#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5r s SER 2 N 0.00 -0.25 -0.73 1.61 0.01 -1.26 -5.10 113.70 107.98 1v5r s SER 2 Ca 0.00 0.62 -0.26 0.00 1.31 0.00 0.00 55.95 57.61 1v5r s SER 2 Cb 0.00 1.42 0.01 0.00 0.21 0.00 0.00 66.02 67.67 1v5r s SER 2 CO 0.00 -0.27 1.50 -0.94 0.41 0.00 0.00 173.24 173.94 1v5r s SER 3 N 2.64 5.87 0.08 2.44 1.04 -1.26 -4.86 113.70 119.65 1v5r s SER 3 Ca 0.09 -0.30 -0.18 0.00 0.48 0.00 0.00 55.95 56.05 1v5r s SER 3 Cb -0.14 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.33 1v5r s SER 3 CO -0.16 -2.02 1.43 1.23 0.98 0.00 0.00 173.24 174.70 1v5r h GLY 4 N 14.26 0.56 -3.77 7.32 0.00 -2.00 -3.42 103.07 116.03 1v5r h GLY 4 Ca -0.22 -0.52 -0.49 0.00 0.00 0.00 0.00 47.33 46.11 1v5r h GLY 4 CO 1.27 0.47 -0.79 -0.56 0.00 0.00 0.00 176.54 176.93 1v5r s SER 5 N -6.21 2.31 -1.34 0.19 0.01 -1.26 -4.78 113.70 102.61 1v5r s SER 5 Ca -0.13 -0.77 -0.06 0.00 1.31 0.00 0.00 55.95 56.29 1v5r s SER 5 Cb 0.07 -0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.21 1v5r s SER 5 CO 0.78 -0.05 1.04 -1.20 0.41 0.00 0.00 173.24 174.22 1v5r n SER 6 N 0.70 -4.26 0.00 2.44 7.64 -1.26 -4.83 113.62 114.04 1v5r n SER 6 Ca -0.17 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.07 1v5r n SER 6 Cb 0.56 -4.72 0.00 0.00 -1.01 0.00 0.00 64.21 59.03 1v5r n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5r n GLY 7 N -1.66 0.03 3.23 0.23 0.00 -1.26 -5.04 105.19 100.72 1v5r n GLY 7 Ca -0.11 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 1v5r n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1v5r s ASN 8 N -2.08 5.56 -0.12 1.61 0.01 -1.26 -4.94 114.94 113.73 1v5r s ASN 8 Ca 0.00 -1.64 -0.11 0.00 -0.71 0.00 0.00 52.86 50.40 1v5r s ASN 8 Cb 0.00 -1.96 -0.04 0.00 0.41 0.00 0.00 41.25 39.67 1v5r s ASN 8 CO 0.00 -0.55 -0.22 -0.11 -1.51 0.00 0.00 177.10 174.71 1v5r n LEU 9 N 4.86 1.33 0.40 0.60 7.94 -1.26 -4.14 117.00 126.73 1v5r n LEU 9 Ca -0.09 0.30 -0.16 0.00 -1.11 0.00 0.00 56.01 54.95 1v5r n LEU 9 Cb 0.42 -0.69 -0.07 0.00 0.53 0.00 0.00 43.42 43.61 1v5r n LEU 9 CO 0.38 -0.37 0.51 0.25 -1.11 0.00 0.00 177.39 177.05 1v5r h LEU 10 N -0.70 -0.86 -0.91 -1.96 5.85 -2.01 -3.04 115.31 111.68 1v5r h LEU 10 Ca 0.00 0.03 0.21 0.00 0.84 0.00 0.00 57.88 58.96 1v5r h LEU 10 Cb 0.62 0.22 -0.17 0.00 0.37 0.00 0.00 40.66 41.70 1v5r h LEU 10 CO 0.00 -0.60 -0.11 -0.78 -0.34 0.00 0.00 178.44 176.61 1v5r h ASP 11 N -1.05 -0.65 -0.88 1.25 3.58 -1.97 0.63 116.42 117.33 1v5r h ASP 11 Ca -0.10 0.26 0.21 0.00 0.42 0.00 0.00 57.03 57.82 1v5r h ASP 11 Cb 0.78 0.50 -0.12 0.00 1.72 0.00 0.00 39.33 42.21 1v5r h ASP 11 CO 0.17 -0.30 0.36 -0.78 -2.88 0.00 0.00 179.24 175.82 1v5r h ASP 12 N 0.02 0.29 0.39 2.28 3.58 -1.69 0.09 116.42 121.38 1v5r h ASP 12 Ca 0.49 0.15 -0.02 0.00 0.42 0.00 0.00 57.03 58.07 1v5r h ASP 12 Cb 0.86 0.14 0.00 0.00 1.72 0.00 0.00 39.33 42.06 1v5r h ASP 12 CO -0.89 -0.01 -0.19 0.00 -2.88 0.00 0.00 179.24 175.28 1v5r h ALA 13 N 1.70 -0.59 -0.90 -0.78 0.00 0.33 -1.48 119.26 117.53 1v5r h ALA 13 Ca 0.54 -0.11 0.17 0.00 0.00 0.00 0.00 54.91 55.51 1v5r h ALA 13 Cb 1.01 0.20 -0.17 0.00 0.00 0.00 0.00 17.79 18.84 1v5r h ALA 13 CO -0.53 -0.56 -0.27 0.28 0.00 0.00 0.00 179.25 178.18 1v5r h VAL 14 N -0.99 0.08 -0.21 0.00 2.07 -0.91 0.28 116.25 116.58 1v5r h VAL 14 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1v5r h VAL 14 Cb 0.40 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1v5r h VAL 14 CO 0.09 0.00 0.06 0.50 0.02 0.00 0.00 177.57 178.24 1v5r h LYS 15 N -0.01 0.32 -0.54 1.57 3.11 -1.08 0.11 116.57 120.05 1v5r h LYS 15 Ca 0.40 -0.07 0.09 0.00 -2.81 0.00 0.00 60.65 58.26 1v5r h LYS 15 Cb 0.64 -0.05 -0.07 0.00 -1.00 0.00 0.00 32.23 31.76 1v5r h LYS 15 CO -0.93 0.43 0.15 0.00 -2.81 0.00 0.00 179.45 176.29 1v5r h ARG 16 N 0.16 0.29 -0.13 1.90 3.08 0.46 0.27 114.38 120.41 1v5r h ARG 16 Ca 0.07 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 1v5r h ARG 16 Cb 0.24 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 1v5r h ARG 16 CO -0.00 0.20 -0.15 0.82 -1.07 0.00 0.00 179.97 179.76 1v5r h ILE 17 N 0.30 1.36 0.00 2.04 2.04 -0.50 0.84 117.51 123.60 1v5r h ILE 17 Ca 0.27 -1.34 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 1v5r h ILE 17 Cb 0.35 1.94 -0.00 0.00 -0.74 0.00 0.00 36.82 38.37 1v5r h ILE 17 CO -0.31 0.39 -0.02 0.77 0.00 0.00 0.00 178.15 178.98 1v5r h SER 18 N -0.07 0.00 0.00 1.72 4.64 -0.31 -1.84 113.55 117.70 1v5r h SER 18 Ca 0.02 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 1v5r h SER 18 Cb 0.69 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.77 1v5r h SER 18 CO 0.04 0.02 -2.03 -0.62 -0.87 0.00 0.00 176.83 173.37 1v5r n GLU 19 N -3.87 0.66 -3.76 4.77 -0.58 0.90 -4.48 120.64 114.28 1v5r n GLU 19 Ca -0.03 -0.17 -0.26 0.00 -0.42 0.00 0.00 57.16 56.28 1v5r n GLU 19 Cb 0.10 -1.51 -0.17 0.00 -0.57 0.00 0.00 31.44 29.30 1v5r n GLU 19 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1v5r s ASP 20 N -4.59 2.36 0.32 1.62 2.15 0.29 0.74 116.67 119.57 1v5r s ASP 20 Ca -0.08 -0.51 -0.29 0.00 0.43 0.00 0.00 52.55 52.10 1v5r s ASP 20 Cb 0.13 -0.56 -0.10 0.00 -0.30 0.00 0.00 42.92 42.09 1v5r s ASP 20 CO 0.88 -0.25 1.22 -2.16 -0.17 0.00 0.00 175.17 174.69 1v5r s PRO 21 N 1.89 4.41 0.12 4.34 0.04 -1.24 -4.05 135.00 140.52 1v5r s PRO 21 Ca 0.02 2.04 -0.31 0.00 0.04 0.00 0.00 61.00 62.79 1v5r s PRO 21 Cb -0.15 -3.07 -0.08 0.00 0.04 0.00 0.00 34.50 31.25 1v5r s PRO 21 CO -0.07 -0.07 1.35 -1.25 0.04 0.00 0.00 177.00 177.00 1v5r s PRO 22 N -1.74 4.35 -0.10 0.56 0.04 0.23 -4.85 135.00 133.49 1v5r s PRO 22 Ca 0.48 2.03 -0.35 0.00 0.04 0.00 0.00 61.00 63.21 1v5r s PRO 22 Cb -0.36 -3.25 -0.12 0.00 0.04 0.00 0.00 34.50 30.81 1v5r s PRO 22 CO 0.47 -0.38 1.86 0.00 0.04 0.00 0.00 177.00 178.99 1v5r h LYS 24 N 8.94 0.16 -4.48 0.00 1.79 -1.93 -3.46 116.57 117.58 1v5r h LYS 24 Ca -0.48 -0.06 -0.44 0.00 -2.18 0.00 0.00 60.65 57.49 1v5r h LYS 24 Cb 1.28 -0.01 0.14 0.00 -1.58 0.00 0.00 32.23 32.06 1v5r h LYS 24 CO 0.95 0.48 -0.98 0.00 -1.08 0.00 0.00 179.45 178.82 1v5r n PRO 26 N 1.29 0.49 -3.66 0.00 -0.04 -1.26 -4.40 135.00 127.41 1v5r n PRO 26 Ca 0.04 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.23 1v5r n PRO 26 Cb 0.37 -1.36 -0.17 0.00 -0.04 0.00 0.00 33.50 32.30 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 0.21 0.35 0.52 2.01 -1.26 -5.13 115.64 110.33 1v5r s THR 27 Ca 0.17 -0.41 -0.28 0.00 0.31 0.00 0.00 61.69 61.47 1v5r s THR 27 Cb 0.08 -0.83 -0.11 0.00 0.01 0.00 0.00 72.50 71.65 1v5r s THR 27 CO 0.13 -0.30 1.38 -0.75 -0.69 0.00 0.00 174.62 174.39 1v5r s LYS 28 N 2.00 4.26 1.06 4.92 2.47 -1.26 -4.97 119.74 128.21 1v5r s LYS 28 Ca 0.01 2.35 -0.18 0.00 -1.56 0.00 0.00 55.97 56.60 1v5r s LYS 28 Cb -0.17 -3.03 0.10 0.00 -1.46 0.00 0.00 37.83 33.27 1v5r s LYS 28 CO -0.11 -0.32 -0.06 0.34 0.16 0.00 0.00 175.35 175.36 1v5r n PHE 29 N 0.69 -1.78 -3.36 4.03 7.35 -1.26 -4.91 117.46 118.22 1v5r n PHE 29 Ca 0.00 0.14 -0.43 0.00 -0.76 0.00 0.00 57.45 56.41 1v5r n PHE 29 Cb 0.41 -1.46 -0.09 0.00 0.35 0.00 0.00 39.48 38.69 1v5r n PHE 29 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1v5r s VAL 31 N 2.00 0.04 -0.06 0.00 1.01 -1.14 -2.90 120.40 119.34 1v5r s VAL 31 Ca 0.10 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1v5r s VAL 31 Cb -0.18 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.44 1v5r s VAL 31 CO 0.12 -0.40 -0.08 -0.70 0.00 0.00 0.00 175.10 174.04 1v5r s GLU 32 N 2.07 1.28 0.02 2.72 2.56 -1.12 -4.92 118.70 121.31 1v5r s GLU 32 Ca 0.04 -0.25 -0.30 0.00 0.00 0.00 0.00 54.97 54.45 1v5r s GLU 32 Cb -0.16 -1.16 -0.05 0.00 2.00 0.00 0.00 34.13 34.76 1v5r s GLU 32 CO -0.16 -0.05 1.20 0.50 -0.56 0.00 0.00 175.26 176.18 1v5r s ARG 33 N 0.88 4.41 -0.07 4.30 3.00 -1.26 -0.59 118.95 129.63 1v5r s ARG 33 Ca -0.11 1.74 -0.02 0.00 -1.00 0.00 0.00 55.73 56.34 1v5r s ARG 33 Cb -0.15 -3.42 -0.03 0.00 0.00 0.00 0.00 34.95 31.35 1v5r s ARG 33 CO 0.01 -0.31 -0.07 1.28 0.00 0.00 0.00 175.30 176.21 1v5r n LEU 34 N 4.34 1.62 -3.96 -0.88 4.77 -1.12 -4.96 117.00 116.82 1v5r n LEU 34 Ca 0.10 0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1v5r n LEU 34 Cb 0.46 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1v5r n LEU 34 CO 0.55 0.35 0.27 -0.55 -1.33 0.00 0.00 177.39 176.69 1v5r s SER 35 N -5.15 -0.09 -0.69 -1.43 0.15 -1.16 -5.01 113.70 100.33 1v5r s SER 35 Ca -0.09 -0.87 -0.25 0.00 0.70 0.00 0.00 55.95 55.43 1v5r s SER 35 Cb 0.03 0.64 -0.12 0.00 -1.71 0.00 0.00 66.02 64.86 1v5r s SER 35 CO 0.13 -1.23 2.42 1.67 1.20 0.00 0.00 173.24 177.43 1v5r n GLN 36 N -0.42 0.71 0.00 5.44 -0.06 -1.26 -0.85 117.38 120.93 1v5r n GLN 36 Ca -0.02 -0.46 0.00 0.00 -2.00 0.00 0.00 57.00 54.52 1v5r n GLN 36 Cb 0.61 -3.42 0.00 0.00 -4.06 0.00 0.00 30.24 23.37 1v5r n GLN 36 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1v5r n GLY 37 N 6.43 1.81 3.79 1.69 0.00 -1.26 -5.03 105.19 112.63 1v5r n GLY 37 Ca 0.45 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.09 4.20 -0.12 1.61 3.52 -0.03 0.18 118.95 128.21 1v5r s ARG 38 Ca 0.00 0.65 -0.16 0.00 -0.13 0.00 0.00 55.73 56.09 1v5r s ARG 38 Cb 0.00 -3.29 0.04 0.00 -1.56 0.00 0.00 34.95 30.14 1v5r s ARG 38 CO 0.00 0.52 0.41 0.71 -0.81 0.00 0.00 175.30 176.13 1v5r s TYR 39 N -0.66 -0.41 -0.75 5.12 1.51 -0.98 -2.77 117.35 118.41 1v5r s TYR 39 Ca 0.28 0.95 -0.26 0.00 -1.01 0.00 0.00 57.07 57.03 1v5r s TYR 39 Cb -0.18 0.16 0.04 0.00 -0.11 0.00 0.00 41.96 41.86 1v5r s TYR 39 CO 0.17 -0.28 1.25 0.50 -1.11 0.00 0.00 175.55 176.08 1v5r s ARG 40 N -0.18 3.21 -0.11 -0.62 3.52 0.24 -2.95 118.95 122.06 1v5r s ARG 40 Ca -0.03 -0.39 -0.01 0.00 -0.13 0.00 0.00 55.73 55.16 1v5r s ARG 40 Cb -0.03 -4.28 -0.03 0.00 -1.56 0.00 0.00 34.95 29.05 1v5r s ARG 40 CO 0.02 -2.11 -0.08 0.08 -0.81 0.00 0.00 175.30 172.40 1v5r s VAL 41 N 5.44 3.59 -0.81 7.11 1.01 0.10 -2.81 120.40 134.03 1v5r s VAL 41 Ca 0.34 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 1v5r s VAL 41 Cb -0.09 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1v5r s VAL 41 CO 0.12 0.54 0.60 0.61 0.00 0.00 0.00 175.10 176.98 1v5r n GLY 42 N 3.03 -1.24 2.02 4.51 0.00 -1.14 0.10 105.19 112.47 1v5r n GLY 42 Ca -0.18 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1v5r n GLY 42 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1v5r n GLU 43 N -2.52 -2.44 -4.15 1.61 0.28 -1.26 -4.83 120.64 107.33 1v5r n GLU 43 Ca -0.32 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.55 1v5r n GLU 43 Cb 0.70 -3.88 -0.11 0.00 1.43 0.00 0.00 31.44 29.58 1v5r n GLU 43 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1v5r s LYS 44 N -3.95 0.77 -0.42 3.44 1.02 0.29 -5.12 119.74 115.77 1v5r s LYS 44 Ca 0.00 -1.09 -0.10 0.00 0.02 0.00 0.00 55.97 54.80 1v5r s LYS 44 Cb 0.00 -0.45 0.07 0.00 -0.52 0.00 0.00 37.83 36.94 1v5r s LYS 44 CO 0.00 0.07 0.27 0.42 -0.92 0.00 0.00 175.35 175.19 1v5r s ILE 45 N -2.33 4.37 0.14 2.17 -1.09 -1.26 0.01 121.20 123.21 1v5r s ILE 45 Ca 0.03 -1.32 0.10 0.00 -2.23 0.00 0.00 60.65 57.22 1v5r s ILE 45 Cb -0.04 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.16 1v5r s ILE 45 CO -0.01 -0.50 -0.21 -0.76 -1.23 0.00 0.00 174.94 172.24 1v5r s LEU 46 N 1.46 2.55 -0.55 2.97 1.43 -1.15 -5.00 118.68 120.38 1v5r s LEU 46 Ca 0.03 -0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 52.29 1v5r s LEU 46 Cb -0.23 -1.38 0.13 0.00 0.03 0.00 0.00 46.19 44.74 1v5r s LEU 46 CO 0.03 0.16 0.52 -0.36 0.23 0.00 0.00 176.35 176.93 1v5r s PHE 47 N -1.25 3.24 0.04 0.29 0.40 -1.26 -2.31 117.98 117.12 1v5r s PHE 47 Ca 0.18 -1.28 -0.27 0.00 -0.60 0.00 0.00 56.93 54.96 1v5r s PHE 47 Cb -0.10 -3.82 -0.05 0.00 0.51 0.00 0.00 43.02 39.57 1v5r s PHE 47 CO 0.09 -1.04 0.84 0.42 0.70 0.00 0.00 175.22 176.23 1v5r s ILE 48 N 1.66 4.74 0.33 0.64 1.01 0.47 -0.86 121.20 129.20 1v5r s ILE 48 Ca 0.04 1.77 0.05 0.00 0.00 0.00 0.00 60.65 62.51 1v5r s ILE 48 Cb -0.29 -4.19 -0.07 0.00 0.01 0.00 0.00 42.46 37.92 1v5r s ILE 48 CO 0.03 0.31 0.03 -0.13 0.00 0.00 0.00 174.94 175.17 1v5r s ARG 49 N 0.24 1.70 -0.12 2.79 0.52 0.71 -4.34 118.95 120.45 1v5r s ARG 49 Ca 0.42 -1.93 -0.00 0.00 -0.52 0.00 0.00 55.73 53.70 1v5r s ARG 49 Cb -0.21 -1.08 0.02 0.00 0.52 0.00 0.00 34.95 34.21 1v5r s ARG 49 CO 0.25 -0.12 -0.10 1.41 0.02 0.00 0.00 175.30 176.76 1v5r s MET 50 N -3.83 1.81 -0.44 3.54 1.75 -1.26 -1.74 119.30 119.13 1v5r s MET 50 Ca 0.35 -0.37 -0.24 0.00 -1.25 0.00 0.00 55.69 54.18 1v5r s MET 50 Cb 0.08 -1.77 0.02 0.00 2.84 0.00 0.00 34.83 36.01 1v5r s MET 50 CO 0.15 -0.25 0.85 -0.51 -0.65 0.00 0.00 175.02 174.62 1v5r s LEU 51 N 1.61 4.11 -1.31 4.11 1.43 0.12 -4.08 118.68 124.67 1v5r s LEU 51 Ca 0.05 0.11 -0.10 0.00 -1.03 0.00 0.00 54.13 53.16 1v5r s LEU 51 Cb -0.13 -3.09 0.07 0.00 0.03 0.00 0.00 46.19 43.07 1v5r s LEU 51 CO -0.09 -0.94 0.51 1.41 0.23 0.00 0.00 176.35 177.47 1v5r n HIS 52 N 6.87 -1.79 -3.32 0.29 8.25 -1.26 -0.34 115.22 123.91 1v5r n HIS 52 Ca 0.04 0.49 -0.22 0.00 -0.26 0.00 0.00 57.72 57.77 1v5r n HIS 52 Cb 0.48 -3.00 -0.01 0.00 1.12 0.00 0.00 29.99 28.58 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 -2.31 -3.13 0.00 0.41 6.94 -1.26 -4.72 115.26 111.19 1v5r n ASN 53 Ca -0.01 -0.33 0.00 0.00 -0.02 0.00 0.00 54.58 54.22 1v5r n ASN 53 Cb 0.54 -2.63 0.00 0.00 -2.36 0.00 0.00 39.78 35.33 1v5r n ASN 53 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1v5r n LYS 54 N -3.53 1.34 -4.58 -3.83 5.02 0.54 -5.08 118.16 108.04 1v5r n LYS 54 Ca -0.01 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.01 1v5r n LYS 54 Cb 0.53 -0.80 -0.14 0.00 -0.02 0.00 0.00 35.03 34.60 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 -1.60 2.07 -0.31 2.13 3.76 -0.82 -4.96 115.29 115.56 1v5r s HIS 55 Ca 0.00 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 54.55 1v5r s HIS 55 Cb 0.00 -1.19 0.09 0.00 1.11 0.00 0.00 32.58 32.59 1v5r s HIS 55 CO 0.00 0.19 0.01 0.08 -0.85 0.00 0.00 174.74 174.17 1v5r s VAL 56 N -0.94 2.14 0.35 -0.90 1.01 -1.26 0.16 120.40 120.95 1v5r s VAL 56 Ca 0.10 -2.08 0.08 0.00 0.00 0.00 0.00 61.98 60.08 1v5r s VAL 56 Cb -0.10 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 1v5r s VAL 56 CO 0.03 -0.45 0.25 -0.04 0.00 0.00 0.00 175.10 174.90 1v5r s MET 57 N 1.01 2.59 0.12 2.72 -1.94 -0.71 -1.11 119.30 121.97 1v5r s MET 57 Ca 0.05 -1.41 0.07 0.00 -1.71 0.00 0.00 55.69 52.70 1v5r s MET 57 Cb -0.19 -2.37 -0.04 0.00 2.01 0.00 0.00 34.83 34.25 1v5r s MET 57 CO -0.08 0.06 -0.17 0.14 -0.01 0.00 0.00 175.02 174.96 1v5r s VAL 58 N -2.36 1.52 -0.33 -6.03 -7.23 0.63 -0.21 120.40 106.40 1v5r s VAL 58 Ca 0.41 -1.66 -0.27 0.00 -1.81 0.00 0.00 61.98 58.65 1v5r s VAL 58 Cb -0.04 -1.55 0.01 0.00 0.56 0.00 0.00 36.38 35.37 1v5r s VAL 58 CO 0.25 -0.26 0.99 -0.60 -0.31 0.00 0.00 175.10 175.17 1v5r s ARG 59 N -2.35 4.00 -0.12 4.82 6.06 -0.04 -2.74 118.95 128.58 1v5r s ARG 59 Ca 0.08 0.87 -0.03 0.00 -2.50 0.00 0.00 55.73 54.15 1v5r s ARG 59 Cb -0.07 -3.75 0.05 0.00 0.06 0.00 0.00 34.95 31.23 1v5r s ARG 59 CO 0.04 -0.87 0.06 0.08 -2.50 0.00 0.00 175.30 172.11 1v5r s VAL 60 N 3.49 0.02 0.00 7.11 1.01 -1.16 -4.22 120.40 126.65 1v5r s VAL 60 Ca 0.41 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1v5r s VAL 60 Cb -0.12 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.78 1v5r s VAL 60 CO 0.16 -0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1v5r n GLY 61 N 5.25 2.24 2.34 4.51 0.00 -1.26 -0.30 105.19 117.97 1v5r n GLY 61 Ca -0.06 0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 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 5.98 3.65 -0.02 0.00 -1.26 -4.94 105.19 108.60 1v5r n GLY 62 Ca 0.00 -2.46 -0.01 0.00 0.00 0.00 0.00 46.02 43.54 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 -2.32 0.34 -0.09 -0.02 0.00 0.59 -5.15 107.32 100.66 1v5r s GLY 63 Ca 0.58 3.48 -0.15 0.00 0.00 0.00 0.00 44.72 48.63 1v5r s GLY 63 CO -0.07 2.39 0.38 -0.98 0.00 0.00 0.00 173.10 174.82 1v5r s TRP 64 N 0.72 3.57 0.38 1.90 0.52 -1.26 -3.00 118.94 121.77 1v5r s TRP 64 Ca -0.03 0.81 0.08 0.00 0.02 0.00 0.00 56.10 56.99 1v5r s TRP 64 Cb -0.04 -2.36 -0.07 0.00 -1.15 0.00 0.00 33.47 29.85 1v5r s TRP 64 CO -0.12 0.38 0.00 -1.83 0.02 0.00 0.00 176.95 175.40 1v5r s GLU 65 N -0.08 1.98 -0.14 4.98 -1.05 -1.11 -4.86 118.70 118.41 1v5r s GLU 65 Ca 0.22 -1.96 -0.29 0.00 -0.15 0.00 0.00 54.97 52.78 1v5r s GLU 65 Cb -0.15 -1.76 -0.02 0.00 -0.44 0.00 0.00 34.13 31.77 1v5r s GLU 65 CO 0.09 0.03 1.25 0.95 0.95 0.00 0.00 175.26 178.53 1v5r s THR 66 N -2.63 4.28 0.03 1.83 -4.23 -1.26 -0.26 115.64 113.39 1v5r s THR 66 Ca 0.35 1.56 -0.07 0.00 -1.18 0.00 0.00 61.69 62.35 1v5r s THR 66 Cb 0.05 -4.00 -0.02 0.00 1.34 0.00 0.00 72.50 69.87 1v5r s THR 66 CO 0.18 -0.11 0.88 0.33 -0.54 0.00 0.00 174.62 175.36 1v5r n PHE 67 N 6.33 -0.10 -0.32 3.99 7.35 -0.27 0.23 117.46 134.68 1v5r n PHE 67 Ca 0.13 0.27 0.30 0.00 -0.76 0.00 0.00 57.45 57.39 1v5r n PHE 67 Cb 0.45 -0.43 0.65 0.00 0.35 0.00 0.00 39.48 40.50 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 -0.43 2.74 -0.17 3.13 0.00 -1.92 0.37 119.26 122.99 1v5r h ALA 68 Ca 0.03 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1v5r h ALA 68 Cb 0.09 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1v5r h ALA 68 CO -0.20 -1.11 -0.60 0.78 0.00 0.00 0.00 179.25 178.11 1v5r h GLY 69 N 0.16 0.61 1.59 0.00 0.00 0.25 -1.93 103.07 103.75 1v5r h GLY 69 Ca 0.58 -0.75 -0.22 0.00 0.00 0.00 0.00 47.33 46.93 1v5r h GLY 69 CO -0.13 0.67 -0.92 -1.82 0.00 0.00 0.00 176.54 174.34 1v5r h TYR 70 N 0.42 0.55 -0.31 5.60 5.03 0.20 -2.89 116.97 125.58 1v5r h TYR 70 Ca -0.00 -0.30 -0.13 0.00 2.58 0.00 0.00 58.73 60.88 1v5r h TYR 70 Cb 1.16 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 39.37 1v5r h TYR 70 CO 0.05 1.11 -0.32 1.25 -1.32 0.00 0.00 178.16 178.94 1v5r h LEU 71 N 0.21 0.82 -1.13 2.82 5.85 -1.03 -3.09 115.31 119.76 1v5r h LEU 71 Ca -0.07 -0.47 -0.05 0.00 0.84 0.00 0.00 57.88 58.13 1v5r h LEU 71 Cb 1.55 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1v5r h LEU 71 CO 0.16 1.12 0.05 0.17 -0.34 0.00 0.00 178.44 179.60 1v5r h LEU 72 N 0.53 0.62 -0.02 2.25 8.10 -1.40 0.20 115.31 125.59 1v5r h LEU 72 Ca 0.05 -0.11 0.03 0.00 0.11 0.00 0.00 57.88 57.96 1v5r h LEU 72 Cb 0.89 -0.16 -0.04 0.00 -0.44 0.00 0.00 40.66 40.91 1v5r h LEU 72 CO 0.08 0.65 -0.24 0.11 -4.11 0.00 0.00 178.44 174.93 1v5r h LYS 73 N 0.64 -0.35 0.01 0.17 1.57 -1.42 -3.01 116.57 114.18 1v5r h LYS 73 Ca 0.14 0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.75 1v5r h LYS 73 Cb 0.32 0.08 0.02 0.00 0.08 0.00 0.00 32.23 32.72 1v5r h LYS 73 CO 0.01 -0.23 -0.75 0.45 -0.57 0.00 0.00 179.45 178.35 1v5r h HIS 74 N -0.36 0.73 -2.71 -1.35 3.86 -1.53 -3.44 115.15 110.35 1v5r h HIS 74 Ca 0.07 -0.41 -0.56 0.00 -1.16 0.00 0.00 60.37 58.31 1v5r h HIS 74 Cb 0.45 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 1v5r h HIS 74 CO -0.28 1.24 1.09 0.34 0.86 0.00 0.00 177.93 181.17 1v5r s ASP 75 N -6.93 6.56 -0.02 2.45 -1.08 0.69 -4.92 116.67 113.42 1v5r s ASP 75 Ca -0.12 1.87 -0.25 0.00 -0.52 0.00 0.00 52.55 53.53 1v5r s ASP 75 Cb 0.04 -2.53 -0.20 0.00 -1.46 0.00 0.00 42.92 38.77 1v5r s ASP 75 CO 0.85 -1.07 1.23 1.55 0.52 0.00 0.00 175.17 178.26 1v5r h PRO 76 N 9.98 -0.05 -0.52 4.34 0.13 -1.85 -2.43 132.00 141.60 1v5r h PRO 76 Ca -0.35 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.93 1v5r h PRO 76 Cb 1.16 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1v5r h PRO 76 CO 0.98 0.42 0.40 0.00 -0.23 0.00 0.00 178.00 179.56 1v5r h ARG 78 N 0.00 0.46 -0.90 0.00 3.08 -1.83 -3.25 114.38 111.94 1v5r h ARG 78 Ca 0.25 -0.62 0.22 0.00 0.07 0.00 0.00 59.98 59.90 1v5r h ARG 78 Cb 1.03 0.21 -0.17 0.00 0.08 0.00 0.00 29.97 31.13 1v5r h ARG 78 CO -0.00 1.26 -0.03 1.98 -1.07 0.00 0.00 179.97 182.10 1v5r h MET 79 N -0.05 0.04 -1.82 0.04 4.05 -0.65 0.88 114.93 117.42 1v5r h MET 79 Ca -0.14 -0.00 -0.69 0.00 -0.28 0.00 0.00 59.70 58.59 1v5r h MET 79 Cb 1.66 -0.01 -0.34 0.00 -0.80 0.00 0.00 31.60 32.11 1v5r h MET 79 CO 0.18 0.03 0.24 1.47 0.23 0.00 0.00 176.91 179.06 1v5r n LEU 80 N -5.46 6.22 0.01 3.39 -0.00 -1.19 -4.72 117.00 115.25 1v5r n LEU 80 Ca 0.18 -5.06 -0.18 0.00 -0.00 0.00 0.00 56.01 50.96 1v5r n LEU 80 Cb 0.60 -0.80 -0.11 0.00 -0.00 0.00 0.00 43.42 43.11 1v5r n LEU 80 CO -0.03 2.00 0.23 0.06 -0.00 0.00 0.00 177.39 179.65 1v5r h GLN 81 N 2.88 0.38 -3.01 1.47 3.07 -0.84 -3.40 115.11 115.66 1v5r h GLN 81 Ca 0.44 -0.43 -0.62 0.00 0.09 0.00 0.00 58.65 58.13 1v5r h GLN 81 Cb 0.43 0.13 -0.41 0.00 0.08 0.00 0.00 27.48 27.71 1v5r h GLN 81 CO 1.16 1.11 -0.65 -1.50 0.09 0.00 0.00 178.83 179.04 1v5r s ILE 82 N -3.10 2.38 -0.29 1.86 1.10 -1.26 -5.04 121.20 116.85 1v5r s ILE 82 Ca -0.13 -3.81 -0.17 0.00 -0.51 0.00 0.00 60.65 56.02 1v5r s ILE 82 Cb 0.03 -2.59 0.18 0.00 0.15 0.00 0.00 42.46 40.23 1v5r s ILE 82 CO 0.82 -1.01 1.14 -0.55 -2.11 0.00 0.00 174.94 173.23 1v5r s SER 83 N -0.98 -0.27 0.00 4.50 0.15 -1.26 -5.02 113.70 110.83 1v5r s SER 83 Ca 0.25 0.43 0.29 0.00 0.70 0.00 0.00 55.95 57.62 1v5r s SER 83 Cb -0.07 1.04 1.27 0.00 -1.71 0.00 0.00 66.02 66.54 1v5r s SER 83 CO -0.14 -0.07 1.93 -2.11 1.20 0.00 0.00 173.24 174.05 1v5r n ARG 84 N 3.21 0.13 -3.67 5.44 0.00 -1.26 -4.75 116.66 115.76 1v5r n ARG 84 Ca -0.17 -0.01 -0.08 0.00 -0.00 0.00 0.00 57.85 57.59 1v5r n ARG 84 Cb 0.57 -1.50 -0.09 0.00 -0.00 0.00 0.00 32.46 31.44 1v5r n ARG 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1v5r s VAL 85 N -2.88 -0.20 0.45 8.89 0.11 -1.26 -5.17 120.40 120.34 1v5r s VAL 85 Ca 0.18 0.06 0.05 0.00 -2.93 0.00 0.00 61.98 59.35 1v5r s VAL 85 Cb 0.19 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1v5r s VAL 85 CO 0.52 0.03 0.09 1.51 -3.33 0.00 0.00 175.10 173.92 1v5r s ASP 86 N 1.79 4.16 0.09 3.54 -4.77 -1.26 -5.08 116.67 115.15 1v5r s ASP 86 Ca -0.08 -1.35 0.00 0.00 -3.30 0.00 0.00 52.55 47.82 1v5r s ASP 86 Cb -0.08 -0.12 0.00 0.00 -1.09 0.00 0.00 42.92 41.63 1v5r s ASP 86 CO -0.16 -0.63 0.00 0.61 0.70 0.00 0.00 175.17 175.69 1v5r n GLY 87 N -1.19 -0.10 4.06 2.12 0.00 -1.26 -5.04 105.19 103.78 1v5r n GLY 87 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1v5r n GLY 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1v5r n LYS 88 N -2.86 -3.91 -3.55 1.61 4.81 -1.26 -4.92 118.16 108.09 1v5r n LYS 88 Ca 0.00 0.45 -0.41 0.00 -0.87 0.00 0.00 58.31 57.48 1v5r n LYS 88 Cb 0.03 -5.08 -0.11 0.00 0.02 0.00 0.00 35.03 29.90 1v5r n LYS 88 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1v5r s THR 89 N -3.47 5.06 -0.01 3.15 2.01 -1.26 -5.06 115.64 116.07 1v5r s THR 89 Ca 0.52 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 62.07 1v5r s THR 89 Cb -0.27 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.56 1v5r s THR 89 CO 0.89 -0.09 0.02 -0.94 -0.69 0.00 0.00 174.62 173.81 1v5r s SER 90 N 1.67 -0.02 0.12 3.53 1.04 -1.26 -5.03 113.70 113.75 1v5r s SER 90 Ca 0.05 0.04 0.18 0.00 0.48 0.00 0.00 55.95 56.70 1v5r s SER 90 Cb -0.18 0.05 0.78 0.00 0.10 0.00 0.00 66.02 66.77 1v5r s SER 90 CO 0.09 -0.01 1.57 -0.81 0.98 0.00 0.00 173.24 175.06 1v5r n PRO 91 N 3.04 0.09 -1.17 4.02 -0.04 -1.26 -4.87 135.00 134.81 1v5r n PRO 91 Ca -0.12 0.33 -0.46 0.00 -0.04 0.00 0.00 63.50 63.22 1v5r n PRO 91 Cb 0.60 -1.67 -0.07 0.00 -0.04 0.00 0.00 33.50 32.32 1v5r n PRO 91 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v5r n SER 92 N -1.84 0.50 -4.17 3.54 2.88 -1.26 -4.87 113.62 108.41 1v5r n SER 92 Ca 0.03 0.83 -0.40 0.00 -1.33 0.00 0.00 58.87 58.01 1v5r n SER 92 Cb 0.19 -0.64 -0.07 0.00 -0.75 0.00 0.00 64.21 62.94 1v5r n SER 92 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1v5r s GLY 93 N 1.26 2.51 0.50 0.46 0.00 -1.26 -5.08 107.32 105.71 1v5r s GLY 93 Ca 0.70 -3.21 -0.21 0.00 0.00 0.00 0.00 44.72 42.00 1v5r s GLY 93 CO 0.51 1.14 1.14 2.56 0.00 0.00 0.00 173.10 178.46 1v5r s PRO 94 N 0.12 3.55 0.07 2.90 0.04 -1.26 -5.05 135.00 135.37 1v5r s PRO 94 Ca 0.16 1.68 0.06 0.00 0.04 0.00 0.00 61.00 62.95 1v5r s PRO 94 Cb -0.18 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 1v5r s PRO 94 CO -0.05 -0.70 -0.11 0.45 0.04 0.00 0.00 177.00 176.63 1v5r s SER 95 N -1.58 4.33 0.42 6.66 0.15 -1.26 -5.13 113.70 117.29 1v5r s SER 95 Ca 0.68 -0.35 -0.07 0.00 0.70 0.00 0.00 55.95 56.92 1v5r s SER 95 Cb -0.26 -0.84 -0.05 0.00 -1.71 0.00 0.00 66.02 63.16 1v5r s SER 95 CO 0.30 0.21 0.74 -0.55 1.20 0.00 0.00 173.24 175.14 1v5r s SER 96 N -1.91 6.37 0.00 5.45 0.15 -1.26 -5.36 113.70 117.14 1v5r s SER 96 Ca 0.19 0.94 0.00 0.00 0.70 0.00 0.00 55.95 57.78 1v5r s SER 96 Cb -0.11 -2.25 0.00 0.00 -1.71 0.00 0.00 66.02 61.95 1v5r s SER 96 CO 0.11 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.71