#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whz s PRO 4 N 0.00 0.54 0.65 5.87 0.02 -1.26 -5.19 135.00 135.63 1whz s PRO 4 Ca 0.00 -0.04 -0.16 0.00 0.02 0.00 0.00 61.00 60.83 1whz s PRO 4 Cb 0.00 -1.32 -0.00 0.00 0.02 0.00 0.00 34.50 33.19 1whz s PRO 4 CO 0.00 -0.43 1.12 -2.14 -0.33 0.00 0.00 177.00 175.23 1whz s PRO 5 N 1.97 2.79 0.06 5.54 0.02 -1.26 -4.62 135.00 139.49 1whz s PRO 5 Ca 0.03 1.46 -0.27 0.00 0.02 0.00 0.00 61.00 62.25 1whz s PRO 5 Cb -0.14 -1.94 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 1whz s PRO 5 CO -0.06 -1.27 0.84 1.03 -0.33 0.00 0.00 177.00 177.21 1whz s ARG 6 N -3.97 4.56 0.28 5.54 0.52 -1.26 -1.32 118.95 123.30 1whz s ARG 6 Ca 0.69 1.20 0.01 0.00 -0.52 0.00 0.00 55.73 57.11 1whz s ARG 6 Cb -0.22 -3.38 0.59 0.00 0.52 0.00 0.00 34.95 32.47 1whz s ARG 6 CO 0.40 0.23 1.78 -1.35 0.02 0.00 0.00 175.30 176.38 1whz h PRO 7 N 5.75 0.71 0.00 3.54 0.11 -1.84 -0.81 132.00 139.46 1whz h PRO 7 Ca -0.43 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 1whz h PRO 7 Cb 1.21 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1whz h PRO 7 CO 0.72 0.47 -0.35 0.93 -0.21 0.00 0.00 178.00 179.56 1whz h GLU 8 N 0.73 0.00 -0.18 1.05 4.39 -1.92 -0.13 114.58 118.51 1whz h GLU 8 Ca 0.50 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.98 1whz h GLU 8 Cb 0.69 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.35 1whz h GLU 8 CO -0.35 0.35 -0.74 1.49 -1.16 0.00 0.00 179.01 178.60 1whz h GLU 9 N 0.00 0.82 -0.51 2.33 4.57 -1.58 -1.40 114.58 118.80 1whz h GLU 9 Ca -0.00 -0.64 0.06 0.00 -1.18 0.00 0.00 59.36 57.60 1whz h GLU 9 Cb 0.72 0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 29.38 1whz h GLU 9 CO 0.05 1.25 0.21 0.28 -1.18 0.00 0.00 179.01 179.61 1whz h VAL 10 N 0.57 0.86 -0.71 0.32 2.07 -0.90 -1.89 116.25 116.57 1whz h VAL 10 Ca -0.04 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.28 1whz h VAL 10 Cb 1.37 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 1whz h VAL 10 CO 0.16 0.07 0.22 0.00 0.02 0.00 0.00 177.57 178.04 1whz h ALA 11 N 1.32 0.93 -0.72 1.67 0.00 -0.93 -0.03 119.26 121.50 1whz h ALA 11 Ca 0.24 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1whz h ALA 11 Cb 0.23 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1whz h ALA 11 CO -0.22 0.61 0.43 -0.09 0.00 0.00 0.00 179.25 179.98 1whz h ARG 12 N 1.05 0.98 -0.55 0.00 2.43 -0.92 -0.33 114.38 117.04 1whz h ARG 12 Ca 0.23 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.25 1whz h ARG 12 Cb 0.30 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1whz h ARG 12 CO -0.01 0.69 0.12 0.87 -1.51 0.00 0.00 179.97 180.13 1whz h LYS 13 N 0.98 0.89 -0.53 0.20 1.57 -0.88 -1.14 116.57 117.67 1whz h LYS 13 Ca 0.26 -0.22 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1whz h LYS 13 Cb -0.03 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1whz h LYS 13 CO -0.05 0.84 0.34 -0.07 -0.57 0.00 0.00 179.45 179.95 1whz h LEU 14 N 0.78 0.58 -1.87 2.94 3.38 -0.70 -1.85 115.31 118.58 1whz h LEU 14 Ca 0.17 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1whz h LEU 14 Cb 0.37 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1whz h LEU 14 CO 0.01 0.42 -0.08 0.03 0.09 0.00 0.00 178.44 178.90 1whz h ARG 15 N 0.69 0.00 0.00 1.13 3.08 -0.75 -1.23 114.38 117.30 1whz h ARG 15 Ca 0.20 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 1whz h ARG 15 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1whz h ARG 15 CO -0.06 0.08 -0.30 -0.09 -1.07 0.00 0.00 179.97 178.53 1whz h ARG 16 N 0.00 0.00 0.00 0.04 2.43 -0.37 -2.03 114.38 114.45 1whz h ARG 16 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1whz h ARG 16 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1whz h ARG 16 CO 0.01 0.30 -0.05 1.28 -1.51 0.00 0.00 179.97 179.99 1whz n LEU 17 N -3.60 0.15 0.00 3.80 4.77 -0.55 -4.92 117.00 116.66 1whz n LEU 17 Ca -0.01 0.46 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1whz n LEU 17 Cb 0.43 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1whz n LEU 17 CO 0.35 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1whz n GLY 18 N 1.47 1.01 3.78 -0.72 0.00 -0.76 -5.02 105.19 104.96 1whz n GLY 18 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1whz n GLY 18 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1whz s PHE 19 N -2.00 2.78 0.01 1.61 0.08 -0.71 -4.41 117.98 115.35 1whz s PHE 19 Ca 0.00 1.55 0.04 0.00 0.12 0.00 0.00 56.93 58.65 1whz s PHE 19 Cb 0.00 -3.27 -0.02 0.00 -0.57 0.00 0.00 43.02 39.17 1whz s PHE 19 CO 0.00 -1.41 -0.14 0.08 -0.10 0.00 0.00 175.22 173.66 1whz s VAL 20 N -1.75 1.08 -0.00 -0.44 1.01 0.35 -4.20 120.40 116.43 1whz s VAL 20 Ca 0.70 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 1whz s VAL 20 Cb -0.24 -0.94 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 1whz s VAL 20 CO 0.27 0.15 1.27 -0.70 0.00 0.00 0.00 175.10 176.10 1whz s GLU 21 N -0.71 4.35 -0.09 2.72 2.12 -1.26 -1.24 118.70 124.59 1whz s GLU 21 Ca 0.03 1.81 0.12 0.00 0.36 0.00 0.00 54.97 57.30 1whz s GLU 21 Cb -0.06 -3.49 0.28 0.00 0.26 0.00 0.00 34.13 31.11 1whz s GLU 21 CO 0.00 -0.44 1.20 0.54 -0.54 0.00 0.00 175.26 176.02 1whz n ARG 22 N 4.87 2.40 -3.16 4.30 5.12 0.54 -4.96 116.66 125.78 1whz n ARG 22 Ca 0.11 -2.28 0.05 0.00 -1.93 0.00 0.00 57.85 53.80 1whz n ARG 22 Cb 0.45 -1.42 -0.03 0.00 -1.16 0.00 0.00 32.46 30.31 1whz n ARG 22 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1whz s ALA 24 N -2.06 -3.71 -0.18 7.54 0.00 -1.26 -4.97 121.76 117.12 1whz s ALA 24 Ca 0.25 1.44 -0.28 0.00 0.00 0.00 0.00 51.96 53.37 1whz s ALA 24 Cb 0.20 -2.52 0.09 0.00 0.00 0.00 0.00 23.12 20.89 1whz s ALA 24 CO 0.06 -1.33 0.83 0.21 0.00 0.00 0.00 175.76 175.53 1whz s LYS 25 N 2.68 0.78 -1.61 0.00 2.20 -0.76 -4.98 119.74 118.05 1whz s LYS 25 Ca -0.07 0.50 0.00 0.00 -0.36 0.00 0.00 55.97 56.04 1whz s LYS 25 Cb -0.06 0.38 0.00 0.00 -1.51 0.00 0.00 37.83 36.64 1whz s LYS 25 CO -0.10 -0.18 0.00 0.41 -0.36 0.00 0.00 175.35 175.12 1whz n GLY 26 N 1.61 0.65 2.30 5.54 0.00 -1.26 -1.83 105.19 112.20 1whz n GLY 26 Ca -0.14 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1whz n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1whz n GLY 27 N -0.97 0.60 3.37 -0.02 0.00 -1.26 -4.95 105.19 101.95 1whz n GLY 27 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1whz n GLY 27 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1whz s HIS 28 N -2.43 2.00 0.06 1.61 3.76 -0.76 -0.20 115.29 119.32 1whz s HIS 28 Ca 0.00 -0.43 0.04 0.00 -0.15 0.00 0.00 55.06 54.53 1whz s HIS 28 Cb 0.00 -0.99 -0.03 0.00 1.11 0.00 0.00 32.58 32.68 1whz s HIS 28 CO 0.00 0.40 -0.13 1.03 -0.85 0.00 0.00 174.74 175.20 1whz s ARG 29 N -2.78 0.77 -0.10 1.40 0.52 -0.29 -1.84 118.95 116.63 1whz s ARG 29 Ca 0.18 -0.84 0.02 0.00 -0.52 0.00 0.00 55.73 54.57 1whz s ARG 29 Cb -0.06 -0.73 -0.01 0.00 0.52 0.00 0.00 34.95 34.66 1whz s ARG 29 CO 0.08 0.16 -0.16 -1.17 0.02 0.00 0.00 175.30 174.23 1whz s LEU 30 N -1.52 2.55 -0.02 2.53 0.20 -1.26 -0.93 118.68 120.23 1whz s LEU 30 Ca -0.03 -0.36 0.08 0.00 0.69 0.00 0.00 54.13 54.51 1whz s LEU 30 Cb -0.09 -1.54 -0.02 0.00 -0.43 0.00 0.00 46.19 44.11 1whz s LEU 30 CO 0.02 0.21 -0.26 -0.31 -0.29 0.00 0.00 176.35 175.72 1whz s TYR 31 N 0.06 2.32 0.18 5.38 2.02 0.34 -0.34 117.35 127.31 1whz s TYR 31 Ca -0.07 -0.45 0.09 0.00 -0.37 0.00 0.00 57.07 56.27 1whz s TYR 31 Cb -0.15 -1.50 -0.04 0.00 -0.40 0.00 0.00 41.96 39.87 1whz s TYR 31 CO 0.05 -0.05 -0.19 0.95 -1.57 0.00 0.00 175.55 174.74 1whz s THR 32 N -0.59 1.95 0.14 -0.71 -4.23 -0.37 -1.01 115.64 110.83 1whz s THR 32 Ca 0.09 -2.02 0.08 0.00 -1.18 0.00 0.00 61.69 58.67 1whz s THR 32 Cb -0.10 -1.95 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 1whz s THR 32 CO -0.01 -0.33 -0.11 -2.28 -0.54 0.00 0.00 174.62 171.35 1whz s HIS 33 N -2.15 2.66 0.59 3.99 2.46 -0.40 -0.50 115.29 121.94 1whz s HIS 33 Ca 0.19 -0.21 0.29 0.00 0.47 0.00 0.00 55.06 55.80 1whz s HIS 33 Cb -0.05 -1.35 1.64 0.00 -0.13 0.00 0.00 32.58 32.70 1whz s HIS 33 CO 0.08 0.46 2.07 -1.35 -2.47 0.00 0.00 174.74 173.53 1whz h PRO 34 N 3.27 0.00 -0.03 2.88 0.11 -1.89 -0.25 132.00 136.09 1whz h PRO 34 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1whz h PRO 34 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1whz h PRO 34 CO 0.52 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 1whz n ASP 35 N -3.74 0.55 0.00 -2.05 5.68 -1.26 -4.90 116.55 110.83 1whz n ASP 35 Ca 0.02 -1.31 0.00 0.00 -0.50 0.00 0.00 54.79 53.00 1whz n ASP 35 Cb 0.38 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.34 1whz n ASP 35 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1whz n GLY 36 N 1.00 0.27 3.74 6.12 0.00 -0.10 -5.08 105.19 111.14 1whz n GLY 36 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1whz n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1whz s ARG 37 N -0.91 2.93 -0.03 1.61 0.52 -1.26 -4.81 118.95 116.99 1whz s ARG 37 Ca 0.00 2.08 0.00 0.00 -0.52 0.00 0.00 55.73 57.29 1whz s ARG 37 Cb 0.00 -2.06 0.03 0.00 0.52 0.00 0.00 34.95 33.44 1whz s ARG 37 CO 0.00 -1.31 -0.00 0.42 0.02 0.00 0.00 175.30 174.43 1whz s ILE 38 N -1.40 0.21 -0.03 1.52 1.09 -1.26 -1.27 121.20 120.06 1whz s ILE 38 Ca 0.76 0.07 0.00 0.00 -1.10 0.00 0.00 60.65 60.39 1whz s ILE 38 Cb -0.37 -0.30 0.03 0.00 -1.06 0.00 0.00 42.46 40.75 1whz s ILE 38 CO 0.42 0.16 0.01 -0.69 -0.10 0.00 0.00 174.94 174.73 1whz s VAL 39 N 1.05 0.16 -0.15 2.92 1.01 -0.18 -4.73 120.40 120.49 1whz s VAL 39 Ca -0.09 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 1whz s VAL 39 Cb -0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1whz s VAL 39 CO -0.02 0.15 0.08 -0.69 0.00 0.00 0.00 175.10 174.63 1whz s VAL 40 N 1.17 4.99 -0.07 2.92 1.01 -1.26 -0.50 120.40 128.66 1whz s VAL 40 Ca -0.08 0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.95 1whz s VAL 40 Cb -0.13 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.06 1whz s VAL 40 CO -0.02 0.54 -0.14 -0.69 0.00 0.00 0.00 175.10 174.79 1whz s VAL 41 N -0.32 1.27 -0.01 2.92 1.01 -0.11 -4.88 120.40 120.27 1whz s VAL 41 Ca 0.09 -0.56 -0.22 0.00 0.00 0.00 0.00 61.98 61.29 1whz s VAL 41 Cb -0.12 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1whz s VAL 41 CO 0.01 0.38 0.66 -2.16 0.00 0.00 0.00 175.10 174.00 1whz s PRO 42 N 0.57 4.40 0.00 2.72 0.04 -1.26 -1.14 135.00 140.33 1whz s PRO 42 Ca -0.14 0.85 0.04 0.00 0.04 0.00 0.00 61.00 61.78 1whz s PRO 42 Cb -0.16 -3.38 0.09 0.00 0.04 0.00 0.00 34.50 31.10 1whz s PRO 42 CO 0.04 0.26 1.02 1.19 0.04 0.00 0.00 177.00 179.55 1whz n PHE 43 N 3.05 0.13 0.24 0.56 3.72 0.72 -4.71 117.46 121.18 1whz n PHE 43 Ca -0.04 -0.43 0.13 0.00 -0.05 0.00 0.00 57.45 57.06 1whz n PHE 43 Cb 0.51 -0.04 0.48 0.00 -0.94 0.00 0.00 39.48 39.49 1whz n PHE 43 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 1whz h HIS 44 N 0.69 0.00 -2.20 1.38 2.07 -1.92 -3.43 115.15 111.74 1whz h HIS 44 Ca 0.00 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.95 1whz h HIS 44 Cb 0.52 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 30.39 1whz h HIS 44 CO 0.07 0.11 -0.68 -1.12 -3.07 0.00 0.00 177.93 173.24 1whz s SER 45 N -6.01 4.23 0.02 3.10 0.01 -1.26 -5.04 113.70 108.75 1whz s SER 45 Ca 0.02 -0.77 0.29 0.00 1.31 0.00 0.00 55.95 56.80 1whz s SER 45 Cb 0.09 -0.67 1.20 0.00 0.21 0.00 0.00 66.02 66.85 1whz s SER 45 CO 0.61 0.01 1.92 0.61 0.41 0.00 0.00 173.24 176.80 1whz n GLY 46 N -0.81 -1.52 3.18 3.44 0.00 -1.26 -4.68 105.19 103.54 1whz n GLY 46 Ca -0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 1whz n GLY 46 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1whz s GLU 47 N -3.01 0.61 0.06 1.61 -1.05 -1.26 -4.39 118.70 111.27 1whz s GLU 47 Ca 0.14 -0.36 -0.10 0.00 -0.15 0.00 0.00 54.97 54.49 1whz s GLU 47 Cb 0.18 0.26 -0.06 0.00 -0.44 0.00 0.00 34.13 34.08 1whz s GLU 47 CO 0.54 -0.16 0.39 -0.51 0.95 0.00 0.00 175.26 176.46 1whz s LEU 48 N -1.51 4.37 0.75 1.83 1.43 -0.43 -4.92 118.68 120.20 1whz s LEU 48 Ca -0.12 0.79 -0.13 0.00 -1.03 0.00 0.00 54.13 53.64 1whz s LEU 48 Cb -0.05 -2.90 0.05 0.00 0.03 0.00 0.00 46.19 43.32 1whz s LEU 48 CO 0.02 0.20 1.15 -2.84 0.23 0.00 0.00 176.35 175.10 1whz s PRO 49 N -1.79 2.12 0.14 1.29 0.02 -1.26 -4.54 135.00 130.99 1whz s PRO 49 Ca 0.31 1.51 -0.17 0.00 0.02 0.00 0.00 61.00 62.67 1whz s PRO 49 Cb -0.14 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.53 1whz s PRO 49 CO 0.17 -1.80 1.78 -0.22 -0.33 0.00 0.00 177.00 176.60 1whz h LYS 50 N -0.66 0.34 -0.73 5.54 3.64 -1.99 -1.60 116.57 121.09 1whz h LYS 50 Ca -0.46 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1whz h LYS 50 Cb 1.27 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 1whz h LYS 50 CO 0.50 0.22 0.44 0.78 -2.27 0.00 0.00 179.45 179.12 1whz h GLY 51 N 0.35 1.06 1.29 5.01 0.00 -1.99 -0.50 103.07 108.29 1whz h GLY 51 Ca 0.13 -0.43 -0.10 0.00 0.00 0.00 0.00 47.33 46.93 1whz h GLY 51 CO -0.08 0.42 -0.11 -0.84 0.00 0.00 0.00 176.54 175.92 1whz h THR 52 N 1.01 1.26 -0.32 4.70 2.02 -1.69 0.12 112.91 120.01 1whz h THR 52 Ca 0.26 -1.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.23 1whz h THR 52 Cb -0.04 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1whz h THR 52 CO -0.05 0.41 0.14 0.15 0.37 0.00 0.00 175.52 176.55 1whz h PHE 53 N 0.75 0.48 -0.08 3.16 3.57 -0.98 0.21 116.94 124.05 1whz h PHE 53 Ca 0.12 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 1whz h PHE 53 Cb 0.62 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1whz h PHE 53 CO 0.03 0.43 -0.30 0.87 -2.23 0.00 0.00 178.31 177.11 1whz h LYS 54 N 0.38 0.15 -0.57 1.11 1.79 -0.98 -0.84 116.57 117.62 1whz h LYS 54 Ca 0.11 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.48 1whz h LYS 54 Cb 0.15 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 1whz h LYS 54 CO -0.01 0.45 0.16 -0.09 -1.08 0.00 0.00 179.45 178.88 1whz h ARG 55 N 0.14 0.89 -0.48 3.15 2.43 -0.40 -1.15 114.38 118.95 1whz h ARG 55 Ca 0.02 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 58.96 1whz h ARG 55 Cb 0.61 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 1whz h ARG 55 CO 0.04 0.82 0.17 0.82 -1.51 0.00 0.00 179.97 180.31 1whz h ILE 56 N 0.80 1.22 -0.63 1.20 2.04 -0.39 0.17 117.51 121.91 1whz h ILE 56 Ca 0.18 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1whz h ILE 56 Cb 0.31 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1whz h ILE 56 CO -0.00 0.26 0.38 -0.07 0.00 0.00 0.00 178.15 178.72 1whz h LEU 57 N 0.63 0.76 0.04 1.44 3.38 -1.06 0.16 115.31 120.66 1whz h LEU 57 Ca 0.16 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1whz h LEU 57 Cb 0.23 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1whz h LEU 57 CO -0.01 0.60 -0.15 -0.09 0.09 0.00 0.00 178.44 178.87 1whz h ARG 58 N 0.86 -0.26 0.00 1.13 2.43 -0.79 -1.04 114.38 116.70 1whz h ARG 58 Ca 0.23 0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1whz h ARG 58 Cb -0.02 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1whz h ARG 58 CO -0.04 -0.18 -0.46 -0.44 -1.51 0.00 0.00 179.97 177.34 1whz h ASP 59 N -0.27 0.00 0.56 -3.80 3.32 -0.78 -2.26 116.42 113.18 1whz h ASP 59 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1whz h ASP 59 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1whz h ASP 59 CO -0.12 0.46 0.00 0.00 -1.72 0.00 0.00 179.24 177.86 1whz n ALA 60 N -2.45 2.41 -2.60 3.45 0.00 0.55 -4.32 120.51 117.55 1whz n ALA 60 Ca -0.02 -0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.16 1whz n ALA 60 Cb 0.48 -1.46 0.02 0.00 0.00 0.00 0.00 19.45 18.48 1whz n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1whz n GLY 61 N 1.16 -0.05 3.61 0.00 0.00 -0.56 -5.00 105.19 104.34 1whz n GLY 61 Ca 0.13 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 1whz n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1whz s LEU 62 N -4.01 3.14 0.50 0.99 1.43 -0.50 -5.05 118.68 115.18 1whz s LEU 62 Ca 0.14 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 1whz s LEU 62 Cb -0.06 -1.84 0.03 0.00 0.03 0.00 0.00 46.19 44.35 1whz s LEU 62 CO 0.17 0.11 0.69 0.42 0.23 0.00 0.00 176.35 177.98 1whz s THR 63 N -1.61 2.77 0.18 5.49 -4.23 -1.26 -4.63 115.64 112.35 1whz s THR 63 Ca 0.25 -0.83 -0.11 0.00 -1.18 0.00 0.00 61.69 59.82 1whz s THR 63 Cb -0.10 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.89 1whz s THR 63 CO 0.16 0.00 1.75 -0.33 -0.54 0.00 0.00 174.62 175.66 1whz h GLU 64 N 0.31 0.92 -0.34 3.99 4.39 -1.99 -1.09 114.58 120.78 1whz h GLU 64 Ca -0.40 -0.16 0.05 0.00 0.34 0.00 0.00 59.36 59.19 1whz h GLU 64 Cb 1.29 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 29.74 1whz h GLU 64 CO 0.48 0.77 0.08 1.49 -1.16 0.00 0.00 179.01 180.67 1whz h GLU 65 N 0.87 0.20 -0.63 2.33 4.81 -2.00 -0.21 114.58 119.95 1whz h GLU 65 Ca 0.21 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1whz h GLU 65 Cb 0.17 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1whz h GLU 65 CO -0.02 0.13 0.15 0.93 -0.73 0.00 0.00 179.01 179.47 1whz h GLU 66 N 0.21 1.02 -0.07 1.92 5.08 -1.89 -2.28 114.58 118.56 1whz h GLU 66 Ca 0.16 -0.25 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1whz h GLU 66 Cb 0.17 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1whz h GLU 66 CO -0.20 0.93 -0.07 0.35 -1.00 0.00 0.00 179.01 179.03 1whz h PHE 67 N 0.94 -0.16 0.00 4.33 3.57 -0.67 -2.92 116.94 122.03 1whz h PHE 67 Ca 0.20 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1whz h PHE 67 Cb 0.37 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 1whz h PHE 67 CO 0.03 -0.10 -0.12 0.45 -2.23 0.00 0.00 178.31 176.33 1whz h HIS 68 N -0.08 0.00 -0.00 0.41 3.86 -0.81 -2.67 115.15 115.85 1whz h HIS 68 Ca 0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1whz h HIS 68 Cb 0.16 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.63 1whz h HIS 68 CO -0.17 0.12 -0.08 0.09 0.86 0.00 0.00 177.93 178.76 1whz n ASN 69 N -4.00 0.23 -0.25 2.45 3.02 -0.88 -5.12 115.26 110.71 1whz n ASN 69 Ca -0.02 -0.26 0.15 0.00 -0.03 0.00 0.00 54.58 54.42 1whz n ASN 69 Cb 0.21 -0.19 0.73 0.00 -0.61 0.00 0.00 39.78 39.92 1whz n ASN 69 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82