#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ex7 s GLY 65 N 0.00 1.92 0.41 0.55 0.00 -1.26 -4.62 107.32 104.32 3ex7 s GLY 65 Ca 0.00 0.47 -0.25 0.00 0.00 0.00 0.00 44.72 44.94 3ex7 s GLY 65 CO 0.00 0.83 1.06 -1.55 0.00 0.00 0.00 173.10 173.44 3ex7 n PRO 66 N -3.12 1.46 -4.32 2.90 -0.04 -1.26 -0.30 135.00 130.32 3ex7 n PRO 66 Ca 0.10 0.52 -0.34 0.00 -0.04 0.00 0.00 63.50 63.75 3ex7 n PRO 66 Cb 0.52 -2.09 -0.13 0.00 -0.04 0.00 0.00 33.50 31.76 3ex7 n PRO 66 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 3ex7 s GLN 67 N -2.01 3.55 0.25 0.54 2.00 0.55 -4.45 119.66 120.08 3ex7 s GLN 67 Ca 0.62 -0.57 -0.30 0.00 -2.00 0.00 0.00 55.36 53.11 3ex7 s GLN 67 Cb -0.56 -2.91 -0.09 0.00 0.80 0.00 0.00 33.01 30.26 3ex7 s GLN 67 CO 0.57 0.11 1.05 0.50 -0.50 0.00 0.00 175.29 177.02 3ex7 s ARG 68 N 0.69 4.69 0.85 1.67 3.52 -1.26 -4.55 118.95 124.56 3ex7 s ARG 68 Ca -0.03 1.70 -0.10 0.00 -0.13 0.00 0.00 55.73 57.17 3ex7 s ARG 68 Cb -0.15 -3.23 0.16 0.00 -1.56 0.00 0.00 34.95 30.17 3ex7 s ARG 68 CO 0.02 0.27 1.17 -1.12 -0.81 0.00 0.00 175.30 174.84 3ex7 s SER 69 N -0.81 3.74 0.25 -2.12 0.01 0.25 -4.98 113.70 110.04 3ex7 s SER 69 Ca 0.44 0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.74 3ex7 s SER 69 Cb -0.30 -0.29 0.45 0.00 0.21 0.00 0.00 66.02 66.09 3ex7 s SER 69 CO 0.37 -2.30 1.80 1.62 0.41 0.00 0.00 173.24 175.14 3ex7 h VAL 70 N -1.14 0.85 0.00 3.43 3.04 -2.03 -3.16 116.25 117.25 3ex7 h VAL 70 Ca -0.41 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 3ex7 h VAL 70 Cb 1.26 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 3ex7 h VAL 70 CO 0.41 0.14 0.00 -0.62 -1.01 0.00 0.00 177.57 176.49 3ex7 n GLU 71 N -4.78 2.41 -3.42 4.17 1.02 -1.26 -5.10 120.64 113.67 3ex7 n GLU 71 Ca 0.15 -1.32 0.00 0.00 -0.02 0.00 0.00 57.16 55.97 3ex7 n GLU 71 Cb 0.33 -0.95 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 3ex7 n GLU 71 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ex7 n GLY 72 N -0.41 -1.49 3.56 0.62 0.00 -1.19 -4.78 105.19 101.50 3ex7 n GLY 72 Ca 0.00 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.62 3ex7 n GLY 72 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ex7 s TRP 73 N -2.68 3.19 -0.16 1.61 0.52 0.17 -0.58 118.94 121.00 3ex7 s TRP 73 Ca 0.00 -0.09 -0.08 0.00 0.02 0.00 0.00 56.10 55.95 3ex7 s TRP 73 Cb 0.00 -2.22 -0.04 0.00 -1.15 0.00 0.00 33.47 30.06 3ex7 s TRP 73 CO 0.00 -0.12 0.12 0.42 0.02 0.00 0.00 176.95 177.39 3ex7 s ILE 74 N 1.20 5.29 -0.04 2.03 -1.09 -1.26 -1.49 121.20 125.83 3ex7 s ILE 74 Ca 0.05 0.14 0.01 0.00 -2.23 0.00 0.00 60.65 58.62 3ex7 s ILE 74 Cb -0.14 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.34 3ex7 s ILE 74 CO 0.04 0.51 -0.05 -0.76 -1.23 0.00 0.00 174.94 173.46 3ex7 s LEU 75 N -0.17 3.29 -0.20 2.97 1.43 0.88 -1.79 118.68 125.09 3ex7 s LEU 75 Ca 0.10 -0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.10 3ex7 s LEU 75 Cb -0.12 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 3ex7 s LEU 75 CO 0.01 0.33 0.08 0.12 0.23 0.00 0.00 176.35 177.12 3ex7 s PHE 76 N -0.91 3.26 -0.12 0.29 5.36 0.10 -1.37 117.98 124.58 3ex7 s PHE 76 Ca 0.15 0.07 0.02 0.00 -0.96 0.00 0.00 56.93 56.21 3ex7 s PHE 76 Cb -0.11 -2.13 0.01 0.00 -0.34 0.00 0.00 43.02 40.45 3ex7 s PHE 76 CO 0.04 0.11 -0.18 0.08 -1.46 0.00 0.00 175.22 173.81 3ex7 s VAL 77 N 0.58 1.74 0.38 3.12 1.01 0.60 -1.93 120.40 125.91 3ex7 s VAL 77 Ca 0.04 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.30 3ex7 s VAL 77 Cb -0.13 -1.56 -0.07 0.00 0.00 0.00 0.00 36.38 34.61 3ex7 s VAL 77 CO 0.01 0.49 0.00 0.28 0.00 0.00 0.00 175.10 175.88 3ex7 s THR 78 N 0.92 1.86 -1.05 3.92 -1.32 -0.57 -0.05 115.64 119.34 3ex7 s THR 78 Ca -0.07 -2.03 0.00 0.00 -1.21 0.00 0.00 61.69 58.38 3ex7 s THR 78 Cb -0.15 -2.88 0.00 0.00 -1.51 0.00 0.00 72.50 67.96 3ex7 s THR 78 CO -0.02 -0.04 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 3ex7 n GLY 79 N -0.87 0.03 3.74 6.08 0.00 -0.90 -1.65 105.19 111.62 3ex7 n GLY 79 Ca -0.04 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3ex7 n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ex7 s VAL 80 N -2.58 3.74 0.35 1.61 1.01 0.12 -4.49 120.40 120.16 3ex7 s VAL 80 Ca 0.00 1.50 -0.29 0.00 0.00 0.00 0.00 61.98 63.19 3ex7 s VAL 80 Cb 0.00 -3.96 -0.11 0.00 0.00 0.00 0.00 36.38 32.31 3ex7 s VAL 80 CO 0.00 0.26 1.48 -2.28 0.00 0.00 0.00 175.10 174.56 3ex7 s HIS 81 N -0.23 2.68 -0.08 5.22 5.65 -1.26 -4.43 115.29 122.84 3ex7 s HIS 81 Ca 0.50 1.13 0.30 0.00 0.25 0.00 0.00 55.06 57.24 3ex7 s HIS 81 Cb -0.31 -3.98 1.33 0.00 -1.18 0.00 0.00 32.58 28.45 3ex7 s HIS 81 CO 0.36 -2.94 1.89 1.49 -0.65 0.00 0.00 174.74 174.89 3ex7 h GLU 82 N 3.42 0.00 -0.08 2.88 4.81 -1.94 -2.05 114.58 121.62 3ex7 h GLU 82 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3ex7 h GLU 82 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3ex7 h GLU 82 CO 0.67 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 179.34 3ex7 n GLU 83 N -2.66 1.01 -0.91 1.92 1.02 -1.26 -2.18 120.64 117.58 3ex7 n GLU 83 Ca 0.00 -1.33 -0.33 0.00 -0.02 0.00 0.00 57.16 55.48 3ex7 n GLU 83 Cb 0.21 -1.22 0.12 0.00 -0.02 0.00 0.00 31.44 30.53 3ex7 n GLU 83 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ex7 n ALA 84 N 0.58 -1.87 -2.74 0.62 0.00 -0.77 -5.03 120.51 111.30 3ex7 n ALA 84 Ca 0.07 -0.50 -0.32 0.00 0.00 0.00 0.00 53.44 52.69 3ex7 n ALA 84 Cb 0.30 -1.91 -0.08 0.00 0.00 0.00 0.00 19.45 17.76 3ex7 n ALA 84 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ex7 s THR 85 N -2.30 1.26 0.25 0.00 -4.23 -1.26 -4.92 115.64 104.45 3ex7 s THR 85 Ca 0.62 -1.99 0.09 0.00 -1.18 0.00 0.00 61.69 59.22 3ex7 s THR 85 Cb -0.25 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.29 3ex7 s THR 85 CO 0.63 0.00 1.57 -0.08 -0.54 0.00 0.00 174.62 176.20 3ex7 h GLU 86 N 1.38 0.06 -0.24 3.99 4.81 -1.98 -2.54 114.58 120.05 3ex7 h GLU 86 Ca -0.44 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 58.63 3ex7 h GLU 86 Cb 1.31 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 3ex7 h GLU 86 CO 0.75 0.68 -0.34 1.49 -0.73 0.00 0.00 179.01 180.86 3ex7 h GLU 87 N 0.04 0.52 -0.51 1.92 4.81 -1.98 -0.85 114.58 118.53 3ex7 h GLU 87 Ca -0.01 -0.23 -0.09 0.00 -0.13 0.00 0.00 59.36 58.90 3ex7 h GLU 87 Cb 1.15 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 3ex7 h GLU 87 CO 0.09 0.79 -0.05 -0.44 -0.73 0.00 0.00 179.01 178.67 3ex7 h ASP 88 N 0.44 0.87 0.02 1.04 3.32 -1.86 0.13 116.42 120.38 3ex7 h ASP 88 Ca 0.05 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 3ex7 h ASP 88 Cb 0.80 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.12 3ex7 h ASP 88 CO 0.07 0.96 -0.01 0.40 -1.72 0.00 0.00 179.24 178.94 3ex7 h ILE 89 N 0.81 1.38 -0.32 0.35 1.08 -1.27 -2.59 117.51 116.96 3ex7 h ILE 89 Ca 0.14 -1.23 0.07 0.00 -0.39 0.00 0.00 64.86 63.45 3ex7 h ILE 89 Cb 0.55 2.21 -0.08 0.00 -3.07 0.00 0.00 36.82 36.44 3ex7 h ILE 89 CO 0.03 0.32 -0.19 -0.74 -0.69 0.00 0.00 178.15 176.88 3ex7 h HIS 90 N -0.56 -0.48 0.01 1.37 2.76 -1.07 -0.07 115.15 117.11 3ex7 h HIS 90 Ca -0.00 0.04 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 3ex7 h HIS 90 Cb 0.53 0.26 -0.06 0.00 1.55 0.00 0.00 27.41 29.70 3ex7 h HIS 90 CO 0.11 -0.27 -0.47 -0.44 -1.30 0.00 0.00 177.93 175.56 3ex7 h ASP 91 N -0.15 -1.43 -0.96 3.26 3.32 -0.95 1.20 116.42 120.71 3ex7 h ASP 91 Ca 0.17 0.17 0.13 0.00 0.02 0.00 0.00 57.03 57.51 3ex7 h ASP 91 Cb 0.40 0.55 -0.09 0.00 0.22 0.00 0.00 39.33 40.42 3ex7 h ASP 91 CO -0.41 -0.49 0.59 0.50 -1.72 0.00 0.00 179.24 177.70 3ex7 h LYS 92 N -0.63 0.88 0.00 3.56 1.63 -1.11 -3.17 116.57 117.73 3ex7 h LYS 92 Ca 0.03 -0.05 -0.24 0.00 -0.85 0.00 0.00 60.65 59.54 3ex7 h LYS 92 Cb 0.69 -0.20 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 3ex7 h LYS 92 CO -0.33 0.58 -1.80 1.19 -3.45 0.00 0.00 179.45 175.64 3ex7 n PHE 93 N -4.68 0.64 0.27 1.91 3.72 -0.07 -4.22 117.46 115.04 3ex7 n PHE 93 Ca 0.18 0.22 0.12 0.00 -0.05 0.00 0.00 57.45 57.93 3ex7 n PHE 93 Cb 0.37 -1.04 0.59 0.00 -0.94 0.00 0.00 39.48 38.47 3ex7 n PHE 93 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ex7 h ALA 94 N 1.26 1.00 0.00 4.37 0.00 0.15 -2.17 119.26 123.87 3ex7 h ALA 94 Ca -0.28 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3ex7 h ALA 94 Cb 1.82 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 3ex7 h ALA 94 CO 0.05 0.00 -0.14 0.93 0.00 0.00 0.00 179.25 180.09 3ex7 h GLU 95 N 0.00 0.00 -0.02 0.00 5.08 -1.73 -3.13 114.58 114.78 3ex7 h GLU 95 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3ex7 h GLU 95 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3ex7 h GLU 95 CO 0.00 0.14 -0.31 0.66 -1.00 0.00 0.00 179.01 178.50 3ex7 n TYR 96 N -4.02 0.00 0.00 4.33 4.02 -0.81 -5.02 117.16 115.65 3ex7 n TYR 96 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 3ex7 n TYR 96 Cb 0.23 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 3ex7 n TYR 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ex7 n GLY 97 N 1.37 -0.18 3.64 2.72 0.00 -1.19 -4.53 105.19 107.03 3ex7 n GLY 97 Ca 0.11 -1.26 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 3ex7 n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ex7 s GLU 98 N -2.00 4.05 -0.30 1.61 2.56 -1.26 -4.55 118.70 118.80 3ex7 s GLU 98 Ca 0.00 1.57 -0.28 0.00 0.00 0.00 0.00 54.97 56.26 3ex7 s GLU 98 Cb 0.00 -3.87 0.01 0.00 2.00 0.00 0.00 34.13 32.27 3ex7 s GLU 98 CO 0.00 -0.96 1.02 0.42 -0.56 0.00 0.00 175.26 175.18 3ex7 s ILE 99 N 4.13 4.59 -0.36 -3.70 1.01 -1.26 -4.19 121.20 121.43 3ex7 s ILE 99 Ca 0.60 1.71 0.23 0.00 0.00 0.00 0.00 60.65 63.19 3ex7 s ILE 99 Cb -0.22 -4.35 0.02 0.00 0.01 0.00 0.00 42.46 37.92 3ex7 s ILE 99 CO 0.21 -0.38 1.13 0.11 0.00 0.00 0.00 174.94 176.02 3ex7 h LYS 100 N 7.96 0.00 -1.41 2.79 1.79 -1.38 -3.48 116.57 122.84 3ex7 h LYS 100 Ca -0.21 0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.38 3ex7 h LYS 100 Cb 1.07 0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 31.45 3ex7 h LYS 100 CO 1.00 0.00 0.63 1.21 -1.08 0.00 0.00 179.45 181.21 3ex7 s ASN 101 N -5.07 -0.29 -0.03 0.86 3.84 -1.24 -5.00 114.94 108.02 3ex7 s ASN 101 Ca 0.02 0.48 0.01 0.00 0.21 0.00 0.00 52.86 53.58 3ex7 s ASN 101 Cb 0.10 0.46 0.01 0.00 -0.55 0.00 0.00 41.25 41.27 3ex7 s ASN 101 CO 0.77 -0.16 -0.05 -0.63 -2.79 0.00 0.00 177.10 174.25 3ex7 s ILE 102 N -0.31 0.47 -0.20 -5.21 -1.09 -1.26 -1.25 121.20 112.35 3ex7 s ILE 102 Ca 0.04 -0.15 -0.02 0.00 -2.23 0.00 0.00 60.65 58.28 3ex7 s ILE 102 Cb -0.03 -0.46 0.00 0.00 -1.58 0.00 0.00 42.46 40.38 3ex7 s ILE 102 CO -0.07 0.18 -0.10 -1.00 -1.23 0.00 0.00 174.94 172.72 3ex7 s HIS 103 N 0.50 2.88 -0.55 3.97 3.76 -0.24 -4.97 115.29 120.64 3ex7 s HIS 103 Ca -0.06 -1.14 0.02 0.00 -0.15 0.00 0.00 55.06 53.74 3ex7 s HIS 103 Cb -0.10 -2.02 0.14 0.00 1.11 0.00 0.00 32.58 31.71 3ex7 s HIS 103 CO -0.00 -0.60 0.31 -0.51 -0.85 0.00 0.00 174.74 173.09 3ex7 s LEU 104 N 1.30 4.54 0.09 0.89 1.43 -1.26 -1.18 118.68 124.49 3ex7 s LEU 104 Ca 0.04 -2.99 -0.30 0.00 -1.03 0.00 0.00 54.13 49.84 3ex7 s LEU 104 Cb -0.14 -1.69 -0.06 0.00 0.03 0.00 0.00 46.19 44.33 3ex7 s LEU 104 CO -0.05 -0.26 1.17 0.20 0.23 0.00 0.00 176.35 177.64 3ex7 s ASN 105 N -0.07 7.12 0.30 2.29 0.01 -1.26 -4.96 114.94 118.37 3ex7 s ASN 105 Ca 0.17 2.03 -0.24 0.00 -0.71 0.00 0.00 52.86 54.11 3ex7 s ASN 105 Cb -0.25 -2.58 -0.09 0.00 0.41 0.00 0.00 41.25 38.74 3ex7 s ASN 105 CO -0.01 -0.41 0.89 -0.76 -1.51 0.00 0.00 177.10 175.29 3ex7 s LEU 106 N 0.72 4.34 0.17 0.60 1.43 -1.26 -1.12 118.68 123.55 3ex7 s LEU 106 Ca 0.56 1.73 -0.32 0.00 -1.03 0.00 0.00 54.13 55.08 3ex7 s LEU 106 Cb -0.29 -3.90 -0.11 0.00 0.03 0.00 0.00 46.19 41.92 3ex7 s LEU 106 CO 0.31 -0.04 1.70 -0.62 0.23 0.00 0.00 176.35 177.93 3ex7 s ASP 107 N -1.62 6.46 0.43 2.29 -1.08 0.86 -4.56 116.67 119.46 3ex7 s ASP 107 Ca 0.48 2.75 0.24 0.00 -0.52 0.00 0.00 52.55 55.49 3ex7 s ASP 107 Cb -0.18 -2.59 0.51 0.00 -1.46 0.00 0.00 42.92 39.20 3ex7 s ASP 107 CO 0.23 -0.93 1.66 0.03 0.52 0.00 0.00 175.17 176.68 3ex7 h ARG 108 N 7.31 0.00 0.07 4.34 2.47 -1.96 -0.07 114.38 126.54 3ex7 h ARG 108 Ca -0.43 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.07 3ex7 h ARG 108 Cb 1.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 3ex7 h ARG 108 CO 0.94 0.09 -1.10 -0.09 0.56 0.00 0.00 179.97 180.37 3ex7 h ARG 109 N 0.00 0.16 -0.02 0.04 2.43 -1.95 -3.41 114.38 111.63 3ex7 h ARG 109 Ca -0.00 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 3ex7 h ARG 109 Cb 0.96 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3ex7 h ARG 109 CO 0.01 1.13 -0.35 0.25 -1.51 0.00 0.00 179.97 179.50 3ex7 n THR 110 N -4.16 0.00 -1.30 0.20 -2.24 -1.20 -4.96 114.28 100.62 3ex7 n THR 110 Ca -0.23 -0.32 -0.10 0.00 -2.27 0.00 0.00 64.05 61.12 3ex7 n THR 110 Cb 0.78 1.27 -0.04 0.00 -2.10 0.00 0.00 70.33 70.24 3ex7 n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ex7 n GLY 111 N 1.30 1.00 3.98 3.38 0.00 -0.05 -4.97 105.19 109.83 3ex7 n GLY 111 Ca 0.09 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 3ex7 n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ex7 s TYR 112 N -1.92 2.72 0.22 1.61 2.02 -1.26 -4.79 117.35 115.95 3ex7 s TYR 112 Ca 0.00 -0.44 -0.32 0.00 -0.37 0.00 0.00 57.07 55.94 3ex7 s TYR 112 Cb 0.00 -2.32 -0.13 0.00 -0.40 0.00 0.00 41.96 39.12 3ex7 s TYR 112 CO 0.00 -0.38 1.60 1.28 -1.57 0.00 0.00 175.55 176.48 3ex7 n LEU 113 N -1.79 3.66 0.24 -1.29 4.32 -0.92 0.30 117.00 121.52 3ex7 n LEU 113 Ca 0.07 1.10 0.10 0.00 -0.02 0.00 0.00 56.01 57.26 3ex7 n LEU 113 Cb 0.60 -1.51 0.63 0.00 -1.62 0.00 0.00 43.42 41.52 3ex7 n LEU 113 CO 0.40 -0.08 0.93 0.50 -1.22 0.00 0.00 177.39 177.92 3ex7 h LYS 114 N 5.60 0.00 0.00 3.23 1.63 -1.37 -3.41 116.57 122.26 3ex7 h LYS 114 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 3ex7 h LYS 114 Cb 1.24 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 3ex7 h LYS 114 CO 0.86 0.16 0.00 0.41 -3.45 0.00 0.00 179.45 177.43 3ex7 n GLY 115 N -0.75 1.21 3.38 5.01 0.00 -1.26 -4.95 105.19 107.84 3ex7 n GLY 115 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3ex7 n GLY 115 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ex7 s TYR 116 N -1.89 1.86 -0.00 1.61 -0.85 -1.26 0.16 117.35 116.98 3ex7 s TYR 116 Ca 0.00 -0.55 -0.09 0.00 -0.52 0.00 0.00 57.07 55.91 3ex7 s TYR 116 Cb 0.00 -0.89 0.01 0.00 0.38 0.00 0.00 41.96 41.45 3ex7 s TYR 116 CO 0.00 0.41 0.17 -0.08 -1.52 0.00 0.00 175.55 174.53 3ex7 s THR 117 N -2.90 0.07 -0.15 -3.49 -1.32 0.93 -4.06 115.64 104.72 3ex7 s THR 117 Ca 0.25 -0.61 -0.02 0.00 -1.21 0.00 0.00 61.69 60.10 3ex7 s THR 117 Cb -0.01 -0.46 -0.02 0.00 -1.51 0.00 0.00 72.50 70.51 3ex7 s THR 117 CO 0.09 -0.34 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.31 3ex7 s LEU 118 N -1.29 2.88 -0.08 9.08 2.01 -0.32 -0.29 118.68 130.67 3ex7 s LEU 118 Ca -0.14 -0.29 0.02 0.00 0.01 0.00 0.00 54.13 53.73 3ex7 s LEU 118 Cb -0.07 -1.68 0.01 0.00 0.01 0.00 0.00 46.19 44.47 3ex7 s LEU 118 CO 0.02 0.13 -0.13 -0.69 1.01 0.00 0.00 176.35 176.69 3ex7 s VAL 119 N 0.57 1.23 -0.09 -1.59 1.01 -0.47 -1.08 120.40 119.99 3ex7 s VAL 119 Ca -0.06 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.44 3ex7 s VAL 119 Cb -0.15 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 3ex7 s VAL 119 CO 0.03 0.38 -0.15 -0.70 0.00 0.00 0.00 175.10 174.66 3ex7 s GLU 120 N 0.88 2.91 0.35 2.72 2.12 -0.38 -0.08 118.70 127.22 3ex7 s GLU 120 Ca -0.10 -0.72 0.09 0.00 0.36 0.00 0.00 54.97 54.60 3ex7 s GLU 120 Cb -0.15 -2.46 -0.06 0.00 0.26 0.00 0.00 34.13 31.71 3ex7 s GLU 120 CO 0.01 0.40 -0.06 0.71 -0.54 0.00 0.00 175.26 175.78 3ex7 s TYR 121 N -0.15 2.44 0.11 5.30 1.51 -0.56 -0.94 117.35 125.06 3ex7 s TYR 121 Ca -0.01 -0.51 -0.09 0.00 -1.01 0.00 0.00 57.07 55.45 3ex7 s TYR 121 Cb -0.14 -1.45 -0.15 0.00 -0.11 0.00 0.00 41.96 40.11 3ex7 s TYR 121 CO 0.03 0.55 1.26 0.93 -1.11 0.00 0.00 175.55 177.21 3ex7 h GLU 122 N 1.95 0.55 -6.60 -0.62 5.08 -1.87 0.51 114.58 113.58 3ex7 h GLU 122 Ca -0.42 -0.58 -0.64 0.00 -1.00 0.00 0.00 59.36 56.71 3ex7 h GLU 122 Cb 1.25 0.16 -0.21 0.00 0.50 0.00 0.00 28.75 30.45 3ex7 h GLU 122 CO 0.71 1.21 -0.85 0.95 -1.00 0.00 0.00 179.01 180.03 3ex7 s THR 123 N -3.30 2.11 0.16 1.13 -4.23 -1.26 -4.45 115.64 105.79 3ex7 s THR 123 Ca -0.08 -1.76 -0.16 0.00 -1.18 0.00 0.00 61.69 58.51 3ex7 s THR 123 Cb 0.08 -1.90 0.05 0.00 1.34 0.00 0.00 72.50 72.07 3ex7 s THR 123 CO 0.89 -0.01 1.72 0.22 -0.54 0.00 0.00 174.62 176.90 3ex7 h TYR 124 N 3.77 0.06 -0.57 3.99 3.20 -1.97 -2.53 116.97 122.93 3ex7 h TYR 124 Ca -0.48 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.43 3ex7 h TYR 124 Cb 1.18 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.45 3ex7 h TYR 124 CO 0.62 -0.02 0.36 1.57 -1.64 0.00 0.00 178.16 179.05 3ex7 h LYS 125 N 0.16 0.70 0.06 1.82 2.10 -1.98 0.23 116.57 119.65 3ex7 h LYS 125 Ca 0.18 -0.04 0.03 0.00 -2.00 0.00 0.00 60.65 58.81 3ex7 h LYS 125 Cb 0.22 -0.16 -0.04 0.00 -0.90 0.00 0.00 32.23 31.35 3ex7 h LYS 125 CO -0.26 0.46 -0.27 0.93 -2.00 0.00 0.00 179.45 178.31 3ex7 h GLU 126 N 0.72 -0.43 -0.57 0.07 5.08 -1.74 0.13 114.58 117.83 3ex7 h GLU 126 Ca 0.22 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 3ex7 h GLU 126 Cb -0.03 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3ex7 h GLU 126 CO -0.07 -0.29 0.28 0.00 -1.00 0.00 0.00 179.01 177.94 3ex7 h ALA 127 N 0.32 0.74 -0.44 3.43 0.00 -0.99 -1.07 119.26 121.25 3ex7 h ALA 127 Ca 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3ex7 h ALA 127 Cb 0.50 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3ex7 h ALA 127 CO -0.20 0.29 0.16 0.37 0.00 0.00 0.00 179.25 179.87 3ex7 h GLN 128 N 0.78 0.66 -0.27 0.00 4.15 -0.38 -1.14 115.11 118.91 3ex7 h GLN 128 Ca 0.20 -0.13 0.01 0.00 0.77 0.00 0.00 58.65 59.49 3ex7 h GLN 128 Cb 0.10 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3ex7 h GLN 128 CO -0.03 0.63 0.17 0.00 -1.93 0.00 0.00 178.83 177.67 3ex7 h ALA 129 N 1.00 0.34 -0.86 3.38 0.00 -0.51 -1.05 119.26 121.57 3ex7 h ALA 129 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3ex7 h ALA 129 Cb 0.23 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 3ex7 h ALA 129 CO -0.01 -0.20 0.57 0.00 0.00 0.00 0.00 179.25 179.61 3ex7 h ALA 130 N 1.11 1.43 0.37 0.00 0.00 -1.03 -1.62 119.26 119.53 3ex7 h ALA 130 Ca 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3ex7 h ALA 130 Cb -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.45 3ex7 h ALA 130 CO -0.04 0.50 -0.18 1.98 0.00 0.00 0.00 179.25 181.52 3ex7 h MET 131 N 1.11 -0.48 -0.38 0.00 -1.53 -0.65 0.01 114.93 113.01 3ex7 h MET 131 Ca 0.33 0.03 -0.02 0.00 -3.44 0.00 0.00 59.70 56.60 3ex7 h MET 131 Cb -0.05 0.11 -0.02 0.00 -0.55 0.00 0.00 31.60 31.09 3ex7 h MET 131 CO -0.09 -0.22 0.14 0.93 0.14 0.00 0.00 176.91 177.81 3ex7 h GLU 132 N -0.69 0.54 0.00 0.39 5.08 -1.05 0.14 114.58 118.99 3ex7 h GLU 132 Ca -0.05 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3ex7 h GLU 132 Cb 0.49 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3ex7 h GLU 132 CO 0.08 0.46 -0.60 0.41 -1.00 0.00 0.00 179.01 178.37 3ex7 n GLY 133 N -1.17 -1.34 0.00 -3.84 0.00 -0.62 -4.27 105.19 93.95 3ex7 n GLY 133 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3ex7 n GLY 133 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ex7 n LEU 134 N -1.85 0.01 -4.69 0.99 4.77 -0.02 -4.83 117.00 111.38 3ex7 n LEU 134 Ca 0.04 -0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.47 3ex7 n LEU 134 Cb 0.40 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3ex7 n LEU 134 CO 0.36 0.00 1.28 0.21 -1.33 0.00 0.00 177.39 177.92 3ex7 s ASN 135 N -1.84 6.63 0.00 -1.43 3.84 0.46 -1.58 114.94 121.03 3ex7 s ASN 135 Ca -0.00 2.47 0.00 0.00 0.21 0.00 0.00 52.86 55.54 3ex7 s ASN 135 Cb 0.01 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.14 3ex7 s ASN 135 CO 0.04 -0.85 0.00 0.61 -2.79 0.00 0.00 177.10 174.10 3ex7 n GLY 136 N 3.91 3.06 0.31 1.21 0.00 0.83 -4.92 105.19 109.58 3ex7 n GLY 136 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 3ex7 n GLY 136 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ex7 n GLN 137 N -1.92 -2.12 -5.22 1.61 1.13 -0.61 -4.29 117.38 105.96 3ex7 n GLN 137 Ca 0.00 -0.14 -0.31 0.00 -1.94 0.00 0.00 57.00 54.60 3ex7 n GLN 137 Cb 0.00 -0.18 -0.17 0.00 0.11 0.00 0.00 30.24 30.01 3ex7 n GLN 137 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3ex7 s ASP 138 N -2.06 3.02 -0.20 1.08 2.15 -1.26 -1.32 116.67 118.08 3ex7 s ASP 138 Ca 0.06 -0.53 -0.01 0.00 0.43 0.00 0.00 52.55 52.51 3ex7 s ASP 138 Cb -0.01 -1.11 0.06 0.00 -0.30 0.00 0.00 42.92 41.55 3ex7 s ASP 138 CO 0.05 0.20 -0.01 -0.22 -0.17 0.00 0.00 175.17 175.02 3ex7 s LEU 139 N 0.11 1.79 -1.26 -1.34 0.20 0.13 -4.84 118.68 113.47 3ex7 s LEU 139 Ca -0.11 -0.93 -0.01 0.00 0.69 0.00 0.00 54.13 53.77 3ex7 s LEU 139 Cb -0.16 -0.87 0.00 0.00 -0.43 0.00 0.00 46.19 44.73 3ex7 s LEU 139 CO 0.06 -0.26 0.89 0.23 -0.29 0.00 0.00 176.35 176.98 3ex7 n MET 140 N 4.87 -5.97 -1.09 1.98 2.81 -1.26 -2.67 117.12 115.80 3ex7 n MET 140 Ca -0.11 0.75 -0.03 0.00 -1.81 0.00 0.00 57.70 56.50 3ex7 n MET 140 Cb 0.46 -5.58 -0.01 0.00 -0.71 0.00 0.00 33.22 27.38 3ex7 n MET 140 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ex7 n GLY 141 N -1.37 0.61 2.87 3.03 0.00 -1.26 -4.99 105.19 104.09 3ex7 n GLY 141 Ca -0.27 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 3ex7 n GLY 141 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3ex7 s GLN 142 N -1.59 0.04 0.38 1.61 0.74 -1.09 -5.14 119.66 114.61 3ex7 s GLN 142 Ca 0.00 0.19 -0.25 0.00 0.05 0.00 0.00 55.36 55.35 3ex7 s GLN 142 Cb 0.00 -0.11 -0.09 0.00 1.10 0.00 0.00 33.01 33.91 3ex7 s GLN 142 CO 0.00 -0.10 1.08 -1.25 -0.55 0.00 0.00 175.29 174.47 3ex7 s PRO 143 N 0.66 4.21 0.16 1.67 0.04 -1.26 0.21 135.00 140.70 3ex7 s PRO 143 Ca -0.05 1.61 0.10 0.00 0.04 0.00 0.00 61.00 62.69 3ex7 s PRO 143 Cb -0.07 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 3ex7 s PRO 143 CO -0.02 -0.12 -0.17 0.96 0.04 0.00 0.00 177.00 177.69 3ex7 s ILE 144 N -1.54 2.83 0.04 0.56 -4.36 -0.44 -4.71 121.20 113.59 3ex7 s ILE 144 Ca 0.56 -1.72 0.02 0.00 -0.26 0.00 0.00 60.65 59.25 3ex7 s ILE 144 Cb -0.25 -2.35 -0.04 0.00 1.25 0.00 0.00 42.46 41.07 3ex7 s ILE 144 CO 0.31 -0.04 0.06 -0.44 0.24 0.00 0.00 174.94 175.07 3ex7 s SER 145 N -2.55 5.46 -0.11 4.36 0.01 -0.66 -0.12 113.70 120.09 3ex7 s SER 145 Ca 0.21 0.02 -0.03 0.00 1.31 0.00 0.00 55.95 57.46 3ex7 s SER 145 Cb -0.09 -1.47 0.04 0.00 0.21 0.00 0.00 66.02 64.71 3ex7 s SER 145 CO 0.12 0.22 0.06 -0.69 0.41 0.00 0.00 173.24 173.35 3ex7 s VAL 146 N -1.28 0.05 0.12 3.43 1.01 -1.26 -1.52 120.40 120.96 3ex7 s VAL 146 Ca 0.26 0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 3ex7 s VAL 146 Cb -0.12 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 3ex7 s VAL 146 CO 0.17 0.00 0.02 -1.81 0.00 0.00 0.00 175.10 173.48 3ex7 s ASP 147 N 2.09 0.59 0.48 3.32 1.01 -0.81 -4.74 116.67 118.61 3ex7 s ASP 147 Ca 0.03 -1.14 -0.24 0.00 0.71 0.00 0.00 52.55 51.91 3ex7 s ASP 147 Cb -0.14 0.22 -0.07 0.00 1.01 0.00 0.00 42.92 43.94 3ex7 s ASP 147 CO -0.06 -0.65 1.40 0.26 0.21 0.00 0.00 175.17 176.34 3ex7 s TRP 148 N -3.91 2.41 -0.01 4.23 0.52 -1.26 0.02 118.94 120.93 3ex7 s TRP 148 Ca 0.19 1.30 -0.06 0.00 0.02 0.00 0.00 56.10 57.55 3ex7 s TRP 148 Cb 0.07 -3.88 -0.29 0.00 -1.15 0.00 0.00 33.47 28.22 3ex7 s TRP 148 CO -0.01 -2.91 0.81 0.00 0.02 0.00 0.00 176.95 174.85 3ex7 s PHE 150 N -2.60 1.96 0.26 0.00 0.40 -1.26 -4.95 117.98 111.79 3ex7 s PHE 150 Ca -0.11 -0.39 0.08 0.00 -0.60 0.00 0.00 56.93 55.91 3ex7 s PHE 150 Cb 0.06 -1.17 -0.05 0.00 0.51 0.00 0.00 43.02 42.36 3ex7 s PHE 150 CO 0.86 0.10 -0.10 0.14 0.70 0.00 0.00 175.22 176.92 3ex7 s VAL 151 N -0.79 1.80 -0.13 -0.44 -7.23 -1.26 -0.33 120.40 112.02 3ex7 s VAL 151 Ca 0.09 -2.19 0.30 0.00 -1.81 0.00 0.00 61.98 58.37 3ex7 s VAL 151 Cb -0.09 -2.33 0.36 0.00 0.56 0.00 0.00 36.38 34.88 3ex7 s VAL 151 CO 0.02 -0.39 1.85 0.03 -0.31 0.00 0.00 175.10 176.30 3ex7 h ARG 152 N 2.34 0.00 0.00 4.82 3.08 -0.87 -3.41 114.38 120.34 3ex7 h ARG 152 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 3ex7 h ARG 152 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.28 3ex7 h ARG 152 CO 0.65 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.96 3ex7 n GLY 153 N 0.38 1.05 3.75 0.04 0.00 -1.26 -5.03 105.19 104.12 3ex7 n GLY 153 Ca 0.02 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 3ex7 n GLY 153 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ex7 s PRO 154 N -1.14 2.53 0.55 1.61 0.02 -1.26 -4.70 135.00 132.62 3ex7 s PRO 154 Ca 0.00 1.50 -0.22 0.00 0.02 0.00 0.00 61.00 62.30 3ex7 s PRO 154 Cb 0.00 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.57 3ex7 s PRO 154 CO 0.00 -1.48 1.37 -2.30 -0.33 0.00 0.00 177.00 174.26 3ex7 n PRO 155 N -2.60 1.69 0.31 5.54 -0.02 -1.26 -4.57 135.00 134.09 3ex7 n PRO 155 Ca 0.11 0.62 0.19 0.00 -2.02 0.00 0.00 63.50 62.41 3ex7 n PRO 155 Cb 0.51 -2.59 1.01 0.00 -0.02 0.00 0.00 33.50 32.41 3ex7 n PRO 155 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3ex7 h LYS 156 N 1.41 0.00 0.00 -0.52 1.79 -2.01 -3.49 116.57 113.75 3ex7 h LYS 156 Ca -0.51 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.96 3ex7 h LYS 156 Cb 1.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.95 3ex7 h LYS 156 CO 0.57 0.02 0.00 0.41 -1.08 0.00 0.00 179.45 179.37