#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5r n SER 2 N 0.00 -0.53 -4.85 1.61 2.88 -1.26 -4.40 113.62 107.07 1v5r n SER 2 Ca 0.00 1.65 -0.32 0.00 -1.33 0.00 0.00 58.87 58.88 1v5r n SER 2 Cb 0.00 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 1v5r n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v5r s SER 3 N -5.31 6.15 0.00 -3.46 0.15 -1.26 -4.91 113.70 105.06 1v5r s SER 3 Ca -0.13 1.55 0.00 0.00 0.70 0.00 0.00 55.95 58.06 1v5r s SER 3 Cb 0.21 -2.49 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1v5r s SER 3 CO 0.70 -0.92 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1v5r n GLY 4 N -2.05 0.00 3.52 9.45 0.00 -1.26 -5.08 105.19 109.76 1v5r n GLY 4 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1v5r n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5r s SER 5 N 0.00 6.85 0.25 1.61 0.15 -1.26 -4.92 113.70 116.38 1v5r s SER 5 Ca 0.00 -2.46 0.02 0.00 0.70 0.00 0.00 55.95 54.21 1v5r s SER 5 Cb 0.00 -2.50 -0.03 0.00 -1.71 0.00 0.00 66.02 61.78 1v5r s SER 5 CO 0.00 -1.06 0.20 -0.44 1.20 0.00 0.00 173.24 173.14 1v5r s SER 6 N 3.78 0.73 0.48 5.45 0.01 -1.26 -5.16 113.70 117.72 1v5r s SER 6 Ca 0.47 -1.52 -0.13 0.00 1.31 0.00 0.00 55.95 56.08 1v5r s SER 6 Cb 0.00 0.46 -0.07 0.00 0.21 0.00 0.00 66.02 66.62 1v5r s SER 6 CO 0.01 -0.94 0.89 -0.83 0.41 0.00 0.00 173.24 172.78 1v5r s GLY 7 N -3.24 1.94 -0.00 3.44 0.00 -1.26 -5.09 107.32 103.11 1v5r s GLY 7 Ca 0.39 -0.04 0.05 0.00 0.00 0.00 0.00 44.72 45.12 1v5r s GLY 7 CO 0.18 0.19 -0.16 -1.31 0.00 0.00 0.00 173.10 172.00 1v5r s ASN 8 N -3.28 1.89 -0.26 1.64 0.01 -1.26 -5.05 114.94 108.63 1v5r s ASN 8 Ca 0.55 -0.32 -0.12 0.00 -0.71 0.00 0.00 52.86 52.26 1v5r s ASN 8 Cb -0.10 -0.20 -0.14 0.00 0.41 0.00 0.00 41.25 41.21 1v5r s ASN 8 CO 0.34 0.18 -0.23 0.18 -1.51 0.00 0.00 177.10 176.06 1v5r n LEU 9 N 2.56 2.18 -0.31 0.60 4.32 -1.26 -4.45 117.00 120.63 1v5r n LEU 9 Ca -0.15 0.25 -0.08 0.00 -0.02 0.00 0.00 56.01 56.01 1v5r n LEU 9 Cb 0.54 -0.87 -0.07 0.00 -1.62 0.00 0.00 43.42 41.40 1v5r n LEU 9 CO 0.24 0.62 0.41 -0.11 -1.22 0.00 0.00 177.39 177.34 1v5r n LEU 10 N -4.05 -0.79 -0.32 2.23 7.94 -1.26 0.11 117.00 120.86 1v5r n LEU 10 Ca -0.49 1.44 -0.01 0.00 -1.11 0.00 0.00 56.01 55.83 1v5r n LEU 10 Cb 0.89 -0.23 0.04 0.00 0.53 0.00 0.00 43.42 44.66 1v5r n LEU 10 CO 0.11 -1.14 0.61 -2.24 -1.11 0.00 0.00 177.39 173.63 1v5r h ASP 11 N 0.00 -1.26 -0.36 1.96 2.03 -1.89 0.45 116.42 117.35 1v5r h ASP 11 Ca 0.12 0.28 0.07 0.00 -0.73 0.00 0.00 57.03 56.77 1v5r h ASP 11 Cb 0.31 0.68 -0.06 0.00 -0.83 0.00 0.00 39.33 39.42 1v5r h ASP 11 CO -0.70 -0.29 -0.04 -0.78 -1.03 0.00 0.00 179.24 176.40 1v5r h ASP 12 N -0.04 -0.22 0.57 4.15 3.58 -0.55 0.32 116.42 124.23 1v5r h ASP 12 Ca 0.33 0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.86 1v5r h ASP 12 Cb 0.60 0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.82 1v5r h ASP 12 CO -0.90 -0.07 -0.07 0.00 -2.88 0.00 0.00 179.24 175.32 1v5r h ALA 13 N 1.33 1.10 0.12 -0.78 0.00 0.49 -0.96 119.26 120.57 1v5r h ALA 13 Ca 0.18 -0.07 -0.29 0.00 0.00 0.00 0.00 54.91 54.73 1v5r h ALA 13 Cb 0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1v5r h ALA 13 CO -0.33 0.09 -1.44 0.28 0.00 0.00 0.00 179.25 177.86 1v5r h VAL 14 N 0.00 1.26 0.01 0.00 2.07 0.21 -3.26 116.25 116.54 1v5r h VAL 14 Ca -0.00 -2.88 -0.25 0.00 0.82 0.00 0.00 66.70 64.38 1v5r h VAL 14 Cb 0.38 2.82 0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1v5r h VAL 14 CO 0.01 0.84 -1.01 0.50 0.02 0.00 0.00 177.57 177.92 1v5r h LYS 15 N 0.07 0.57 -0.36 1.57 3.64 -0.11 -3.03 116.57 118.92 1v5r h LYS 15 Ca -0.21 -0.62 0.04 0.00 -1.27 0.00 0.00 60.65 58.59 1v5r h LYS 15 Cb 2.00 0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 33.96 1v5r h LYS 15 CO 0.17 1.24 0.12 0.07 -2.27 0.00 0.00 179.45 178.78 1v5r h ARG 16 N 0.32 0.26 0.00 1.90 0.11 -1.31 0.85 114.38 116.51 1v5r h ARG 16 Ca -0.11 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.95 1v5r h ARG 16 Cb 1.66 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.68 1v5r h ARG 16 CO 0.19 0.17 -0.00 0.82 0.10 0.00 0.00 179.97 181.25 1v5r h ILE 17 N 0.27 1.07 -0.22 0.08 2.04 -1.63 1.17 117.51 120.29 1v5r h ILE 17 Ca 0.16 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1v5r h ILE 17 Cb 0.15 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1v5r h ILE 17 CO -0.17 0.06 0.15 0.77 0.00 0.00 0.00 178.15 178.95 1v5r h SER 18 N -0.10 0.22 0.86 1.72 4.64 -1.36 -1.64 113.55 117.91 1v5r h SER 18 Ca -0.00 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 1v5r h SER 18 Cb 0.09 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 1v5r h SER 18 CO 0.00 0.16 -1.22 -0.33 -0.87 0.00 0.00 176.83 174.57 1v5r h GLU 19 N 0.26 0.00 -3.51 4.77 4.39 -0.41 -3.38 114.58 116.71 1v5r h GLU 19 Ca 0.08 0.00 -0.47 0.00 0.34 0.00 0.00 59.36 59.31 1v5r h GLU 19 Cb 0.02 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 28.27 1v5r h GLU 19 CO -0.02 0.30 -0.76 0.34 -1.16 0.00 0.00 179.01 177.71 1v5r s ASP 20 N -5.86 2.25 0.32 1.42 -1.08 0.40 0.46 116.67 114.59 1v5r s ASP 20 Ca -0.01 -0.48 -0.28 0.00 -0.52 0.00 0.00 52.55 51.25 1v5r s ASP 20 Cb 0.09 -0.46 -0.10 0.00 -1.46 0.00 0.00 42.92 40.99 1v5r s ASP 20 CO 0.80 -0.27 1.22 -2.16 0.52 0.00 0.00 175.17 175.28 1v5r s PRO 21 N 1.96 4.41 0.17 4.34 0.04 -1.21 -4.09 135.00 140.61 1v5r s PRO 21 Ca 0.02 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 1v5r s PRO 21 Cb -0.15 -3.06 -0.08 0.00 0.04 0.00 0.00 34.50 31.25 1v5r s PRO 21 CO -0.07 -0.07 1.33 -1.25 0.04 0.00 0.00 177.00 176.97 1v5r s PRO 22 N -1.75 4.37 -0.09 0.56 0.04 0.17 -4.80 135.00 133.51 1v5r s PRO 22 Ca 0.49 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 63.26 1v5r s PRO 22 Cb -0.36 -3.22 -0.08 0.00 0.04 0.00 0.00 34.50 30.88 1v5r s PRO 22 CO 0.47 -0.31 2.06 0.00 0.04 0.00 0.00 177.00 179.26 1v5r h LYS 24 N 12.03 -0.02 -4.51 0.00 1.79 -1.92 -3.46 116.57 120.49 1v5r h LYS 24 Ca -0.45 0.00 -0.44 0.00 -2.18 0.00 0.00 60.65 57.58 1v5r h LYS 24 Cb 1.25 0.00 0.15 0.00 -1.58 0.00 0.00 32.23 32.05 1v5r h LYS 24 CO 0.95 0.27 -1.01 0.00 -1.08 0.00 0.00 179.45 178.58 1v5r n PRO 26 N 1.33 0.49 -3.90 0.00 -0.04 -1.26 -4.57 135.00 127.04 1v5r n PRO 26 Ca 0.04 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.32 1v5r n PRO 26 Cb 0.37 -1.35 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 1v5r n PRO 26 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1v5r s THR 27 N -2.00 0.20 0.45 0.52 2.01 -1.26 -5.15 115.64 110.41 1v5r s THR 27 Ca 0.16 0.10 -0.18 0.00 0.31 0.00 0.00 61.69 62.09 1v5r s THR 27 Cb 0.08 -0.31 -0.09 0.00 0.01 0.00 0.00 72.50 72.18 1v5r s THR 27 CO 0.13 0.17 0.93 -0.75 -0.69 0.00 0.00 174.62 174.40 1v5r s LYS 28 N 1.22 4.05 1.09 4.92 2.47 -1.26 -4.95 119.74 127.28 1v5r s LYS 28 Ca -0.07 0.95 -0.13 0.00 -1.56 0.00 0.00 55.97 55.17 1v5r s LYS 28 Cb -0.13 -2.20 0.24 0.00 -1.46 0.00 0.00 37.83 34.28 1v5r s LYS 28 CO -0.02 -0.11 1.05 0.12 0.16 0.00 0.00 175.35 176.55 1v5r s PHE 29 N -2.37 1.64 -0.48 4.03 5.36 -1.26 -4.96 117.98 119.94 1v5r s PHE 29 Ca 0.59 1.14 -0.20 0.00 -0.96 0.00 0.00 56.93 57.51 1v5r s PHE 29 Cb -0.10 -3.16 0.04 0.00 -0.34 0.00 0.00 43.02 39.47 1v5r s PHE 29 CO 0.23 -3.48 0.62 0.00 -1.46 0.00 0.00 175.22 171.13 1v5r s VAL 31 N 2.68 0.21 0.08 0.00 1.01 -1.18 -2.43 120.40 120.78 1v5r s VAL 31 Ca 0.18 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.62 1v5r s VAL 31 Cb -0.17 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1v5r s VAL 31 CO 0.14 -0.45 -0.21 -0.70 0.00 0.00 0.00 175.10 173.89 1v5r s GLU 32 N 1.98 1.19 -0.22 2.72 2.12 -1.10 -4.92 118.70 120.47 1v5r s GLU 32 Ca 0.04 -1.09 -0.23 0.00 0.36 0.00 0.00 54.97 54.05 1v5r s GLU 32 Cb -0.16 -1.40 -0.01 0.00 0.26 0.00 0.00 34.13 32.81 1v5r s GLU 32 CO -0.19 0.34 0.76 0.50 -0.54 0.00 0.00 175.26 176.13 1v5r s ARG 33 N -1.68 4.20 -0.22 4.30 3.52 -1.26 -0.38 118.95 127.43 1v5r s ARG 33 Ca 0.06 0.84 -0.08 0.00 -0.13 0.00 0.00 55.73 56.42 1v5r s ARG 33 Cb -0.10 -3.62 -0.10 0.00 -1.56 0.00 0.00 34.95 29.57 1v5r s ARG 33 CO 0.03 -0.42 -0.26 1.28 -0.81 0.00 0.00 175.30 175.13 1v5r n LEU 34 N 5.65 1.89 -4.07 -0.88 4.77 -0.35 -4.95 117.00 119.05 1v5r n LEU 34 Ca 0.03 0.18 -0.13 0.00 -0.03 0.00 0.00 56.01 56.05 1v5r n LEU 34 Cb 0.48 -0.66 -0.04 0.00 -2.33 0.00 0.00 43.42 40.87 1v5r n LEU 34 CO 0.46 0.55 0.14 -0.55 -1.33 0.00 0.00 177.39 176.66 1v5r s SER 35 N -6.72 0.64 0.26 -1.43 0.15 -0.85 -4.95 113.70 100.81 1v5r s SER 35 Ca -0.30 -1.36 -0.10 0.00 0.70 0.00 0.00 55.95 54.89 1v5r s SER 35 Cb 0.11 0.64 0.40 0.00 -1.71 0.00 0.00 66.02 65.46 1v5r s SER 35 CO 0.40 -1.26 1.57 1.56 1.20 0.00 0.00 173.24 176.72 1v5r h GLN 36 N 2.16 -0.00 -0.72 5.44 7.50 -1.99 -1.57 115.11 125.92 1v5r h GLN 36 Ca -0.28 0.00 -0.50 0.00 0.50 0.00 0.00 58.65 58.36 1v5r h GLN 36 Cb 1.24 0.00 -0.43 0.00 0.05 0.00 0.00 27.48 28.35 1v5r h GLN 36 CO 0.39 -0.00 -0.86 0.41 -1.50 0.00 0.00 178.83 177.26 1v5r n GLY 37 N -1.58 5.70 2.87 3.46 0.00 -1.26 -4.85 105.19 109.52 1v5r n GLY 37 Ca 0.14 -2.43 -0.15 0.00 0.00 0.00 0.00 46.02 43.58 1v5r n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1v5r s ARG 38 N -3.63 0.17 -0.01 1.61 3.52 -0.59 -2.41 118.95 117.61 1v5r s ARG 38 Ca 0.47 -0.00 -0.13 0.00 -0.13 0.00 0.00 55.73 55.95 1v5r s ARG 38 Cb 0.40 -0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.55 1v5r s ARG 38 CO 0.02 -0.03 0.26 0.71 -0.81 0.00 0.00 175.30 175.46 1v5r s TYR 39 N 0.37 -0.12 -0.57 5.12 1.51 -0.94 -1.21 117.35 121.50 1v5r s TYR 39 Ca -0.03 0.17 -0.22 0.00 -1.01 0.00 0.00 57.07 55.98 1v5r s TYR 39 Cb -0.06 0.06 0.06 0.00 -0.11 0.00 0.00 41.96 41.91 1v5r s TYR 39 CO -0.01 -0.36 0.86 0.50 -1.11 0.00 0.00 175.55 175.43 1v5r s ARG 40 N -1.30 3.21 -0.19 -0.62 3.52 0.48 -2.76 118.95 121.30 1v5r s ARG 40 Ca -0.13 -0.62 -0.04 0.00 -0.13 0.00 0.00 55.73 54.80 1v5r s ARG 40 Cb -0.06 -4.12 -0.02 0.00 -1.56 0.00 0.00 34.95 29.19 1v5r s ARG 40 CO 0.03 -1.51 -0.02 0.08 -0.81 0.00 0.00 175.30 173.07 1v5r s VAL 41 N 3.59 3.82 -1.40 7.11 1.01 0.66 -2.72 120.40 132.47 1v5r s VAL 41 Ca 0.23 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 1v5r s VAL 41 Cb -0.16 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.52 1v5r s VAL 41 CO 0.14 0.45 0.35 0.61 0.00 0.00 0.00 175.10 176.66 1v5r n GLY 42 N 4.09 -0.37 3.74 4.51 0.00 -1.02 -0.09 105.19 116.05 1v5r n GLY 42 Ca -0.17 0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 1v5r n GLY 42 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1v5r n GLU 43 N -4.56 -6.59 -3.90 1.61 1.02 -1.26 -4.98 120.64 101.97 1v5r n GLU 43 Ca -0.26 0.71 -0.10 0.00 -0.02 0.00 0.00 57.16 57.49 1v5r n GLU 43 Cb 0.66 -5.66 -0.10 0.00 -0.02 0.00 0.00 31.44 26.32 1v5r n GLU 43 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1v5r s LYS 44 N -6.38 0.50 -0.42 3.49 1.02 0.87 -5.13 119.74 113.70 1v5r s LYS 44 Ca 0.55 -0.55 -0.11 0.00 0.02 0.00 0.00 55.97 55.88 1v5r s LYS 44 Cb -0.26 0.20 0.06 0.00 -0.52 0.00 0.00 37.83 37.31 1v5r s LYS 44 CO 0.78 -0.12 0.27 0.42 -0.92 0.00 0.00 175.35 175.78 1v5r s ILE 45 N -1.83 4.52 0.15 2.17 -1.09 -1.26 -0.25 121.20 123.60 1v5r s ILE 45 Ca -0.11 -1.18 0.09 0.00 -2.23 0.00 0.00 60.65 57.22 1v5r s ILE 45 Cb -0.06 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.10 1v5r s ILE 45 CO -0.01 -0.44 -0.21 -0.76 -1.23 0.00 0.00 174.94 172.29 1v5r s LEU 46 N 1.50 2.38 -0.50 2.97 1.43 -1.11 -5.01 118.68 120.34 1v5r s LEU 46 Ca 0.03 -0.79 -0.16 0.00 -1.03 0.00 0.00 54.13 52.18 1v5r s LEU 46 Cb -0.22 -0.95 0.10 0.00 0.03 0.00 0.00 46.19 45.15 1v5r s LEU 46 CO 0.04 0.05 0.43 -0.36 0.23 0.00 0.00 176.35 176.74 1v5r s PHE 47 N -1.59 3.25 -0.06 0.29 0.08 -1.25 -2.22 117.98 116.48 1v5r s PHE 47 Ca 0.13 -1.09 -0.18 0.00 0.12 0.00 0.00 56.93 55.92 1v5r s PHE 47 Cb -0.08 -3.42 -0.05 0.00 -0.57 0.00 0.00 43.02 38.90 1v5r s PHE 47 CO 0.06 -0.89 0.49 0.42 -0.10 0.00 0.00 175.22 175.21 1v5r s ILE 48 N 1.62 5.07 0.14 0.64 1.01 -1.01 0.07 121.20 128.74 1v5r s ILE 48 Ca 0.04 1.00 0.09 0.00 0.00 0.00 0.00 60.65 61.78 1v5r s ILE 48 Cb -0.27 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1v5r s ILE 48 CO 0.05 0.41 -0.20 0.00 0.00 0.00 0.00 174.94 175.20 1v5r s ARG 49 N -0.01 1.25 -0.22 2.79 1.70 -0.16 -4.57 118.95 119.73 1v5r s ARG 49 Ca 0.27 -1.33 -0.01 0.00 -0.47 0.00 0.00 55.73 54.19 1v5r s ARG 49 Cb -0.16 -1.42 0.02 0.00 -0.57 0.00 0.00 34.95 32.81 1v5r s ARG 49 CO 0.13 0.31 -0.11 1.41 -1.08 0.00 0.00 175.30 175.96 1v5r s MET 50 N -2.45 2.97 -0.16 3.89 1.75 -1.26 -1.82 119.30 122.22 1v5r s MET 50 Ca 0.13 -0.88 -0.18 0.00 -1.25 0.00 0.00 55.69 53.52 1v5r s MET 50 Cb -0.08 -2.84 -0.04 0.00 2.84 0.00 0.00 34.83 34.71 1v5r s MET 50 CO 0.06 -0.30 0.48 -0.51 -0.65 0.00 0.00 175.02 174.09 1v5r s LEU 51 N 1.33 4.21 -0.64 4.11 1.43 0.11 -4.15 118.68 125.08 1v5r s LEU 51 Ca 0.02 0.72 0.00 0.00 -1.03 0.00 0.00 54.13 53.84 1v5r s LEU 51 Cb -0.15 -2.67 0.00 0.00 0.03 0.00 0.00 46.19 43.40 1v5r s LEU 51 CO -0.07 -0.07 0.00 1.41 0.23 0.00 0.00 176.35 177.85 1v5r n HIS 52 N 4.16 -1.62 -3.02 0.29 8.25 -1.26 -0.25 115.22 121.77 1v5r n HIS 52 Ca -0.07 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.23 1v5r n HIS 52 Cb 0.51 -2.06 -0.01 0.00 1.12 0.00 0.00 29.99 29.55 1v5r n HIS 52 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1v5r n ASN 53 N -1.64 -2.91 0.00 0.41 6.94 -1.26 -4.65 115.26 112.15 1v5r n ASN 53 Ca -0.09 -0.09 0.00 0.00 -0.02 0.00 0.00 54.58 54.38 1v5r n ASN 53 Cb 0.56 -2.48 0.00 0.00 -2.36 0.00 0.00 39.78 35.50 1v5r n ASN 53 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1v5r n LYS 54 N -3.21 0.16 -3.81 -3.83 2.85 0.65 -5.06 118.16 105.92 1v5r n LYS 54 Ca -0.03 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.87 1v5r n LYS 54 Cb 0.54 -0.62 -0.11 0.00 -0.65 0.00 0.00 35.03 34.19 1v5r n LYS 54 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 1v5r s HIS 55 N -1.25 3.21 -0.47 5.58 3.76 -0.21 -4.96 115.29 120.95 1v5r s HIS 55 Ca 0.00 -0.04 -0.08 0.00 -0.15 0.00 0.00 55.06 54.79 1v5r s HIS 55 Cb 0.00 -2.20 0.12 0.00 1.11 0.00 0.00 32.58 31.61 1v5r s HIS 55 CO 0.00 -0.06 0.33 0.08 -0.85 0.00 0.00 174.74 174.24 1v5r s VAL 56 N 1.07 4.08 0.36 -0.90 1.01 -1.26 0.06 120.40 124.82 1v5r s VAL 56 Ca 0.05 -1.87 0.08 0.00 0.00 0.00 0.00 61.98 60.25 1v5r s VAL 56 Cb -0.14 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1v5r s VAL 56 CO 0.04 -0.77 0.19 -0.04 0.00 0.00 0.00 175.10 174.51 1v5r s MET 57 N 1.28 2.40 0.11 2.72 -1.94 -0.76 -1.04 119.30 122.07 1v5r s MET 57 Ca 0.07 -1.56 0.07 0.00 -1.71 0.00 0.00 55.69 52.55 1v5r s MET 57 Cb -0.25 -2.20 -0.04 0.00 2.01 0.00 0.00 34.83 34.35 1v5r s MET 57 CO -0.01 0.05 -0.17 0.14 -0.01 0.00 0.00 175.02 175.01 1v5r s VAL 58 N -2.44 1.49 -0.34 -6.03 -7.23 0.12 -0.99 120.40 104.97 1v5r s VAL 58 Ca 0.39 -1.58 -0.19 0.00 -1.81 0.00 0.00 61.98 58.79 1v5r s VAL 58 Cb -0.02 -1.47 -0.01 0.00 0.56 0.00 0.00 36.38 35.44 1v5r s VAL 58 CO 0.24 -0.23 0.54 -0.60 -0.31 0.00 0.00 175.10 174.74 1v5r s ARG 59 N -2.19 3.69 -0.44 4.82 3.00 0.11 -2.96 118.95 124.99 1v5r s ARG 59 Ca 0.06 -0.05 0.08 0.00 -1.00 0.00 0.00 55.73 54.82 1v5r s ARG 59 Cb -0.08 -3.79 0.41 0.00 0.00 0.00 0.00 34.95 31.49 1v5r s ARG 59 CO 0.04 -0.62 1.03 1.33 0.00 0.00 0.00 175.30 177.08 1v5r n VAL 60 N 5.42 2.07 0.00 7.11 0.24 -1.01 -3.93 118.33 128.23 1v5r n VAL 60 Ca -0.04 -4.65 0.00 0.00 -2.04 0.00 0.00 64.34 57.61 1v5r n VAL 60 Cb 0.49 -0.85 0.00 0.00 -1.47 0.00 0.00 33.84 32.01 1v5r n VAL 60 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1v5r n GLY 61 N -0.32 1.58 2.76 7.63 0.00 -1.26 -4.16 105.19 111.43 1v5r n GLY 61 Ca 0.31 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1v5r n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5r n GLY 62 N 0.00 5.70 3.65 -0.02 0.00 -1.26 -4.96 105.19 108.30 1v5r n GLY 62 Ca 0.00 -2.58 -0.01 0.00 0.00 0.00 0.00 46.02 43.42 1v5r n GLY 62 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1v5r s GLY 63 N -1.95 0.23 -0.12 -0.02 0.00 -1.26 -5.14 107.32 99.06 1v5r s GLY 63 Ca 0.50 3.16 0.02 0.00 0.00 0.00 0.00 44.72 48.41 1v5r s GLY 63 CO -0.34 1.39 -0.19 -0.98 0.00 0.00 0.00 173.10 172.98 1v5r s TRP 64 N -0.67 2.67 0.26 1.90 0.52 -1.26 -2.40 118.94 119.95 1v5r s TRP 64 Ca 0.09 -0.93 0.06 0.00 0.02 0.00 0.00 56.10 55.34 1v5r s TRP 64 Cb -0.02 -1.78 -0.05 0.00 -1.15 0.00 0.00 33.47 30.47 1v5r s TRP 64 CO -0.12 -0.37 -0.04 -1.83 0.02 0.00 0.00 176.95 174.61 1v5r s GLU 65 N 0.41 1.46 -0.10 4.98 -1.05 -1.16 -4.90 118.70 118.35 1v5r s GLU 65 Ca -0.14 -1.73 -0.30 0.00 -0.15 0.00 0.00 54.97 52.65 1v5r s GLU 65 Cb -0.17 -0.96 -0.03 0.00 -0.44 0.00 0.00 34.13 32.53 1v5r s GLU 65 CO 0.06 -0.00 1.22 0.95 0.95 0.00 0.00 175.26 178.45 1v5r s THR 66 N -3.15 4.26 0.27 1.83 -4.23 -1.26 0.12 115.64 113.49 1v5r s THR 66 Ca 0.28 1.57 -0.02 0.00 -1.18 0.00 0.00 61.69 62.34 1v5r s THR 66 Cb 0.04 -4.01 0.41 0.00 1.34 0.00 0.00 72.50 70.28 1v5r s THR 66 CO 0.10 -0.05 1.44 0.33 -0.54 0.00 0.00 174.62 175.90 1v5r n PHE 67 N 5.73 0.47 -0.30 3.99 7.35 -0.21 0.21 117.46 134.71 1v5r n PHE 67 Ca 0.12 1.12 0.05 0.00 -0.76 0.00 0.00 57.45 57.98 1v5r n PHE 67 Cb 0.46 -1.12 0.26 0.00 0.35 0.00 0.00 39.48 39.43 1v5r n PHE 67 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1v5r h ALA 68 N 1.85 1.56 -0.61 3.13 0.00 -1.91 -1.12 119.26 122.16 1v5r h ALA 68 Ca 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 1v5r h ALA 68 Cb 0.93 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1v5r h ALA 68 CO -0.91 0.28 0.35 0.78 0.00 0.00 0.00 179.25 179.75 1v5r h GLY 69 N 0.97 0.91 2.00 0.00 0.00 0.21 0.51 103.07 107.66 1v5r h GLY 69 Ca 0.40 -0.40 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1v5r h GLY 69 CO -0.16 0.38 -0.29 -1.82 0.00 0.00 0.00 176.54 174.65 1v5r h TYR 70 N 0.83 0.00 0.06 5.60 5.03 -0.98 -2.15 116.97 125.36 1v5r h TYR 70 Ca 0.22 0.00 -0.28 0.00 2.58 0.00 0.00 58.73 61.24 1v5r h TYR 70 Cb 0.02 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.28 1v5r h TYR 70 CO -0.01 0.29 -1.48 1.25 -1.32 0.00 0.00 178.16 176.89 1v5r h LEU 71 N 0.00 0.19 -0.24 2.82 5.85 -0.65 -3.28 115.31 120.01 1v5r h LEU 71 Ca -0.00 -0.29 -0.21 0.00 0.84 0.00 0.00 57.88 58.22 1v5r h LEU 71 Cb 0.87 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.85 1v5r h LEU 71 CO 0.04 1.24 -0.74 0.17 -0.34 0.00 0.00 178.44 178.81 1v5r h LEU 72 N 0.03 0.84 -0.82 2.25 8.10 0.07 0.12 115.31 125.91 1v5r h LEU 72 Ca -0.21 -0.54 0.01 0.00 0.11 0.00 0.00 57.88 57.25 1v5r h LEU 72 Cb 1.96 -0.25 -0.04 0.00 -0.44 0.00 0.00 40.66 41.89 1v5r h LEU 72 CO 0.13 1.32 0.54 0.07 -4.11 0.00 0.00 178.44 176.39 1v5r h LYS 73 N 0.49 1.06 0.05 0.17 2.10 -1.52 -3.14 116.57 115.80 1v5r h LYS 73 Ca -0.04 -0.06 -0.09 0.00 -2.00 0.00 0.00 60.65 58.46 1v5r h LYS 73 Cb 1.35 -0.24 0.01 0.00 -0.90 0.00 0.00 32.23 32.45 1v5r h LYS 73 CO 0.15 0.70 -0.42 0.45 -2.00 0.00 0.00 179.45 178.33 1v5r h HIS 74 N 1.10 0.21 -2.76 0.07 3.86 -1.61 -3.44 115.15 112.58 1v5r h HIS 74 Ca 0.30 -0.15 -0.56 0.00 -1.16 0.00 0.00 60.37 58.80 1v5r h HIS 74 Cb -0.11 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 1v5r h HIS 74 CO -0.02 1.16 1.02 0.34 0.86 0.00 0.00 177.93 181.30 1v5r s ASP 75 N -6.56 6.73 0.03 2.45 -1.08 0.41 -4.92 116.67 113.74 1v5r s ASP 75 Ca -0.18 1.92 -0.22 0.00 -0.52 0.00 0.00 52.55 53.56 1v5r s ASP 75 Cb -0.01 -2.54 -0.16 0.00 -1.46 0.00 0.00 42.92 38.76 1v5r s ASP 75 CO 0.74 -0.91 1.33 1.55 0.52 0.00 0.00 175.17 178.39 1v5r h PRO 76 N 9.18 0.28 -0.33 4.34 0.13 -1.86 -3.01 132.00 140.73 1v5r h PRO 76 Ca -0.33 -0.15 0.04 0.00 -0.87 0.00 0.00 66.00 64.69 1v5r h PRO 76 Cb 1.14 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 1v5r h PRO 76 CO 0.97 0.68 0.22 0.00 -0.23 0.00 0.00 178.00 179.64 1v5r h ARG 78 N 0.27 0.44 -0.90 0.00 3.08 -1.84 -3.07 114.38 112.36 1v5r h ARG 78 Ca 0.14 -0.15 0.25 0.00 0.07 0.00 0.00 59.98 60.28 1v5r h ARG 78 Cb 0.22 -0.03 -0.14 0.00 0.08 0.00 0.00 29.97 30.09 1v5r h ARG 78 CO -0.03 0.65 0.29 1.98 -1.07 0.00 0.00 179.97 181.79 1v5r h MET 79 N 0.19 0.23 -0.77 0.04 4.05 -1.25 0.32 114.93 117.74 1v5r h MET 79 Ca 0.06 -0.01 0.30 0.00 -0.28 0.00 0.00 59.70 59.77 1v5r h MET 79 Cb 0.47 -0.05 -0.12 0.00 -0.80 0.00 0.00 31.60 31.10 1v5r h MET 79 CO 0.02 0.15 0.44 1.28 0.23 0.00 0.00 176.91 179.04 1v5r n LEU 80 N -5.19 0.21 -3.28 3.39 4.77 -1.16 -4.47 117.00 111.27 1v5r n LEU 80 Ca 0.23 1.09 -0.47 0.00 -0.03 0.00 0.00 56.01 56.84 1v5r n LEU 80 Cb 0.72 -0.53 -0.08 0.00 -2.33 0.00 0.00 43.42 41.19 1v5r n LEU 80 CO 0.07 -1.22 1.15 0.00 -1.33 0.00 0.00 177.39 176.06 1v5r n GLN 81 N -4.42 0.00 -1.06 3.23 6.02 0.10 -4.77 117.38 116.47 1v5r n GLN 81 Ca 0.27 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.90 1v5r n GLN 81 Cb 0.95 -1.12 0.06 0.00 1.02 0.00 0.00 30.24 31.15 1v5r n GLN 81 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1v5r n ILE 82 N 4.23 0.38 -3.46 5.09 5.41 -1.26 -3.12 119.36 126.62 1v5r n ILE 82 Ca 0.35 -0.42 -0.19 0.00 1.00 0.00 0.00 62.75 63.49 1v5r n ILE 82 Cb -0.03 -0.27 0.08 0.00 -0.71 0.00 0.00 39.64 38.71 1v5r n ILE 82 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1v5r n SER 83 N 1.60 -3.66 -1.94 4.38 7.64 -1.26 -4.88 113.62 115.51 1v5r n SER 83 Ca 0.04 -0.58 -0.15 0.00 1.01 0.00 0.00 58.87 59.19 1v5r n SER 83 Cb 0.53 -4.99 -0.00 0.00 -1.01 0.00 0.00 64.21 58.73 1v5r n SER 83 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1v5r n ARG 84 N -4.38 1.78 -1.66 1.43 1.85 -1.18 -4.46 116.66 110.04 1v5r n ARG 84 Ca -0.17 -1.38 -0.33 0.00 -1.00 0.00 0.00 57.85 54.97 1v5r n ARG 84 Cb 0.63 -1.63 0.05 0.00 -1.05 0.00 0.00 32.46 30.46 1v5r n ARG 84 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1v5r n VAL 85 N 0.83 3.30 -3.97 8.89 0.24 -1.26 -4.88 118.33 121.47 1v5r n VAL 85 Ca 0.29 -3.58 -0.31 0.00 -2.04 0.00 0.00 64.34 58.71 1v5r n VAL 85 Cb 0.59 -1.18 -0.15 0.00 -1.47 0.00 0.00 33.84 31.63 1v5r n VAL 85 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1v5r s ASP 86 N -2.23 4.59 -0.01 -1.34 1.11 -1.26 -5.09 116.67 112.44 1v5r s ASP 86 Ca 0.59 -2.23 -0.02 0.00 0.18 0.00 0.00 52.55 51.06 1v5r s ASP 86 Cb 0.47 -1.52 0.00 0.00 1.07 0.00 0.00 42.92 42.94 1v5r s ASP 86 CO -0.08 -0.36 0.05 -0.83 1.18 0.00 0.00 175.17 175.13 1v5r s GLY 87 N 0.80 0.01 0.10 0.21 0.00 -1.26 -5.13 107.32 102.05 1v5r s GLY 87 Ca 0.12 0.01 -0.15 0.00 0.00 0.00 0.00 44.72 44.70 1v5r s GLY 87 CO -0.09 -0.03 0.36 1.25 0.00 0.00 0.00 173.10 174.60 1v5r s LYS 88 N -0.33 0.99 -0.12 2.90 2.20 -1.26 -5.17 119.74 118.95 1v5r s LYS 88 Ca -0.04 -0.69 -0.10 0.00 -0.36 0.00 0.00 55.97 54.79 1v5r s LYS 88 Cb -0.03 0.43 0.03 0.00 -1.51 0.00 0.00 37.83 36.76 1v5r s LYS 88 CO 0.00 -0.36 0.30 0.99 -0.36 0.00 0.00 175.35 175.92 1v5r s THR 89 N -3.53 -0.01 0.19 3.43 2.01 -1.26 -5.15 115.64 111.33 1v5r s THR 89 Ca 0.02 0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 1v5r s THR 89 Cb 0.02 -0.43 -0.08 0.00 0.01 0.00 0.00 72.50 72.02 1v5r s THR 89 CO -0.10 0.01 1.07 -0.55 -0.69 0.00 0.00 174.62 174.36 1v5r s SER 90 N 0.40 7.33 1.22 3.53 0.15 -1.26 -5.04 113.70 120.03 1v5r s SER 90 Ca -0.02 2.08 -0.20 0.00 0.70 0.00 0.00 55.95 58.51 1v5r s SER 90 Cb -0.04 -2.61 0.30 0.00 -1.71 0.00 0.00 66.02 61.96 1v5r s SER 90 CO -0.02 -0.15 1.11 -2.16 1.20 0.00 0.00 173.24 173.22 1v5r s PRO 91 N -0.60 -1.38 -0.85 5.44 0.04 -1.26 -4.99 135.00 131.39 1v5r s PRO 91 Ca 0.47 -0.12 -0.08 0.00 0.04 0.00 0.00 61.00 61.32 1v5r s PRO 91 Cb -0.29 -1.58 0.22 0.00 0.04 0.00 0.00 34.50 32.89 1v5r s PRO 91 CO 0.35 -3.81 0.76 -1.54 0.04 0.00 0.00 177.00 172.80 1v5r s SER 92 N -3.93 6.33 -0.00 6.66 1.04 -1.26 -4.88 113.70 117.66 1v5r s SER 92 Ca 0.71 -3.15 -0.00 0.00 0.48 0.00 0.00 55.95 53.99 1v5r s SER 92 Cb -0.09 -2.06 0.00 0.00 0.10 0.00 0.00 66.02 63.98 1v5r s SER 92 CO 0.56 -0.38 0.01 0.61 0.98 0.00 0.00 173.24 175.02 1v5r n GLY 93 N 3.22 0.00 0.25 7.32 0.00 -1.26 -4.79 105.19 109.92 1v5r n GLY 93 Ca 0.16 0.01 0.16 0.00 0.00 0.00 0.00 46.02 46.36 1v5r n GLY 93 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5r h PRO 94 N 2.91 0.00 -1.57 1.61 0.13 -1.90 -3.41 132.00 129.78 1v5r h PRO 94 Ca -0.01 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.23 1v5r h PRO 94 Cb 0.75 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.63 1v5r h PRO 94 CO 0.00 0.00 0.23 0.45 -0.23 0.00 0.00 178.00 178.46 1v5r s SER 95 N -5.33 -0.67 -1.42 1.44 0.15 -1.26 -4.96 113.70 101.65 1v5r s SER 95 Ca 0.02 1.02 -0.08 0.00 0.70 0.00 0.00 55.95 57.60 1v5r s SER 95 Cb 0.09 1.43 0.04 0.00 -1.71 0.00 0.00 66.02 65.88 1v5r s SER 95 CO 0.50 -0.16 0.95 -1.20 1.20 0.00 0.00 173.24 174.54 1v5r n SER 96 N 4.23 -3.99 0.00 5.45 7.64 -1.26 -5.23 113.62 120.45 1v5r n SER 96 Ca -0.16 -0.73 0.00 0.00 1.01 0.00 0.00 58.87 58.98 1v5r n SER 96 Cb 0.56 -4.23 0.00 0.00 -1.01 0.00 0.00 64.21 59.54 1v5r n SER 96 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64