#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rqs n ALA 48 N 0.00 3.74 -1.78 0.00 0.00 -1.26 -4.98 120.51 116.24 1rqs n ALA 48 Ca 0.00 -4.05 -0.37 0.00 0.00 0.00 0.00 53.44 49.02 1rqs n ALA 48 Cb 0.00 -3.33 -0.06 0.00 0.00 0.00 0.00 19.45 16.07 1rqs n ALA 48 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1rqs s GLU 49 N 2.86 4.51 0.28 0.00 0.41 -1.26 -5.05 118.70 120.45 1rqs s GLU 49 Ca 0.48 1.42 -0.05 0.00 -0.41 0.00 0.00 54.97 56.41 1rqs s GLU 49 Cb 0.01 -2.79 -0.05 0.00 -1.78 0.00 0.00 34.13 29.51 1rqs s GLU 49 CO 0.04 0.19 0.55 -1.21 -0.49 0.00 0.00 175.26 174.34 1rqs s GLU 50 N -2.06 3.64 -0.46 1.61 8.01 -1.26 -5.05 118.70 123.13 1rqs s GLU 50 Ca 0.51 0.02 0.03 0.00 0.01 0.00 0.00 54.97 55.54 1rqs s GLU 50 Cb -0.21 -2.65 0.22 0.00 -4.31 0.00 0.00 34.13 27.18 1rqs s GLU 50 CO 0.26 0.23 0.90 0.36 0.01 0.00 0.00 175.26 177.02 1rqs n LYS 51 N -0.87 0.51 -0.59 1.61 2.85 -1.26 -4.98 118.16 115.43 1rqs n LYS 51 Ca -0.02 -1.58 0.08 0.00 -1.05 0.00 0.00 58.31 55.74 1rqs n LYS 51 Cb 0.54 -1.08 0.32 0.00 -0.65 0.00 0.00 35.03 34.16 1rqs n LYS 51 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1rqs n THR 52 N 2.26 1.77 -3.47 0.58 -2.24 -1.26 -4.75 114.28 107.16 1rqs n THR 52 Ca 0.12 -1.07 -0.18 0.00 -2.27 0.00 0.00 64.05 60.65 1rqs n THR 52 Cb 0.62 -0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.72 1rqs n THR 52 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1rqs s GLU 53 N -1.96 0.22 0.07 -0.78 2.02 -1.26 -4.79 118.70 112.22 1rqs s GLU 53 Ca 0.46 0.12 0.03 0.00 0.02 0.00 0.00 54.97 55.60 1rqs s GLU 53 Cb 0.30 -1.10 -0.04 0.00 0.10 0.00 0.00 34.13 33.40 1rqs s GLU 53 CO 0.20 -0.73 0.08 -0.06 0.02 0.00 0.00 175.26 174.77 1rqs s PHE 54 N 2.33 3.20 -0.20 1.61 0.40 -1.00 -4.68 117.98 119.64 1rqs s PHE 54 Ca 0.08 0.09 -0.04 0.00 -0.60 0.00 0.00 56.93 56.45 1rqs s PHE 54 Cb -0.15 -1.63 -0.02 0.00 0.51 0.00 0.00 43.02 41.72 1rqs s PHE 54 CO -0.17 0.52 -0.03 -0.51 0.70 0.00 0.00 175.22 175.74 1rqs s ASP 55 N -2.32 4.60 -0.43 1.36 1.11 0.19 -0.47 116.67 120.70 1rqs s ASP 55 Ca 0.29 -0.27 -0.19 0.00 0.18 0.00 0.00 52.55 52.56 1rqs s ASP 55 Cb -0.12 -1.78 0.02 0.00 1.07 0.00 0.00 42.92 42.11 1rqs s ASP 55 CO 0.21 0.05 0.55 -0.69 1.18 0.00 0.00 175.17 176.47 1rqs s VAL 56 N 1.06 4.95 0.05 -1.27 1.01 -0.22 -1.71 120.40 124.27 1rqs s VAL 56 Ca 0.01 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.90 1rqs s VAL 56 Cb -0.15 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 1rqs s VAL 56 CO 0.01 -0.53 0.01 -0.63 0.00 0.00 0.00 175.10 173.96 1rqs s ILE 57 N 2.50 4.14 -0.23 2.22 1.01 0.01 -0.21 121.20 130.64 1rqs s ILE 57 Ca 0.17 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 59.98 1rqs s ILE 57 Cb -0.16 -2.92 -0.02 0.00 0.01 0.00 0.00 42.46 39.37 1rqs s ILE 57 CO 0.16 0.24 0.02 -0.22 0.00 0.00 0.00 174.94 175.14 1rqs s LEU 58 N -1.98 3.25 -0.19 2.97 2.96 0.90 -0.81 118.68 125.78 1rqs s LEU 58 Ca 0.23 -0.25 -0.15 0.00 -0.22 0.00 0.00 54.13 53.75 1rqs s LEU 58 Cb -0.12 -1.85 -0.09 0.00 0.50 0.00 0.00 46.19 44.64 1rqs s LEU 58 CO 0.15 0.00 -0.19 0.29 -1.32 0.00 0.00 176.35 175.28 1rqs n LYS 59 N 4.65 0.52 -3.69 1.98 5.02 -0.90 -1.33 118.16 124.42 1rqs n LYS 59 Ca -0.17 0.39 -0.17 0.00 -2.02 0.00 0.00 58.31 56.34 1rqs n LYS 59 Cb 0.51 -1.58 -0.16 0.00 -0.02 0.00 0.00 35.03 33.78 1rqs n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rqs s ALA 60 N -2.68 -0.01 0.44 7.82 0.00 -1.03 -4.45 121.76 121.84 1rqs s ALA 60 Ca -0.26 0.42 0.31 0.00 0.00 0.00 0.00 51.96 52.43 1rqs s ALA 60 Cb 0.06 -0.63 1.64 0.00 0.00 0.00 0.00 23.12 24.19 1rqs s ALA 60 CO 0.40 -0.42 2.13 0.00 0.00 0.00 0.00 175.76 177.87 1rqs h ALA 61 N 8.09 1.23 -0.24 0.00 0.00 -1.91 0.73 119.26 127.16 1rqs h ALA 61 Ca -0.21 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1rqs h ALA 61 Cb 1.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1rqs h ALA 61 CO 0.23 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.98 1rqs n GLY 62 N -0.73 -0.61 1.92 0.00 0.00 -1.26 -3.71 105.19 100.80 1rqs n GLY 62 Ca -0.02 -1.12 -0.18 0.00 0.00 0.00 0.00 46.02 44.70 1rqs n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rqs n ALA 63 N 3.10 5.16 -2.77 4.61 0.00 -1.25 -4.01 120.51 125.35 1rqs n ALA 63 Ca 0.00 -1.83 -0.09 0.00 0.00 0.00 0.00 53.44 51.52 1rqs n ALA 63 Cb 0.00 -1.40 0.08 0.00 0.00 0.00 0.00 19.45 18.12 1rqs n ALA 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rqs n ASN 64 N 0.16 -1.15 0.30 0.00 2.85 -1.24 -4.94 115.26 111.24 1rqs n ASN 64 Ca 0.33 -2.99 0.15 0.00 -0.11 0.00 0.00 54.58 51.97 1rqs n ASN 64 Cb 0.63 0.85 0.92 0.00 1.24 0.00 0.00 39.78 43.42 1rqs n ASN 64 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 1rqs h LYS 65 N 2.62 0.00 0.73 1.20 3.64 -1.75 -1.81 116.57 121.20 1rqs h LYS 65 Ca -0.14 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.20 1rqs h LYS 65 Cb 1.17 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1rqs h LYS 65 CO 0.16 0.01 -0.35 0.28 -2.27 0.00 0.00 179.45 177.28 1rqs h VAL 66 N 0.00 0.00 -0.61 2.00 2.07 -1.94 0.30 116.25 118.07 1rqs h VAL 66 Ca -0.00 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.35 1rqs h VAL 66 Cb 0.04 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.75 1rqs h VAL 66 CO 0.00 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.90 1rqs h ALA 67 N -1.32 0.80 0.51 1.67 0.00 -1.88 -1.57 119.26 117.47 1rqs h ALA 67 Ca -0.10 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1rqs h ALA 67 Cb 0.76 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1rqs h ALA 67 CO 0.17 -0.04 -0.47 0.28 0.00 0.00 0.00 179.25 179.19 1rqs h VAL 68 N 0.58 0.00 -1.05 0.00 2.07 -1.32 0.10 116.25 116.64 1rqs h VAL 68 Ca 0.28 0.00 0.27 0.00 0.82 0.00 0.00 66.70 68.07 1rqs h VAL 68 Cb 0.21 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.89 1rqs h VAL 68 CO -0.20 0.00 0.67 0.40 0.02 0.00 0.00 177.57 178.46 1rqs h ILE 69 N -0.97 0.51 0.21 4.57 2.04 -0.56 0.40 117.51 123.72 1rqs h ILE 69 Ca -0.07 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1rqs h ILE 69 Cb 0.83 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1rqs h ILE 69 CO -0.03 0.07 -0.10 0.11 0.00 0.00 0.00 178.15 178.20 1rqs h LYS 70 N 0.39 -0.28 -0.71 2.37 1.57 -0.35 -0.35 116.57 119.21 1rqs h LYS 70 Ca 0.60 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 59.49 1rqs h LYS 70 Cb 1.53 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.83 1rqs h LYS 70 CO -0.30 0.01 0.36 0.00 -0.57 0.00 0.00 179.45 178.94 1rqs h ALA 71 N 0.15 0.98 -0.23 3.86 0.00 0.21 0.42 119.26 124.67 1rqs h ALA 71 Ca -0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1rqs h ALA 71 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rqs h ALA 71 CO 0.05 -0.04 0.00 0.28 0.00 0.00 0.00 179.25 179.54 1rqs n VAL 72 N -4.86 0.00 -0.34 0.00 0.31 0.76 -0.33 118.33 113.87 1rqs n VAL 72 Ca 0.11 1.46 0.31 0.00 -0.01 0.00 0.00 64.34 66.21 1rqs n VAL 72 Cb 0.27 -2.46 0.65 0.00 -0.91 0.00 0.00 33.84 31.39 1rqs n VAL 72 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1rqs h ARG 73 N 0.00 0.16 -0.08 5.55 1.12 -0.91 0.79 114.38 121.00 1rqs h ARG 73 Ca 0.00 -0.01 -0.16 0.00 -1.11 0.00 0.00 59.98 58.70 1rqs h ARG 73 Cb 0.00 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 29.92 1rqs h ARG 73 CO 0.00 0.10 -0.64 0.78 -3.11 0.00 0.00 179.97 177.10 1rqs h GLY 74 N 0.16 0.34 1.44 2.80 0.00 0.13 0.64 103.07 108.58 1rqs h GLY 74 Ca 0.61 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 47.46 1rqs h GLY 74 CO -0.16 0.39 -0.68 0.00 0.00 0.00 0.00 176.54 176.10 1rqs h ALA 75 N 1.10 0.70 -1.58 3.60 0.00 0.34 -3.43 119.26 120.00 1rqs h ALA 75 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1rqs h ALA 75 Cb 1.17 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1rqs h ALA 75 CO 0.10 0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.82 1rqs n THR 76 N -2.91 0.00 0.00 0.00 -2.24 0.54 -5.07 114.28 104.59 1rqs n THR 76 Ca 0.00 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1rqs n THR 76 Cb 0.61 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 1rqs n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rqs n GLY 77 N 3.63 1.92 3.77 3.38 0.00 0.22 -5.01 105.19 113.09 1rqs n GLY 77 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1rqs n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rqs s LEU 78 N 0.00 3.50 0.48 0.99 1.43 -1.26 -4.96 118.68 118.86 1rqs s LEU 78 Ca 0.00 2.06 -0.23 0.00 -1.03 0.00 0.00 54.13 54.94 1rqs s LEU 78 Cb 0.00 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 41.57 1rqs s LEU 78 CO 0.00 -1.52 1.05 0.61 0.23 0.00 0.00 176.35 176.72 1rqs n GLY 79 N -0.29 -0.08 0.33 -3.19 0.00 -1.26 -4.60 105.19 96.10 1rqs n GLY 79 Ca 0.11 0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.29 1rqs n GLY 79 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rqs h LEU 80 N 1.33 -0.59 0.42 0.99 6.46 -1.99 0.20 115.31 122.13 1rqs h LEU 80 Ca -0.46 0.27 -0.02 0.00 -0.12 0.00 0.00 57.88 57.55 1rqs h LEU 80 Cb 1.34 0.50 0.00 0.00 -0.73 0.00 0.00 40.66 41.77 1rqs h LEU 80 CO 0.56 -0.32 -0.23 0.50 -0.62 0.00 0.00 178.44 178.33 1rqs h LYS 81 N 0.02 -0.58 -0.95 1.25 3.64 -1.99 0.22 116.57 118.17 1rqs h LYS 81 Ca 0.53 0.04 0.28 0.00 -1.27 0.00 0.00 60.65 60.22 1rqs h LYS 81 Cb 0.98 0.13 -0.17 0.00 -0.41 0.00 0.00 32.23 32.77 1rqs h LYS 81 CO -0.91 -0.39 0.14 0.93 -2.27 0.00 0.00 179.45 176.96 1rqs h GLU 82 N -0.60 0.06 -0.29 1.90 4.39 -1.40 0.77 114.58 119.40 1rqs h GLU 82 Ca -0.06 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1rqs h GLU 82 Cb 0.47 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1rqs h GLU 82 CO 0.08 0.04 0.12 0.00 -1.16 0.00 0.00 179.01 178.08 1rqs h ALA 83 N 1.92 0.38 0.18 3.43 0.00 -0.44 0.75 119.26 125.49 1rqs h ALA 83 Ca 0.61 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.41 1rqs h ALA 83 Cb 1.31 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1rqs h ALA 83 CO -0.83 -0.02 -0.28 -0.22 0.00 0.00 0.00 179.25 177.90 1rqs h LYS 84 N 0.32 -0.52 -0.37 0.00 3.64 0.26 -1.11 116.57 118.80 1rqs h LYS 84 Ca 0.10 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1rqs h LYS 84 Cb 0.18 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 1rqs h LYS 84 CO -0.01 -0.34 0.10 -0.44 -2.27 0.00 0.00 179.45 176.49 1rqs h ASP 85 N -0.53 0.07 -0.12 4.20 3.32 -0.71 0.16 116.42 122.81 1rqs h ASP 85 Ca 0.01 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.15 1rqs h ASP 85 Cb 0.53 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.08 1rqs h ASP 85 CO -0.12 0.08 -0.54 0.25 -1.72 0.00 0.00 179.24 177.18 1rqs h LEU 86 N 0.24 -1.72 -1.12 1.55 5.85 -0.38 0.42 115.31 120.15 1rqs h LEU 86 Ca 0.18 0.20 0.02 0.00 0.84 0.00 0.00 57.88 59.12 1rqs h LEU 86 Cb 0.18 0.67 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 1rqs h LEU 86 CO -0.21 -0.49 0.60 0.58 -0.34 0.00 0.00 178.44 178.58 1rqs h VAL 87 N -0.59 1.20 0.00 1.05 2.07 -0.77 -0.24 116.25 118.97 1rqs h VAL 87 Ca 0.03 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1rqs h VAL 87 Cb 0.68 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1rqs h VAL 87 CO -0.43 0.22 0.00 -0.33 0.02 0.00 0.00 177.57 177.05 1rqs h GLU 88 N 1.19 0.00 -0.41 1.57 4.39 0.94 -2.10 114.58 120.15 1rqs h GLU 88 Ca 0.34 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.03 1rqs h GLU 88 Cb -0.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 1rqs h GLU 88 CO -0.08 0.00 0.01 -1.13 -1.16 0.00 0.00 179.01 176.64 1rqs n SER 89 N -2.43 4.69 -4.47 1.42 3.41 0.13 -5.02 113.62 111.35 1rqs n SER 89 Ca 0.02 -3.01 -0.38 0.00 -0.26 0.00 0.00 58.87 55.25 1rqs n SER 89 Cb 0.27 -0.61 0.05 0.00 -0.26 0.00 0.00 64.21 63.65 1rqs n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rqs n ALA 90 N -0.04 -1.21 -1.62 7.33 0.00 -0.79 -4.48 120.51 119.71 1rqs n ALA 90 Ca 0.25 -0.08 -0.32 0.00 0.00 0.00 0.00 53.44 53.29 1rqs n ALA 90 Cb 1.05 -1.84 0.03 0.00 0.00 0.00 0.00 19.45 18.68 1rqs n ALA 90 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rqs s PRO 91 N -2.29 3.12 0.06 0.00 0.04 -1.26 -5.10 135.00 129.56 1rqs s PRO 91 Ca 0.68 1.05 -0.00 0.00 0.04 0.00 0.00 61.00 62.76 1rqs s PRO 91 Cb -0.42 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 1rqs s PRO 91 CO 0.55 -0.96 -0.04 0.00 0.04 0.00 0.00 177.00 176.59 1rqs s ALA 92 N -2.81 0.60 -0.32 8.56 0.00 -0.44 -4.98 121.76 122.37 1rqs s ALA 92 Ca 0.60 -1.24 -0.17 0.00 0.00 0.00 0.00 51.96 51.16 1rqs s ALA 92 Cb -0.15 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1rqs s ALA 92 CO 0.47 -0.34 0.44 0.00 0.00 0.00 0.00 175.76 176.34 1rqs s ALA 93 N -3.86 3.51 -0.14 0.00 0.00 -1.26 -0.07 121.76 119.94 1rqs s ALA 93 Ca 0.08 -0.98 -0.28 0.00 0.00 0.00 0.00 51.96 50.78 1rqs s ALA 93 Cb 0.07 -2.89 -0.25 0.00 0.00 0.00 0.00 23.12 20.06 1rqs s ALA 93 CO -0.09 -1.01 0.72 -0.07 0.00 0.00 0.00 175.76 175.31 1rqs h LEU 94 N 8.87 0.00 -7.99 0.00 3.38 -0.93 -3.48 115.31 115.15 1rqs h LEU 94 Ca -0.29 -0.95 -0.13 0.00 0.09 0.00 0.00 57.88 56.60 1rqs h LEU 94 Cb 1.14 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.72 1rqs h LEU 94 CO 0.72 1.01 -0.58 -0.54 0.09 0.00 0.00 178.44 179.15 1rqs s LYS 95 N -2.21 0.58 -0.08 1.13 1.02 -0.73 -4.93 119.74 114.52 1rqs s LYS 95 Ca -0.19 -0.88 0.00 0.00 0.02 0.00 0.00 55.97 54.92 1rqs s LYS 95 Cb -0.02 0.22 0.02 0.00 -0.52 0.00 0.00 37.83 37.53 1rqs s LYS 95 CO 0.67 -0.13 -0.06 -1.21 -0.92 0.00 0.00 175.35 173.69 1rqs s GLU 96 N -2.93 1.21 -1.05 1.68 2.02 -1.26 -1.06 118.70 117.32 1rqs s GLU 96 Ca -0.02 -0.18 -0.08 0.00 0.02 0.00 0.00 54.97 54.70 1rqs s GLU 96 Cb 0.01 -1.24 -0.05 0.00 0.10 0.00 0.00 34.13 32.95 1rqs s GLU 96 CO -0.06 -0.16 0.88 0.41 0.02 0.00 0.00 175.26 176.35 1rqs n GLY 97 N 4.49 -1.14 3.63 -1.39 0.00 -0.24 -4.96 105.19 105.58 1rqs n GLY 97 Ca -0.17 0.56 -0.24 0.00 0.00 0.00 0.00 46.02 46.17 1rqs n GLY 97 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rqs s VAL 98 N -3.38 2.71 0.43 1.61 -7.23 0.38 -4.71 120.40 110.21 1rqs s VAL 98 Ca 0.44 -1.97 -0.26 0.00 -1.81 0.00 0.00 61.98 58.38 1rqs s VAL 98 Cb -0.08 -2.79 -0.09 0.00 0.56 0.00 0.00 36.38 33.98 1rqs s VAL 98 CO 0.76 -0.22 1.42 -1.54 -0.31 0.00 0.00 175.10 175.21 1rqs n SER 99 N -0.94 3.29 -0.27 4.85 3.41 -1.26 -2.37 113.62 120.33 1rqs n SER 99 Ca -0.04 1.14 -0.05 0.00 -0.26 0.00 0.00 58.87 59.66 1rqs n SER 99 Cb 0.62 -1.59 0.06 0.00 -0.26 0.00 0.00 64.21 63.04 1rqs n SER 99 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1rqs h LYS 100 N 2.40 0.99 -0.75 4.33 3.64 -1.94 -0.57 116.57 124.68 1rqs h LYS 100 Ca -0.50 -0.09 0.08 0.00 -1.27 0.00 0.00 60.65 58.87 1rqs h LYS 100 Cb 1.27 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 32.83 1rqs h LYS 100 CO 0.61 0.70 0.49 -0.44 -2.27 0.00 0.00 179.45 178.54 1rqs h ASP 101 N 1.00 0.65 0.33 4.20 5.19 -1.99 0.24 116.42 126.04 1rqs h ASP 101 Ca 0.26 0.01 -0.23 0.00 -0.62 0.00 0.00 57.03 56.45 1rqs h ASP 101 Cb -0.04 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.34 1rqs h ASP 101 CO -0.05 0.41 -0.95 0.44 -3.12 0.00 0.00 179.24 175.97 1rqs h ASP 102 N 0.74 0.55 -0.17 6.45 3.32 -1.68 -0.77 116.42 124.86 1rqs h ASP 102 Ca 0.33 -0.44 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 1rqs h ASP 102 Cb 0.34 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1rqs h ASP 102 CO -0.12 1.24 0.03 0.00 -1.72 0.00 0.00 179.24 178.67 1rqs h ALA 103 N 0.73 0.22 -0.34 3.45 0.00 0.48 -2.61 119.26 121.19 1rqs h ALA 103 Ca -0.08 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1rqs h ALA 103 Cb 1.59 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1rqs h ALA 103 CO 0.16 -0.13 -0.47 1.49 0.00 0.00 0.00 179.25 180.31 1rqs h GLU 104 N 0.07 0.92 -0.54 0.00 4.81 -0.63 -1.33 114.58 117.87 1rqs h GLU 104 Ca 0.05 -0.53 0.07 0.00 -0.13 0.00 0.00 59.36 58.82 1rqs h GLU 104 Cb 0.29 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.65 1rqs h GLU 104 CO 0.00 1.18 0.20 0.00 -0.73 0.00 0.00 179.01 179.66 1rqs h ALA 105 N 0.73 0.67 -0.16 2.92 0.00 -1.08 0.12 119.26 122.46 1rqs h ALA 105 Ca 0.04 0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 1rqs h ALA 105 Cb 1.08 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1rqs h ALA 105 CO 0.11 -0.20 -0.69 1.25 0.00 0.00 0.00 179.25 179.73 1rqs h LEU 106 N 0.39 0.75 -0.35 0.00 5.85 -1.42 -2.92 115.31 117.60 1rqs h LEU 106 Ca 0.26 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.59 1rqs h LEU 106 Cb 0.29 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1rqs h LEU 106 CO -0.26 1.22 -0.01 0.50 -0.34 0.00 0.00 178.44 179.55 1rqs h LYS 107 N 0.46 0.08 -0.28 1.25 3.11 0.01 0.49 116.57 121.69 1rqs h LYS 107 Ca -0.02 -0.01 0.04 0.00 -2.81 0.00 0.00 60.65 57.85 1rqs h LYS 107 Cb 1.28 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.45 1rqs h LYS 107 CO 0.13 0.06 0.06 0.87 -2.81 0.00 0.00 179.45 177.76 1rqs h LYS 108 N 0.09 0.16 -0.74 1.90 1.57 -0.79 0.22 116.57 118.97 1rqs h LYS 108 Ca 0.17 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 1rqs h LYS 108 Cb 0.24 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 1rqs h LYS 108 CO -0.29 0.11 0.45 0.00 -0.57 0.00 0.00 179.45 179.15 1rqs h ALA 109 N 1.20 0.99 -0.76 3.86 0.00 -1.08 -0.02 119.26 123.46 1rqs h ALA 109 Ca 0.13 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1rqs h ALA 109 Cb 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1rqs h ALA 109 CO -0.17 0.21 0.31 -0.07 0.00 0.00 0.00 179.25 179.53 1rqs h LEU 110 N 0.86 1.04 -0.46 0.00 3.38 0.11 -1.85 115.31 118.40 1rqs h LEU 110 Ca 0.31 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1rqs h LEU 110 Cb 0.09 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1rqs h LEU 110 CO -0.14 0.92 0.18 -0.33 0.09 0.00 0.00 178.44 179.17 1rqs h GLU 111 N 1.09 0.68 -0.73 1.13 5.08 0.23 0.25 114.58 122.31 1rqs h GLU 111 Ca 0.25 -0.12 0.10 0.00 -1.00 0.00 0.00 59.36 58.59 1rqs h GLU 111 Cb 0.21 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.30 1rqs h GLU 111 CO -0.02 0.62 0.48 0.93 -1.00 0.00 0.00 179.01 180.02 1rqs h GLU 112 N 0.60 0.60 0.04 2.33 4.39 -0.50 -0.15 114.58 121.87 1rqs h GLU 112 Ca 0.15 -0.04 -0.23 0.00 0.34 0.00 0.00 59.36 59.59 1rqs h GLU 112 Cb 0.19 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1rqs h GLU 112 CO -0.01 0.40 -1.09 0.00 -1.16 0.00 0.00 179.01 177.14 1rqs h ALA 113 N 1.63 0.28 0.00 3.43 0.00 -0.71 -3.48 119.26 120.41 1rqs h ALA 113 Ca 0.34 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1rqs h ALA 113 Cb 0.50 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1rqs h ALA 113 CO -0.12 1.18 0.00 0.41 0.00 0.00 0.00 179.25 180.72 1rqs n GLY 114 N 1.41 0.79 3.30 0.00 0.00 0.74 -4.65 105.19 106.78 1rqs n GLY 114 Ca -0.03 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.23 1rqs n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rqs s ALA 115 N -1.65 1.74 -0.23 4.61 0.00 -0.37 -3.78 121.76 122.08 1rqs s ALA 115 Ca 0.00 -1.61 -0.05 0.00 0.00 0.00 0.00 51.96 50.30 1rqs s ALA 115 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 1rqs s ALA 115 CO 0.00 -0.07 -0.01 -2.00 0.00 0.00 0.00 175.76 173.67 1rqs s GLU 116 N -3.73 3.43 0.12 0.00 2.12 0.25 -4.32 118.70 116.56 1rqs s GLU 116 Ca 0.21 -0.60 0.10 0.00 0.36 0.00 0.00 54.97 55.04 1rqs s GLU 116 Cb 0.02 -3.09 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 1rqs s GLU 116 CO 0.04 -0.20 -0.26 0.08 -0.54 0.00 0.00 175.26 174.38 1rqs s VAL 117 N 1.51 2.14 -0.09 3.70 1.01 -1.26 -2.11 120.40 125.29 1rqs s VAL 117 Ca 0.06 -1.69 0.03 0.00 0.00 0.00 0.00 61.98 60.38 1rqs s VAL 117 Cb -0.14 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 1rqs s VAL 117 CO -0.02 0.08 -0.20 -0.70 0.00 0.00 0.00 175.10 174.27 1rqs s GLU 118 N -1.96 2.96 -0.20 2.72 2.56 0.01 -4.93 118.70 119.85 1rqs s GLU 118 Ca 0.12 -0.81 -0.05 0.00 0.00 0.00 0.00 54.97 54.23 1rqs s GLU 118 Cb -0.10 -2.37 -0.02 0.00 2.00 0.00 0.00 34.13 33.64 1rqs s GLU 118 CO 0.05 0.29 0.00 0.08 -0.56 0.00 0.00 175.26 175.13 1rqs s VAL 119 N 0.09 3.93 0.00 3.70 1.01 -1.26 -0.81 120.40 127.07 1rqs s VAL 119 Ca -0.09 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1rqs s VAL 119 Cb -0.15 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1rqs s VAL 119 CO 0.06 0.42 0.31 1.17 0.00 0.00 0.00 175.10 177.06