#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 -2.11 -2.86 0.00 0.00 -1.26 -5.02 120.51 109.27 1rqs n ALA 48 Ca 0.00 0.10 -0.24 0.00 0.00 0.00 0.00 53.44 53.30 1rqs n ALA 48 Cb 0.00 -4.64 -0.04 0.00 0.00 0.00 0.00 19.45 14.77 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 -4.25 3.07 -1.33 0.00 2.02 -1.26 -5.02 118.70 111.93 1rqs s GLU 49 Ca 0.34 -0.89 -0.13 0.00 0.02 0.00 0.00 54.97 54.31 1rqs s GLU 49 Cb -0.04 -2.69 0.11 0.00 0.10 0.00 0.00 34.13 31.60 1rqs s GLU 49 CO 0.61 0.45 1.89 0.39 0.02 0.00 0.00 175.26 178.62 1rqs n GLU 50 N -0.87 3.26 -3.81 1.61 1.02 -1.26 -4.89 120.64 115.69 1rqs n GLU 50 Ca -0.08 -3.24 -0.36 0.00 -0.02 0.00 0.00 57.16 53.46 1rqs n GLU 50 Cb 0.56 -3.16 -0.12 0.00 -0.02 0.00 0.00 31.44 28.69 1rqs n GLU 50 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1rqs s LYS 51 N 2.17 2.29 -0.01 3.49 2.47 -1.26 -4.89 119.74 124.00 1rqs s LYS 51 Ca 0.45 -1.50 0.17 0.00 -1.56 0.00 0.00 55.97 53.53 1rqs s LYS 51 Cb 0.08 -3.44 -0.21 0.00 -1.46 0.00 0.00 37.83 32.81 1rqs s LYS 51 CO -0.01 -0.84 0.60 0.25 0.16 0.00 0.00 175.35 175.51 1rqs n THR 52 N 4.66 0.00 -3.81 3.43 -2.24 -1.26 -4.89 114.28 110.18 1rqs n THR 52 Ca -0.08 -0.20 -0.36 0.00 -2.27 0.00 0.00 64.05 61.14 1rqs n THR 52 Cb 0.43 0.72 -0.13 0.00 -2.10 0.00 0.00 70.33 69.25 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 -2.75 3.49 0.17 -0.78 2.02 -1.26 -4.14 118.70 115.45 1rqs s GLU 53 Ca 0.02 -0.57 0.05 0.00 0.02 0.00 0.00 54.97 54.49 1rqs s GLU 53 Cb 0.12 -3.22 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 1rqs s GLU 53 CO 0.69 -0.22 0.17 -0.06 0.02 0.00 0.00 175.26 175.85 1rqs s PHE 54 N 1.56 3.21 -0.13 1.61 0.40 -0.52 -4.67 117.98 119.43 1rqs s PHE 54 Ca 0.06 -0.00 -0.02 0.00 -0.60 0.00 0.00 56.93 56.37 1rqs s PHE 54 Cb -0.15 -1.53 -0.03 0.00 0.51 0.00 0.00 43.02 41.82 1rqs s PHE 54 CO 0.01 0.52 -0.06 -0.51 0.70 0.00 0.00 175.22 175.88 1rqs s ASP 55 N -3.18 4.66 -0.31 1.36 1.01 0.36 -0.13 116.67 120.42 1rqs s ASP 55 Ca 0.32 -0.12 -0.05 0.00 0.71 0.00 0.00 52.55 53.40 1rqs s ASP 55 Cb -0.10 -1.58 0.03 0.00 1.01 0.00 0.00 42.92 42.28 1rqs s ASP 55 CO 0.24 0.23 0.06 -0.69 0.21 0.00 0.00 175.17 175.23 1rqs s VAL 56 N -0.00 3.63 0.00 -1.27 1.01 -0.13 -2.21 120.40 121.42 1rqs s VAL 56 Ca -0.00 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.96 1rqs s VAL 56 Cb -0.13 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1rqs s VAL 56 CO 0.03 -0.05 0.04 -0.63 0.00 0.00 0.00 175.10 174.49 1rqs s ILE 57 N 1.40 4.44 -0.38 2.22 1.09 -0.22 -1.32 121.20 128.43 1rqs s ILE 57 Ca -0.01 -0.52 -0.16 0.00 -1.10 0.00 0.00 60.65 58.86 1rqs s ILE 57 Cb -0.19 -3.01 0.00 0.00 -1.06 0.00 0.00 42.46 38.21 1rqs s ILE 57 CO 0.01 0.35 0.39 -0.22 -0.10 0.00 0.00 174.94 175.38 1rqs s LEU 58 N -1.68 4.67 -0.10 2.97 0.20 0.11 -1.02 118.68 123.83 1rqs s LEU 58 Ca 0.21 -0.47 -0.05 0.00 0.69 0.00 0.00 54.13 54.52 1rqs s LEU 58 Cb -0.12 -2.35 -0.02 0.00 -0.43 0.00 0.00 46.19 43.28 1rqs s LEU 58 CO 0.12 -0.45 -0.09 0.11 -0.29 0.00 0.00 176.35 175.75 1rqs h LYS 59 N 8.59 0.00 -3.39 1.98 1.79 -1.72 -1.29 116.57 122.53 1rqs h LYS 59 Ca -0.28 0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 57.89 1rqs h LYS 59 Cb 1.13 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 31.43 1rqs h LYS 59 CO 0.74 0.00 -0.70 0.00 -1.08 0.00 0.00 179.45 178.41 1rqs s ALA 60 N -2.75 0.02 0.42 3.86 0.00 -1.03 -4.35 121.76 117.94 1rqs s ALA 60 Ca -0.07 0.38 0.28 0.00 0.00 0.00 0.00 51.96 52.55 1rqs s ALA 60 Cb 0.01 -0.41 1.49 0.00 0.00 0.00 0.00 23.12 24.22 1rqs s ALA 60 CO 0.11 -0.23 2.09 0.00 0.00 0.00 0.00 175.76 177.73 1rqs h ALA 61 N 7.59 1.29 -0.23 0.00 0.00 -1.90 0.97 119.26 126.99 1rqs h ALA 61 Ca -0.36 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1rqs h ALA 61 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1rqs h ALA 61 CO 0.38 0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.17 1rqs n GLY 62 N -0.73 -0.50 1.93 0.00 0.00 -1.26 -3.69 105.19 100.94 1rqs n GLY 62 Ca -0.02 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.72 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 3.58 5.17 -2.81 4.61 0.00 -1.26 -4.08 120.51 125.72 1rqs n ALA 63 Ca 0.00 -1.92 -0.10 0.00 0.00 0.00 0.00 53.44 51.42 1rqs n ALA 63 Cb 0.00 -1.41 0.07 0.00 0.00 0.00 0.00 19.45 18.10 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 0.05 -1.22 0.26 0.00 4.05 -1.24 -4.95 115.26 112.21 1rqs n ASN 64 Ca 0.35 -3.16 0.12 0.00 0.45 0.00 0.00 54.58 52.34 1rqs n ASN 64 Cb 0.68 0.95 0.72 0.00 1.23 0.00 0.00 39.78 43.36 1rqs n ASN 64 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 177.26 174.71 1rqs h LYS 65 N 2.76 0.00 0.40 1.20 3.64 -1.76 -1.94 116.57 120.86 1rqs h LYS 65 Ca -0.10 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1rqs h LYS 65 Cb 1.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1rqs h LYS 65 CO 0.19 0.10 -0.19 0.28 -2.27 0.00 0.00 179.45 177.56 1rqs h VAL 66 N 0.00 0.00 -0.91 2.00 2.07 -1.94 0.69 116.25 118.16 1rqs h VAL 66 Ca -0.00 -0.14 0.12 0.00 0.82 0.00 0.00 66.70 67.50 1rqs h VAL 66 Cb 0.25 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.94 1rqs h VAL 66 CO 0.01 0.00 0.53 0.00 0.02 0.00 0.00 177.57 178.14 1rqs h ALA 67 N -1.61 1.35 0.59 1.67 0.00 -1.95 -1.31 119.26 118.00 1rqs h ALA 67 Ca -0.06 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1rqs h ALA 67 Cb 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1rqs h ALA 67 CO 0.09 0.09 -0.45 0.28 0.00 0.00 0.00 179.25 179.26 1rqs h VAL 68 N 0.83 0.09 -0.99 0.00 2.07 -1.31 0.11 116.25 117.04 1rqs h VAL 68 Ca 0.46 0.00 0.24 0.00 0.82 0.00 0.00 66.70 68.22 1rqs h VAL 68 Cb 0.51 0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.29 1rqs h VAL 68 CO -0.29 0.00 0.64 0.40 0.02 0.00 0.00 177.57 178.35 1rqs h ILE 69 N -1.02 0.59 0.16 4.57 1.08 -0.02 0.41 117.51 123.29 1rqs h ILE 69 Ca -0.07 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 64.25 1rqs h ILE 69 Cb 0.85 0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.75 1rqs h ILE 69 CO 0.01 0.08 -0.08 0.11 -0.69 0.00 0.00 178.15 177.58 1rqs h LYS 70 N 0.42 -0.21 -0.85 2.37 1.57 -0.38 -1.22 116.57 118.26 1rqs h LYS 70 Ca 0.54 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.43 1rqs h LYS 70 Cb 1.36 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 33.64 1rqs h LYS 70 CO -0.25 0.09 0.50 0.00 -0.57 0.00 0.00 179.45 179.22 1rqs h ALA 71 N 0.25 1.21 -1.08 3.86 0.00 0.19 0.26 119.26 123.96 1rqs h ALA 71 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rqs h ALA 71 Cb 0.40 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1rqs h ALA 71 CO 0.04 0.14 0.00 0.28 0.00 0.00 0.00 179.25 179.71 1rqs n VAL 72 N -4.71 0.00 -0.25 0.00 0.31 0.11 -0.06 118.33 113.72 1rqs n VAL 72 Ca 0.14 1.31 0.30 0.00 -0.01 0.00 0.00 64.34 66.08 1rqs n VAL 72 Cb 0.27 -2.31 0.70 0.00 -0.91 0.00 0.00 33.84 31.59 1rqs n VAL 72 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 1rqs h ARG 73 N 0.00 0.06 -0.09 5.55 0.11 -1.18 0.69 114.38 119.53 1rqs h ARG 73 Ca 0.00 -0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.92 1rqs h ARG 73 Cb 0.00 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.06 1rqs h ARG 73 CO 0.00 0.04 -0.62 0.78 0.10 0.00 0.00 179.97 180.27 1rqs h GLY 74 N 0.06 0.35 1.35 0.08 0.00 -0.25 0.66 103.07 105.32 1rqs h GLY 74 Ca 0.50 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 1rqs h GLY 74 CO -0.05 0.39 -0.83 0.00 0.00 0.00 0.00 176.54 176.06 1rqs h ALA 75 N 1.11 0.66 -1.73 3.60 0.00 0.39 -3.43 119.26 119.86 1rqs h ALA 75 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rqs h ALA 75 Cb 1.15 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1rqs h ALA 75 CO 0.10 0.33 0.00 0.25 0.00 0.00 0.00 179.25 179.94 1rqs n THR 76 N -2.90 0.00 0.00 0.00 -2.24 0.63 -5.07 114.28 104.70 1rqs n THR 76 Ca -0.01 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1rqs n THR 76 Cb 0.65 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 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 3.49 1.93 3.77 3.38 0.00 0.23 -5.01 105.19 112.98 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 3.56 0.48 0.99 1.43 -1.26 -4.95 118.68 118.93 1rqs s LEU 78 Ca 0.00 2.12 -0.22 0.00 -1.03 0.00 0.00 54.13 55.00 1rqs s LEU 78 Cb 0.00 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.56 1rqs s LEU 78 CO 0.00 -1.49 1.01 0.61 0.23 0.00 0.00 176.35 176.72 1rqs n GLY 79 N -0.11 -0.19 0.34 -3.19 0.00 -1.26 -4.57 105.19 96.21 1rqs n GLY 79 Ca 0.11 0.05 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 1.25 -0.61 0.43 0.99 7.12 -1.99 0.23 115.31 122.72 1rqs h LEU 80 Ca -0.46 0.27 -0.02 0.00 0.13 0.00 0.00 57.88 57.80 1rqs h LEU 80 Cb 1.34 0.51 0.00 0.00 -0.53 0.00 0.00 40.66 41.99 1rqs h LEU 80 CO 0.55 -0.32 -0.22 0.50 -0.13 0.00 0.00 178.44 178.81 1rqs h LYS 81 N 0.02 -0.58 -0.96 1.25 3.64 -1.99 0.39 116.57 118.35 1rqs h LYS 81 Ca 0.53 0.04 0.25 0.00 -1.27 0.00 0.00 60.65 60.20 1rqs h LYS 81 Cb 0.99 0.13 -0.18 0.00 -0.41 0.00 0.00 32.23 32.77 1rqs h LYS 81 CO -0.92 -0.38 0.01 0.93 -2.27 0.00 0.00 179.45 176.81 1rqs h GLU 82 N -0.60 0.03 -0.26 1.90 4.39 -1.38 0.76 114.58 119.40 1rqs h GLU 82 Ca -0.06 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1rqs h GLU 82 Cb 0.46 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1rqs h GLU 82 CO 0.09 0.02 0.14 0.00 -1.16 0.00 0.00 179.01 178.09 1rqs h ALA 83 N 1.94 0.34 0.25 3.43 0.00 -0.42 0.17 119.26 124.97 1rqs h ALA 83 Ca 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1rqs h ALA 83 Cb 1.12 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1rqs h ALA 83 CO -0.89 -0.12 -0.29 -0.22 0.00 0.00 0.00 179.25 177.73 1rqs h LYS 84 N 0.30 -0.56 -0.41 0.00 3.64 0.26 -1.18 116.57 118.63 1rqs h LYS 84 Ca 0.09 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1rqs h LYS 84 Cb 0.09 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.98 1rqs h LYS 84 CO -0.01 -0.37 0.10 -0.44 -2.27 0.00 0.00 179.45 176.46 1rqs h ASP 85 N -0.58 0.06 -0.08 4.20 5.19 -0.50 0.14 116.42 124.86 1rqs h ASP 85 Ca -0.00 0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.50 1rqs h ASP 85 Cb 0.55 0.07 -0.06 0.00 0.18 0.00 0.00 39.33 40.07 1rqs h ASP 85 CO -0.08 0.07 -0.53 0.25 -3.12 0.00 0.00 179.24 175.83 1rqs h LEU 86 N 0.24 -1.66 -1.03 1.55 6.46 -0.20 0.69 115.31 121.36 1rqs h LEU 86 Ca 0.19 0.19 0.02 0.00 -0.12 0.00 0.00 57.88 58.17 1rqs h LEU 86 Cb 0.22 0.64 -0.05 0.00 -0.73 0.00 0.00 40.66 40.74 1rqs h LEU 86 CO -0.23 -0.50 0.65 0.58 -0.62 0.00 0.00 178.44 178.32 1rqs h VAL 87 N -0.61 1.21 0.00 1.05 2.07 -0.79 0.23 116.25 119.41 1rqs h VAL 87 Ca 0.03 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1rqs h VAL 87 Cb 0.70 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1rqs h VAL 87 CO -0.40 0.24 0.00 -0.62 0.02 0.00 0.00 177.57 176.80 1rqs n GLU 88 N -4.41 0.20 -0.60 1.57 -0.58 0.46 -2.01 120.64 115.27 1rqs n GLU 88 Ca 0.12 0.37 0.08 0.00 -0.42 0.00 0.00 57.16 57.31 1rqs n GLU 88 Cb 0.05 -1.84 0.31 0.00 -0.57 0.00 0.00 31.44 29.40 1rqs n GLU 88 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1rqs n SER 89 N -2.21 4.53 -4.53 1.62 3.41 0.23 -5.02 113.62 111.65 1rqs n SER 89 Ca 0.03 -2.99 -0.37 0.00 -0.26 0.00 0.00 58.87 55.28 1rqs n SER 89 Cb 0.27 -0.59 0.06 0.00 -0.26 0.00 0.00 64.21 63.69 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 -0.11 -0.68 -1.59 7.33 0.00 -0.85 -4.46 120.51 120.14 1rqs n ALA 90 Ca 0.24 -0.09 -0.31 0.00 0.00 0.00 0.00 53.44 53.27 1rqs n ALA 90 Cb 1.00 -1.96 0.04 0.00 0.00 0.00 0.00 19.45 18.53 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 -2.65 3.02 0.08 0.00 0.04 -1.26 -5.10 135.00 129.13 1rqs s PRO 91 Ca 0.71 0.99 -0.01 0.00 0.04 0.00 0.00 61.00 62.73 1rqs s PRO 91 Cb -0.40 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1rqs s PRO 91 CO 0.52 -1.04 -0.00 0.00 0.04 0.00 0.00 177.00 176.52 1rqs s ALA 92 N -2.95 0.64 -0.38 8.56 0.00 -0.49 -4.98 121.76 122.16 1rqs s ALA 92 Ca 0.59 -1.30 -0.19 0.00 0.00 0.00 0.00 51.96 51.05 1rqs s ALA 92 Cb -0.14 0.47 0.01 0.00 0.00 0.00 0.00 23.12 23.46 1rqs s ALA 92 CO 0.52 -0.41 0.57 0.00 0.00 0.00 0.00 175.76 176.44 1rqs s ALA 93 N -3.96 3.43 -0.10 0.00 0.00 -1.26 0.05 121.76 119.92 1rqs s ALA 93 Ca 0.13 -1.06 -0.22 0.00 0.00 0.00 0.00 51.96 50.81 1rqs s ALA 93 Cb 0.08 -3.13 -0.28 0.00 0.00 0.00 0.00 23.12 19.79 1rqs s ALA 93 CO -0.06 -1.43 0.70 -0.07 0.00 0.00 0.00 175.76 174.90 1rqs h LEU 94 N 9.32 0.28 -7.68 0.00 3.38 -1.56 -3.48 115.31 115.57 1rqs h LEU 94 Ca -0.27 -0.89 -0.15 0.00 0.09 0.00 0.00 57.88 56.67 1rqs h LEU 94 Cb 1.11 -0.09 -0.22 0.00 0.09 0.00 0.00 40.66 41.56 1rqs h LEU 94 CO 0.82 1.37 -0.47 -0.54 0.09 0.00 0.00 178.44 179.72 1rqs s LYS 95 N -2.38 0.46 -0.10 1.13 1.02 -0.44 -4.98 119.74 114.45 1rqs s LYS 95 Ca -0.18 -0.26 0.02 0.00 0.02 0.00 0.00 55.97 55.57 1rqs s LYS 95 Cb 0.01 0.20 0.01 0.00 -0.52 0.00 0.00 37.83 37.53 1rqs s LYS 95 CO 0.75 -0.11 -0.17 -1.21 -0.92 0.00 0.00 175.35 173.70 1rqs s GLU 96 N -1.11 2.33 -0.49 1.68 2.02 -1.26 -0.96 118.70 120.91 1rqs s GLU 96 Ca -0.12 -0.62 -0.35 0.00 0.02 0.00 0.00 54.97 53.91 1rqs s GLU 96 Cb -0.06 -1.89 0.05 0.00 0.10 0.00 0.00 34.13 32.33 1rqs s GLU 96 CO 0.02 0.03 0.66 0.41 0.02 0.00 0.00 175.26 176.39 1rqs n GLY 97 N 3.91 -0.03 3.47 -1.39 0.00 -0.93 -4.94 105.19 105.28 1rqs n GLY 97 Ca -0.20 1.11 -0.23 0.00 0.00 0.00 0.00 46.02 46.71 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 -1.67 1.24 0.39 1.61 -7.23 0.81 -4.77 120.40 110.78 1rqs s VAL 98 Ca 0.34 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.24 1rqs s VAL 98 Cb -0.04 -2.78 -0.10 0.00 0.56 0.00 0.00 36.38 34.01 1rqs s VAL 98 CO 0.88 0.00 1.48 -0.94 -0.31 0.00 0.00 175.10 176.21 1rqs s SER 99 N -3.52 6.24 0.22 4.85 1.04 -1.26 -1.44 113.70 119.82 1rqs s SER 99 Ca 0.35 3.04 -0.07 0.00 0.48 0.00 0.00 55.95 59.75 1rqs s SER 99 Cb 0.08 -2.67 0.34 0.00 0.10 0.00 0.00 66.02 63.87 1rqs s SER 99 CO 0.16 -0.95 1.75 0.50 0.98 0.00 0.00 173.24 175.68 1rqs h LYS 100 N 2.85 0.48 -0.78 4.02 3.64 -1.94 -0.32 116.57 124.53 1rqs h LYS 100 Ca -0.51 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 58.94 1rqs h LYS 100 Cb 1.24 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.88 1rqs h LYS 100 CO 0.63 0.32 0.42 -0.44 -2.27 0.00 0.00 179.45 178.11 1rqs h ASP 101 N 0.49 0.57 -0.16 4.20 5.19 -1.95 0.20 116.42 124.96 1rqs h ASP 101 Ca 0.35 0.06 -0.11 0.00 -0.62 0.00 0.00 57.03 56.71 1rqs h ASP 101 Cb 0.42 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 1rqs h ASP 101 CO -0.31 0.32 -0.25 0.44 -3.12 0.00 0.00 179.24 176.32 1rqs h ASP 102 N 0.69 0.62 -0.10 6.45 3.32 -1.48 -0.23 116.42 125.69 1rqs h ASP 102 Ca 0.38 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1rqs h ASP 102 Cb 0.39 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 1rqs h ASP 102 CO -0.27 0.86 0.04 0.00 -1.72 0.00 0.00 179.24 178.14 1rqs h ALA 103 N 1.19 0.13 0.00 3.45 0.00 0.70 -0.83 119.26 123.90 1rqs h ALA 103 Ca 0.08 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1rqs h ALA 103 Cb 0.71 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1rqs h ALA 103 CO 0.05 -0.26 -0.36 0.93 0.00 0.00 0.00 179.25 179.61 1rqs h GLU 104 N -0.01 0.00 0.07 0.00 4.39 -0.58 0.33 114.58 118.78 1rqs h GLU 104 Ca 0.03 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1rqs h GLU 104 Cb 0.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1rqs h GLU 104 CO -0.00 0.36 -0.03 0.00 -1.16 0.00 0.00 179.01 178.18 1rqs h ALA 105 N 1.64 -0.09 -0.19 3.43 0.00 -0.68 -0.66 119.26 122.69 1rqs h ALA 105 Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1rqs h ALA 105 Cb 0.71 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1rqs h ALA 105 CO 0.05 -0.36 0.03 1.25 0.00 0.00 0.00 179.25 180.21 1rqs h LEU 106 N -0.48 0.31 -0.32 0.00 7.12 -1.00 -2.59 115.31 118.35 1rqs h LEU 106 Ca -0.01 -0.27 0.07 0.00 0.13 0.00 0.00 57.88 57.80 1rqs h LEU 106 Cb 0.41 -0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 40.40 1rqs h LEU 106 CO 0.02 0.50 -0.08 0.50 -0.13 0.00 0.00 178.44 179.24 1rqs h LYS 107 N 0.10 -0.00 -1.00 1.25 3.64 -0.95 0.40 116.57 120.01 1rqs h LYS 107 Ca 0.06 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.57 1rqs h LYS 107 Cb 0.32 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.06 1rqs h LYS 107 CO 0.00 -0.00 0.63 0.87 -2.27 0.00 0.00 179.45 178.68 1rqs h LYS 108 N -0.01 0.91 -0.51 1.90 1.79 -0.99 0.17 116.57 119.84 1rqs h LYS 108 Ca 0.16 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 58.51 1rqs h LYS 108 Cb 0.24 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 1rqs h LYS 108 CO -0.34 0.60 0.07 0.00 -1.08 0.00 0.00 179.45 178.71 1rqs h ALA 109 N 1.56 0.68 -0.39 3.86 0.00 -0.58 0.19 119.26 124.58 1rqs h ALA 109 Ca 0.51 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1rqs h ALA 109 Cb 0.58 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1rqs h ALA 109 CO -0.28 0.43 0.16 -0.07 0.00 0.00 0.00 179.25 179.49 1rqs h LEU 110 N 0.74 0.53 -0.68 0.00 -0.00 0.45 -2.57 115.31 113.77 1rqs h LEU 110 Ca 0.15 -0.16 -0.08 0.00 -0.00 0.00 0.00 57.88 57.80 1rqs h LEU 110 Cb 0.42 -0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 40.91 1rqs h LEU 110 CO 0.01 0.54 0.13 -0.33 -0.00 0.00 0.00 178.44 178.79 1rqs h GLU 111 N 0.48 1.12 -0.90 1.13 5.08 -0.40 0.18 114.58 121.27 1rqs h GLU 111 Ca 0.13 -0.29 0.07 0.00 -1.00 0.00 0.00 59.36 58.27 1rqs h GLU 111 Cb 0.17 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 1rqs h GLU 111 CO -0.01 1.01 0.58 0.93 -1.00 0.00 0.00 179.01 180.52 1rqs h GLU 112 N 1.05 0.95 0.00 2.33 5.08 -0.42 -0.95 114.58 122.61 1rqs h GLU 112 Ca 0.21 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.33 1rqs h GLU 112 Cb 0.42 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1rqs h GLU 112 CO 0.01 0.63 -0.98 0.00 -1.00 0.00 0.00 179.01 177.67 1rqs h ALA 113 N 1.53 0.55 -0.01 3.43 0.00 -1.03 -3.48 119.26 120.24 1rqs h ALA 113 Ca 0.39 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1rqs h ALA 113 Cb 0.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1rqs h ALA 113 CO -0.15 1.05 0.00 0.41 0.00 0.00 0.00 179.25 180.55 1rqs n GLY 114 N 1.34 0.89 3.37 0.00 0.00 0.42 -4.70 105.19 106.50 1rqs n GLY 114 Ca -0.03 -0.79 -0.19 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.96 2.02 -0.26 4.61 0.00 0.04 -4.02 121.76 122.20 1rqs s ALA 115 Ca 0.00 -1.80 -0.09 0.00 0.00 0.00 0.00 51.96 50.07 1rqs s ALA 115 Cb 0.00 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 1rqs s ALA 115 CO 0.00 -0.15 0.13 -2.00 0.00 0.00 0.00 175.76 173.74 1rqs s GLU 116 N -3.79 3.84 0.31 0.00 2.56 0.33 -4.34 118.70 117.61 1rqs s GLU 116 Ca 0.28 -0.38 0.08 0.00 0.00 0.00 0.00 54.97 54.95 1rqs s GLU 116 Cb 0.04 -3.47 -0.04 0.00 2.00 0.00 0.00 34.13 32.66 1rqs s GLU 116 CO 0.09 -0.13 0.11 0.08 -0.56 0.00 0.00 175.26 174.86 1rqs s VAL 117 N 1.53 3.37 -0.05 3.70 1.01 -1.26 -2.19 120.40 126.50 1rqs s VAL 117 Ca 0.06 -1.71 0.02 0.00 0.00 0.00 0.00 61.98 60.36 1rqs s VAL 117 Cb -0.15 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1rqs s VAL 117 CO 0.07 -0.26 -0.10 -0.70 0.00 0.00 0.00 175.10 174.10 1rqs s GLU 118 N -3.80 1.37 -0.25 2.72 2.12 -0.18 -4.83 118.70 115.84 1rqs s GLU 118 Ca 0.35 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 55.37 1rqs s GLU 118 Cb -0.05 -1.19 0.04 0.00 0.26 0.00 0.00 34.13 33.20 1rqs s GLU 118 CO 0.22 0.02 -0.10 0.08 -0.54 0.00 0.00 175.26 174.95 1rqs s VAL 119 N 0.62 2.43 0.00 3.70 1.01 -1.26 -1.05 120.40 125.85 1rqs s VAL 119 Ca -0.12 -1.33 0.00 0.00 0.00 0.00 0.00 61.98 60.53 1rqs s VAL 119 Cb -0.14 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.93 1rqs s VAL 119 CO 0.02 0.12 0.07 2.29 0.00 0.00 0.00 175.10 177.60