#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 -4.28 -3.59 1.61 2.88 -1.26 -5.02 113.62 103.95 1v5r n SER 2 Ca 0.00 -0.37 -0.15 0.00 -1.33 0.00 0.00 58.87 57.01 1v5r n SER 2 Cb 0.00 -3.56 -0.07 0.00 -0.75 0.00 0.00 64.21 59.83 1v5r n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v5r s SER 3 N -3.38 -0.72 0.48 -3.46 0.01 -1.26 -5.18 113.70 100.20 1v5r s SER 3 Ca 0.30 1.20 0.02 0.00 1.31 0.00 0.00 55.95 58.79 1v5r s SER 3 Cb -0.13 1.15 -0.02 0.00 0.21 0.00 0.00 66.02 67.23 1v5r s SER 3 CO 0.49 -0.37 0.02 -0.83 0.41 0.00 0.00 173.24 172.96 1v5r s GLY 4 N -0.15 2.90 -0.26 3.44 0.00 -1.26 -5.16 107.32 106.83 1v5r s GLY 4 Ca -0.04 -0.75 -0.12 0.00 0.00 0.00 0.00 44.72 43.81 1v5r s GLY 4 CO 0.04 -2.13 0.60 -0.56 0.00 0.00 0.00 173.10 171.05 1v5r s SER 5 N -3.81 -0.85 -0.04 1.64 0.01 -1.26 -5.05 113.70 104.33 1v5r s SER 5 Ca 0.12 1.36 -0.23 0.00 1.31 0.00 0.00 55.95 58.52 1v5r s SER 5 Cb 0.03 1.50 -0.26 0.00 0.21 0.00 0.00 66.02 67.50 1v5r s SER 5 CO 0.06 -0.23 0.98 0.77 0.41 0.00 0.00 173.24 175.24 1v5r h SER 6 N 7.40 0.36 -0.17 2.44 4.64 -2.10 -3.47 113.55 122.65 1v5r h SER 6 Ca -0.27 -0.85 0.27 0.00 -0.47 0.00 0.00 61.79 60.47 1v5r h SER 6 Cb 1.18 -0.11 -0.22 0.00 -0.31 0.00 0.00 62.40 62.93 1v5r h SER 6 CO 0.17 1.17 0.30 -0.83 -0.87 0.00 0.00 176.83 176.77 1v5r s GLY 7 N -4.15 -0.08 -0.10 -0.77 0.00 -1.26 -5.15 107.32 95.81 1v5r s GLY 7 Ca -0.15 3.15 -0.13 0.00 0.00 0.00 0.00 44.72 47.59 1v5r s GLY 7 CO 0.79 3.81 0.32 -1.31 0.00 0.00 0.00 173.10 176.70 1v5r s ASN 8 N 2.80 6.57 -0.12 1.64 -0.87 -1.26 -5.01 114.94 118.68 1v5r s ASN 8 Ca -0.06 0.67 -0.27 0.00 -1.57 0.00 0.00 52.86 51.63 1v5r s ASN 8 Cb -0.07 -2.19 -0.24 0.00 -0.02 0.00 0.00 41.25 38.73 1v5r s ASN 8 CO -0.10 0.22 0.77 -0.07 -2.57 0.00 0.00 177.10 175.36 1v5r h LEU 9 N 5.72 -0.00 0.55 0.60 3.38 -2.01 -3.27 115.31 120.27 1v5r h LEU 9 Ca -0.47 -0.88 -0.02 0.00 0.09 0.00 0.00 57.88 56.60 1v5r h LEU 9 Cb 1.20 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 1v5r h LEU 9 CO 0.68 0.91 -0.51 0.25 0.09 0.00 0.00 178.44 179.86 1v5r h LEU 10 N -0.95 -1.38 -0.97 1.67 5.85 -1.97 -1.48 115.31 116.08 1v5r h LEU 10 Ca -0.00 0.11 0.15 0.00 0.84 0.00 0.00 57.88 58.97 1v5r h LEU 10 Cb 0.89 0.45 -0.15 0.00 0.37 0.00 0.00 40.66 42.21 1v5r h LEU 10 CO 0.00 -0.69 -0.39 -0.67 -0.34 0.00 0.00 178.44 176.36 1v5r n ASP 11 N -5.55 -0.65 0.09 1.25 2.03 -1.26 0.42 116.55 112.89 1v5r n ASP 11 Ca -0.12 1.69 -0.12 0.00 0.52 0.00 0.00 54.79 56.75 1v5r n ASP 11 Cb 0.47 -0.38 -0.05 0.00 -0.72 0.00 0.00 41.12 40.44 1v5r n ASP 11 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1v5r h ASP 12 N 0.00 -0.51 0.01 1.67 1.82 -1.55 0.05 116.42 117.92 1v5r h ASP 12 Ca 0.33 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 57.03 1v5r h ASP 12 Cb 0.57 0.20 -0.00 0.00 0.68 0.00 0.00 39.33 40.77 1v5r h ASP 12 CO -0.96 -0.26 -0.00 0.00 -1.61 0.00 0.00 179.24 176.41 1v5r h ALA 13 N 0.50 1.32 0.06 -0.78 0.00 0.44 0.28 119.26 121.08 1v5r h ALA 13 Ca 0.03 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 1v5r h ALA 13 Cb 0.37 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1v5r h ALA 13 CO -0.11 0.00 -1.21 0.28 0.00 0.00 0.00 179.25 178.22 1v5r h VAL 14 N 0.00 1.50 0.23 0.00 2.07 0.14 -3.21 116.25 116.98 1v5r h VAL 14 Ca -0.00 -3.17 -0.31 0.00 0.82 0.00 0.00 66.70 64.04 1v5r h VAL 14 Cb 0.01 2.83 0.04 0.00 -1.52 0.00 0.00 31.29 32.65 1v5r h VAL 14 CO 0.00 0.89 -1.34 0.50 0.02 0.00 0.00 177.57 177.64 1v5r h LYS 15 N 0.03 0.50 -0.42 1.57 3.64 0.26 -3.12 116.57 119.03 1v5r h LYS 15 Ca -0.10 -0.85 0.06 0.00 -1.27 0.00 0.00 60.65 58.49 1v5r h LYS 15 Cb 1.89 0.31 -0.05 0.00 -0.41 0.00 0.00 32.23 33.97 1v5r h LYS 15 CO 0.15 1.40 0.13 0.07 -2.27 0.00 0.00 179.45 178.94 1v5r h ARG 16 N 0.05 0.28 -0.27 1.90 0.11 -1.12 0.80 114.38 116.12 1v5r h ARG 16 Ca -0.23 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.83 1v5r h ARG 16 Cb 2.06 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 33.06 1v5r h ARG 16 CO 0.25 0.18 0.15 0.82 0.10 0.00 0.00 179.97 181.48 1v5r h ILE 17 N 0.29 1.12 0.00 0.08 2.04 -1.67 -0.80 117.51 118.57 1v5r h ILE 17 Ca 0.20 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1v5r h ILE 17 Cb 0.21 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1v5r h ILE 17 CO -0.22 0.12 -0.11 0.77 0.00 0.00 0.00 178.15 178.71 1v5r h SER 18 N 0.33 0.00 -0.54 1.72 4.64 -1.37 -1.79 113.55 116.54 1v5r h SER 18 Ca 0.10 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.21 1v5r h SER 18 Cb 0.06 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.03 1v5r h SER 18 CO -0.02 0.11 0.15 -0.62 -0.87 0.00 0.00 176.83 175.58 1v5r n GLU 19 N -3.72 2.66 -3.15 4.77 1.02 0.23 -4.38 120.64 118.07 1v5r n GLU 19 Ca -0.02 -3.06 0.05 0.00 -0.02 0.00 0.00 57.16 54.12 1v5r n GLU 19 Cb 0.22 -1.99 -0.01 0.00 -0.02 0.00 0.00 31.44 29.64 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 -1.81 -0.39 0.46 1.62 2.15 -0.37 -3.92 116.67 114.41 1v5r s ASP 20 Ca 0.49 0.14 -0.23 0.00 0.43 0.00 0.00 52.55 53.38 1v5r s ASP 20 Cb 0.41 1.28 -0.07 0.00 -0.30 0.00 0.00 42.92 44.24 1v5r s ASP 20 CO 0.07 -0.07 1.16 -2.16 -0.17 0.00 0.00 175.17 174.00 1v5r s PRO 21 N 2.96 3.74 0.09 4.34 0.04 -1.26 -4.48 135.00 140.44 1v5r s PRO 21 Ca 0.12 1.77 -0.31 0.00 0.04 0.00 0.00 61.00 62.62 1v5r s PRO 21 Cb -0.06 -2.39 -0.07 0.00 0.04 0.00 0.00 34.50 32.02 1v5r s PRO 21 CO -0.16 -0.56 1.38 -1.25 0.04 0.00 0.00 177.00 176.44 1v5r s PRO 22 N -2.72 4.32 -0.34 0.56 0.04 -1.25 -4.87 135.00 130.73 1v5r s PRO 22 Ca 0.64 2.03 -0.35 0.00 0.04 0.00 0.00 61.00 63.36 1v5r s PRO 22 Cb -0.28 -3.33 -0.11 0.00 0.04 0.00 0.00 34.50 30.82 1v5r s PRO 22 CO 0.34 -0.45 2.20 0.00 0.04 0.00 0.00 177.00 179.13 1v5r h LYS 24 N 12.62 0.77 -6.14 0.00 1.79 -1.92 -3.45 116.57 120.25 1v5r h LYS 24 Ca -0.28 -0.08 -0.58 0.00 -2.18 0.00 0.00 60.65 57.53 1v5r h LYS 24 Cb 1.32 -0.16 0.19 0.00 -1.58 0.00 0.00 32.23 32.00 1v5r h LYS 24 CO 1.02 0.58 -1.15 0.00 -1.08 0.00 0.00 179.45 178.81 1v5r n PRO 26 N 1.28 0.49 -3.54 0.00 -0.04 -1.26 -4.42 135.00 127.51 1v5r n PRO 26 Ca 0.06 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.32 1v5r n PRO 26 Cb 0.50 -1.32 -0.14 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.26 0.69 0.52 2.01 -1.26 -5.14 115.64 110.20 1v5r s THR 27 Ca 0.15 -0.10 -0.16 0.00 0.31 0.00 0.00 61.69 61.89 1v5r s THR 27 Cb 0.07 -0.62 0.02 0.00 0.01 0.00 0.00 72.50 71.97 1v5r s THR 27 CO 0.11 -0.20 1.18 -0.75 -0.69 0.00 0.00 174.62 174.27 1v5r s LYS 28 N 2.27 2.46 1.25 4.92 2.47 -1.26 -4.99 119.74 126.85 1v5r s LYS 28 Ca 0.05 1.67 -0.15 0.00 -1.56 0.00 0.00 55.97 55.98 1v5r s LYS 28 Cb -0.16 -1.88 0.32 0.00 -1.46 0.00 0.00 37.83 34.65 1v5r s LYS 28 CO -0.11 -1.57 0.99 0.12 0.16 0.00 0.00 175.35 174.94 1v5r s PHE 29 N -2.02 0.90 -0.43 4.03 5.36 -1.26 -4.96 117.98 119.59 1v5r s PHE 29 Ca 0.73 1.05 -0.15 0.00 -0.96 0.00 0.00 56.93 57.60 1v5r s PHE 29 Cb -0.27 -3.03 0.03 0.00 -0.34 0.00 0.00 43.02 39.42 1v5r s PHE 29 CO 0.42 -4.25 0.33 0.00 -1.46 0.00 0.00 175.22 170.25 1v5r s VAL 31 N 1.67 0.60 0.00 0.00 1.01 -1.19 -1.44 120.40 121.05 1v5r s VAL 31 Ca 0.05 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.26 1v5r s VAL 31 Cb -0.20 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.92 1v5r s VAL 31 CO 0.09 -0.39 -0.23 -0.70 0.00 0.00 0.00 175.10 173.87 1v5r s GLU 32 N 1.80 1.74 -0.14 2.72 2.56 -1.08 -4.90 118.70 121.39 1v5r s GLU 32 Ca 0.03 -0.87 -0.21 0.00 0.00 0.00 0.00 54.97 53.91 1v5r s GLU 32 Cb -0.17 -1.75 -0.03 0.00 2.00 0.00 0.00 34.13 34.18 1v5r s GLU 32 CO -0.16 0.47 0.63 0.50 -0.56 0.00 0.00 175.26 176.14 1v5r s ARG 33 N -0.74 4.31 -0.23 4.30 3.52 -1.26 0.04 118.95 128.88 1v5r s ARG 33 Ca 0.09 0.68 -0.10 0.00 -0.13 0.00 0.00 55.73 56.26 1v5r s ARG 33 Cb -0.09 -3.51 -0.10 0.00 -1.56 0.00 0.00 34.95 29.69 1v5r s ARG 33 CO 0.00 -0.07 -0.28 1.28 -0.81 0.00 0.00 175.30 175.41 1v5r n LEU 34 N 4.40 1.76 0.00 -0.88 4.77 -0.55 -4.97 117.00 121.53 1v5r n LEU 34 Ca -0.02 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.14 1v5r n LEU 34 Cb 0.51 -0.68 0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1v5r n LEU 34 CO 0.45 0.52 0.68 -1.20 -1.33 0.00 0.00 177.39 176.51 1v5r n SER 35 N -3.92 -1.97 -4.55 -1.43 7.64 -1.18 -5.02 113.62 103.19 1v5r n SER 35 Ca -0.44 -2.20 -0.27 0.00 1.01 0.00 0.00 58.87 56.97 1v5r n SER 35 Cb 0.83 3.24 -0.06 0.00 -1.01 0.00 0.00 64.21 67.21 1v5r n SER 35 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1v5r n GLN 36 N -0.63 0.75 -0.68 1.43 6.02 -1.26 -1.29 117.38 121.72 1v5r n GLN 36 Ca -0.05 -0.34 0.00 0.00 -0.01 0.00 0.00 57.00 56.60 1v5r n GLN 36 Cb 0.58 -3.34 0.00 0.00 1.02 0.00 0.00 30.24 28.50 1v5r n GLN 36 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1v5r n GLY 37 N 6.33 1.03 3.60 1.08 0.00 -1.26 -5.05 105.19 110.92 1v5r n GLY 37 Ca 0.44 -0.19 -0.07 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.42 0.68 -0.00 1.61 6.06 -0.41 -3.40 118.95 122.06 1v5r s ARG 38 Ca 0.00 1.19 -0.18 0.00 -2.50 0.00 0.00 55.73 54.24 1v5r s ARG 38 Cb 0.00 0.14 0.03 0.00 0.06 0.00 0.00 34.95 35.18 1v5r s ARG 38 CO 0.00 -0.15 0.38 0.71 -2.50 0.00 0.00 175.30 173.74 1v5r s TYR 39 N 1.64 -0.26 -0.55 5.12 1.51 -1.23 -1.49 117.35 122.09 1v5r s TYR 39 Ca -0.10 0.36 -0.22 0.00 -1.01 0.00 0.00 57.07 56.10 1v5r s TYR 39 Cb -0.05 0.17 0.06 0.00 -0.11 0.00 0.00 41.96 42.02 1v5r s TYR 39 CO -0.19 -0.47 0.82 0.50 -1.11 0.00 0.00 175.55 175.10 1v5r s ARG 40 N -1.65 3.21 -0.38 -0.62 3.52 0.11 -2.99 118.95 120.14 1v5r s ARG 40 Ca -0.11 -0.64 -0.12 0.00 -0.13 0.00 0.00 55.73 54.74 1v5r s ARG 40 Cb -0.03 -4.11 0.03 0.00 -1.56 0.00 0.00 34.95 29.28 1v5r s ARG 40 CO 0.03 -1.45 0.23 0.08 -0.81 0.00 0.00 175.30 173.39 1v5r s VAL 41 N 3.42 4.76 -1.18 7.11 1.01 0.18 -2.65 120.40 133.05 1v5r s VAL 41 Ca 0.23 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1v5r s VAL 41 Cb -0.16 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 1v5r s VAL 41 CO 0.14 -0.25 0.80 0.61 0.00 0.00 0.00 175.10 176.41 1v5r n GLY 42 N 5.04 -0.73 3.32 4.51 0.00 -0.52 -1.87 105.19 114.94 1v5r n GLY 42 Ca -0.12 0.34 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.96 -5.32 -3.85 1.61 1.02 -1.26 -4.98 120.64 103.90 1v5r n GLU 43 Ca -0.18 0.77 -0.12 0.00 -0.02 0.00 0.00 57.16 57.61 1v5r n GLU 43 Cb 0.64 -5.65 -0.12 0.00 -0.02 0.00 0.00 31.44 26.29 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 -6.01 0.24 -0.50 3.49 1.02 -0.78 -5.12 119.74 112.07 1v5r s LYS 44 Ca 0.43 -0.03 -0.17 0.00 0.02 0.00 0.00 55.97 56.22 1v5r s LYS 44 Cb -0.20 0.11 0.08 0.00 -0.52 0.00 0.00 37.83 37.30 1v5r s LYS 44 CO 0.53 -0.04 0.51 0.42 -0.92 0.00 0.00 175.35 175.84 1v5r s ILE 45 N -0.42 5.09 -0.05 2.17 -1.09 -1.26 0.50 121.20 126.14 1v5r s ILE 45 Ca -0.05 -0.97 0.06 0.00 -2.23 0.00 0.00 60.65 57.46 1v5r s ILE 45 Cb -0.03 -4.25 -0.02 0.00 -1.58 0.00 0.00 42.46 36.59 1v5r s ILE 45 CO 0.00 -0.74 -0.23 -0.76 -1.23 0.00 0.00 174.94 171.98 1v5r s LEU 46 N 2.01 2.22 -0.16 2.97 1.43 -1.16 -5.02 118.68 120.98 1v5r s LEU 46 Ca 0.08 -0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 52.45 1v5r s LEU 46 Cb -0.24 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 1v5r s LEU 46 CO 0.07 0.28 1.12 0.12 0.23 0.00 0.00 176.35 178.18 1v5r s PHE 47 N -0.35 3.21 -0.19 0.29 5.36 -1.26 -3.48 117.98 121.57 1v5r s PHE 47 Ca 0.02 1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 57.29 1v5r s PHE 47 Cb -0.12 -3.35 -0.01 0.00 -0.34 0.00 0.00 43.02 39.20 1v5r s PHE 47 CO 0.02 -0.92 -0.09 0.42 -1.46 0.00 0.00 175.22 173.19 1v5r s ILE 48 N 2.88 3.11 0.45 3.12 1.01 -1.22 0.79 121.20 131.35 1v5r s ILE 48 Ca 0.50 -0.60 0.06 0.00 0.00 0.00 0.00 60.65 60.61 1v5r s ILE 48 Cb -0.19 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 1v5r s ILE 48 CO 0.13 0.47 0.17 0.00 0.00 0.00 0.00 174.94 175.71 1v5r s ARG 49 N 1.10 2.20 -0.08 2.79 1.70 0.14 -4.33 118.95 122.47 1v5r s ARG 49 Ca 0.01 -1.99 0.00 0.00 -0.47 0.00 0.00 55.73 53.28 1v5r s ARG 49 Cb -0.15 -1.89 0.02 0.00 -0.57 0.00 0.00 34.95 32.37 1v5r s ARG 49 CO -0.02 -0.23 -0.07 1.41 -1.08 0.00 0.00 175.30 175.31 1v5r s MET 50 N -3.94 1.30 -0.45 3.89 1.75 -1.26 -1.69 119.30 118.91 1v5r s MET 50 Ca 0.34 -0.21 -0.23 0.00 -1.25 0.00 0.00 55.69 54.34 1v5r s MET 50 Cb 0.03 -1.30 0.03 0.00 2.84 0.00 0.00 34.83 36.43 1v5r s MET 50 CO 0.19 -0.16 0.76 -0.51 -0.65 0.00 0.00 175.02 174.65 1v5r s LEU 51 N 1.31 4.29 -1.31 4.11 1.43 0.11 -4.12 118.68 124.51 1v5r s LEU 51 Ca -0.03 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.88 1v5r s LEU 51 Cb -0.14 -2.93 0.03 0.00 0.03 0.00 0.00 46.19 43.18 1v5r s LEU 51 CO -0.03 -0.90 0.35 1.41 0.23 0.00 0.00 176.35 177.41 1v5r n HIS 52 N 6.65 -1.68 -3.70 0.29 8.25 -1.26 -0.92 115.22 122.84 1v5r n HIS 52 Ca 0.02 0.32 -0.28 0.00 -0.26 0.00 0.00 57.72 57.51 1v5r n HIS 52 Cb 0.48 -3.32 -0.01 0.00 1.12 0.00 0.00 29.99 28.27 1v5r n HIS 52 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1v5r n ASN 53 N -2.19 -3.72 0.00 0.41 3.02 -1.26 -4.75 115.26 106.78 1v5r n ASN 53 Ca -0.09 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 1v5r n ASN 53 Cb 0.59 -3.05 0.00 0.00 -0.61 0.00 0.00 39.78 36.71 1v5r n ASN 53 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1v5r n LYS 54 N -4.05 0.21 -4.92 3.52 4.81 -0.10 -5.07 118.16 112.56 1v5r n LYS 54 Ca 0.02 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.16 1v5r n LYS 54 Cb 0.52 -0.75 -0.14 0.00 0.02 0.00 0.00 35.03 34.68 1v5r n LYS 54 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1v5r s HIS 55 N -1.49 2.45 -0.39 5.64 3.76 -0.98 -4.96 115.29 119.32 1v5r s HIS 55 Ca 0.00 -0.34 -0.02 0.00 -0.15 0.00 0.00 55.06 54.56 1v5r s HIS 55 Cb 0.00 -1.47 0.11 0.00 1.11 0.00 0.00 32.58 32.32 1v5r s HIS 55 CO 0.00 0.14 0.17 0.08 -0.85 0.00 0.00 174.74 174.28 1v5r s VAL 56 N -0.79 3.12 0.35 -0.90 1.01 -1.26 0.07 120.40 122.00 1v5r s VAL 56 Ca 0.12 -2.06 0.07 0.00 0.00 0.00 0.00 61.98 60.11 1v5r s VAL 56 Cb -0.10 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 1v5r s VAL 56 CO 0.02 -0.65 0.42 -0.04 0.00 0.00 0.00 175.10 174.86 1v5r s MET 57 N 1.11 2.95 0.22 2.72 -1.94 -0.68 -0.44 119.30 123.23 1v5r s MET 57 Ca 0.08 -1.14 0.06 0.00 -1.71 0.00 0.00 55.69 52.98 1v5r s MET 57 Cb -0.22 -2.69 -0.05 0.00 2.01 0.00 0.00 34.83 33.88 1v5r s MET 57 CO -0.05 0.03 -0.09 0.14 -0.01 0.00 0.00 175.02 175.04 1v5r s VAL 58 N -2.24 1.50 -0.44 -6.03 -7.23 0.14 -0.68 120.40 105.42 1v5r s VAL 58 Ca 0.45 -2.14 -0.11 0.00 -1.81 0.00 0.00 61.98 58.37 1v5r s VAL 58 Cb -0.08 -2.16 0.08 0.00 0.56 0.00 0.00 36.38 34.78 1v5r s VAL 58 CO 0.30 -0.50 0.31 -0.60 -0.31 0.00 0.00 175.10 174.29 1v5r s ARG 59 N -3.72 2.69 0.23 4.82 6.06 0.24 -2.72 118.95 126.55 1v5r s ARG 59 Ca 0.24 -1.47 0.10 0.00 -2.50 0.00 0.00 55.73 52.10 1v5r s ARG 59 Cb 0.02 -3.89 -0.05 0.00 0.06 0.00 0.00 34.95 31.09 1v5r s ARG 59 CO 0.07 -1.01 -0.19 0.14 -2.50 0.00 0.00 175.30 171.82 1v5r s VAL 60 N 1.47 2.15 -0.65 7.11 -7.23 -0.87 -4.14 120.40 118.23 1v5r s VAL 60 Ca 0.03 -2.23 -0.28 0.00 -1.81 0.00 0.00 61.98 57.70 1v5r s VAL 60 Cb -0.24 -2.13 -0.12 0.00 0.56 0.00 0.00 36.38 34.45 1v5r s VAL 60 CO 0.03 -0.41 2.51 0.61 -0.31 0.00 0.00 175.10 177.52 1v5r n GLY 61 N -0.30 -0.03 0.00 2.32 0.00 -1.26 -1.35 105.19 104.57 1v5r n GLY 61 Ca -0.08 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.76 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 6.17 4.35 0.00 -0.02 0.00 -1.26 -4.93 105.19 109.50 1v5r n GLY 62 Ca 0.46 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1v5r n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5r n GLY 63 N 0.00 -0.53 3.72 -0.02 0.00 -0.45 -5.15 105.19 102.76 1v5r n GLY 63 Ca 0.00 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 1v5r n GLY 63 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1v5r s TRP 64 N -3.06 3.21 0.23 1.61 0.52 -1.26 -2.06 118.94 118.13 1v5r s TRP 64 Ca 0.00 0.20 0.00 0.00 0.02 0.00 0.00 56.10 56.33 1v5r s TRP 64 Cb 0.00 -1.77 -0.04 0.00 -1.15 0.00 0.00 33.47 30.51 1v5r s TRP 64 CO 0.00 0.51 0.12 -1.83 0.02 0.00 0.00 176.95 175.77 1v5r s GLU 65 N -1.20 1.31 -0.15 4.98 -1.05 -1.10 -4.92 118.70 116.58 1v5r s GLU 65 Ca 0.17 -1.70 -0.29 0.00 -0.15 0.00 0.00 54.97 52.99 1v5r s GLU 65 Cb -0.12 0.05 -0.02 0.00 -0.44 0.00 0.00 34.13 33.61 1v5r s GLU 65 CO 0.06 -0.36 1.23 0.95 0.95 0.00 0.00 175.26 178.09 1v5r s THR 66 N -3.96 4.32 0.28 1.83 -4.23 -1.26 -0.68 115.64 111.93 1v5r s THR 66 Ca 0.38 1.60 -0.05 0.00 -1.18 0.00 0.00 61.69 62.44 1v5r s THR 66 Cb 0.07 -4.03 0.40 0.00 1.34 0.00 0.00 72.50 70.28 1v5r s THR 66 CO 0.13 -0.11 1.58 0.15 -0.54 0.00 0.00 174.62 175.83 1v5r h PHE 67 N 7.97 -0.29 -0.42 3.99 3.57 -1.04 1.40 116.94 132.11 1v5r h PHE 67 Ca -0.27 0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.34 1v5r h PHE 67 Cb 1.11 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 1v5r h PHE 67 CO 0.78 -0.39 0.28 0.00 -2.23 0.00 0.00 178.31 176.75 1v5r h ALA 68 N 1.92 1.87 -0.12 2.41 0.00 -1.91 -1.85 119.26 121.58 1v5r h ALA 68 Ca 0.49 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.34 1v5r h ALA 68 Cb 0.87 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1v5r h ALA 68 CO -0.91 0.07 -0.10 0.78 0.00 0.00 0.00 179.25 179.09 1v5r h GLY 69 N 0.42 0.30 1.63 0.00 0.00 0.15 -2.00 103.07 103.57 1v5r h GLY 69 Ca 0.17 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 1v5r h GLY 69 CO -0.04 0.27 0.07 -1.82 0.00 0.00 0.00 176.54 175.02 1v5r h TYR 70 N -0.10 0.48 -0.11 5.60 5.03 -0.92 -1.32 116.97 125.63 1v5r h TYR 70 Ca 0.02 -0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 1v5r h TYR 70 Cb 0.61 -0.15 -0.00 0.00 1.55 0.00 0.00 36.73 38.74 1v5r h TYR 70 CO 0.08 0.43 -0.11 1.25 -1.32 0.00 0.00 178.16 178.49 1v5r h LEU 71 N 0.47 0.28 -1.05 2.82 5.85 -1.30 -3.09 115.31 119.29 1v5r h LEU 71 Ca 0.11 -0.48 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 1v5r h LEU 71 Cb 0.19 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 1v5r h LEU 71 CO -0.00 0.71 0.35 0.17 -0.34 0.00 0.00 178.44 179.32 1v5r h LEU 72 N -0.14 0.92 -0.13 2.25 8.10 -1.11 0.22 115.31 125.43 1v5r h LEU 72 Ca 0.02 -0.10 0.04 0.00 0.11 0.00 0.00 57.88 57.95 1v5r h LEU 72 Cb 0.63 -0.24 -0.05 0.00 -0.44 0.00 0.00 40.66 40.56 1v5r h LEU 72 CO 0.03 0.78 -0.20 0.11 -4.11 0.00 0.00 178.44 175.05 1v5r h LYS 73 N 1.02 -0.24 0.06 0.17 1.57 -1.22 -3.13 116.57 114.79 1v5r h LYS 73 Ca 0.25 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1v5r h LYS 73 Cb 0.10 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1v5r h LYS 73 CO -0.03 -0.16 -0.03 0.45 -0.57 0.00 0.00 179.45 179.11 1v5r h HIS 74 N -0.25 -0.07 -2.34 -1.35 3.86 -1.43 -3.44 115.15 110.13 1v5r h HIS 74 Ca 0.10 -0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.76 1v5r h HIS 74 Cb 0.39 0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.90 1v5r h HIS 74 CO -0.30 0.53 1.27 0.34 0.86 0.00 0.00 177.93 180.63 1v5r s ASP 75 N -5.77 6.24 0.01 2.45 -1.08 0.75 -4.89 116.67 114.39 1v5r s ASP 75 Ca -0.15 2.38 -0.23 0.00 -0.52 0.00 0.00 52.55 54.04 1v5r s ASP 75 Cb -0.00 -2.53 -0.17 0.00 -1.46 0.00 0.00 42.92 38.76 1v5r s ASP 75 CO 0.57 -1.26 1.31 1.55 0.52 0.00 0.00 175.17 177.86 1v5r h PRO 76 N 11.50 0.21 -0.69 4.34 0.13 -1.85 -3.01 132.00 142.64 1v5r h PRO 76 Ca -0.46 -0.11 0.07 0.00 -0.87 0.00 0.00 66.00 64.63 1v5r h PRO 76 Cb 1.23 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 1v5r h PRO 76 CO 0.95 0.64 0.45 0.00 -0.23 0.00 0.00 178.00 179.81 1v5r h ARG 78 N 0.66 0.39 -1.91 0.00 3.08 -1.84 -2.68 114.38 112.07 1v5r h ARG 78 Ca 0.30 -0.08 0.55 0.00 0.07 0.00 0.00 59.98 60.82 1v5r h ARG 78 Cb 0.33 -0.06 -0.08 0.00 0.08 0.00 0.00 29.97 30.25 1v5r h ARG 78 CO -0.10 0.47 1.41 -1.33 -1.07 0.00 0.00 179.97 179.35 1v5r n MET 79 N -4.75 0.00 -1.59 0.04 2.81 -0.78 -2.60 117.12 110.25 1v5r n MET 79 Ca -0.03 1.08 -0.41 0.00 -1.81 0.00 0.00 57.70 56.52 1v5r n MET 79 Cb 0.16 -2.50 -0.01 0.00 -0.71 0.00 0.00 33.22 30.15 1v5r n MET 79 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1v5r n LEU 80 N -3.86 6.82 -3.80 4.03 4.32 -1.01 -4.71 117.00 118.79 1v5r n LEU 80 Ca 0.43 -4.02 -0.28 0.00 -0.02 0.00 0.00 56.01 52.12 1v5r n LEU 80 Cb 1.99 -1.58 -0.12 0.00 -1.62 0.00 0.00 43.42 42.09 1v5r n LEU 80 CO 0.43 1.09 -0.12 -1.10 -1.22 0.00 0.00 177.39 176.47 1v5r s GLN 81 N 3.24 2.04 -1.13 3.23 -0.21 -1.07 -4.90 119.66 120.87 1v5r s GLN 81 Ca 0.51 -2.95 -0.12 0.00 0.02 0.00 0.00 55.36 52.83 1v5r s GLN 81 Cb 0.15 -2.97 0.02 0.00 1.00 0.00 0.00 33.01 31.21 1v5r s GLN 81 CO -0.06 -1.28 0.22 -0.89 -2.12 0.00 0.00 175.29 171.16 1v5r n ILE 82 N 2.36 -1.32 -3.95 1.08 -0.00 -1.26 -4.89 119.36 111.38 1v5r n ILE 82 Ca 0.19 -0.43 -0.11 0.00 -0.00 0.00 0.00 62.75 62.41 1v5r n ILE 82 Cb 0.37 -1.19 -0.02 0.00 -0.00 0.00 0.00 39.64 38.80 1v5r n ILE 82 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 1v5r s SER 83 N -3.99 0.25 0.19 4.38 0.15 -1.26 -5.18 113.70 108.24 1v5r s SER 83 Ca 0.16 -1.15 0.05 0.00 0.70 0.00 0.00 55.95 55.71 1v5r s SER 83 Cb -0.09 0.71 -0.04 0.00 -1.71 0.00 0.00 66.02 64.90 1v5r s SER 83 CO 0.79 -1.39 0.20 -0.60 1.20 0.00 0.00 173.24 173.44 1v5r s ARG 84 N -3.14 3.07 0.95 5.44 6.06 -1.26 -4.97 118.95 125.10 1v5r s ARG 84 Ca 0.22 -0.84 -0.14 0.00 -2.50 0.00 0.00 55.73 52.47 1v5r s ARG 84 Cb -0.03 -2.72 0.16 0.00 0.06 0.00 0.00 34.95 32.43 1v5r s ARG 84 CO 0.13 0.47 1.16 0.14 -2.50 0.00 0.00 175.30 174.70 1v5r s VAL 85 N -1.85 1.95 0.05 7.11 -7.23 -1.26 -5.09 120.40 114.08 1v5r s VAL 85 Ca 0.32 0.00 -0.01 0.00 -1.81 0.00 0.00 61.98 60.48 1v5r s VAL 85 Cb -0.10 -2.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 1v5r s VAL 85 CO 0.25 0.00 -0.02 -0.62 -0.31 0.00 0.00 175.10 174.40 1v5r s ASP 86 N -4.14 0.44 0.57 4.85 2.15 -1.26 -5.16 116.67 114.12 1v5r s ASP 86 Ca 0.66 -0.91 0.00 0.00 0.43 0.00 0.00 52.55 52.73 1v5r s ASP 86 Cb -0.13 0.19 0.00 0.00 -0.30 0.00 0.00 42.92 42.68 1v5r s ASP 86 CO 0.53 -0.56 0.00 0.61 -0.17 0.00 0.00 175.17 175.58 1v5r n GLY 87 N 0.32 -3.50 3.76 2.66 0.00 -1.26 -4.90 105.19 102.27 1v5r n GLY 87 Ca -0.16 -1.17 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 1v5r n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v5r s LYS 88 N -1.72 3.73 -0.58 1.61 1.02 -1.26 -4.99 119.74 117.54 1v5r s LYS 88 Ca 0.00 2.15 0.04 0.00 0.02 0.00 0.00 55.97 58.18 1v5r s LYS 88 Cb 0.00 -2.58 0.15 0.00 -0.52 0.00 0.00 37.83 34.87 1v5r s LYS 88 CO 0.00 -0.69 0.35 0.99 -0.92 0.00 0.00 175.35 175.08 1v5r s THR 89 N -1.31 2.49 0.12 2.17 2.01 -1.26 -5.09 115.64 114.77 1v5r s THR 89 Ca 0.61 -3.60 -0.35 0.00 0.31 0.00 0.00 61.69 58.66 1v5r s THR 89 Cb -0.38 -2.69 -0.16 0.00 0.01 0.00 0.00 72.50 69.28 1v5r s THR 89 CO 0.47 -0.91 1.35 -1.54 -0.69 0.00 0.00 174.62 173.30 1v5r n SER 90 N 2.69 1.86 -4.74 3.53 3.41 -1.26 -4.93 113.62 114.17 1v5r n SER 90 Ca 0.12 1.12 -0.30 0.00 -0.26 0.00 0.00 58.87 59.55 1v5r n SER 90 Cb 0.34 -1.24 0.12 0.00 -0.26 0.00 0.00 64.21 63.17 1v5r n SER 90 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1v5r s PRO 91 N 0.36 1.66 -0.02 4.33 0.04 -1.26 -4.99 135.00 135.11 1v5r s PRO 91 Ca 0.81 0.97 -0.21 0.00 0.04 0.00 0.00 61.00 62.61 1v5r s PRO 91 Cb -0.88 -1.84 -0.30 0.00 0.04 0.00 0.00 34.50 31.51 1v5r s PRO 91 CO 0.46 -2.00 0.95 0.66 0.04 0.00 0.00 177.00 177.12 1v5r h SER 92 N -1.38 0.54 -5.17 6.66 4.64 -1.91 -3.50 113.55 113.44 1v5r h SER 92 Ca -0.47 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 59.94 1v5r h SER 92 Cb 1.26 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 63.15 1v5r h SER 92 CO 0.53 1.41 -1.11 0.61 -0.87 0.00 0.00 176.83 177.40 1v5r n GLY 93 N 1.55 -4.35 3.59 -0.77 0.00 -1.26 -4.84 105.19 99.11 1v5r n GLY 93 Ca -0.14 0.71 -0.42 0.00 0.00 0.00 0.00 46.02 46.17 1v5r n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5r s PRO 94 N -1.43 3.22 0.16 1.61 0.04 -1.26 -4.99 135.00 132.35 1v5r s PRO 94 Ca -0.05 1.15 0.10 0.00 0.04 0.00 0.00 61.00 62.24 1v5r s PRO 94 Cb 0.00 -4.21 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 1v5r s PRO 94 CO 0.76 -2.00 -0.21 -1.12 0.04 0.00 0.00 177.00 174.47 1v5r s SER 95 N 6.13 3.62 -0.19 6.66 0.01 -1.26 -5.14 113.70 123.53 1v5r s SER 95 Ca 0.73 -0.73 -0.30 0.00 1.31 0.00 0.00 55.95 56.97 1v5r s SER 95 Cb -0.18 -0.37 0.14 0.00 0.21 0.00 0.00 66.02 65.81 1v5r s SER 95 CO 0.30 0.15 1.10 -0.55 0.41 0.00 0.00 173.24 174.65 1v5r s SER 96 N -2.40 -0.27 0.00 2.44 0.15 -1.26 -5.24 113.70 107.12 1v5r s SER 96 Ca 0.19 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.10 1v5r s SER 96 Cb -0.09 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1v5r s SER 96 CO 0.10 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.88