#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hpo s GLN 2 N 0.00 3.48 -0.12 0.54 0.74 -1.26 -5.08 119.66 117.96 1hpo s GLN 2 Ca 0.00 -0.40 0.02 0.00 0.05 0.00 0.00 55.36 55.04 1hpo s GLN 2 Cb 0.00 -2.97 0.01 0.00 1.10 0.00 0.00 33.01 31.15 1hpo s GLN 2 CO 0.00 0.47 -0.19 0.42 -0.55 0.00 0.00 175.29 175.44 1hpo s ILE 3 N -0.22 1.82 0.49 -2.34 1.01 -1.26 -5.12 121.20 115.59 1hpo s ILE 3 Ca 0.06 -0.84 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 1hpo s ILE 3 Cb -0.12 -1.62 -0.07 0.00 0.01 0.00 0.00 42.46 40.65 1hpo s ILE 3 CO 0.02 0.50 0.92 0.42 0.00 0.00 0.00 174.94 176.80 1hpo s THR 4 N 0.82 4.64 -0.43 2.92 -4.23 -1.26 -5.00 115.64 113.10 1hpo s THR 4 Ca -0.08 0.97 0.05 0.00 -1.18 0.00 0.00 61.69 61.44 1hpo s THR 4 Cb -0.16 -3.74 0.58 0.00 1.34 0.00 0.00 72.50 70.52 1hpo s THR 4 CO -0.00 -0.69 1.77 0.18 -0.54 0.00 0.00 174.62 175.33 1hpo n LEU 5 N -1.64 6.04 0.20 4.79 4.77 -1.26 -4.34 117.00 125.56 1hpo n LEU 5 Ca 0.05 -3.83 0.08 0.00 -0.03 0.00 0.00 56.01 52.28 1hpo n LEU 5 Cb 0.54 -0.78 0.23 0.00 -2.33 0.00 0.00 43.42 41.09 1hpo n LEU 5 CO 0.48 1.24 0.70 -0.50 -1.33 0.00 0.00 177.39 177.98 1hpo h TRP 6 N 1.21 0.00 -3.09 -1.77 4.06 -2.06 -3.45 115.95 110.84 1hpo h TRP 6 Ca 0.50 0.00 -0.40 0.00 2.06 0.00 0.00 58.89 61.05 1hpo h TRP 6 Cb 2.13 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 30.15 1hpo h TRP 6 CO 1.38 0.25 -0.70 0.15 -3.56 0.00 0.00 178.44 175.95 1hpo s LYS 7 N -3.27 1.28 0.09 0.49 3.01 -1.26 -5.10 119.74 114.98 1hpo s LYS 7 Ca 0.04 -1.59 -0.31 0.00 -1.01 0.00 0.00 55.97 53.09 1hpo s LYS 7 Cb 0.08 -0.86 -0.10 0.00 -1.01 0.00 0.00 37.83 35.93 1hpo s LYS 7 CO 0.68 0.07 1.88 0.54 0.51 0.00 0.00 175.35 179.03 1hpo n ARG 8 N -0.36 2.79 -2.27 1.68 1.74 -1.26 -4.85 116.66 114.14 1hpo n ARG 8 Ca -0.08 1.02 -0.33 0.00 -0.77 0.00 0.00 57.85 57.69 1hpo n ARG 8 Cb 0.62 -2.93 -0.04 0.00 -1.02 0.00 0.00 32.46 29.08 1hpo n ARG 8 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1hpo s PRO 9 N 3.31 3.02 -0.19 5.56 0.04 -1.26 -4.94 135.00 140.54 1hpo s PRO 9 Ca 0.85 -0.81 -0.12 0.00 0.04 0.00 0.00 61.00 60.96 1hpo s PRO 9 Cb -0.48 -5.22 -0.05 0.00 0.04 0.00 0.00 34.50 28.79 1hpo s PRO 9 CO 0.39 -2.95 0.22 -0.51 0.04 0.00 0.00 177.00 174.20 1hpo s LEU 10 N 7.96 4.20 0.44 -3.56 1.43 -1.26 -1.47 118.68 126.41 1hpo s LEU 10 Ca 0.60 0.33 0.04 0.00 -1.03 0.00 0.00 54.13 54.07 1hpo s LEU 10 Cb -0.03 -2.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1hpo s LEU 10 CO -0.02 0.10 0.04 0.68 0.23 0.00 0.00 176.35 177.38 1hpo s VAL 11 N 0.65 1.29 -0.22 -1.59 -7.23 0.11 -4.90 120.40 108.51 1hpo s VAL 11 Ca 0.12 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.23 1hpo s VAL 11 Cb -0.13 -2.51 -0.02 0.00 0.56 0.00 0.00 36.38 34.28 1hpo s VAL 11 CO 0.02 0.00 0.02 -0.89 -0.31 0.00 0.00 175.10 173.95 1hpo s THR 12 N -2.95 4.05 0.11 5.32 2.01 -1.26 -0.51 115.64 122.40 1hpo s THR 12 Ca 0.21 -0.27 0.08 0.00 0.31 0.00 0.00 61.69 62.02 1hpo s THR 12 Cb 0.05 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1hpo s THR 12 CO 0.11 0.40 -0.14 0.27 -0.69 0.00 0.00 174.62 174.57 1hpo s ILE 13 N 1.22 3.14 -0.26 1.82 -4.36 0.17 -3.08 121.20 119.84 1hpo s ILE 13 Ca 0.04 -1.36 -0.04 0.00 -0.26 0.00 0.00 60.65 59.03 1hpo s ILE 13 Cb -0.15 -2.45 0.01 0.00 1.25 0.00 0.00 42.46 41.13 1hpo s ILE 13 CO 0.02 0.11 -0.01 -0.75 0.24 0.00 0.00 174.94 174.55 1hpo s LYS 14 N -2.16 3.01 -0.05 0.37 2.36 -1.06 -1.45 119.74 120.76 1hpo s LYS 14 Ca 0.20 -0.88 -0.04 0.00 -2.55 0.00 0.00 55.97 52.70 1hpo s LYS 14 Cb -0.11 -3.12 0.02 0.00 -1.05 0.00 0.00 37.83 33.57 1hpo s LYS 14 CO 0.12 -0.38 0.14 -1.50 1.55 0.00 0.00 175.35 175.28 1hpo s ILE 15 N 1.41 -0.01 -0.96 5.43 2.07 0.14 -2.17 121.20 127.11 1hpo s ILE 15 Ca 0.02 0.04 -0.01 0.00 -1.41 0.00 0.00 60.65 59.29 1hpo s ILE 15 Cb -0.16 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.23 1hpo s ILE 15 CO -0.02 0.01 0.04 0.61 -1.91 0.00 0.00 174.94 173.67 1hpo n GLY 16 N 3.25 -0.50 2.07 1.50 0.00 -1.26 -0.06 105.19 110.19 1hpo n GLY 16 Ca -0.15 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1hpo n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hpo n GLY 17 N -0.80 0.84 3.37 -0.02 0.00 -1.26 -5.04 105.19 102.27 1hpo n GLY 17 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1hpo n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hpo s GLN 18 N -0.29 1.63 -0.01 1.61 -0.21 0.92 -5.12 119.66 118.19 1hpo s GLN 18 Ca 0.00 -1.22 -0.14 0.00 0.02 0.00 0.00 55.36 54.03 1hpo s GLN 18 Cb 0.00 -1.95 -0.05 0.00 1.00 0.00 0.00 33.01 32.01 1hpo s GLN 18 CO 0.00 0.48 0.38 -0.51 -2.12 0.00 0.00 175.29 173.52 1hpo s LEU 19 N -1.61 4.46 0.01 2.90 1.43 -1.26 -0.69 118.68 123.92 1hpo s LEU 19 Ca 0.13 0.91 -0.18 0.00 -1.03 0.00 0.00 54.13 53.96 1hpo s LEU 19 Cb -0.10 -2.54 0.03 0.00 0.03 0.00 0.00 46.19 43.62 1hpo s LEU 19 CO 0.04 0.33 0.39 -0.54 0.23 0.00 0.00 176.35 176.80 1hpo s LYS 20 N -1.09 0.83 0.09 1.70 1.02 -0.53 -4.99 119.74 116.77 1hpo s LYS 20 Ca 0.23 -0.25 0.02 0.00 0.02 0.00 0.00 55.97 55.99 1hpo s LYS 20 Cb -0.16 0.37 -0.04 0.00 -0.52 0.00 0.00 37.83 37.48 1hpo s LYS 20 CO 0.12 -0.26 0.20 -1.83 -0.92 0.00 0.00 175.35 172.66 1hpo s GLU 21 N -1.92 3.29 0.17 1.68 -1.05 -1.26 0.41 118.70 120.02 1hpo s GLU 21 Ca -0.09 -0.56 -0.07 0.00 -0.15 0.00 0.00 54.97 54.10 1hpo s GLU 21 Cb -0.02 -2.93 -0.02 0.00 -0.44 0.00 0.00 34.13 30.72 1hpo s GLU 21 CO 0.01 0.57 0.25 0.00 0.95 0.00 0.00 175.26 177.04 1hpo s ALA 22 N -1.57 0.25 -0.15 -0.84 0.00 0.33 -4.59 121.76 115.19 1hpo s ALA 22 Ca 0.33 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 1hpo s ALA 22 Cb -0.12 0.95 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1hpo s ALA 22 CO 0.27 -0.64 0.04 -1.17 0.00 0.00 0.00 175.76 174.26 1hpo s LEU 23 N -3.01 3.71 -0.36 0.00 2.96 -0.57 0.08 118.68 121.49 1hpo s LEU 23 Ca 0.21 0.09 -0.26 0.00 -0.22 0.00 0.00 54.13 53.95 1hpo s LEU 23 Cb 0.04 -1.91 0.01 0.00 0.50 0.00 0.00 46.19 44.84 1hpo s LEU 23 CO 0.03 0.24 0.95 -0.76 -1.32 0.00 0.00 176.35 175.48 1hpo s LEU 24 N -0.02 3.98 -0.27 -0.68 1.43 -0.54 -1.25 118.68 121.33 1hpo s LEU 24 Ca 0.05 0.65 0.03 0.00 -1.03 0.00 0.00 54.13 53.83 1hpo s LEU 24 Cb -0.12 -3.30 0.06 0.00 0.03 0.00 0.00 46.19 42.86 1hpo s LEU 24 CO 0.01 -0.86 -0.09 -0.62 0.23 0.00 0.00 176.35 175.02 1hpo s ASP 25 N 1.85 4.50 0.19 2.29 -1.08 -0.76 -4.81 116.67 118.84 1hpo s ASP 25 Ca 0.39 -1.45 0.24 0.00 -0.52 0.00 0.00 52.55 51.22 1hpo s ASP 25 Cb -0.12 -1.57 0.91 0.00 -1.46 0.00 0.00 42.92 40.68 1hpo s ASP 25 CO 0.18 -0.21 1.74 0.35 0.52 0.00 0.00 175.17 177.75 1hpo n THR 26 N 4.43 0.66 0.13 1.71 -2.24 -1.26 -3.10 114.28 114.61 1hpo n THR 26 Ca -0.13 -0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.66 1hpo n THR 26 Cb 0.42 -0.84 0.07 0.00 -2.10 0.00 0.00 70.33 67.88 1hpo n THR 26 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1hpo h GLY 27 N 3.49 0.00 -4.66 3.38 0.00 -1.94 -3.44 103.07 99.91 1hpo h GLY 27 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.78 1hpo h GLY 27 CO 0.00 0.00 0.08 0.00 0.00 0.00 0.00 176.54 176.62 1hpo s ALA 28 N -3.09 3.44 -0.01 3.60 0.00 -1.18 -4.98 121.76 119.54 1hpo s ALA 28 Ca 0.02 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.92 1hpo s ALA 28 Cb 0.09 -2.87 -0.17 0.00 0.00 0.00 0.00 23.12 20.18 1hpo s ALA 28 CO 0.75 0.15 1.16 -0.44 0.00 0.00 0.00 175.76 177.38 1hpo h ASP 29 N 5.45 -0.28 -4.73 0.00 3.32 -1.90 0.29 116.42 118.57 1hpo h ASP 29 Ca -0.45 -0.24 -0.16 0.00 0.02 0.00 0.00 57.03 56.20 1hpo h ASP 29 Cb 1.20 0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1hpo h ASP 29 CO 0.69 0.13 -0.04 0.47 -1.72 0.00 0.00 179.24 178.78 1hpo n ASP 30 N -5.06 0.87 -4.31 6.45 8.00 -1.26 -1.76 116.55 119.49 1hpo n ASP 30 Ca -0.09 -1.53 -0.34 0.00 0.71 0.00 0.00 54.79 53.54 1hpo n ASP 30 Cb 0.26 -0.11 -0.14 0.00 -0.02 0.00 0.00 41.12 41.10 1hpo n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1hpo s THR 31 N -0.32 3.15 -0.21 -3.53 2.01 -1.26 -2.90 115.64 112.58 1hpo s THR 31 Ca 0.18 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.60 1hpo s THR 31 Cb -0.01 -2.40 0.02 0.00 0.01 0.00 0.00 72.50 70.12 1hpo s THR 31 CO 0.11 0.46 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.68 1hpo s VAL 32 N 1.16 2.41 0.17 3.82 1.01 -0.65 -0.71 120.40 127.62 1hpo s VAL 32 Ca 0.02 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.07 1hpo s VAL 32 Cb -0.14 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1hpo s VAL 32 CO -0.02 0.38 0.05 -0.63 0.00 0.00 0.00 175.10 174.88 1hpo s ILE 33 N 1.30 4.00 0.79 2.22 -1.09 -0.53 -0.62 121.20 127.25 1hpo s ILE 33 Ca 0.02 -1.31 -0.11 0.00 -2.23 0.00 0.00 60.65 57.01 1hpo s ILE 33 Cb -0.15 -3.03 0.07 0.00 -1.58 0.00 0.00 42.46 37.77 1hpo s ILE 33 CO -0.09 -0.12 1.12 -1.83 -1.23 0.00 0.00 174.94 172.79 1hpo s GLU 34 N -3.03 2.02 -0.31 2.79 -1.05 -1.26 -2.05 118.70 115.81 1hpo s GLU 34 Ca 0.29 1.35 -0.40 0.00 -0.15 0.00 0.00 54.97 56.06 1hpo s GLU 34 Cb -0.09 -1.86 -0.15 0.00 -0.44 0.00 0.00 34.13 31.59 1hpo s GLU 34 CO 0.20 -1.85 1.85 -1.91 0.95 0.00 0.00 175.26 174.51 1hpo n GLU 35 N -3.47 1.07 -3.98 -4.83 4.07 -0.38 -4.48 120.64 108.64 1hpo n GLU 35 Ca 0.10 0.37 -0.09 0.00 -0.06 0.00 0.00 57.16 57.48 1hpo n GLU 35 Cb 0.52 -2.13 -0.04 0.00 -0.06 0.00 0.00 31.44 29.73 1hpo n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1hpo s MET 36 N 4.20 1.66 -0.27 5.31 0.23 -1.26 -4.99 119.30 124.18 1hpo s MET 36 Ca 1.02 -1.28 -0.15 0.00 -1.03 0.00 0.00 55.69 54.25 1hpo s MET 36 Cb -1.06 0.50 -0.04 0.00 -1.53 0.00 0.00 34.83 32.70 1hpo s MET 36 CO 0.63 -0.71 0.39 0.45 -2.03 0.00 0.00 175.02 173.75 1hpo s SER 37 N -3.03 6.27 0.05 -1.18 0.15 -1.26 -5.02 113.70 109.67 1hpo s SER 37 Ca 0.21 0.29 0.07 0.00 0.70 0.00 0.00 55.95 57.23 1hpo s SER 37 Cb -0.02 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 62.05 1hpo s SER 37 CO 0.10 -0.20 -0.21 -0.76 1.20 0.00 0.00 173.24 173.37 1hpo s LEU 38 N 2.09 2.17 0.36 3.45 1.43 -1.26 -5.02 118.68 121.90 1hpo s LEU 38 Ca 0.15 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.55 1hpo s LEU 38 Cb -0.16 -0.98 -0.10 0.00 0.03 0.00 0.00 46.19 44.98 1hpo s LEU 38 CO 0.10 0.16 0.81 -2.16 0.23 0.00 0.00 176.35 175.49 1hpo s PRO 39 N -1.22 4.10 0.00 1.29 0.04 -1.26 -4.95 135.00 133.00 1hpo s PRO 39 Ca 0.08 0.84 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1hpo s PRO 39 Cb -0.09 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1hpo s PRO 39 CO 0.02 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.57 1hpo n GLY 40 N -0.40 0.58 3.60 0.56 0.00 -1.26 -5.04 105.19 103.23 1hpo n GLY 40 Ca 0.04 -2.22 -0.24 0.00 0.00 0.00 0.00 46.02 43.60 1hpo n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hpo s ARG 41 N -0.36 2.03 0.11 1.61 3.00 -1.26 -5.15 118.95 118.93 1hpo s ARG 41 Ca 0.00 -1.70 -0.16 0.00 0.00 0.00 0.00 55.73 53.87 1hpo s ARG 41 Cb 0.00 -1.93 0.03 0.00 0.00 0.00 0.00 34.95 33.05 1hpo s ARG 41 CO 0.00 0.22 0.39 1.67 0.00 0.00 0.00 175.30 177.58 1hpo s TRP 42 N -2.48 -0.20 -0.09 -0.53 1.48 -1.26 -4.46 118.94 111.39 1hpo s TRP 42 Ca 0.33 -0.08 0.02 0.00 -1.06 0.00 0.00 56.10 55.32 1hpo s TRP 42 Cb -0.02 0.24 -0.02 0.00 -1.16 0.00 0.00 33.47 32.51 1hpo s TRP 42 CO 0.18 -0.67 -0.15 0.15 -4.06 0.00 0.00 176.95 172.40 1hpo s LYS 43 N -3.59 2.90 0.39 3.25 -0.14 -0.86 -4.88 119.74 116.81 1hpo s LYS 43 Ca 0.02 -0.71 -0.24 0.00 -1.36 0.00 0.00 55.97 53.68 1hpo s LYS 43 Cb 0.02 -2.47 -0.10 0.00 -1.68 0.00 0.00 37.83 33.60 1hpo s LYS 43 CO -0.10 0.42 0.99 -1.25 -0.76 0.00 0.00 175.35 174.64 1hpo s PRO 44 N -0.20 4.28 0.28 -1.68 0.04 -1.26 -0.49 135.00 135.97 1hpo s PRO 44 Ca -0.00 1.34 -0.17 0.00 0.04 0.00 0.00 61.00 62.22 1hpo s PRO 44 Cb -0.13 -2.49 0.01 0.00 0.04 0.00 0.00 34.50 31.93 1hpo s PRO 44 CO 0.03 -0.01 0.62 -1.59 0.04 0.00 0.00 177.00 176.09 1hpo s LYS 45 N -2.59 1.73 -0.14 4.56 -2.85 0.37 -4.90 119.74 115.92 1hpo s LYS 45 Ca 0.57 -1.15 0.01 0.00 -1.00 0.00 0.00 55.97 54.40 1hpo s LYS 45 Cb -0.17 0.55 0.02 0.00 -2.06 0.00 0.00 37.83 36.17 1hpo s LYS 45 CO 0.22 -0.77 -0.17 -1.64 0.10 0.00 0.00 175.35 173.09 1hpo s MET 46 N -3.81 2.54 0.04 1.78 -1.94 -1.26 -0.67 119.30 115.98 1hpo s MET 46 Ca 0.16 -0.66 0.02 0.00 -1.71 0.00 0.00 55.69 53.50 1hpo s MET 46 Cb -0.04 -2.18 -0.04 0.00 2.01 0.00 0.00 34.83 34.58 1hpo s MET 46 CO 0.09 -0.13 0.08 0.96 -0.01 0.00 0.00 175.02 176.00 1hpo s ILE 47 N 1.15 4.59 0.28 2.53 -4.36 -0.92 -4.92 121.20 119.56 1hpo s ILE 47 Ca -0.01 -0.62 0.10 0.00 -0.26 0.00 0.00 60.65 59.86 1hpo s ILE 47 Cb -0.14 -3.16 -0.05 0.00 1.25 0.00 0.00 42.46 40.36 1hpo s ILE 47 CO -0.06 0.23 -0.06 -0.83 0.24 0.00 0.00 174.94 174.45 1hpo s GLY 48 N -2.09 1.77 0.00 6.27 0.00 -1.26 -0.96 107.32 111.04 1hpo s GLY 48 Ca 0.26 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.23 1hpo s GLY 48 CO 0.18 -1.81 0.00 0.61 0.00 0.00 0.00 173.10 172.08 1hpo n GLY 49 N -0.82 4.13 3.61 0.20 0.00 0.19 -4.93 105.19 107.57 1hpo n GLY 49 Ca -0.06 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1hpo n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hpo s ILE 50 N -0.14 4.55 0.00 -0.61 -1.09 -1.26 -3.53 121.20 119.11 1hpo s ILE 50 Ca 0.00 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 59.77 1hpo s ILE 50 Cb 0.00 -4.37 0.00 0.00 -1.58 0.00 0.00 42.46 36.51 1hpo s ILE 50 CO 0.00 -0.54 0.00 0.61 -1.23 0.00 0.00 174.94 173.78 1hpo n GLY 51 N 4.26 1.41 0.00 6.18 0.00 -1.26 -5.00 105.19 110.78 1hpo n GLY 51 Ca 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1hpo n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hpo n GLY 52 N 0.00 0.56 3.75 -0.02 0.00 -1.23 -5.12 105.19 103.13 1hpo n GLY 52 Ca 0.00 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 1hpo n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hpo s PHE 53 N -3.13 3.11 0.08 1.61 0.40 -1.26 0.52 117.98 119.31 1hpo s PHE 53 Ca 0.00 0.02 0.07 0.00 -0.60 0.00 0.00 56.93 56.42 1hpo s PHE 53 Cb 0.00 -1.56 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 1hpo s PHE 53 CO 0.00 0.51 -0.18 0.96 0.70 0.00 0.00 175.22 177.21 1hpo s ILE 54 N -1.46 1.45 0.17 0.64 -4.36 -0.14 -4.97 121.20 112.53 1hpo s ILE 54 Ca 0.29 -1.35 -0.22 0.00 -0.26 0.00 0.00 60.65 59.11 1hpo s ILE 54 Cb -0.11 -1.33 -0.08 0.00 1.25 0.00 0.00 42.46 42.19 1hpo s ILE 54 CO 0.21 -0.06 0.71 -0.75 0.24 0.00 0.00 174.94 175.30 1hpo s LYS 55 N -1.64 4.37 0.20 0.37 2.20 -1.26 -2.16 119.74 121.83 1hpo s LYS 55 Ca 0.04 0.96 -0.08 0.00 -0.36 0.00 0.00 55.97 56.53 1hpo s LYS 55 Cb -0.09 -3.12 -0.02 0.00 -1.51 0.00 0.00 37.83 33.09 1hpo s LYS 55 CO 0.03 0.52 0.31 0.14 -0.36 0.00 0.00 175.35 175.99 1hpo s VAL 56 N -1.27 0.02 -0.22 4.02 -7.23 0.16 -4.30 120.40 111.58 1hpo s VAL 56 Ca 0.37 -1.57 -0.02 0.00 -1.81 0.00 0.00 61.98 58.94 1hpo s VAL 56 Cb -0.20 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.59 1hpo s VAL 56 CO 0.23 -0.11 -0.08 -0.13 -0.31 0.00 0.00 175.10 174.70 1hpo s ARG 57 N -4.04 3.07 -0.42 4.82 0.52 -0.47 -0.48 118.95 121.96 1hpo s ARG 57 Ca 0.25 -0.81 -0.23 0.00 -0.52 0.00 0.00 55.73 54.42 1hpo s ARG 57 Cb 0.03 -2.91 0.02 0.00 0.52 0.00 0.00 34.95 32.60 1hpo s ARG 57 CO 0.07 -0.29 0.78 -1.14 0.02 0.00 0.00 175.30 174.74 1hpo s GLN 58 N 1.38 3.54 -0.11 3.54 0.74 0.36 -1.20 119.66 127.90 1hpo s GLN 58 Ca 0.03 0.05 -0.04 0.00 0.05 0.00 0.00 55.36 55.45 1hpo s GLN 58 Cb -0.15 -3.89 -0.03 0.00 1.10 0.00 0.00 33.01 30.04 1hpo s GLN 58 CO -0.06 -1.01 0.02 0.71 -0.55 0.00 0.00 175.29 174.40 1hpo s TYR 59 N 3.21 3.21 0.21 1.67 1.51 -0.81 -2.04 117.35 124.31 1hpo s TYR 59 Ca 0.30 0.16 0.01 0.00 -1.01 0.00 0.00 57.07 56.53 1hpo s TYR 59 Cb -0.12 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1hpo s TYR 59 CO 0.20 0.40 0.37 -0.51 -1.11 0.00 0.00 175.55 174.91 1hpo s ASP 60 N -0.56 6.36 -0.27 2.29 1.11 -1.26 -2.04 116.67 122.29 1hpo s ASP 60 Ca 0.10 0.31 -0.24 0.00 0.18 0.00 0.00 52.55 52.89 1hpo s ASP 60 Cb -0.12 -1.97 0.04 0.00 1.07 0.00 0.00 42.92 41.94 1hpo s ASP 60 CO 0.02 -0.04 0.41 0.00 1.18 0.00 0.00 175.17 176.73 1hpo n GLN 61 N -0.82 -1.17 -4.27 8.23 10.64 -1.23 -4.90 117.38 123.87 1hpo n GLN 61 Ca -0.06 0.87 -0.29 0.00 -1.83 0.00 0.00 57.00 55.69 1hpo n GLN 61 Cb 0.54 -1.22 -0.11 0.00 -0.86 0.00 0.00 30.24 28.60 1hpo n GLN 61 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1hpo s ILE 62 N -0.89 3.10 -0.13 -0.39 -1.09 -0.59 -4.81 121.20 116.40 1hpo s ILE 62 Ca 0.24 -1.41 -0.06 0.00 -2.23 0.00 0.00 60.65 57.19 1hpo s ILE 62 Cb -0.02 -2.44 -0.04 0.00 -1.58 0.00 0.00 42.46 38.38 1hpo s ILE 62 CO 0.53 0.09 0.08 -0.63 -1.23 0.00 0.00 174.94 173.79 1hpo s ILE 63 N -1.20 4.97 0.00 2.92 1.01 -1.26 -1.67 121.20 125.97 1hpo s ILE 63 Ca 0.20 0.01 0.02 0.00 0.00 0.00 0.00 60.65 60.88 1hpo s ILE 63 Cb -0.11 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 1hpo s ILE 63 CO 0.12 0.57 -0.06 -0.63 0.00 0.00 0.00 174.94 174.94 1hpo s ILE 64 N -0.58 0.44 -0.91 2.92 1.01 -0.27 -4.58 121.20 119.24 1hpo s ILE 64 Ca 0.11 -0.35 -0.05 0.00 0.00 0.00 0.00 60.65 60.35 1hpo s ILE 64 Cb -0.12 -0.40 0.23 0.00 0.01 0.00 0.00 42.46 42.18 1hpo s ILE 64 CO 0.02 0.05 0.82 -0.70 0.00 0.00 0.00 174.94 175.13 1hpo s GLU 65 N -0.34 3.47 -0.18 2.79 2.12 -0.92 -0.90 118.70 124.74 1hpo s GLU 65 Ca 0.00 -3.06 -0.24 0.00 0.36 0.00 0.00 54.97 52.03 1hpo s GLU 65 Cb -0.03 -4.15 -0.02 0.00 0.26 0.00 0.00 34.13 30.19 1hpo s GLU 65 CO -0.00 -1.25 0.80 -1.50 -0.54 0.00 0.00 175.26 172.77 1hpo s ILE 66 N -0.95 4.90 -0.26 -3.70 2.07 0.55 -2.58 121.20 121.22 1hpo s ILE 66 Ca 0.26 1.56 -0.23 0.00 -1.41 0.00 0.00 60.65 60.82 1hpo s ILE 66 Cb -0.10 -4.10 0.04 0.00 0.13 0.00 0.00 42.46 38.42 1hpo s ILE 66 CO -0.09 0.03 0.39 0.00 -1.91 0.00 0.00 174.94 173.36 1hpo n GLY 68 N -0.08 1.34 3.52 0.00 0.00 -1.26 -4.94 105.19 103.77 1hpo n GLY 68 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1hpo n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hpo s HIS 69 N -0.93 2.64 0.35 1.61 3.76 0.08 -5.10 115.29 117.70 1hpo s HIS 69 Ca 0.00 -0.21 -0.07 0.00 -0.15 0.00 0.00 55.06 54.63 1hpo s HIS 69 Cb 0.00 -1.43 -0.06 0.00 1.11 0.00 0.00 32.58 32.21 1hpo s HIS 69 CO 0.00 0.36 0.65 0.15 -0.85 0.00 0.00 174.74 175.05 1hpo s LYS 70 N -1.91 3.68 -0.07 1.40 1.02 -1.26 -0.33 119.74 122.27 1hpo s LYS 70 Ca 0.18 0.19 -0.28 0.00 0.02 0.00 0.00 55.97 56.07 1hpo s LYS 70 Cb -0.11 -2.53 0.06 0.00 -0.52 0.00 0.00 37.83 34.73 1hpo s LYS 70 CO 0.10 0.09 0.64 0.00 -0.92 0.00 0.00 175.35 175.26 1hpo s ALA 71 N -2.23 -1.66 0.07 5.17 0.00 -0.08 -4.83 121.76 118.19 1hpo s ALA 71 Ca 0.47 1.30 0.04 0.00 0.00 0.00 0.00 51.96 53.77 1hpo s ALA 71 Cb -0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1hpo s ALA 71 CO 0.31 -0.35 -0.12 -1.50 0.00 0.00 0.00 175.76 174.10 1hpo s ILE 72 N -1.00 0.95 -5.00 0.00 2.07 -1.26 -1.12 121.20 115.84 1hpo s ILE 72 Ca -0.10 -1.27 0.00 0.00 -1.41 0.00 0.00 60.65 57.87 1hpo s ILE 72 Cb -0.01 -0.97 0.00 0.00 0.13 0.00 0.00 42.46 41.61 1hpo s ILE 72 CO 0.08 -0.29 0.00 0.61 -1.91 0.00 0.00 174.94 173.43 1hpo n GLY 73 N 1.28 -1.63 3.77 1.50 0.00 -0.67 -4.91 105.19 104.53 1hpo n GLY 73 Ca -0.21 -1.34 -0.35 0.00 0.00 0.00 0.00 46.02 44.12 1hpo n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hpo s THR 74 N -2.52 3.19 -0.07 2.61 2.01 -1.26 -1.54 115.64 118.06 1hpo s THR 74 Ca 0.00 0.73 -0.03 0.00 0.31 0.00 0.00 61.69 62.70 1hpo s THR 74 Cb 0.00 -3.28 0.04 0.00 0.01 0.00 0.00 72.50 69.27 1hpo s THR 74 CO 0.00 -0.17 0.14 -0.69 -0.69 0.00 0.00 174.62 173.21 1hpo s VAL 75 N -1.82 -0.15 -0.20 3.82 1.01 -0.87 -4.43 120.40 117.76 1hpo s VAL 75 Ca 0.72 0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.88 1hpo s VAL 75 Cb -0.23 -0.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 1hpo s VAL 75 CO 0.28 0.11 0.11 -0.76 0.00 0.00 0.00 175.10 174.84 1hpo s LEU 76 N 1.72 4.02 -0.14 3.92 1.43 0.12 -1.92 118.68 127.82 1hpo s LEU 76 Ca -0.03 0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1hpo s LEU 76 Cb -0.12 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 1hpo s LEU 76 CO -0.06 0.14 -0.01 -0.69 0.23 0.00 0.00 176.35 175.96 1hpo s VAL 77 N 0.57 4.13 -0.07 -1.59 1.01 -0.34 -1.46 120.40 122.65 1hpo s VAL 77 Ca 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1hpo s VAL 77 Cb -0.12 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.46 1hpo s VAL 77 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1hpo n GLY 78 N 3.17 -0.91 2.14 4.51 0.00 -0.87 -1.37 105.19 111.86 1hpo n GLY 78 Ca -0.17 -0.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.94 1hpo n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hpo n PRO 79 N 0.00 2.44 -3.13 1.61 -0.04 -1.26 -1.25 135.00 133.37 1hpo n PRO 79 Ca 0.00 -1.34 -0.32 0.00 -0.04 0.00 0.00 63.50 61.80 1hpo n PRO 79 Cb 0.00 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.16 1hpo n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1hpo s THR 80 N 1.53 4.67 -0.33 0.52 -1.32 -1.26 -4.98 115.64 114.46 1hpo s THR 80 Ca 0.64 0.96 0.21 0.00 -1.21 0.00 0.00 61.69 62.29 1hpo s THR 80 Cb 0.26 -3.61 0.20 0.00 -1.51 0.00 0.00 72.50 67.84 1hpo s THR 80 CO -0.02 -0.19 1.44 1.55 -2.21 0.00 0.00 174.62 175.19 1hpo h PRO 81 N 2.23 0.00 -3.91 7.08 0.13 -1.97 -3.44 132.00 132.12 1hpo h PRO 81 Ca -0.48 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.48 1hpo h PRO 81 Cb 1.17 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.09 1hpo h PRO 81 CO 0.65 0.12 -0.68 0.54 -0.23 0.00 0.00 178.00 178.40 1hpo s VAL 82 N -3.17 0.10 -0.02 1.56 0.11 -1.26 -5.09 120.40 112.63 1hpo s VAL 82 Ca 0.05 -0.82 -0.30 0.00 -2.93 0.00 0.00 61.98 57.97 1hpo s VAL 82 Cb 0.06 -0.27 -0.03 0.00 -1.53 0.00 0.00 36.38 34.62 1hpo s VAL 82 CO 0.71 -0.45 0.99 0.20 -3.33 0.00 0.00 175.10 173.22 1hpo s ASN 83 N -1.35 7.35 -0.07 3.54 0.01 -1.26 -4.73 114.94 118.42 1hpo s ASN 83 Ca -0.15 1.64 0.03 0.00 -0.71 0.00 0.00 52.86 53.67 1hpo s ASN 83 Cb -0.09 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 39.01 1hpo s ASN 83 CO -0.01 -0.30 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.50 1hpo s ILE 84 N 1.20 1.43 -0.29 0.60 1.01 0.21 -1.51 121.20 123.84 1hpo s ILE 84 Ca 0.51 -0.67 -0.11 0.00 0.00 0.00 0.00 60.65 60.39 1hpo s ILE 84 Cb -0.20 -1.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.97 1hpo s ILE 84 CO 0.26 0.42 0.18 -0.63 0.00 0.00 0.00 174.94 175.17 1hpo s ILE 85 N 0.43 5.07 0.29 2.92 -1.09 -0.38 -1.63 121.20 126.80 1hpo s ILE 85 Ca -0.13 -0.05 0.04 0.00 -2.23 0.00 0.00 60.65 58.28 1hpo s ILE 85 Cb -0.15 -3.48 0.04 0.00 -1.58 0.00 0.00 42.46 37.29 1hpo s ILE 85 CO 0.05 0.18 0.33 0.61 -1.23 0.00 0.00 174.94 174.87 1hpo n GLY 86 N 5.04 2.29 0.23 6.18 0.00 -1.14 -1.83 105.19 115.96 1hpo n GLY 86 Ca -0.14 -2.20 0.01 0.00 0.00 0.00 0.00 46.02 43.69 1hpo n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1hpo h ARG 87 N 0.00 0.09 0.00 1.61 3.08 -0.43 -1.18 114.38 117.55 1hpo h ARG 87 Ca -0.15 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.89 1hpo h ARG 87 Cb 0.63 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1hpo h ARG 87 CO 0.22 0.06 0.35 -2.95 -1.07 0.00 0.00 179.97 176.59 1hpo h ASN 88 N 0.10 0.00 0.00 7.04 -1.07 -1.59 -0.66 115.58 119.40 1hpo h ASN 88 Ca 0.32 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 56.62 1hpo h ASN 88 Cb 0.51 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.75 1hpo h ASN 88 CO -0.54 0.00 -1.41 0.18 0.07 0.00 0.00 177.43 175.73 1hpo n LEU 89 N -2.66 0.00 0.15 6.14 4.77 -0.79 -4.61 117.00 119.99 1hpo n LEU 89 Ca -0.02 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 55.99 1hpo n LEU 89 Cb 0.39 0.10 0.40 0.00 -2.33 0.00 0.00 43.42 41.98 1hpo n LEU 89 CO 0.11 0.10 0.86 -0.07 -1.33 0.00 0.00 177.39 177.05 1hpo h LEU 90 N 0.00 0.14 -0.97 2.23 3.38 0.06 -2.02 115.31 118.13 1hpo h LEU 90 Ca -0.11 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.74 1hpo h LEU 90 Cb 0.95 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1hpo h LEU 90 CO 0.01 0.35 -0.44 0.71 0.09 0.00 0.00 178.44 179.15 1hpo h THR 91 N 0.14 1.11 0.00 0.22 1.35 -1.70 -2.35 112.91 111.68 1hpo h THR 91 Ca 0.03 -1.64 -0.06 0.00 -0.55 0.00 0.00 66.41 64.19 1hpo h THR 91 Cb 0.43 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.77 1hpo h THR 91 CO 0.03 0.43 -0.28 1.56 -0.25 0.00 0.00 175.52 177.02 1hpo h GLN 92 N 0.00 0.00 -0.61 4.72 1.08 -1.62 -2.94 115.11 115.74 1hpo h GLN 92 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1hpo h GLN 92 Cb 0.90 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 1hpo h GLN 92 CO 0.06 0.28 0.00 0.44 -0.95 0.00 0.00 178.83 178.65 1hpo n ILE 93 N -3.51 1.26 -1.57 2.54 -5.35 -1.19 -4.95 119.36 106.59 1hpo n ILE 93 Ca -0.00 -1.09 -0.05 0.00 -0.27 0.00 0.00 62.75 61.34 1hpo n ILE 93 Cb 0.44 0.38 -0.01 0.00 -1.74 0.00 0.00 39.64 38.70 1hpo n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hpo n GLY 94 N 1.19 0.48 3.74 3.28 0.00 -1.11 -5.02 105.19 107.75 1hpo n GLY 94 Ca 0.22 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1hpo n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hpo s THR 96 N 0.14 0.94 -0.14 0.00 -4.23 -1.26 -4.76 115.64 106.33 1hpo s THR 96 Ca 0.57 -2.02 -0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1hpo s THR 96 Cb -0.36 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.40 1hpo s THR 96 CO 0.38 -0.56 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.13 1hpo s LEU 97 N -3.20 3.46 -0.03 4.79 1.43 -1.26 -5.09 118.68 118.78 1hpo s LEU 97 Ca 0.22 -0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.33 1hpo s LEU 97 Cb 0.05 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.44 1hpo s LEU 97 CO 0.03 0.23 -0.07 0.20 0.23 0.00 0.00 176.35 176.97 1hpo s ASN 98 N 0.02 1.03 0.00 2.29 -0.87 -1.26 -5.29 114.94 110.86 1hpo s ASN 98 Ca 0.02 -0.15 0.00 0.00 -1.57 0.00 0.00 52.86 51.16 1hpo s ASN 98 Cb -0.13 -0.33 0.00 0.00 -0.02 0.00 0.00 41.25 40.77 1hpo s ASN 98 CO 0.02 0.03 0.00 2.22 -2.57 0.00 0.00 177.10 176.80