#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 -4.37 -3.79 1.61 2.88 -1.26 -4.98 113.62 103.71 1v5r n SER 2 Ca 0.00 -0.73 -0.13 0.00 -1.33 0.00 0.00 58.87 56.69 1v5r n SER 2 Cb 0.00 -4.23 -0.11 0.00 -0.75 0.00 0.00 64.21 59.13 1v5r n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v5r s SER 3 N -3.55 -0.21 0.00 -3.46 1.04 -1.26 -5.02 113.70 101.24 1v5r s SER 3 Ca 0.50 0.35 0.00 0.00 0.48 0.00 0.00 55.95 57.27 1v5r s SER 3 Cb -0.24 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.33 1v5r s SER 3 CO 0.80 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 175.44 1v5r n GLY 4 N 2.45 -0.08 0.15 7.32 0.00 -1.26 -5.00 105.19 108.77 1v5r n GLY 4 Ca -0.16 0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 1v5r n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1v5r h SER 5 N 0.00 -0.25 -2.12 1.61 0.02 -2.05 -3.44 113.55 107.33 1v5r h SER 5 Ca 0.00 -0.10 -0.62 0.00 -0.84 0.00 0.00 61.79 60.23 1v5r h SER 5 Cb 0.00 0.07 0.11 0.00 0.14 0.00 0.00 62.40 62.71 1v5r h SER 5 CO 0.00 -0.05 -0.02 -1.20 -1.14 0.00 0.00 176.83 174.42 1v5r n SER 6 N -5.15 0.70 -4.36 3.07 7.64 -1.26 -4.89 113.62 109.37 1v5r n SER 6 Ca -0.09 1.17 -0.46 0.00 1.01 0.00 0.00 58.87 60.50 1v5r n SER 6 Cb 0.19 -1.21 -0.03 0.00 -1.01 0.00 0.00 64.21 62.15 1v5r n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v5r s GLY 7 N -0.65 2.15 -0.99 0.23 0.00 -1.26 -4.99 107.32 101.81 1v5r s GLY 7 Ca 0.60 -2.74 -0.20 0.00 0.00 0.00 0.00 44.72 42.38 1v5r s GLY 7 CO 0.59 1.48 1.27 -1.31 0.00 0.00 0.00 173.10 175.14 1v5r s ASN 8 N 3.14 6.61 -0.17 1.64 -0.87 -1.26 -4.77 114.94 119.25 1v5r s ASN 8 Ca 0.16 -1.90 -0.15 0.00 -1.57 0.00 0.00 52.86 49.40 1v5r s ASN 8 Cb -0.17 -2.46 -0.06 0.00 -0.02 0.00 0.00 41.25 38.54 1v5r s ASN 8 CO -0.02 -1.21 -0.29 -0.11 -2.57 0.00 0.00 177.10 172.90 1v5r n LEU 9 N 7.38 1.90 -0.33 0.60 -0.00 -1.26 -4.38 117.00 120.91 1v5r n LEU 9 Ca 0.29 0.43 -0.05 0.00 -0.00 0.00 0.00 56.01 56.67 1v5r n LEU 9 Cb 0.49 -0.79 -0.03 0.00 -0.00 0.00 0.00 43.42 43.09 1v5r n LEU 9 CO 0.57 -0.30 0.42 -0.11 -0.00 0.00 0.00 177.39 177.98 1v5r n LEU 10 N -4.50 -0.71 -0.35 -1.96 7.94 -1.26 0.33 117.00 116.49 1v5r n LEU 10 Ca -0.14 1.42 -0.03 0.00 -1.11 0.00 0.00 56.01 56.15 1v5r n LEU 10 Cb 0.46 -0.24 0.02 0.00 0.53 0.00 0.00 43.42 44.19 1v5r n LEU 10 CO 0.17 -1.20 0.58 -2.24 -1.11 0.00 0.00 177.39 173.59 1v5r h ASP 11 N 0.00 -1.45 -0.41 1.96 2.03 -1.97 0.21 116.42 116.79 1v5r h ASP 11 Ca 0.19 0.30 0.08 0.00 -0.73 0.00 0.00 57.03 56.87 1v5r h ASP 11 Cb 0.39 0.74 -0.09 0.00 -0.83 0.00 0.00 39.33 39.54 1v5r h ASP 11 CO -0.77 -0.29 -0.27 -0.78 -1.03 0.00 0.00 179.24 176.10 1v5r h ASP 12 N -0.04 -0.90 0.20 4.15 1.82 -0.33 0.44 116.42 121.77 1v5r h ASP 12 Ca 0.31 0.18 -0.01 0.00 -0.39 0.00 0.00 57.03 57.11 1v5r h ASP 12 Cb 0.58 0.44 -0.00 0.00 0.68 0.00 0.00 39.33 41.03 1v5r h ASP 12 CO -0.92 -0.28 -0.06 0.00 -1.61 0.00 0.00 179.24 176.36 1v5r h ALA 13 N 0.95 1.36 0.10 -0.78 0.00 -0.43 0.77 119.26 121.24 1v5r h ALA 13 Ca 0.19 -0.06 -0.26 0.00 0.00 0.00 0.00 54.91 54.78 1v5r h ALA 13 Cb 0.50 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1v5r h ALA 13 CO -0.52 0.08 -1.20 0.28 0.00 0.00 0.00 179.25 177.89 1v5r h VAL 14 N 0.00 1.54 0.13 0.00 2.07 0.22 -3.19 116.25 117.02 1v5r h VAL 14 Ca -0.00 -3.13 -0.19 0.00 0.82 0.00 0.00 66.70 64.20 1v5r h VAL 14 Cb 0.18 2.93 0.02 0.00 -1.52 0.00 0.00 31.29 32.90 1v5r h VAL 14 CO 0.01 0.91 -0.81 0.50 0.02 0.00 0.00 177.57 178.19 1v5r h LYS 15 N 0.06 0.32 -0.34 1.57 3.64 0.29 -3.19 116.57 118.93 1v5r h LYS 15 Ca -0.11 -0.52 0.07 0.00 -1.27 0.00 0.00 60.65 58.82 1v5r h LYS 15 Cb 1.93 0.19 -0.07 0.00 -0.41 0.00 0.00 32.23 33.87 1v5r h LYS 15 CO 0.19 1.24 -0.15 0.07 -2.27 0.00 0.00 179.45 178.53 1v5r h ARG 16 N -0.32 -0.09 -0.42 1.90 0.11 -1.00 -0.33 114.38 114.23 1v5r h ARG 16 Ca -0.14 0.01 0.05 0.00 0.10 0.00 0.00 59.98 59.99 1v5r h ARG 16 Cb 1.63 0.02 -0.04 0.00 1.11 0.00 0.00 29.97 32.68 1v5r h ARG 16 CO 0.15 -0.06 0.17 0.82 0.10 0.00 0.00 179.97 181.15 1v5r h ILE 17 N -0.09 0.90 0.00 0.08 2.04 -1.68 0.13 117.51 118.89 1v5r h ILE 17 Ca 0.17 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 1v5r h ILE 17 Cb 0.35 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1v5r h ILE 17 CO -0.40 0.06 -0.03 0.77 0.00 0.00 0.00 178.15 178.55 1v5r h SER 18 N 0.35 0.00 -0.35 1.72 4.64 -1.31 -1.29 113.55 117.30 1v5r h SER 18 Ca 0.19 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.39 1v5r h SER 18 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.17 1v5r h SER 18 CO -0.18 0.03 0.00 -0.62 -0.87 0.00 0.00 176.83 175.20 1v5r n GLU 19 N -3.37 2.36 -3.15 4.77 1.02 -0.15 -4.42 120.64 117.71 1v5r n GLU 19 Ca -0.02 -3.02 0.05 0.00 -0.02 0.00 0.00 57.16 54.16 1v5r n GLU 19 Cb 0.15 -1.85 -0.01 0.00 -0.02 0.00 0.00 31.44 29.71 1v5r n GLU 19 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1v5r s ASP 20 N -2.19 -0.41 0.41 1.62 -1.08 -0.17 -3.86 116.67 111.00 1v5r s ASP 20 Ca 0.44 0.15 -0.25 0.00 -0.52 0.00 0.00 52.55 52.37 1v5r s ASP 20 Cb 0.38 1.30 -0.08 0.00 -1.46 0.00 0.00 42.92 43.06 1v5r s ASP 20 CO 0.05 -0.08 1.18 -2.16 0.52 0.00 0.00 175.17 174.68 1v5r s PRO 21 N 2.96 3.97 0.13 4.34 0.04 -1.25 -4.46 135.00 140.72 1v5r s PRO 21 Ca 0.12 1.86 -0.31 0.00 0.04 0.00 0.00 61.00 62.71 1v5r s PRO 21 Cb -0.06 -2.62 -0.08 0.00 0.04 0.00 0.00 34.50 31.78 1v5r s PRO 21 CO -0.17 -0.39 1.35 -1.25 0.04 0.00 0.00 177.00 176.58 1v5r s PRO 22 N -2.38 4.35 0.01 0.56 0.04 -1.25 -4.87 135.00 131.46 1v5r s PRO 22 Ca 0.59 2.04 -0.32 0.00 0.04 0.00 0.00 61.00 63.35 1v5r s PRO 22 Cb -0.31 -3.25 -0.10 0.00 0.04 0.00 0.00 34.50 30.88 1v5r s PRO 22 CO 0.39 -0.37 1.92 0.00 0.04 0.00 0.00 177.00 178.98 1v5r h LYS 24 N 9.80 0.11 -4.78 0.00 1.79 -1.92 -3.47 116.57 118.11 1v5r h LYS 24 Ca -0.49 -0.09 -0.47 0.00 -2.18 0.00 0.00 60.65 57.42 1v5r h LYS 24 Cb 1.25 0.02 0.15 0.00 -1.58 0.00 0.00 32.23 32.07 1v5r h LYS 24 CO 0.94 0.77 -0.99 0.00 -1.08 0.00 0.00 179.45 179.09 1v5r n PRO 26 N 1.30 0.49 -3.66 0.00 -0.04 -1.26 -4.41 135.00 127.42 1v5r n PRO 26 Ca 0.05 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.24 1v5r n PRO 26 Cb 0.38 -1.37 -0.17 0.00 -0.04 0.00 0.00 33.50 32.31 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 0.18 1.12 0.52 2.01 -1.26 -5.14 115.64 111.07 1v5r s THR 27 Ca 0.18 -0.39 -0.13 0.00 0.31 0.00 0.00 61.69 61.66 1v5r s THR 27 Cb 0.08 -0.81 0.26 0.00 0.01 0.00 0.00 72.50 72.04 1v5r s THR 27 CO 0.13 -0.29 1.04 -0.75 -0.69 0.00 0.00 174.62 174.07 1v5r s LYS 28 N 2.01 -0.60 0.83 4.92 2.20 -1.26 -5.01 119.74 122.83 1v5r s LYS 28 Ca 0.01 0.82 -0.12 0.00 -0.36 0.00 0.00 55.97 56.32 1v5r s LYS 28 Cb -0.16 -1.59 0.09 0.00 -1.51 0.00 0.00 37.83 34.66 1v5r s LYS 28 CO -0.11 -3.51 1.20 0.12 -0.36 0.00 0.00 175.35 172.69 1v5r s PHE 29 N -2.56 2.79 -0.48 4.03 5.36 -1.26 -5.01 117.98 120.84 1v5r s PHE 29 Ca 0.68 0.70 -0.21 0.00 -0.96 0.00 0.00 56.93 57.14 1v5r s PHE 29 Cb -0.24 -3.57 0.04 0.00 -0.34 0.00 0.00 43.02 38.91 1v5r s PHE 29 CO 0.63 -1.89 0.72 0.00 -1.46 0.00 0.00 175.22 173.22 1v5r s VAL 31 N 3.08 0.07 -0.05 0.00 1.01 -1.17 -3.12 120.40 120.21 1v5r s VAL 31 Ca 0.23 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 1v5r s VAL 31 Cb -0.15 -0.86 0.03 0.00 0.00 0.00 0.00 36.38 35.40 1v5r s VAL 31 CO 0.18 -0.46 0.00 -0.70 0.00 0.00 0.00 175.10 174.12 1v5r s GLU 32 N 2.05 0.48 0.12 2.72 2.56 -1.17 -4.91 118.70 120.55 1v5r s GLU 32 Ca 0.05 0.11 -0.30 0.00 0.00 0.00 0.00 54.97 54.82 1v5r s GLU 32 Cb -0.16 -0.79 -0.07 0.00 2.00 0.00 0.00 34.13 35.11 1v5r s GLU 32 CO -0.20 -0.24 1.19 0.50 -0.56 0.00 0.00 175.26 175.95 1v5r s ARG 33 N 1.66 4.47 -0.13 4.30 3.52 -1.26 -0.03 118.95 131.48 1v5r s ARG 33 Ca -0.00 1.81 -0.03 0.00 -0.13 0.00 0.00 55.73 57.38 1v5r s ARG 33 Cb -0.13 -3.30 -0.07 0.00 -1.56 0.00 0.00 34.95 29.89 1v5r s ARG 33 CO -0.03 -0.17 -0.14 1.28 -0.81 0.00 0.00 175.30 175.43 1v5r n LEU 34 N 3.29 1.97 0.00 -0.88 4.77 -0.74 -4.95 117.00 120.47 1v5r n LEU 34 Ca 0.07 0.05 -0.05 0.00 -0.03 0.00 0.00 56.01 56.04 1v5r n LEU 34 Cb 0.46 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1v5r n LEU 34 CO 0.55 0.49 0.29 -1.20 -1.33 0.00 0.00 177.39 176.20 1v5r n SER 35 N -3.22 -1.26 -4.58 -1.43 7.64 -1.19 -5.03 113.62 104.55 1v5r n SER 35 Ca -0.24 -1.88 -0.41 0.00 1.01 0.00 0.00 58.87 57.35 1v5r n SER 35 Cb 0.71 2.10 -0.03 0.00 -1.01 0.00 0.00 64.21 65.98 1v5r n SER 35 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1v5r s GLN 36 N -2.05 2.88 0.00 1.43 -0.21 -1.26 -1.57 119.66 118.88 1v5r s GLN 36 Ca 0.09 1.63 0.00 0.00 0.02 0.00 0.00 55.36 57.09 1v5r s GLN 36 Cb -0.03 -4.39 0.00 0.00 1.00 0.00 0.00 33.01 29.60 1v5r s GLN 36 CO 0.07 -2.39 0.00 0.41 -2.12 0.00 0.00 175.29 171.25 1v5r n GLY 37 N 5.74 0.62 3.00 3.09 0.00 -1.26 -5.04 105.19 111.34 1v5r n GLY 37 Ca 0.29 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 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 0.15 -0.01 1.61 3.52 -0.61 -2.67 118.95 117.31 1v5r s ARG 38 Ca 0.00 0.53 -0.10 0.00 -0.13 0.00 0.00 55.73 56.03 1v5r s ARG 38 Cb 0.00 -0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.26 1v5r s ARG 38 CO 0.00 -0.20 0.21 0.71 -0.81 0.00 0.00 175.30 175.21 1v5r s TYR 39 N 1.51 -0.06 -0.35 5.12 1.51 -1.11 -1.79 117.35 122.18 1v5r s TYR 39 Ca -0.07 0.07 -0.27 0.00 -1.01 0.00 0.00 57.07 55.79 1v5r s TYR 39 Cb -0.11 0.02 0.01 0.00 -0.11 0.00 0.00 41.96 41.77 1v5r s TYR 39 CO -0.08 -0.32 0.96 0.50 -1.11 0.00 0.00 175.55 175.51 1v5r s ARG 40 N -1.27 3.91 -0.14 -0.62 3.52 0.96 -3.09 118.95 122.23 1v5r s ARG 40 Ca -0.13 0.71 0.01 0.00 -0.13 0.00 0.00 55.73 56.19 1v5r s ARG 40 Cb -0.06 -3.78 -0.00 0.00 -1.56 0.00 0.00 34.95 29.54 1v5r s ARG 40 CO 0.03 -0.93 -0.17 0.08 -0.81 0.00 0.00 175.30 173.49 1v5r s VAL 41 N 3.53 2.59 -1.42 7.11 1.01 0.11 -3.04 120.40 130.29 1v5r s VAL 41 Ca 0.40 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 1v5r s VAL 41 Cb -0.12 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1v5r s VAL 41 CO 0.18 0.53 0.06 0.61 0.00 0.00 0.00 175.10 176.48 1v5r n GLY 42 N 3.84 -0.18 3.37 4.51 0.00 -1.18 0.15 105.19 115.70 1v5r n GLY 42 Ca -0.19 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 -4.40 -6.90 -4.00 1.61 1.02 -1.26 -5.00 120.64 101.72 1v5r n GLU 43 Ca -0.29 0.83 -0.09 0.00 -0.02 0.00 0.00 57.16 57.60 1v5r n GLU 43 Cb 0.64 -5.75 -0.10 0.00 -0.02 0.00 0.00 31.44 26.20 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 -6.10 0.49 -0.48 3.49 1.02 0.39 -5.12 119.74 113.43 1v5r s LYS 44 Ca 0.49 -0.84 -0.11 0.00 0.02 0.00 0.00 55.97 55.53 1v5r s LYS 44 Cb -0.22 0.18 0.11 0.00 -0.52 0.00 0.00 37.83 37.39 1v5r s LYS 44 CO 0.61 -0.10 0.37 0.42 -0.92 0.00 0.00 175.35 175.72 1v5r s ILE 45 N -2.58 4.45 0.18 2.17 -1.09 -1.26 0.09 121.20 123.16 1v5r s ILE 45 Ca -0.05 -1.65 0.09 0.00 -2.23 0.00 0.00 60.65 56.80 1v5r s ILE 45 Cb -0.02 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 1v5r s ILE 45 CO -0.05 -0.75 -0.09 -0.76 -1.23 0.00 0.00 174.94 172.06 1v5r s LEU 46 N 1.43 2.98 -0.53 2.97 1.43 -1.18 -5.02 118.68 120.76 1v5r s LEU 46 Ca 0.05 -0.58 -0.14 0.00 -1.03 0.00 0.00 54.13 52.43 1v5r s LEU 46 Cb -0.26 -1.66 0.13 0.00 0.03 0.00 0.00 46.19 44.43 1v5r s LEU 46 CO 0.01 0.10 0.46 -0.36 0.23 0.00 0.00 176.35 176.79 1v5r s PHE 47 N -1.72 3.32 -0.25 0.29 0.08 -1.24 -2.73 117.98 115.73 1v5r s PHE 47 Ca 0.25 -1.51 -0.18 0.00 0.12 0.00 0.00 56.93 55.61 1v5r s PHE 47 Cb -0.09 -3.70 -0.03 0.00 -0.57 0.00 0.00 43.02 38.63 1v5r s PHE 47 CO 0.15 -1.01 0.50 0.42 -0.10 0.00 0.00 175.22 175.18 1v5r s ILE 48 N 1.47 5.09 0.23 0.64 1.01 -1.09 0.18 121.20 128.73 1v5r s ILE 48 Ca 0.04 0.86 0.11 0.00 0.00 0.00 0.00 60.65 61.66 1v5r s ILE 48 Cb -0.28 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 1v5r s ILE 48 CO 0.01 0.12 -0.21 -0.60 0.00 0.00 0.00 174.94 174.27 1v5r s ARG 49 N 2.11 1.54 -0.12 2.79 3.52 -0.27 -4.36 118.95 124.16 1v5r s ARG 49 Ca 0.21 -1.63 -0.03 0.00 -0.13 0.00 0.00 55.73 54.16 1v5r s ARG 49 Cb -0.16 -1.67 -0.03 0.00 -1.56 0.00 0.00 34.95 31.53 1v5r s ARG 49 CO 0.09 0.33 -0.01 1.41 -0.81 0.00 0.00 175.30 176.31 1v5r s MET 50 N -3.16 3.30 -0.57 5.12 -2.45 -1.26 -1.46 119.30 118.83 1v5r s MET 50 Ca 0.24 -0.46 -0.21 0.00 -1.25 0.00 0.00 55.69 54.02 1v5r s MET 50 Cb -0.06 -2.86 0.07 0.00 1.25 0.00 0.00 34.83 33.24 1v5r s MET 50 CO 0.11 0.49 0.77 -0.51 1.05 0.00 0.00 175.02 176.93 1v5r s LEU 51 N -0.31 4.82 -1.48 4.11 1.43 0.69 -4.24 118.68 123.70 1v5r s LEU 51 Ca 0.06 -0.98 -0.07 0.00 -1.03 0.00 0.00 54.13 52.11 1v5r s LEU 51 Cb -0.12 -2.46 0.03 0.00 0.03 0.00 0.00 46.19 43.66 1v5r s LEU 51 CO 0.02 -1.12 0.74 1.41 0.23 0.00 0.00 176.35 177.63 1v5r n HIS 52 N 6.73 -2.15 -4.24 0.29 8.25 -1.26 -1.72 115.22 121.12 1v5r n HIS 52 Ca -0.05 0.65 -0.37 0.00 -0.26 0.00 0.00 57.72 57.69 1v5r n HIS 52 Cb 0.45 -4.29 -0.03 0.00 1.12 0.00 0.00 29.99 27.23 1v5r n HIS 52 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1v5r n ASN 53 N -2.61 -3.18 0.00 0.41 2.85 -1.26 -4.73 115.26 106.74 1v5r n ASN 53 Ca -0.06 -1.03 0.00 0.00 -0.11 0.00 0.00 54.58 53.39 1v5r n ASN 53 Cb 0.59 -2.69 0.00 0.00 1.24 0.00 0.00 39.78 38.92 1v5r n ASN 53 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1v5r n LYS 54 N -4.37 0.65 -4.34 1.20 5.02 -0.70 -5.10 118.16 110.53 1v5r n LYS 54 Ca 0.07 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.11 1v5r n LYS 54 Cb 0.49 -0.65 -0.13 0.00 -0.02 0.00 0.00 35.03 34.73 1v5r n LYS 54 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1v5r s HIS 55 N -1.30 1.95 -0.33 2.13 3.76 -1.07 -4.96 115.29 115.48 1v5r s HIS 55 Ca 0.00 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.52 1v5r s HIS 55 Cb 0.00 -1.07 0.09 0.00 1.11 0.00 0.00 32.58 32.70 1v5r s HIS 55 CO 0.00 0.24 0.03 0.08 -0.85 0.00 0.00 174.74 174.24 1v5r s VAL 56 N -1.11 2.51 0.34 -0.90 1.01 -1.26 -0.22 120.40 120.77 1v5r s VAL 56 Ca 0.09 -2.01 0.09 0.00 0.00 0.00 0.00 61.98 60.14 1v5r s VAL 56 Cb -0.10 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1v5r s VAL 56 CO 0.05 -0.42 0.08 -0.04 0.00 0.00 0.00 175.10 174.77 1v5r s MET 57 N 1.03 2.23 0.02 2.72 -1.94 -0.53 -1.84 119.30 120.99 1v5r s MET 57 Ca 0.04 -1.65 0.08 0.00 -1.71 0.00 0.00 55.69 52.45 1v5r s MET 57 Cb -0.20 -2.05 -0.02 0.00 2.01 0.00 0.00 34.83 34.57 1v5r s MET 57 CO -0.06 0.12 -0.24 0.14 -0.01 0.00 0.00 175.02 174.97 1v5r s VAL 58 N -2.47 1.94 -0.34 -6.03 -7.23 0.79 -1.11 120.40 105.94 1v5r s VAL 58 Ca 0.36 -1.22 -0.18 0.00 -1.81 0.00 0.00 61.98 59.13 1v5r s VAL 58 Cb -0.01 -1.65 -0.01 0.00 0.56 0.00 0.00 36.38 35.27 1v5r s VAL 58 CO 0.21 0.38 0.49 -0.60 -0.31 0.00 0.00 175.10 175.27 1v5r s ARG 59 N -1.00 3.66 -0.17 4.82 3.00 0.13 -2.59 118.95 126.80 1v5r s ARG 59 Ca 0.10 -0.15 0.17 0.00 -1.00 0.00 0.00 55.73 54.85 1v5r s ARG 59 Cb -0.09 -3.79 0.41 0.00 0.00 0.00 0.00 34.95 31.47 1v5r s ARG 59 CO 0.01 -0.60 1.28 1.33 0.00 0.00 0.00 175.30 177.33 1v5r n VAL 60 N 5.37 2.12 -0.38 7.11 0.24 -0.71 -3.68 118.33 128.41 1v5r n VAL 60 Ca -0.05 -2.25 0.00 0.00 -2.04 0.00 0.00 64.34 59.99 1v5r n VAL 60 Cb 0.49 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 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 -1.05 -0.30 3.69 7.63 0.00 -1.26 -4.62 105.19 109.27 1v5r n GLY 61 Ca 0.20 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.06 1.59 3.77 -0.02 0.00 -1.26 -4.94 105.19 104.28 1v5r n GLY 62 Ca 0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.13 2.00 -0.03 -0.02 0.00 -1.26 -3.81 107.32 104.07 1v5r s GLY 63 Ca 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 44.72 43.90 1v5r s GLY 63 CO 0.00 -0.73 -0.16 -0.98 0.00 0.00 0.00 173.10 171.23 1v5r s TRP 64 N -1.16 1.58 0.29 1.90 0.52 -1.26 -1.73 118.94 119.07 1v5r s TRP 64 Ca 0.22 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 55.95 1v5r s TRP 64 Cb -0.12 -1.05 -0.06 0.00 -1.15 0.00 0.00 33.47 31.09 1v5r s TRP 64 CO 0.13 -0.12 0.08 -1.83 0.02 0.00 0.00 176.95 175.23 1v5r s GLU 65 N -0.06 1.53 -0.21 4.98 -1.05 -1.07 -4.89 118.70 117.93 1v5r s GLU 65 Ca -0.01 -1.84 -0.29 0.00 -0.15 0.00 0.00 54.97 52.68 1v5r s GLU 65 Cb -0.10 -0.51 -0.00 0.00 -0.44 0.00 0.00 34.13 33.08 1v5r s GLU 65 CO 0.01 -0.26 1.21 0.95 0.95 0.00 0.00 175.26 178.12 1v5r s THR 66 N -3.55 4.37 0.25 1.83 -4.23 -1.26 -0.15 115.64 112.90 1v5r s THR 66 Ca 0.37 1.64 -0.12 0.00 -1.18 0.00 0.00 61.69 62.39 1v5r s THR 66 Cb 0.08 -4.11 0.34 0.00 1.34 0.00 0.00 72.50 70.15 1v5r s THR 66 CO 0.15 -0.21 1.57 0.15 -0.54 0.00 0.00 174.62 175.74 1v5r h PHE 67 N 8.17 -0.69 -0.54 3.99 3.57 -1.66 1.40 116.94 131.18 1v5r h PHE 67 Ca -0.24 0.09 0.10 0.00 3.53 0.00 0.00 57.97 61.45 1v5r h PHE 67 Cb 1.09 0.45 -0.03 0.00 2.79 0.00 0.00 35.95 40.25 1v5r h PHE 67 CO 0.80 -0.40 0.37 0.00 -2.23 0.00 0.00 178.31 176.85 1v5r h ALA 68 N 1.70 2.12 -0.05 2.41 0.00 -1.91 -1.64 119.26 121.88 1v5r h ALA 68 Ca 0.40 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1v5r h ALA 68 Cb 0.65 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1v5r h ALA 68 CO -0.94 -0.25 -0.11 0.78 0.00 0.00 0.00 179.25 178.73 1v5r h GLY 69 N 0.29 0.18 2.00 0.00 0.00 0.15 -0.21 103.07 105.48 1v5r h GLY 69 Ca 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1v5r h GLY 69 CO -0.06 0.19 -0.06 -1.82 0.00 0.00 0.00 176.54 174.79 1v5r h TYR 70 N -0.34 0.00 0.00 5.60 5.03 -0.70 -1.49 116.97 125.08 1v5r h TYR 70 Ca 0.00 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.20 1v5r h TYR 70 Cb 0.69 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.95 1v5r h TYR 70 CO 0.12 0.06 -0.60 1.25 -1.32 0.00 0.00 178.16 177.67 1v5r h LEU 71 N 0.00 0.00 -1.68 2.82 5.85 -1.26 -3.21 115.31 117.83 1v5r h LEU 71 Ca -0.00 -0.71 0.08 0.00 0.84 0.00 0.00 57.88 58.09 1v5r h LEU 71 Cb 0.21 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1v5r h LEU 71 CO 0.01 1.20 0.35 0.17 -0.34 0.00 0.00 178.44 179.83 1v5r h LEU 72 N -1.00 0.33 -0.48 2.25 8.10 -0.87 0.22 115.31 123.86 1v5r h LEU 72 Ca -0.16 0.00 -0.14 0.00 0.11 0.00 0.00 57.88 57.69 1v5r h LEU 72 Cb 1.09 -0.07 -0.01 0.00 -0.44 0.00 0.00 40.66 41.24 1v5r h LEU 72 CO -0.10 0.21 -0.30 0.07 -4.11 0.00 0.00 178.44 174.21 1v5r h LYS 73 N 0.38 0.93 -0.01 0.17 2.10 -1.41 -3.27 116.57 115.46 1v5r h LYS 73 Ca 0.23 -0.44 -0.05 0.00 -2.00 0.00 0.00 60.65 58.40 1v5r h LYS 73 Cb 0.43 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 1v5r h LYS 73 CO -0.06 1.10 -0.18 0.45 -2.00 0.00 0.00 179.45 178.76 1v5r h HIS 74 N 0.78 0.20 -3.38 0.07 3.86 -1.21 -3.44 115.15 112.02 1v5r h HIS 74 Ca 0.08 -0.10 -0.54 0.00 -1.16 0.00 0.00 60.37 58.65 1v5r h HIS 74 Cb 0.88 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.30 1v5r h HIS 74 CO 0.05 0.87 0.41 0.34 0.86 0.00 0.00 177.93 180.46 1v5r s ASP 75 N -6.20 7.35 -0.02 2.45 -1.08 0.64 -4.98 116.67 114.83 1v5r s ASP 75 Ca -0.16 1.64 -0.22 0.00 -0.52 0.00 0.00 52.55 53.28 1v5r s ASP 75 Cb 0.01 -2.57 -0.15 0.00 -1.46 0.00 0.00 42.92 38.75 1v5r s ASP 75 CO 0.73 -0.29 0.99 1.55 0.52 0.00 0.00 175.17 178.66 1v5r h PRO 76 N 6.85 -0.40 -0.65 4.34 0.13 -1.85 -3.03 132.00 137.40 1v5r h PRO 76 Ca -0.39 0.03 0.19 0.00 -0.87 0.00 0.00 66.00 64.95 1v5r h PRO 76 Cb 1.21 0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1v5r h PRO 76 CO 0.77 -0.07 0.54 0.00 -0.23 0.00 0.00 178.00 179.02 1v5r h ARG 78 N 0.00 0.70 -1.09 0.00 3.08 -1.81 -3.15 114.38 112.10 1v5r h ARG 78 Ca 0.31 -0.47 0.34 0.00 0.07 0.00 0.00 59.98 60.23 1v5r h ARG 78 Cb 1.39 0.07 -0.13 0.00 0.08 0.00 0.00 29.97 31.38 1v5r h ARG 78 CO -0.00 1.09 0.66 0.52 -1.07 0.00 0.00 179.97 181.17 1v5r h MET 79 N 0.52 0.26 -0.99 0.04 2.86 -0.42 0.15 114.93 117.36 1v5r h MET 79 Ca -0.00 -0.02 0.35 0.00 -2.06 0.00 0.00 59.70 57.97 1v5r h MET 79 Cb 1.19 -0.06 -0.17 0.00 0.06 0.00 0.00 31.60 32.61 1v5r h MET 79 CO 0.12 0.17 0.35 -0.07 1.06 0.00 0.00 176.91 178.54 1v5r h LEU 80 N 0.27 0.05 -8.11 1.22 3.38 -1.63 -3.42 115.31 107.08 1v5r h LEU 80 Ca 0.74 0.25 -0.57 0.00 0.09 0.00 0.00 57.88 58.39 1v5r h LEU 80 Cb 1.90 0.33 0.13 0.00 0.09 0.00 0.00 40.66 43.11 1v5r h LEU 80 CO -0.50 -0.36 -0.79 0.00 0.09 0.00 0.00 178.44 176.87 1v5r n GLN 81 N -5.31 0.00 -3.67 1.13 1.13 0.54 -4.90 117.38 106.30 1v5r n GLN 81 Ca 0.31 0.00 -0.38 0.00 -1.94 0.00 0.00 57.00 54.99 1v5r n GLN 81 Cb 1.04 -0.90 -0.09 0.00 0.11 0.00 0.00 30.24 30.40 1v5r n GLN 81 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1v5r s ILE 82 N -1.41 3.91 -0.04 5.09 1.09 -1.26 -5.03 121.20 123.55 1v5r s ILE 82 Ca 0.54 -2.65 -0.29 0.00 -1.10 0.00 0.00 60.65 57.15 1v5r s ILE 82 Cb -0.62 -3.55 0.11 0.00 -1.06 0.00 0.00 42.46 37.34 1v5r s ILE 82 CO 0.56 -0.86 0.91 -0.55 -0.10 0.00 0.00 174.94 174.90 1v5r s SER 83 N 1.23 -0.37 0.44 3.58 0.15 -1.26 -5.18 113.70 112.30 1v5r s SER 83 Ca 0.15 0.09 0.05 0.00 0.70 0.00 0.00 55.95 56.94 1v5r s SER 83 Cb -0.20 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.49 1v5r s SER 83 CO -0.04 -0.56 0.61 -0.13 1.20 0.00 0.00 173.24 174.32 1v5r s ARG 84 N -2.69 2.83 -0.18 5.44 0.52 -1.26 -5.06 118.95 118.54 1v5r s ARG 84 Ca 0.03 -1.02 -0.17 0.00 -0.52 0.00 0.00 55.73 54.05 1v5r s ARG 84 Cb -0.01 -2.69 -0.14 0.00 0.52 0.00 0.00 34.95 32.64 1v5r s ARG 84 CO -0.06 -0.32 0.12 0.28 0.02 0.00 0.00 175.30 175.33 1v5r h VAL 85 N 0.52 0.64 -5.89 3.52 2.07 -2.02 -3.49 116.25 111.61 1v5r h VAL 85 Ca -0.42 -1.78 -0.39 0.00 0.82 0.00 0.00 66.70 64.93 1v5r h VAL 85 Cb 1.28 1.51 0.11 0.00 -1.52 0.00 0.00 31.29 32.67 1v5r h VAL 85 CO 0.49 0.22 -0.73 -0.67 0.02 0.00 0.00 177.57 176.90 1v5r n ASP 86 N -4.51 -4.47 -4.17 0.57 -0.08 -1.26 -4.98 116.55 97.65 1v5r n ASP 86 Ca -0.22 -0.63 -0.34 0.00 -1.51 0.00 0.00 54.79 52.10 1v5r n ASP 86 Cb 0.51 -4.79 -0.15 0.00 2.34 0.00 0.00 41.12 39.03 1v5r n ASP 86 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1v5r s GLY 87 N -3.70 1.49 -0.30 0.27 0.00 -1.26 -5.07 107.32 98.75 1v5r s GLY 87 Ca 0.38 -1.28 -0.15 0.00 0.00 0.00 0.00 44.72 43.67 1v5r s GLY 87 CO 0.75 0.37 1.01 1.25 0.00 0.00 0.00 173.10 176.48 1v5r s LYS 88 N 1.32 0.27 -0.28 2.90 2.20 -1.26 -5.17 119.74 119.73 1v5r s LYS 88 Ca 0.03 0.67 -0.25 0.00 -0.36 0.00 0.00 55.97 56.07 1v5r s LYS 88 Cb -0.14 0.40 0.10 0.00 -1.51 0.00 0.00 37.83 36.68 1v5r s LYS 88 CO -0.09 -0.10 0.88 -0.08 -0.36 0.00 0.00 175.35 175.60 1v5r s THR 89 N 2.44 0.00 0.28 3.43 -1.32 -1.26 -5.14 115.64 114.07 1v5r s THR 89 Ca -0.02 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.18 1v5r s THR 89 Cb -0.06 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 69.79 1v5r s THR 89 CO -0.17 0.00 0.97 -0.24 -2.21 0.00 0.00 174.62 172.97 1v5r n SER 90 N 2.52 1.08 -4.14 8.08 2.88 -1.26 -4.95 113.62 117.82 1v5r n SER 90 Ca -0.13 1.17 -0.29 0.00 -1.33 0.00 0.00 58.87 58.28 1v5r n SER 90 Cb 0.56 -1.26 0.22 0.00 -0.75 0.00 0.00 64.21 62.98 1v5r n SER 90 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1v5r s PRO 91 N -1.45 -0.65 -0.16 -1.46 0.04 -1.26 -5.01 135.00 125.04 1v5r s PRO 91 Ca 0.60 0.14 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 1v5r s PRO 91 Cb -0.73 -1.64 0.12 0.00 0.04 0.00 0.00 34.50 32.29 1v5r s PRO 91 CO 0.59 -3.37 0.96 -1.54 0.04 0.00 0.00 177.00 173.68 1v5r s SER 92 N -3.72 -0.42 -0.31 6.66 1.04 -1.25 -5.07 113.70 110.64 1v5r s SER 92 Ca 0.69 0.51 -0.05 0.00 0.48 0.00 0.00 55.95 57.57 1v5r s SER 92 Cb -0.13 0.41 0.26 0.00 0.10 0.00 0.00 66.02 66.66 1v5r s SER 92 CO 0.57 -0.35 1.25 0.61 0.98 0.00 0.00 173.24 176.29 1v5r n GLY 93 N 0.95 -1.96 1.32 7.32 0.00 -1.26 -4.02 105.19 107.53 1v5r n GLY 93 Ca -0.12 1.22 -0.11 0.00 0.00 0.00 0.00 46.02 47.01 1v5r n GLY 93 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v5r n PRO 94 N 1.82 -1.82 -3.33 1.61 -0.04 -1.26 -4.99 135.00 127.00 1v5r n PRO 94 Ca 0.04 -0.66 -0.41 0.00 -0.04 0.00 0.00 63.50 62.43 1v5r n PRO 94 Cb 0.70 -0.61 -0.09 0.00 -0.04 0.00 0.00 33.50 33.46 1v5r n PRO 94 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v5r s SER 95 N -2.61 6.26 0.21 3.54 0.15 -1.26 -5.06 113.70 114.93 1v5r s SER 95 Ca 0.27 -0.01 0.09 0.00 0.70 0.00 0.00 55.95 56.99 1v5r s SER 95 Cb -0.03 -2.23 -0.05 0.00 -1.71 0.00 0.00 66.02 62.01 1v5r s SER 95 CO 0.20 -0.36 -0.17 -0.94 1.20 0.00 0.00 173.24 173.17 1v5r s SER 96 N 1.72 2.84 0.00 5.45 1.04 -1.26 -5.38 113.70 118.11 1v5r s SER 96 Ca 0.16 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1v5r s SER 96 Cb -0.16 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.78 1v5r s SER 96 CO 0.12 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.86