0.57 0.00 0.00 179.45 179.78 2jul h SER 193 N 0.17 0.34 -0.86 0.86 0.02 -0.92 -0.90 113.55 112.26 2jul h SER 193 Ca 0.04 -0.45 0.01 0.00 -0.84 0.00 0.00 61.79 60.55 2jul h SER 193 Cb 0.19 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 2jul h SER 193 CO 0.01 0.72 0.57 0.40 -1.14 0.00 0.00 176.83 177.38 2jul h ILE 194 N -0.04 1.20 -0.38 3.27 1.08 -0.92 0.03 117.51 121.76 2jul h ILE 194 Ca 0.03 -0.39 -0.06 0.00 -0.39 0.00 0.00 64.86 64.04 2jul h ILE 194 Cb 0.61 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.30 2jul h ILE 194 CO 0.03 0.21 -0.02 1.88 -0.69 0.00 0.00 178.15 179.56 2jul h TYR 195 N 1.15 0.75 0.00 1.37 -1.99 -1.27 -2.29 116.97 114.69 2jul h TYR 195 Ca 0.32 -0.14 -0.01 0.00 2.00 0.00 0.00 58.73 60.91 2jul h TYR 195 Cb -0.10 -0.19 -0.00 0.00 2.00 0.00 0.00 36.73 38.44 2jul h TYR 195 CO -0.01 0.78 -0.05 0.22 -0.00 0.00 0.00 178.16 179.09 2jul h ASP 196 N 0.50 0.00 -0.05 3.88 3.58 -0.66 -2.48 116.42 121.19 2jul h ASP 196 Ca 0.11 0.00 -0.22 0.00 0.42 0.00 0.00 57.03 57.33 2jul h ASP 196 Cb 0.49 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.55 2jul h ASP 196 CO 0.02 0.05 -0.82 -0.03 -2.88 0.00 0.00 179.24 175.59 2jul h MET 197 N 0.00 0.71 -1.00 0.28 4.05 -0.44 -3.19 114.93 115.35 2jul h MET 197 Ca -0.00 -0.61 0.34 0.00 -0.28 0.00 0.00 59.70 59.15 2jul h MET 197 Cb 0.35 0.14 -0.16 0.00 -0.80 0.00 0.00 31.60 31.13 2jul h MET 197 CO 0.01 1.22 0.54 0.52 0.23 0.00 0.00 176.91 179.42 2jul h MET 198 N 0.47 0.22 0.00 0.39 2.86 -1.09 -3.16 114.93 114.62 2jul h MET 198 Ca -0.06 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2jul h MET 198 Cb 1.44 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 33.05 2jul h MET 198 CO 0.16 0.15 0.00 0.41 1.06 0.00 0.00 176.91 178.69 2jul n GLY 199 N -1.29 -2.68 0.00 8.32 0.00 -1.20 -3.40 105.19 104.93 2jul n GLY 199 Ca 0.33 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2jul n GLY 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jul n ARG 200 N -0.58 0.00 -1.37 1.61 1.74 -1.26 -4.65 116.66 112.15 2jul n ARG 200 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2jul n ARG 200 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2jul n ARG 200 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 2jul n HIS 201 N 0.00 -1.90 -1.42 -1.55 -0.00 -1.26 -4.89 115.22 104.20 2jul n HIS 201 Ca 0.00 1.14 0.19 0.00 0.46 0.00 0.00 57.72 59.50 2jul n HIS 201 Cb 0.00 -2.70 -0.06 0.00 -0.12 0.00 0.00 29.99 27.12 2jul n HIS 201 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 2jul n THR 202 N 0.72 0.00 -3.74 3.57 -1.04 -1.26 -4.87 114.28 107.66 2jul n THR 202 Ca 0.00 0.21 -0.34 0.00 -2.04 0.00 0.00 64.05 61.88 2jul n THR 202 Cb 0.00 -0.69 0.04 0.00 -1.82 0.00 0.00 70.33 67.86 2jul n THR 202 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2jul n TYR 203 N -4.19 -1.83 0.37 -1.42 4.01 -1.26 -4.77 117.16 108.07 2jul n TYR 203 Ca -0.01 0.39 0.03 0.00 -0.16 0.00 0.00 57.90 58.16 2jul n TYR 203 Cb 0.67 -3.34 0.19 0.00 -0.31 0.00 0.00 39.34 36.55 2jul n TYR 203 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2jul n PRO 204 N -4.31 0.15 -1.09 -0.72 -0.04 -1.26 -4.81 135.00 122.91 2jul n PRO 204 Ca -0.09 0.14 -0.36 0.00 -0.04 0.00 0.00 63.50 63.15 2jul n PRO 204 Cb 0.59 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.61 2jul n PRO 204 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2jul n ILE 205 N -1.18 0.71 -0.09 0.52 -0.00 -1.26 -4.96 119.36 113.10 2jul n ILE 205 Ca 0.04 -0.39 -0.11 0.00 -0.00 0.00 0.00 62.75 62.29 2jul n ILE 205 Cb 0.04 -0.44 -0.04 0.00 -0.00 0.00 0.00 39.64 39.20 2jul n ILE 205 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2jul n LEU 206 N 0.71 1.91 -2.27 1.39 4.32 -1.26 -5.03 117.00 116.77 2jul n LEU 206 Ca 0.06 0.32 -0.12 0.00 -0.02 0.00 0.00 56.01 56.25 2jul n LEU 206 Cb 0.52 -0.73 0.05 0.00 -1.62 0.00 0.00 43.42 41.63 2jul n LEU 206 CO 0.51 -0.18 0.12 -1.14 -1.22 0.00 0.00 177.39 175.48 2jul n ARG 207 N -4.40 -4.23 -2.77 3.23 0.63 -1.26 -4.35 116.66 103.50 2jul n ARG 207 Ca -0.18 0.47 -0.02 0.00 -0.92 0.00 0.00 57.85 57.19 2jul n ARG 207 Cb 0.55 -4.39 -0.02 0.00 0.45 0.00 0.00 32.46 29.06 2jul n ARG 207 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jul n GLU 208 N -2.94 -3.30 -3.18 -0.14 -0.58 -1.26 -4.90 120.64 104.35 2jul n GLU 208 Ca -0.05 2.64 -0.41 0.00 -0.42 0.00 0.00 57.16 58.93 2jul n GLU 208 Cb 0.55 -4.31 -0.07 0.00 -0.57 0.00 0.00 31.44 27.04 2jul n GLU 208 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2jul s ASP 209 N -1.07 6.45 -0.40 1.62 1.11 -1.26 -4.92 116.67 118.20 2jul s ASP 209 Ca -0.10 0.42 0.01 0.00 0.18 0.00 0.00 52.55 53.06 2jul s ASP 209 Cb 0.01 -2.30 0.25 0.00 1.07 0.00 0.00 42.92 41.95 2jul s ASP 209 CO 0.62 -0.39 1.08 0.00 1.18 0.00 0.00 175.17 177.66 2jul n ALA 210 N 5.71 -2.75 0.31 5.23 0.00 -1.26 -4.99 120.51 122.77 2jul n ALA 210 Ca -0.03 -0.70 0.20 0.00 0.00 0.00 0.00 53.44 52.91 2jul n ALA 210 Cb 0.49 -2.49 1.00 0.00 0.00 0.00 0.00 19.45 18.46 2jul n ALA 210 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2jul h PRO 211 N 3.61 0.00 -0.27 0.00 0.14 -1.97 -2.71 132.00 130.79 2jul h PRO 211 Ca -0.18 0.00 -0.04 0.00 0.14 0.00 0.00 66.00 65.92 2jul h PRO 211 Cb 1.14 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.27 2jul h PRO 211 CO 0.01 0.02 0.01 -0.07 0.14 0.00 0.00 178.00 178.10 2jul h LEU 212 N 0.00 0.47 -1.27 1.56 3.38 -1.98 -2.87 115.31 114.60 2jul h LEU 212 Ca -0.00 -0.30 0.31 0.00 0.09 0.00 0.00 57.88 57.98 2jul h LEU 212 Cb 0.18 -0.13 -0.11 0.00 0.09 0.00 0.00 40.66 40.69 2jul h LEU 212 CO 0.00 0.65 0.68 -0.08 0.09 0.00 0.00 178.44 179.79 2jul h GLU 213 N 0.27 0.33 0.33 1.13 4.22 -1.91 0.08 114.58 119.03 2jul h GLU 213 Ca 0.08 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.48 2jul h GLU 213 Cb 0.41 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2jul h GLU 213 CO 0.01 0.22 -0.16 1.25 -2.18 0.00 0.00 179.01 178.15 2jul h HIS 214 N 0.34 -0.41 -0.91 0.92 2.76 -1.65 -1.04 115.15 115.16 2jul h HIS 214 Ca 0.67 -0.01 0.15 0.00 -2.20 0.00 0.00 60.37 58.98 2jul h HIS 214 Cb 1.74 0.14 -0.07 0.00 1.55 0.00 0.00 27.41 30.76 2jul h HIS 214 CO -0.00 -0.14 0.58 0.28 -1.30 0.00 0.00 177.93 177.35 2jul h VAL 215 N -0.63 0.82 0.12 5.26 2.07 -1.03 0.33 116.25 123.21 2jul h VAL 215 Ca -0.05 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2jul h VAL 215 Cb 0.45 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 2jul h VAL 215 CO 0.07 0.13 -0.06 -0.08 0.02 0.00 0.00 177.57 177.65 2jul h GLU 216 N 0.71 -0.16 -0.50 1.57 4.81 -1.06 -1.03 114.58 118.92 2jul h GLU 216 Ca 0.46 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.74 2jul h GLU 216 Cb 0.74 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.13 2jul h GLU 216 CO -0.22 0.17 0.33 -0.09 -0.73 0.00 0.00 179.01 178.48 2jul h ARG 217 N -0.51 0.53 -0.15 1.92 2.43 -0.39 0.31 114.38 118.52 2jul h ARG 217 Ca -0.02 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.97 2jul h ARG 217 Cb 0.41 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2jul h ARG 217 CO 0.03 0.35 -0.51 0.35 -1.51 0.00 0.00 179.97 178.68 2jul h PHE 218 N 0.55 0.80 0.00 2.20 3.04 -0.83 -2.49 116.94 120.20 2jul h PHE 218 Ca 0.20 -0.33 -0.13 0.00 3.98 0.00 0.00 57.97 61.70 2jul h PHE 218 Cb 0.13 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 2jul h PHE 218 CO -0.00 1.11 -0.61 0.35 -2.02 0.00 0.00 178.31 177.14 2jul h PHE 219 N 0.26 0.00 -0.32 0.41 3.57 -0.63 -1.70 116.94 118.53 2jul h PHE 219 Ca -0.02 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.36 2jul h PHE 219 Cb 1.14 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 2jul h PHE 219 CO 0.10 0.61 -0.30 0.37 -2.23 0.00 0.00 178.31 176.86 2jul h GLN 220 N 0.00 0.67 0.00 1.11 -0.00 -0.38 -2.79 115.11 113.72 2jul h GLN 220 Ca -0.01 -0.30 -0.11 0.00 -0.00 0.00 0.00 58.65 58.23 2jul h GLN 220 Cb 1.16 -0.02 -0.02 0.00 0.00 0.00 0.00 27.48 28.61 2jul h GLN 220 CO 0.08 0.89 -0.54 0.87 0.00 0.00 0.00 178.83 180.14 2jul h LYS 221 N 0.58 0.00 0.00 1.69 1.79 -1.33 -3.46 116.57 115.84 2jul h LYS 221 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2jul h LYS 221 Cb 0.80 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.45 2jul h LYS 221 CO 0.07 0.54 0.00 -0.12 -1.08 0.00 0.00 179.45 178.85 2jul n MET 222 N -3.25 3.25 0.00 3.15 1.56 -0.65 -4.95 117.12 116.23 2jul n MET 222 Ca 0.02 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.45 2jul n MET 222 Cb 0.74 0.00 0.00 0.00 2.15 0.00 0.00 33.22 36.11 2jul n MET 222 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2jul n ASP 223 N 0.00 0.00 0.00 6.12 2.03 -1.24 -4.73 116.55 118.72 2jul n ASP 223 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2jul n ASP 223 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 5.75 0.00 -1.13 -0.67 0.63 -1.26 -4.87 116.66 115.11 2jul n ARG 224 Ca 0.00 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.54 2jul n ARG 224 Cb 0.00 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 32.89 2jul n ARG 224 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2jul n ASN 225 N 2.95 -1.05 -0.57 6.15 6.94 -1.26 -4.55 115.26 123.87 2jul n ASN 225 Ca 0.00 0.91 0.46 0.00 -0.02 0.00 0.00 54.58 55.93 2jul n ASN 225 Cb 0.00 -0.77 0.77 0.00 -2.36 0.00 0.00 39.78 37.42 2jul n ASN 225 CO 0.00 0.00 0.00 0.06 -1.03 0.00 0.00 177.26 176.29 2jul h GLN 226 N 0.79 0.02 -0.45 -3.83 -0.00 -1.98 1.17 115.11 110.84 2jul h GLN 226 Ca -0.23 -0.00 0.13 0.00 -0.00 0.00 0.00 58.65 58.55 2jul h GLN 226 Cb 1.17 -0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.62 2jul h GLN 226 CO 0.46 0.01 0.59 0.38 -0.00 0.00 0.00 178.83 180.27 2jul h ASP 227 N 0.02 0.00 0.00 0.06 2.03 -1.95 -3.43 116.42 113.15 2jul h ASP 227 Ca 0.83 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 57.13 2jul h ASP 227 Cb 3.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 41.69 2jul h ASP 227 CO -0.10 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.72 2jul n GLY 228 N -1.49 0.38 3.90 7.15 0.00 0.40 -4.87 105.19 110.66 2jul n GLY 228 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 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 4.65 -0.06 1.61 -7.23 -1.26 -4.62 120.40 113.49 2jul s VAL 229 Ca 0.00 0.38 -0.09 0.00 -1.81 0.00 0.00 61.98 60.46 2jul s VAL 229 Cb 0.00 -3.80 -0.05 0.00 0.56 0.00 0.00 36.38 33.09 2jul s VAL 229 CO 0.00 -0.88 0.25 0.54 -0.31 0.00 0.00 175.10 174.70 2jul s VAL 230 N -2.92 5.32 0.23 1.32 0.11 -0.15 -4.76 120.40 119.55 2jul s VAL 230 Ca 0.51 0.40 0.08 0.00 -2.93 0.00 0.00 61.98 60.04 2jul s VAL 230 Cb -0.11 -3.53 -0.05 0.00 -1.53 0.00 0.00 36.38 31.17 2jul s VAL 230 CO 0.48 0.56 -0.13 0.42 -3.33 0.00 0.00 175.10 173.10 2jul s THR 231 N -1.10 1.79 0.30 5.04 -4.23 -1.26 -0.24 115.64 115.94 2jul s THR 231 Ca 0.20 -2.21 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 2jul s THR 231 Cb -0.14 -2.16 0.37 0.00 1.34 0.00 0.00 72.50 71.92 2jul s THR 231 CO 0.09 -0.51 1.60 -0.29 -0.54 0.00 0.00 174.62 174.96 2jul h ILE 232 N 2.47 0.12 0.23 2.99 6.09 -1.97 1.33 117.51 128.77 2jul h ILE 232 Ca -0.39 -0.02 -0.01 0.00 -1.37 0.00 0.00 64.86 63.07 2jul h ILE 232 Cb 1.23 0.05 0.00 0.00 0.47 0.00 0.00 36.82 38.57 2jul h ILE 232 CO 0.63 0.01 -0.11 -2.24 -3.07 0.00 0.00 178.15 173.37 2jul h ASP 233 N 0.06 -0.26 -0.41 2.19 3.04 -1.97 1.68 116.42 120.76 2jul h ASP 233 Ca 0.59 -0.08 -0.00 0.00 -3.24 0.00 0.00 57.03 54.30 2jul h ASP 233 Cb 1.23 0.07 -0.02 0.00 -1.04 0.00 0.00 39.33 39.57 2jul h ASP 233 CO -0.82 -0.09 0.25 -0.08 -2.04 0.00 0.00 179.24 176.46 2jul h GLU 234 N -0.42 0.57 0.09 4.15 4.81 -0.79 0.63 114.58 123.62 2jul h GLU 234 Ca -0.03 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 58.90 2jul h GLU 234 Cb 0.32 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2jul h GLU 234 CO 0.05 0.40 -1.14 0.35 -0.73 0.00 0.00 179.01 177.95 2jul h PHE 235 N 0.58 0.42 0.09 0.92 3.04 0.20 -2.61 116.94 119.58 2jul h PHE 235 Ca 0.15 -0.29 -0.26 0.00 3.98 0.00 0.00 57.97 61.56 2jul h PHE 235 Cb -0.02 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.47 2jul h PHE 235 CO 0.00 1.20 -1.16 1.25 -2.02 0.00 0.00 178.31 177.58 2jul h LEU 236 N 0.08 0.42 -0.60 0.59 5.85 0.32 -2.57 115.31 119.41 2jul h LEU 236 Ca -0.10 -0.42 -0.15 0.00 0.84 0.00 0.00 57.88 58.05 2jul h LEU 236 Cb 1.86 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.74 2jul h LEU 236 CO 0.18 1.30 -0.52 -0.08 -0.34 0.00 0.00 178.44 178.99 2jul h GLU 237 N 0.10 0.49 -0.08 1.25 4.57 0.16 -0.58 114.58 120.49 2jul h GLU 237 Ca -0.12 -0.29 -0.05 0.00 -1.18 0.00 0.00 59.36 57.73 2jul h GLU 237 Cb 1.87 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 30.48 2jul h GLU 237 CO 0.19 0.89 -0.13 1.15 -1.18 0.00 0.00 179.01 179.93 2jul h THR 238 N 0.38 1.40 0.03 0.32 2.02 -1.51 -2.87 112.91 112.69 2jul h THR 238 Ca 0.01 -1.39 -0.00 0.00 0.77 0.00 0.00 66.41 65.80 2jul h THR 238 Cb 1.03 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 2jul h THR 238 CO 0.09 0.39 -0.02 0.00 0.37 0.00 0.00 175.52 176.36 2jul h GLN 240 N -0.47 -0.35 -2.33 0.00 1.08 -1.20 -3.40 115.11 108.45 2jul h GLN 240 Ca -0.00 0.02 -0.32 0.00 -1.45 0.00 0.00 58.65 56.89 2jul h GLN 240 Cb 0.44 0.08 -0.34 0.00 -0.05 0.00 0.00 27.48 27.60 2jul h GLN 240 CO 0.01 -0.23 -0.63 -1.59 -0.95 0.00 0.00 178.83 175.44 2jul s LYS 241 N -5.93 0.26 0.00 1.46 -2.85 -1.08 -4.95 119.74 106.65 2jul s LYS 241 Ca -0.15 0.03 0.00 0.00 -1.00 0.00 0.00 55.97 54.85 2jul s LYS 241 Cb 0.11 -0.91 0.00 0.00 -2.06 0.00 0.00 37.83 34.98 2jul s LYS 241 CO 0.66 -0.85 0.00 -3.47 0.10 0.00 0.00 175.35 171.79 2jul n ASP 242 N 5.31 0.00 -3.54 0.03 -0.08 -1.18 -4.64 116.55 112.45 2jul n ASP 242 Ca -0.04 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.14 2jul n ASP 242 Cb 0.48 0.13 -0.04 0.00 2.34 0.00 0.00 41.12 44.03 2jul n ASP 242 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2jul s GLU 243 N -1.96 0.71 0.00 -0.67 2.56 -1.26 -4.99 118.70 113.09 2jul s GLU 243 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.97 54.94 2jul s GLU 243 Cb 0.00 0.33 0.00 0.00 2.00 0.00 0.00 34.13 36.46 2jul s GLU 243 CO 0.00 -0.26 0.59 0.09 -0.56 0.00 0.00 175.26 175.12 2jul n ASN 244 N 0.33 0.05 0.01 -1.70 3.02 -1.26 -3.67 115.26 112.04 2jul n ASN 244 Ca -0.10 -1.24 -0.12 0.00 -0.03 0.00 0.00 54.58 53.09 2jul n ASN 244 Cb 0.59 -0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.67 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 1.08 -0.07 2.41 6.09 -1.95 -1.77 117.51 123.30 2jul h ILE 245 Ca 0.00 -0.22 -0.11 0.00 -1.37 0.00 0.00 64.86 63.16 2jul h ILE 245 Cb 0.03 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.41 2jul h ILE 245 CO 0.00 0.06 -0.47 0.24 -3.07 0.00 0.00 178.15 174.91 2jul h MET 246 N 0.01 0.18 -0.60 2.19 2.86 -1.91 -2.08 114.93 115.58 2jul h MET 246 Ca 0.02 -0.09 0.06 0.00 -2.06 0.00 0.00 59.70 57.63 2jul h MET 246 Cb 0.08 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 2jul h MET 246 CO -0.00 0.61 0.40 -0.91 1.06 0.00 0.00 176.91 178.07 2jul h ASN 247 N 0.14 0.52 -0.44 1.22 4.21 -1.66 0.55 115.58 120.11 2jul h ASN 247 Ca 0.01 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.39 2jul h ASN 247 Cb 0.89 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.97 2jul h ASN 247 CO 0.07 0.34 -0.22 0.28 -1.29 0.00 0.00 177.43 176.61 2jul h SER 248 N 0.59 0.95 -0.69 5.81 0.02 -0.64 -2.83 113.55 116.76 2jul h SER 248 Ca 0.26 -0.40 0.08 0.00 -0.84 0.00 0.00 61.79 60.88 2jul h SER 248 Cb 0.27 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 2jul h SER 248 CO -0.08 1.14 0.36 -0.03 -1.14 0.00 0.00 176.83 177.08 2jul h MET 249 N 0.75 0.61 -0.54 3.45 1.85 -0.61 -0.43 114.93 120.01 2jul h MET 249 Ca 0.10 -0.04 0.07 0.00 -0.61 0.00 0.00 59.70 59.22 2jul h MET 249 Cb 0.79 -0.14 -0.06 0.00 0.43 0.00 0.00 31.60 32.62 2jul h MET 249 CO 0.07 0.40 0.22 1.96 -0.40 0.00 0.00 176.91 179.16 2jul h GLN 250 N 0.62 0.41 -0.29 0.39 1.08 -1.09 0.31 115.11 116.55 2jul h GLN 250 Ca 0.33 -0.02 0.08 0.00 -1.45 0.00 0.00 58.65 57.58 2jul h GLN 250 Cb 0.30 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 2jul h GLN 250 CO -0.24 0.27 0.20 -0.07 -0.95 0.00 0.00 178.83 178.05 2jul h LEU 251 N 0.42 0.03 -0.24 1.46 -0.00 -0.88 -1.12 115.31 114.98 2jul h LEU 251 Ca 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.13 2jul h LEU 251 Cb 0.26 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 40.90 2jul h LEU 251 CO -0.24 0.02 0.13 0.15 -0.00 0.00 0.00 178.44 178.49 2jul h PHE 252 N 0.03 0.33 -0.61 1.13 3.57 0.46 0.23 116.94 122.07 2jul h PHE 252 Ca 0.13 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 2jul h PHE 252 Cb 0.50 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 2jul h PHE 252 CO -0.00 0.29 0.14 1.49 -2.23 0.00 0.00 178.31 178.00 2jul h GLU 253 N 0.27 0.96 -0.24 1.11 4.81 -0.86 -0.89 114.58 119.73 2jul h GLU 253 Ca 0.08 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 59.00 2jul h GLU 253 Cb 0.07 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2jul h GLU 253 CO -0.01 0.86 -0.26 -0.91 -0.73 0.00 0.00 179.01 177.96 2jul h ASN 254 N 0.91 0.46 -0.47 1.04 4.21 -1.05 -3.42 115.58 117.25 2jul h ASN 254 Ca 0.19 -0.15 0.12 0.00 1.21 0.00 0.00 56.30 57.67 2jul h ASN 254 Cb 0.34 -0.12 -0.19 0.00 -1.12 0.00 0.00 38.32 37.23 2jul h ASN 254 CO 0.00 0.71 -0.16 0.54 -1.29 0.00 0.00 177.43 177.23 2jul s VAL 255 N -4.48 -0.47 -1.46 2.81 0.11 0.04 -5.11 120.40 111.84 2jul s VAL 255 Ca -0.07 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.98 2jul s VAL 255 Cb 0.14 -0.29 0.00 0.00 -1.53 0.00 0.00 36.38 34.70 2jul s VAL 255 CO 0.79 0.00 0.36 2.30 -3.33 0.00 0.00 175.10 175.22