#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vp0 n HIS 3 N 0.00 0.36 -3.34 1.43 -0.00 -1.26 -4.77 115.22 107.64 1vp0 n HIS 3 Ca 0.00 0.10 -0.10 0.00 -0.00 0.00 0.00 57.72 57.73 1vp0 n HIS 3 Cb 0.00 -0.56 -0.08 0.00 -0.00 0.00 0.00 29.99 29.35 1vp0 n HIS 3 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1vp0 s TYR 4 N -3.31 -0.84 0.00 4.41 6.14 -1.26 -3.15 117.35 119.34 1vp0 s TYR 4 Ca -0.00 0.60 0.00 0.00 0.64 0.00 0.00 57.07 58.31 1vp0 s TYR 4 Cb 0.13 -0.07 0.00 0.00 0.42 0.00 0.00 41.96 42.44 1vp0 s TYR 4 CO 0.83 -0.81 0.00 -3.47 0.64 0.00 0.00 175.55 172.74 1vp0 n ASP 5 N 5.36 0.00 0.00 4.32 4.64 -1.26 -4.95 116.55 124.65 1vp0 n ASP 5 Ca -0.02 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.39 1vp0 n ASP 5 Cb 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.58 1vp0 n ASP 5 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 1vp0 n ILE 6 N 0.00 0.00 -1.65 5.18 2.08 -1.26 -4.94 119.36 118.77 1vp0 n ILE 6 Ca 0.00 0.00 -0.47 0.00 0.56 0.00 0.00 62.75 62.84 1vp0 n ILE 6 Cb 0.00 -0.09 -0.04 0.00 -0.75 0.00 0.00 39.64 38.76 1vp0 n ILE 6 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 1vp0 n LEU 7 N -1.98 2.81 -3.06 1.39 0.00 -1.26 -4.76 117.00 110.14 1vp0 n LEU 7 Ca 0.00 1.11 0.03 0.00 0.00 0.00 0.00 56.01 57.15 1vp0 n LEU 7 Cb 0.00 -1.38 -0.00 0.00 0.00 0.00 0.00 43.42 42.04 1vp0 n LEU 7 CO 0.00 -0.51 0.31 -1.58 0.00 0.00 0.00 177.39 175.62 1vp0 s GLN 8 N 0.40 0.40 0.24 1.96 0.74 -1.26 -5.08 119.66 117.05 1vp0 s GLN 8 Ca 0.76 0.07 0.00 0.00 0.05 0.00 0.00 55.36 56.24 1vp0 s GLN 8 Cb -0.72 0.10 0.00 0.00 1.10 0.00 0.00 33.01 33.49 1vp0 s GLN 8 CO 0.43 -0.65 0.00 0.00 -0.55 0.00 0.00 175.29 174.53 1vp0 n ALA 9 N 4.60 -1.41 -1.04 1.58 0.00 -1.26 -4.15 120.51 118.84 1vp0 n ALA 9 Ca 0.08 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1vp0 n ALA 9 Cb 0.58 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1vp0 n ALA 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1vp0 n PRO 10 N -2.83 0.03 0.00 0.00 -0.04 -1.26 -3.80 135.00 127.09 1vp0 n PRO 10 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1vp0 n PRO 10 Cb 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 1vp0 n PRO 10 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1vp0 n VAL 11 N 0.00 0.00 -2.14 0.52 3.14 -1.26 -3.68 118.33 114.91 1vp0 n VAL 11 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1vp0 n VAL 11 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1vp0 n VAL 11 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 1vp0 n ILE 12 N -0.08 -1.02 -4.26 1.55 -5.35 -1.26 -5.04 119.36 103.90 1vp0 n ILE 12 Ca 0.00 0.19 -0.14 0.00 -0.27 0.00 0.00 62.75 62.52 1vp0 n ILE 12 Cb 0.00 -1.81 -0.10 0.00 -1.74 0.00 0.00 39.64 35.99 1vp0 n ILE 12 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1vp0 s SER 13 N -0.38 1.54 0.06 7.28 0.15 -1.26 -5.05 113.70 116.04 1vp0 s SER 13 Ca 0.00 -1.13 0.01 0.00 0.70 0.00 0.00 55.95 55.53 1vp0 s SER 13 Cb 0.00 0.05 -0.26 0.00 -1.71 0.00 0.00 66.02 64.10 1vp0 s SER 13 CO 0.00 -0.48 1.08 -0.08 1.20 0.00 0.00 173.24 174.96 1vp0 h GLU 14 N 2.68 0.17 -1.40 5.44 4.57 -1.97 -3.03 114.58 121.02 1vp0 h GLU 14 Ca -0.37 -0.28 -0.58 0.00 -1.18 0.00 0.00 59.36 56.95 1vp0 h GLU 14 Cb 1.20 0.11 -0.23 0.00 -0.16 0.00 0.00 28.75 29.66 1vp0 h GLU 14 CO 0.64 1.08 0.73 1.17 -1.18 0.00 0.00 179.01 181.44 1vp0 n LYS 15 N -3.42 2.42 -4.69 1.92 3.00 -1.26 -4.40 118.16 111.73 1vp0 n LYS 15 Ca -0.08 -2.75 -0.25 0.00 -0.00 0.00 0.00 58.31 55.22 1vp0 n LYS 15 Cb 1.01 -2.09 -0.16 0.00 0.00 0.00 0.00 35.03 33.79 1vp0 n LYS 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1vp0 s ALA 16 N -3.09 1.39 -1.26 3.14 0.00 -1.15 -3.48 121.76 117.32 1vp0 s ALA 16 Ca 0.53 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 1vp0 s ALA 16 Cb 0.41 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.97 1vp0 s ALA 16 CO -0.09 0.17 0.99 0.98 0.00 0.00 0.00 175.76 177.80 1vp0 n TYR 17 N 3.63 -2.28 0.00 0.00 4.19 -0.07 -4.56 117.16 118.07 1vp0 n TYR 17 Ca -0.21 0.94 0.00 0.00 3.31 0.00 0.00 57.90 61.93 1vp0 n TYR 17 Cb 0.52 -4.93 0.00 0.00 0.49 0.00 0.00 39.34 35.42 1vp0 n TYR 17 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1vp0 n SER 18 N -3.09 0.00 0.00 2.98 2.88 -1.26 -4.77 113.62 110.36 1vp0 n SER 18 Ca -0.23 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.31 1vp0 n SER 18 Cb 0.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1vp0 n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vp0 n ALA 19 N -0.90 0.82 -3.09 -1.46 0.00 -1.23 -4.84 120.51 109.81 1vp0 n ALA 19 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1vp0 n ALA 19 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1vp0 n ALA 19 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1vp0 n MET 20 N -0.55 3.26 -0.01 0.00 2.81 -1.26 -4.76 117.12 116.62 1vp0 n MET 20 Ca 0.00 -4.77 -0.02 0.00 -1.81 0.00 0.00 57.70 51.11 1vp0 n MET 20 Cb 0.00 -2.28 -0.01 0.00 -0.71 0.00 0.00 33.22 30.21 1vp0 n MET 20 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1vp0 n GLU 21 N 0.25 0.67 -0.24 0.03 0.00 -1.26 -0.89 120.64 119.20 1vp0 n GLU 21 Ca 0.32 0.01 0.28 0.00 0.00 0.00 0.00 57.16 57.77 1vp0 n GLU 21 Cb 0.38 -1.05 0.67 0.00 0.00 0.00 0.00 31.44 31.44 1vp0 n GLU 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1vp0 h ARG 22 N 0.00 0.11 0.00 5.31 2.47 -1.95 -3.43 114.38 116.89 1vp0 h ARG 22 Ca -0.06 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1vp0 h ARG 22 Cb 1.10 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1vp0 h ARG 22 CO -0.01 0.07 0.00 0.41 0.56 0.00 0.00 179.97 181.01 1vp0 n GLY 23 N -1.66 0.87 3.70 0.04 0.00 -1.26 -4.90 105.19 101.98 1vp0 n GLY 23 Ca 0.21 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1vp0 n GLY 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1vp0 n VAL 24 N 0.00 2.39 -1.08 1.61 3.14 -0.75 -4.74 118.33 118.91 1vp0 n VAL 24 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 1vp0 n VAL 24 Cb 0.00 -1.55 0.00 0.00 -1.06 0.00 0.00 33.84 31.23 1vp0 n VAL 24 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1vp0 n TYR 25 N -0.07 0.00 -1.73 1.45 4.01 -1.12 -4.52 117.16 115.19 1vp0 n TYR 25 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1vp0 n TYR 25 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1vp0 n TYR 25 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1vp0 n SER 26 N 0.00 0.00 -0.06 7.72 7.64 -1.17 -4.52 113.62 123.23 1vp0 n SER 26 Ca 0.00 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 59.07 1vp0 n SER 26 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1vp0 n SER 26 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1vp0 n PHE 27 N 0.00 -0.49 -2.68 1.43 0.99 -0.96 -0.15 117.46 115.60 1vp0 n PHE 27 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.40 1vp0 n PHE 27 Cb 0.20 0.05 0.06 0.00 -1.00 0.00 0.00 39.48 38.79 1vp0 n PHE 27 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.76 178.63 1vp0 n TRP 28 N -0.12 -0.87 0.00 1.38 -0.00 -1.24 -4.18 117.44 112.41 1vp0 n TRP 28 Ca 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 57.50 56.71 1vp0 n TRP 28 Cb 0.00 1.14 0.00 0.00 -0.00 0.00 0.00 31.31 32.45 1vp0 n TRP 28 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 1vp0 n VAL 29 N 1.80 0.00 -4.48 5.87 0.24 -1.26 -4.46 118.33 116.04 1vp0 n VAL 29 Ca 0.05 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.11 1vp0 n VAL 29 Cb 0.68 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.95 1vp0 n VAL 29 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1vp0 s SER 30 N -1.32 3.06 0.60 -1.34 1.04 -1.26 -4.80 113.70 109.67 1vp0 s SER 30 Ca 0.00 -1.25 0.25 0.00 0.48 0.00 0.00 55.95 55.42 1vp0 s SER 30 Cb 0.00 -0.22 1.34 0.00 0.10 0.00 0.00 66.02 67.23 1vp0 s SER 30 CO 0.00 -0.38 1.73 -0.65 0.98 0.00 0.00 173.24 174.92 1vp0 h PRO 31 N 2.12 0.00 -6.27 4.02 0.11 -1.99 -3.38 132.00 126.61 1vp0 h PRO 31 Ca -0.41 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.17 1vp0 h PRO 31 Cb 1.24 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 1vp0 h PRO 31 CO 0.70 0.00 1.15 0.15 -0.21 0.00 0.00 178.00 179.79 1vp0 s LYS 32 N -3.94 3.06 0.00 1.05 1.02 -1.26 -4.97 119.74 114.70 1vp0 s LYS 32 Ca -0.03 0.15 0.00 0.00 0.02 0.00 0.00 55.97 56.11 1vp0 s LYS 32 Cb 0.07 -4.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.16 1vp0 s LYS 32 CO 0.22 -2.26 0.00 0.00 -0.92 0.00 0.00 175.35 172.40 1vp0 n ALA 33 N 10.33 0.00 -0.45 5.17 0.00 -1.26 -4.92 120.51 129.38 1vp0 n ALA 33 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1vp0 n ALA 33 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1vp0 n ALA 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vp0 n THR 34 N 0.00 0.00 -3.13 0.00 -2.24 -1.26 -4.80 114.28 102.84 1vp0 n THR 34 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1vp0 n THR 34 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1vp0 n THR 34 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1vp0 s LYS 35 N 0.00 0.08 -0.13 -0.78 -2.85 -1.26 -4.98 119.74 109.82 1vp0 s LYS 35 Ca 0.00 0.07 0.05 0.00 -1.00 0.00 0.00 55.97 55.09 1vp0 s LYS 35 Cb 0.00 0.03 0.16 0.00 -2.06 0.00 0.00 37.83 35.96 1vp0 s LYS 35 CO 0.00 -0.14 0.92 2.41 0.10 0.00 0.00 175.35 178.64 1vp0 n THR 36 N 5.00 0.00 0.22 3.79 -1.04 -1.26 -4.95 114.28 116.04 1vp0 n THR 36 Ca 0.10 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 1vp0 n THR 36 Cb 0.59 0.63 0.00 0.00 -1.82 0.00 0.00 70.33 69.72 1vp0 n THR 36 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vp0 n GLU 37 N -0.60 0.00 -1.76 -2.82 -0.58 -1.26 -5.04 120.64 108.58 1vp0 n GLU 37 Ca -0.11 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.44 1vp0 n GLU 37 Cb 0.64 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 31.44 1vp0 n GLU 37 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1vp0 s ILE 38 N -1.92 3.19 0.00 -3.67 1.10 -1.26 -3.24 121.20 115.40 1vp0 s ILE 38 Ca 0.00 -0.24 0.00 0.00 -0.51 0.00 0.00 60.65 59.90 1vp0 s ILE 38 Cb 0.00 -3.77 0.00 0.00 0.15 0.00 0.00 42.46 38.84 1vp0 s ILE 38 CO 0.00 -0.38 0.00 1.17 -2.11 0.00 0.00 174.94 173.62 1vp0 n LYS 39 N 8.54 0.00 0.00 3.50 4.81 -1.26 -4.91 118.16 128.84 1vp0 n LYS 39 Ca 0.44 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.90 1vp0 n LYS 39 Cb 0.46 0.00 0.11 0.00 0.02 0.00 0.00 35.03 35.62 1vp0 n LYS 39 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1vp0 n ASP 40 N 0.00 0.00 -0.03 3.14 4.64 -1.20 -0.38 116.55 122.72 1vp0 n ASP 40 Ca 0.00 0.18 -0.14 0.00 -1.38 0.00 0.00 54.79 53.45 1vp0 n ASP 40 Cb 0.00 -0.25 -0.10 0.00 -1.04 0.00 0.00 41.12 39.73 1vp0 n ASP 40 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1vp0 h ALA 41 N 2.22 0.10 -0.71 -1.67 0.00 -1.65 -3.12 119.26 114.43 1vp0 h ALA 41 Ca 0.00 -0.39 -0.66 0.00 0.00 0.00 0.00 54.91 53.87 1vp0 h ALA 41 Cb 0.04 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 17.64 1vp0 h ALA 41 CO 0.00 0.05 1.32 -0.89 0.00 0.00 0.00 179.25 179.73 1vp0 n ILE 42 N -4.56 4.43 -3.05 0.00 -0.00 0.49 -4.62 119.36 112.04 1vp0 n ILE 42 Ca -0.08 -4.00 -0.14 0.00 -0.00 0.00 0.00 62.75 58.53 1vp0 n ILE 42 Cb 0.42 -1.74 -0.04 0.00 -0.00 0.00 0.00 39.64 38.29 1vp0 n ILE 42 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 1vp0 s GLN 43 N -2.05 0.98 0.00 0.38 -1.52 -1.18 -3.52 119.66 112.74 1vp0 s GLN 43 Ca 0.54 -1.45 0.00 0.00 -1.95 0.00 0.00 55.36 52.50 1vp0 s GLN 43 Cb 0.29 -0.62 0.00 0.00 -0.22 0.00 0.00 33.01 32.46 1vp0 s GLN 43 CO -0.18 -1.34 0.00 0.94 -0.25 0.00 0.00 175.29 174.45 1vp0 n GLN 44 N 3.01 0.00 -1.80 2.91 -0.06 -1.26 -4.97 117.38 115.22 1vp0 n GLN 44 Ca 0.22 0.00 -0.20 0.00 -2.00 0.00 0.00 57.00 55.02 1vp0 n GLN 44 Cb 0.52 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.61 1vp0 n GLN 44 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1vp0 s ALA 45 N -1.00 1.03 0.00 1.69 0.00 -1.26 -2.47 121.76 119.74 1vp0 s ALA 45 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.27 1vp0 s ALA 45 Cb 0.00 -4.68 0.00 0.00 0.00 0.00 0.00 23.12 18.44 1vp0 s ALA 45 CO 0.00 -6.15 0.00 0.34 0.00 0.00 0.00 175.76 169.95 1vp0 n PHE 46 N 17.43 0.00 -2.16 0.00 7.35 -1.26 -5.02 117.46 133.80 1vp0 n PHE 46 Ca 0.43 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.96 1vp0 n PHE 46 Cb 0.47 0.04 -0.02 0.00 0.35 0.00 0.00 39.48 40.31 1vp0 n PHE 46 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1vp0 n GLY 47 N 0.00 0.07 3.24 7.13 0.00 -1.03 -4.99 105.19 109.61 1vp0 n GLY 47 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1vp0 n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vp0 s VAL 48 N -2.69 1.94 -0.03 1.61 1.01 -1.26 -5.10 120.40 115.89 1vp0 s VAL 48 Ca 0.00 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1vp0 s VAL 48 Cb 0.00 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1vp0 s VAL 48 CO 0.00 0.54 -0.22 -0.13 0.00 0.00 0.00 175.10 175.29 1vp0 s ARG 49 N -0.06 2.24 0.02 2.72 0.52 -1.26 -4.25 118.95 118.89 1vp0 s ARG 49 Ca -0.06 -0.86 0.06 0.00 -0.52 0.00 0.00 55.73 54.36 1vp0 s ARG 49 Cb -0.14 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.16 1vp0 s ARG 49 CO 0.04 0.58 -0.19 0.14 0.02 0.00 0.00 175.30 175.89 1vp0 s VAL 50 N -0.64 1.51 -0.09 3.52 -7.23 -1.23 -5.00 120.40 111.23 1vp0 s VAL 50 Ca 0.10 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.95 1vp0 s VAL 50 Cb -0.10 -1.30 0.11 0.00 0.56 0.00 0.00 36.38 35.65 1vp0 s VAL 50 CO -0.00 0.24 0.94 -0.51 -0.31 0.00 0.00 175.10 175.45 1vp0 s ILE 51 N -0.68 0.00 0.00 -0.62 1.10 -1.26 -4.85 121.20 114.89 1vp0 s ILE 51 Ca 0.06 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.20 1vp0 s ILE 51 Cb -0.08 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.53 1vp0 s ILE 51 CO 0.01 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.45 1vp0 n GLY 52 N 0.30 0.95 3.35 1.50 0.00 -1.26 -3.49 105.19 106.53 1vp0 n GLY 52 Ca -0.10 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 1vp0 n GLY 52 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1vp0 n ILE 53 N -2.77 0.00 0.06 -0.61 0.13 -1.26 -3.11 119.36 111.80 1vp0 n ILE 53 Ca 0.00 -0.24 0.00 0.00 -1.10 0.00 0.00 62.75 61.41 1vp0 n ILE 53 Cb 0.32 -0.53 0.00 0.00 -0.84 0.00 0.00 39.64 38.59 1vp0 n ILE 53 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 1vp0 n SER 54 N -0.66 0.73 -1.85 9.51 7.64 -1.26 -4.51 113.62 123.21 1vp0 n SER 54 Ca 0.05 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1vp0 n SER 54 Cb 0.55 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1vp0 n SER 54 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1vp0 n THR 55 N -3.40 -6.36 0.00 0.44 -2.24 -1.25 -4.85 114.28 96.62 1vp0 n THR 55 Ca 0.00 2.68 0.00 0.00 -2.27 0.00 0.00 64.05 64.46 1vp0 n THR 55 Cb 0.07 -3.60 0.00 0.00 -2.10 0.00 0.00 70.33 64.70 1vp0 n THR 55 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1vp0 n MET 56 N 0.62 0.00 0.00 -0.78 1.56 -0.93 -4.90 117.12 112.69 1vp0 n MET 56 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1vp0 n MET 56 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1vp0 n MET 56 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 1vp0 n ASN 57 N 0.00 0.00 -0.89 6.12 2.04 -1.26 -4.90 115.26 116.37 1vp0 n ASN 57 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 1vp0 n ASN 57 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1vp0 n ASN 57 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34 1vp0 n VAL 58 N 0.00 -2.63 0.00 3.53 0.31 -1.26 -3.88 118.33 114.40 1vp0 n VAL 58 Ca 0.00 0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1vp0 n VAL 58 Cb 0.00 -2.80 0.00 0.00 -0.91 0.00 0.00 33.84 30.13 1vp0 n VAL 58 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1vp0 n PRO 59 N 0.10 1.61 0.00 5.55 -0.04 -1.25 -4.16 135.00 136.82 1vp0 n PRO 59 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1vp0 n PRO 59 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1vp0 n PRO 59 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vp0 n GLY 60 N 4.33 -0.09 2.02 0.55 0.00 -1.26 -4.14 105.19 106.59 1vp0 n GLY 60 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1vp0 n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1vp0 n LYS 61 N -1.47 -2.24 -2.98 1.61 4.81 -1.26 -4.91 118.16 111.71 1vp0 n LYS 61 Ca 0.00 1.94 -0.22 0.00 -0.87 0.00 0.00 58.31 59.16 1vp0 n LYS 61 Cb 0.00 -2.96 -0.03 0.00 0.02 0.00 0.00 35.03 32.06 1vp0 n LYS 61 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1vp0 n ARG 62 N 0.83 2.25 -2.42 1.64 3.00 -1.26 -4.81 116.66 115.89 1vp0 n ARG 62 Ca -0.21 -4.16 -0.37 0.00 -0.01 0.00 0.00 57.85 53.10 1vp0 n ARG 62 Cb 0.32 -1.97 -0.03 0.00 0.00 0.00 0.00 32.46 30.77 1vp0 n ARG 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1vp0 s LYS 63 N -3.06 3.31 -0.12 5.56 2.36 -1.24 -2.76 119.74 123.80 1vp0 s LYS 63 Ca 0.44 -0.95 -0.13 0.00 -2.55 0.00 0.00 55.97 52.79 1vp0 s LYS 63 Cb 0.33 -5.29 -0.05 0.00 -1.05 0.00 0.00 37.83 31.77 1vp0 s LYS 63 CO -0.11 -2.56 -0.25 0.54 1.55 0.00 0.00 175.35 174.52 1vp0 n ARG 64 N 8.84 0.39 -1.05 4.03 1.74 -1.26 -5.03 116.66 124.32 1vp0 n ARG 64 Ca 0.36 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.26 1vp0 n ARG 64 Cb 0.50 -1.17 0.13 0.00 -1.02 0.00 0.00 32.46 30.90 1vp0 n ARG 64 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1vp0 s VAL 65 N -2.61 2.02 0.28 1.55 1.01 -1.26 -4.88 120.40 116.50 1vp0 s VAL 65 Ca -0.22 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.78 1vp0 s VAL 65 Cb 0.04 -2.36 0.27 0.00 0.00 0.00 0.00 36.38 34.33 1vp0 s VAL 65 CO 0.32 -0.01 1.80 1.23 0.00 0.00 0.00 175.10 178.44 1vp0 h GLY 66 N -1.04 1.56 0.00 4.51 0.00 -1.95 -3.31 103.07 102.83 1vp0 h GLY 66 Ca -0.46 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1vp0 h GLY 66 CO 0.45 0.06 0.00 0.54 0.00 0.00 0.00 176.54 177.60 1vp0 n ARG 67 N -4.73 0.00 0.00 4.80 1.74 -1.26 -4.99 116.66 112.22 1vp0 n ARG 67 Ca 0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1vp0 n ARG 67 Cb 0.40 -0.22 0.00 0.00 -1.02 0.00 0.00 32.46 31.62 1vp0 n ARG 67 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1vp0 n PHE 68 N 0.00 0.00 -1.67 -1.55 3.72 -1.25 -5.05 117.46 111.66 1vp0 n PHE 68 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 1vp0 n PHE 68 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1vp0 n PHE 68 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1vp0 s ILE 69 N 0.00 3.09 0.00 4.37 -1.09 -1.26 -4.75 121.20 121.56 1vp0 s ILE 69 Ca 0.00 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.49 1vp0 s ILE 69 Cb 0.00 -3.20 0.00 0.00 -1.58 0.00 0.00 42.46 37.68 1vp0 s ILE 69 CO 0.00 -0.18 0.00 0.61 -1.23 0.00 0.00 174.94 174.14 1vp0 n GLY 70 N 5.88 3.89 0.00 6.18 0.00 -1.26 -4.22 105.19 115.66 1vp0 n GLY 70 Ca 0.32 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1vp0 n GLY 70 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1vp0 n GLN 71 N -0.07 0.00 -0.02 1.61 -0.06 -1.11 -3.64 117.38 114.09 1vp0 n GLN 71 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1vp0 n GLN 71 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1vp0 n GLN 71 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1vp0 n ARG 72 N 0.00 0.00 0.00 3.69 5.12 -1.26 -4.14 116.66 120.06 1vp0 n ARG 72 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1vp0 n ARG 72 Cb 0.00 -0.03 0.00 0.00 -1.16 0.00 0.00 32.46 31.27 1vp0 n ARG 72 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1vp0 n ASN 73 N 0.09 0.00 0.00 0.55 4.05 -1.26 -4.80 115.26 113.89 1vp0 n ASN 73 Ca -0.00 -0.18 0.00 0.00 0.45 0.00 0.00 54.58 54.85 1vp0 n ASN 73 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1vp0 n ASN 73 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1vp0 n ASP 74 N 0.00 0.00 -1.06 1.20 10.43 -1.26 -4.88 116.55 120.98 1vp0 n ASP 74 Ca 0.00 0.00 0.12 0.00 2.57 0.00 0.00 54.79 57.48 1vp0 n ASP 74 Cb 0.04 0.00 -0.07 0.00 1.84 0.00 0.00 41.12 42.94 1vp0 n ASP 74 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1vp0 n ARG 75 N 0.00 -2.47 0.00 -1.24 3.00 -1.26 -3.85 116.66 110.85 1vp0 n ARG 75 Ca 0.00 2.02 0.00 0.00 -0.01 0.00 0.00 57.85 59.86 1vp0 n ARG 75 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 32.46 29.61 1vp0 n ARG 75 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1vp0 n LYS 76 N -3.64 2.08 0.00 5.56 4.76 -1.25 -4.19 118.16 121.47 1vp0 n LYS 76 Ca -0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1vp0 n LYS 76 Cb 0.49 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.68 1vp0 n LYS 76 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1vp0 n LYS 77 N 0.00 0.00 -3.50 1.97 2.85 -1.26 -4.65 118.16 113.57 1vp0 n LYS 77 Ca 0.00 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.97 1vp0 n LYS 77 Cb 0.00 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.25 1vp0 n LYS 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1vp0 s ALA 78 N -2.00 0.78 0.19 0.58 0.00 0.78 -2.19 121.76 119.91 1vp0 s ALA 78 Ca 0.00 -1.50 -0.13 0.00 0.00 0.00 0.00 51.96 50.33 1vp0 s ALA 78 Cb 0.00 -1.50 0.22 0.00 0.00 0.00 0.00 23.12 21.83 1vp0 s ALA 78 CO 0.00 -1.90 1.69 0.82 0.00 0.00 0.00 175.76 176.37 1vp0 h ILE 79 N 5.66 0.60 0.00 0.00 1.08 -1.79 -2.55 117.51 120.52 1vp0 h ILE 79 Ca -0.06 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 1vp0 h ILE 79 Cb 0.99 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 1vp0 h ILE 79 CO 0.34 0.03 0.00 0.52 -0.69 0.00 0.00 178.15 178.35 1vp0 n VAL 80 N -5.22 0.00 0.15 1.67 0.31 -1.26 -2.78 118.33 111.20 1vp0 n VAL 80 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1vp0 n VAL 80 Cb 0.29 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 1vp0 n VAL 80 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1vp0 n ARG 81 N 7.23 0.00 -2.31 5.55 3.00 -1.18 -4.58 116.66 124.36 1vp0 n ARG 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1vp0 n ARG 81 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1vp0 n ARG 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1vp0 n LEU 82 N -3.24 -6.36 0.00 6.15 0.00 -1.23 -1.80 117.00 110.52 1vp0 n LEU 82 Ca 0.00 2.92 0.00 0.00 0.00 0.00 0.00 56.01 58.93 1vp0 n LEU 82 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 43.42 40.21 1vp0 n LEU 82 CO 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 177.39 174.70 1vp0 n ALA 83 N 1.89 0.00 -2.02 1.96 0.00 -1.26 -4.35 120.51 116.73 1vp0 n ALA 83 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1vp0 n ALA 83 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1vp0 n ALA 83 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1vp0 s GLU 84 N -0.94 4.07 0.00 0.00 2.12 -1.26 -4.08 118.70 118.61 1vp0 s GLU 84 Ca 0.00 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.40 1vp0 s GLU 84 Cb 0.00 -4.01 0.00 0.00 0.26 0.00 0.00 34.13 30.38 1vp0 s GLU 84 CO 0.00 -0.97 0.00 0.41 -0.54 0.00 0.00 175.26 174.16 1vp0 n GLY 85 N 4.28 0.04 2.76 -1.50 0.00 -1.26 -5.09 105.19 104.42 1vp0 n GLY 85 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1vp0 n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vp0 s GLN 86 N 0.00 0.72 -0.00 1.61 1.11 -1.26 -5.06 119.66 116.78 1vp0 s GLN 86 Ca 0.00 -0.98 -0.00 0.00 0.01 0.00 0.00 55.36 54.39 1vp0 s GLN 86 Cb 0.00 -0.68 -0.00 0.00 -1.01 0.00 0.00 33.01 31.32 1vp0 s GLN 86 CO 0.00 -1.23 0.02 1.03 0.01 0.00 0.00 175.29 175.12 1vp0 h SER 87 N 6.72 -0.00 0.00 5.90 0.87 -1.91 -3.46 113.55 121.67 1vp0 h SER 87 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1vp0 h SER 87 Cb 1.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1vp0 h SER 87 CO 0.19 0.02 0.00 0.00 -0.53 0.00 0.00 176.83 176.51 1vp0 n ILE 88 N -2.09 0.00 -3.61 2.23 3.06 -1.26 -4.91 119.36 112.77 1vp0 n ILE 88 Ca -0.00 0.00 -0.26 0.00 -2.50 0.00 0.00 62.75 59.99 1vp0 n ILE 88 Cb 0.00 0.00 -0.02 0.00 0.54 0.00 0.00 39.64 40.16 1vp0 n ILE 88 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1vp0 n GLU 89 N -3.05 -2.95 -1.57 9.51 2.13 -1.26 -4.45 120.64 119.01 1vp0 n GLU 89 Ca 0.00 0.36 0.00 0.00 0.66 0.00 0.00 57.16 58.18 1vp0 n GLU 89 Cb 0.00 -5.04 0.00 0.00 0.27 0.00 0.00 31.44 26.67 1vp0 n GLU 89 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1vp0 n ALA 90 N -3.67 -1.93 -1.62 4.31 0.00 -1.26 -5.10 120.51 111.24 1vp0 n ALA 90 Ca 0.02 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1vp0 n ALA 90 Cb 0.51 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1vp0 n ALA 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1vp0 n LEU 91 N -1.75 0.00 -2.78 0.00 -0.00 -1.26 -5.09 117.00 106.13 1vp0 n LEU 91 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 55.95 1vp0 n LEU 91 Cb 0.24 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.67 1vp0 n LEU 91 CO 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 177.39 177.52 1vp0 n ALA 92 N -3.00 -1.63 0.00 1.96 0.00 -1.26 -5.04 120.51 111.54 1vp0 n ALA 92 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 53.44 52.25 1vp0 n ALA 92 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1vp0 n ALA 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vp0 n GLY 93 N 2.58 -1.42 3.88 0.00 0.00 -1.26 -5.17 105.19 103.80 1vp0 n GLY 93 Ca 0.16 0.93 0.00 0.00 0.00 0.00 0.00 46.02 47.11 1vp0 n GLY 93 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14