#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iml s LYS 2 N 0.00 0.24 0.02 -0.52 2.36 -1.26 -4.00 119.74 116.57 1iml s LYS 2 Ca 0.00 0.19 -0.29 0.00 -2.55 0.00 0.00 55.97 53.32 1iml s LYS 2 Cb 0.00 0.11 -0.04 0.00 -1.05 0.00 0.00 37.83 36.86 1iml s LYS 2 CO 0.00 -0.05 0.94 0.00 1.55 0.00 0.00 175.35 177.80 1iml h PRO 4 N 6.51 0.00 0.00 0.00 0.11 -1.89 -3.28 132.00 133.45 1iml h PRO 4 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1iml h PRO 4 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1iml h PRO 4 CO 0.74 0.00 0.00 1.17 -0.21 0.00 0.00 178.00 179.70 1iml n LYS 5 N -2.43 0.00 0.05 1.05 4.81 -1.26 -4.61 118.16 115.78 1iml n LYS 5 Ca 0.01 0.08 0.05 0.00 -0.87 0.00 0.00 58.31 57.58 1iml n LYS 5 Cb 0.22 -0.52 -0.06 0.00 0.02 0.00 0.00 35.03 34.68 1iml n LYS 5 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1iml n ASP 7 N -2.73 -3.08 -4.42 0.00 2.03 -1.24 -5.10 116.55 102.02 1iml n ASP 7 Ca -0.06 -0.22 -0.26 0.00 0.52 0.00 0.00 54.79 54.77 1iml n ASP 7 Cb 0.71 -1.98 -0.09 0.00 -0.72 0.00 0.00 41.12 39.04 1iml n ASP 7 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1iml s LYS 8 N -3.70 1.90 0.20 -0.67 2.20 -1.26 -4.97 119.74 113.43 1iml s LYS 8 Ca 0.11 -2.14 -0.07 0.00 -0.36 0.00 0.00 55.97 53.51 1iml s LYS 8 Cb -0.01 -1.01 -0.06 0.00 -1.51 0.00 0.00 37.83 35.24 1iml s LYS 8 CO 0.23 -0.31 0.47 -1.21 -0.36 0.00 0.00 175.35 174.17 1iml s GLU 9 N -3.80 3.70 -0.29 4.03 0.41 -1.26 0.27 118.70 121.76 1iml s GLU 9 Ca 0.25 0.08 -0.05 0.00 -0.41 0.00 0.00 54.97 54.84 1iml s GLU 9 Cb 0.05 -2.74 0.02 0.00 -1.78 0.00 0.00 34.13 29.69 1iml s GLU 9 CO 0.13 0.38 0.03 0.08 -0.49 0.00 0.00 175.26 175.38 1iml s VAL 10 N -1.77 3.48 1.09 2.63 1.01 -1.26 -4.89 120.40 120.69 1iml s VAL 10 Ca 0.44 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 1iml s VAL 10 Cb -0.12 -2.84 0.24 0.00 0.00 0.00 0.00 36.38 33.67 1iml s VAL 10 CO 0.24 0.06 1.06 -0.47 0.00 0.00 0.00 175.10 175.98 1iml s TYR 11 N 1.40 1.74 0.00 5.22 5.04 -1.26 -4.77 117.35 124.71 1iml s TYR 11 Ca 0.00 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 55.66 1iml s TYR 11 Cb -0.18 -3.19 0.00 0.00 0.35 0.00 0.00 41.96 38.94 1iml s TYR 11 CO -0.00 -3.40 0.35 1.19 -1.34 0.00 0.00 175.55 172.35 1iml n PHE 12 N -4.55 0.00 0.47 4.97 3.72 -1.26 -2.94 117.46 117.87 1iml n PHE 12 Ca 0.04 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.52 1iml n PHE 12 Cb 0.56 0.00 0.34 0.00 -0.94 0.00 0.00 39.48 39.44 1iml n PHE 12 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1iml n ALA 13 N -1.05 1.65 -1.71 4.37 0.00 -1.26 0.97 120.51 123.48 1iml n ALA 13 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 53.44 53.07 1iml n ALA 13 Cb 0.00 -1.26 0.05 0.00 0.00 0.00 0.00 19.45 18.24 1iml n ALA 13 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1iml n GLU 14 N -1.65 2.87 -4.16 0.00 1.02 -1.24 -4.97 120.64 112.51 1iml n GLU 14 Ca 0.03 -3.57 -0.29 0.00 -0.02 0.00 0.00 57.16 53.31 1iml n GLU 14 Cb 0.18 -2.28 -0.08 0.00 -0.02 0.00 0.00 31.44 29.24 1iml n GLU 14 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1iml s ARG 15 N -3.87 2.47 0.03 3.49 1.70 0.27 -3.25 118.95 119.79 1iml s ARG 15 Ca 0.57 -0.94 0.02 0.00 -0.47 0.00 0.00 55.73 54.91 1iml s ARG 15 Cb 0.46 -2.47 -0.02 0.00 -0.57 0.00 0.00 34.95 32.36 1iml s ARG 15 CO -0.17 0.51 -0.06 0.14 -1.08 0.00 0.00 175.30 174.64 1iml s VAL 16 N -1.43 0.44 -0.08 4.99 -7.23 -0.19 -4.83 120.40 112.08 1iml s VAL 16 Ca 0.26 -0.84 0.03 0.00 -1.81 0.00 0.00 61.98 59.62 1iml s VAL 16 Cb -0.11 -0.49 -0.02 0.00 0.56 0.00 0.00 36.38 36.33 1iml s VAL 16 CO 0.18 -0.28 -0.18 -0.89 -0.31 0.00 0.00 175.10 173.62 1iml s THR 17 N -1.08 2.70 -0.30 5.32 2.01 -1.26 0.98 115.64 124.01 1iml s THR 17 Ca -0.08 -0.83 -0.18 0.00 0.31 0.00 0.00 61.69 60.91 1iml s THR 17 Cb -0.08 -2.06 0.20 0.00 0.01 0.00 0.00 72.50 70.57 1iml s THR 17 CO 0.00 0.56 1.26 -0.55 -0.69 0.00 0.00 174.62 175.20 1iml s SER 18 N -0.20 -0.10 -1.67 3.53 0.15 -1.24 -4.92 113.70 109.24 1iml s SER 18 Ca -0.01 0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.76 1iml s SER 18 Cb -0.13 1.09 0.00 0.00 -1.71 0.00 0.00 66.02 65.27 1iml s SER 18 CO 0.03 -0.02 0.28 0.18 1.20 0.00 0.00 173.24 174.92 1iml n LEU 19 N 4.03 -2.30 -1.03 3.45 7.99 -1.26 -3.02 117.00 124.86 1iml n LEU 19 Ca -0.11 -0.14 -0.13 0.00 -0.01 0.00 0.00 56.01 55.61 1iml n LEU 19 Cb 0.56 -2.95 -0.06 0.00 -0.11 0.00 0.00 43.42 40.86 1iml n LEU 19 CO -0.01 -0.01 -0.13 0.61 -1.51 0.00 0.00 177.39 176.35 1iml n GLY 20 N -1.26 1.39 2.87 -0.72 0.00 -1.26 -4.95 105.19 101.25 1iml n GLY 20 Ca -0.18 -0.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 1iml n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iml s LYS 21 N -3.07 0.05 1.20 1.61 1.02 -1.17 -5.13 119.74 114.25 1iml s LYS 21 Ca 0.00 0.36 -0.19 0.00 0.02 0.00 0.00 55.97 56.15 1iml s LYS 21 Cb 0.00 -0.22 0.29 0.00 -0.52 0.00 0.00 37.83 37.37 1iml s LYS 21 CO 0.00 -0.19 1.11 -0.51 -0.92 0.00 0.00 175.35 174.84 1iml s ASP 22 N 1.35 0.93 0.34 2.83 1.11 -1.26 -3.69 116.67 118.26 1iml s ASP 22 Ca -0.07 0.63 -0.01 0.00 0.18 0.00 0.00 52.55 53.29 1iml s ASP 22 Cb -0.12 -0.88 -0.00 0.00 1.07 0.00 0.00 42.92 42.99 1iml s ASP 22 CO -0.05 -4.12 0.43 0.26 1.18 0.00 0.00 175.17 172.87 1iml s TRP 23 N -3.01 1.18 -0.09 4.23 0.52 0.28 -4.08 118.94 117.95 1iml s TRP 23 Ca 0.71 -1.35 -0.08 0.00 0.02 0.00 0.00 56.10 55.39 1iml s TRP 23 Cb -0.10 -0.20 -0.04 0.00 -1.15 0.00 0.00 33.47 31.98 1iml s TRP 23 CO 0.56 -1.08 0.19 -1.01 0.02 0.00 0.00 176.95 175.64 1iml s HIS 24 N -3.17 3.62 0.13 -1.98 3.76 -1.26 -1.02 115.29 115.37 1iml s HIS 24 Ca 0.32 0.61 -0.18 0.00 -0.15 0.00 0.00 55.06 55.66 1iml s HIS 24 Cb 0.00 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.66 1iml s HIS 24 CO 0.21 0.72 1.74 -0.09 -0.85 0.00 0.00 174.74 176.47 1iml h ARG 25 N 4.89 0.43 -1.04 1.40 2.43 -1.87 -0.74 114.38 119.88 1iml h ARG 25 Ca -0.54 -0.05 0.26 0.00 -0.81 0.00 0.00 59.98 58.85 1iml h ARG 25 Cb 1.23 -0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.59 1iml h ARG 25 CO 0.59 0.35 0.65 -1.35 -1.51 0.00 0.00 179.97 178.71 1iml h PRO 26 N 0.38 0.42 0.11 0.20 0.11 -1.94 -3.24 132.00 128.04 1iml h PRO 26 Ca 0.11 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1iml h PRO 26 Cb 0.05 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1iml h PRO 26 CO -0.02 0.28 -0.05 0.00 -0.21 0.00 0.00 178.00 178.00 1iml s LEU 28 N -8.70 2.82 0.41 0.00 2.96 -0.74 -4.86 118.68 110.57 1iml s LEU 28 Ca -0.04 -0.08 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1iml s LEU 28 Cb -0.00 -2.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 1iml s LEU 28 CO 0.15 -3.95 0.11 -0.54 -1.32 0.00 0.00 176.35 170.80 1iml s LYS 29 N 8.80 1.92 1.11 1.98 1.02 -1.26 -1.83 119.74 131.47 1iml s LYS 29 Ca 0.91 -2.16 -0.12 0.00 0.02 0.00 0.00 55.97 54.61 1iml s LYS 29 Cb -0.12 -0.71 0.25 0.00 -0.52 0.00 0.00 37.83 36.73 1iml s LYS 29 CO 0.09 -0.43 1.04 0.00 -0.92 0.00 0.00 175.35 175.12 1iml n GLU 31 N -4.75 0.63 0.01 0.00 -0.58 -1.00 -4.63 120.64 110.31 1iml n GLU 31 Ca 0.05 -2.17 -0.02 0.00 -0.42 0.00 0.00 57.16 54.61 1iml n GLU 31 Cb 0.53 -0.81 -0.01 0.00 -0.57 0.00 0.00 31.44 30.59 1iml n GLU 31 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1iml n LYS 32 N -0.39 0.10 -0.04 3.49 3.00 -1.26 -4.94 118.16 118.12 1iml n LYS 32 Ca 0.10 0.04 -0.21 0.00 -0.00 0.00 0.00 58.31 58.23 1iml n LYS 32 Cb 0.83 -0.55 -0.13 0.00 0.00 0.00 0.00 35.03 35.18 1iml n LYS 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iml n GLY 34 N 1.91 0.88 3.08 0.00 0.00 -1.26 -5.11 105.19 104.69 1iml n GLY 34 Ca -0.35 -0.81 -0.17 0.00 0.00 0.00 0.00 46.02 44.69 1iml n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iml s LYS 35 N -1.98 0.73 0.39 1.61 -0.14 -1.26 -4.98 119.74 114.10 1iml s LYS 35 Ca 0.00 -0.60 -0.26 0.00 -1.36 0.00 0.00 55.97 53.76 1iml s LYS 35 Cb 0.00 -0.67 -0.09 0.00 -1.68 0.00 0.00 37.83 35.40 1iml s LYS 35 CO 0.00 0.16 1.16 0.99 -0.76 0.00 0.00 175.35 176.91 1iml s THR 36 N -0.76 3.20 0.00 2.17 2.01 -1.26 -0.49 115.64 120.51 1iml s THR 36 Ca -0.01 1.02 0.00 0.00 0.31 0.00 0.00 61.69 63.02 1iml s THR 36 Cb -0.07 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.86 1iml s THR 36 CO 0.01 0.11 0.00 0.18 -0.69 0.00 0.00 174.62 174.22 1iml n LEU 37 N 0.19 0.00 -1.05 4.42 4.77 -0.76 -4.84 117.00 119.73 1iml n LEU 37 Ca 0.04 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.15 1iml n LEU 37 Cb 0.46 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 1iml n LEU 37 CO 0.51 -0.22 -0.32 0.41 -1.33 0.00 0.00 177.39 176.43 1iml n THR 38 N -0.45 0.00 -1.41 -5.08 -1.04 -1.26 -4.87 114.28 100.17 1iml n THR 38 Ca 0.00 0.33 -0.14 0.00 -2.04 0.00 0.00 64.05 62.19 1iml n THR 38 Cb 0.00 -0.68 -0.06 0.00 -1.82 0.00 0.00 70.33 67.77 1iml n THR 38 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1iml n SER 39 N -3.78 -5.08 0.00 8.00 7.64 -1.26 -4.69 113.62 114.45 1iml n SER 39 Ca -0.03 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.21 1iml n SER 39 Cb 0.49 -3.84 0.00 0.00 -1.01 0.00 0.00 64.21 59.85 1iml n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1iml n GLY 40 N -0.75 -0.11 3.43 0.23 0.00 -1.26 -5.05 105.19 101.68 1iml n GLY 40 Ca -0.14 0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1iml n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iml n GLY 41 N 0.00 -0.67 0.22 -0.02 0.00 -1.26 -4.77 105.19 98.70 1iml n GLY 41 Ca 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 46.02 46.29 1iml n GLY 41 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1iml n HIS 42 N -3.85 -2.17 -4.35 1.61 -0.00 -1.26 -4.43 115.22 100.77 1iml n HIS 42 Ca -0.20 -0.06 -0.20 0.00 -0.00 0.00 0.00 57.72 57.26 1iml n HIS 42 Cb 0.65 -0.09 -0.09 0.00 -0.00 0.00 0.00 29.99 30.46 1iml n HIS 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1iml s ALA 43 N -2.05 2.08 -0.24 1.59 0.00 0.27 -4.71 121.76 118.70 1iml s ALA 43 Ca 0.05 -1.73 -0.26 0.00 0.00 0.00 0.00 51.96 50.02 1iml s ALA 43 Cb -0.01 1.15 0.07 0.00 0.00 0.00 0.00 23.12 24.33 1iml s ALA 43 CO 0.04 -0.51 0.73 -1.83 0.00 0.00 0.00 175.76 174.19 1iml s GLU 44 N -3.74 0.85 -0.12 0.00 4.04 -1.26 0.98 118.70 119.44 1iml s GLU 44 Ca 0.35 0.87 -0.11 0.00 0.04 0.00 0.00 54.97 56.11 1iml s GLU 44 Cb 0.04 0.41 -0.26 0.00 0.02 0.00 0.00 34.13 34.35 1iml s GLU 44 CO 0.19 -0.13 0.42 0.45 -1.84 0.00 0.00 175.26 174.34 1iml h HIS 45 N 4.66 0.44 0.00 4.83 3.86 -1.85 -3.45 115.15 123.64 1iml h HIS 45 Ca -0.29 -0.32 -0.12 0.00 -1.16 0.00 0.00 60.37 58.48 1iml h HIS 45 Cb 1.16 -0.02 -0.10 0.00 1.06 0.00 0.00 27.41 29.51 1iml h HIS 45 CO 0.38 1.69 -0.04 -0.85 0.86 0.00 0.00 177.93 179.97 1iml n GLU 46 N -3.72 0.59 -0.84 2.45 -0.00 -1.26 -4.92 120.64 112.94 1iml n GLU 46 Ca -0.30 -0.98 0.00 0.00 -0.00 0.00 0.00 57.16 55.88 1iml n GLU 46 Cb 0.97 0.04 0.00 0.00 -0.00 0.00 0.00 31.44 32.45 1iml n GLU 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1iml n GLY 47 N -0.60 0.59 2.55 -1.84 0.00 -1.26 -5.05 105.19 99.58 1iml n GLY 47 Ca -0.16 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 44.82 1iml n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iml s LYS 48 N -1.73 0.35 0.48 1.61 1.02 -1.26 -4.19 119.74 116.02 1iml s LYS 48 Ca 0.00 -0.78 -0.24 0.00 0.02 0.00 0.00 55.97 54.97 1iml s LYS 48 Cb 0.00 -1.13 -0.07 0.00 -0.52 0.00 0.00 37.83 36.11 1iml s LYS 48 CO 0.00 -1.10 1.34 -1.25 -0.92 0.00 0.00 175.35 173.43 1iml s PRO 49 N 1.74 3.57 0.19 -1.68 0.04 -1.26 -2.53 135.00 135.07 1iml s PRO 49 Ca 0.13 2.21 0.01 0.00 0.04 0.00 0.00 61.00 63.39 1iml s PRO 49 Cb -0.18 -2.51 -0.00 0.00 0.04 0.00 0.00 34.50 31.85 1iml s PRO 49 CO -0.22 -0.84 0.04 0.66 0.04 0.00 0.00 177.00 176.68 1iml n TYR 50 N -0.45 0.23 -0.03 0.56 4.02 0.27 -2.38 117.16 119.39 1iml n TYR 50 Ca 0.07 -1.11 -0.03 0.00 -0.01 0.00 0.00 57.90 56.82 1iml n TYR 50 Cb 0.44 -0.06 0.03 0.00 -0.02 0.00 0.00 39.34 39.74 1iml n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1iml n ASN 52 N -3.16 2.73 -3.64 0.00 2.85 -1.26 -2.23 115.26 110.55 1iml n ASN 52 Ca 0.01 -0.02 -0.14 0.00 -0.11 0.00 0.00 54.58 54.33 1iml n ASN 52 Cb 0.06 0.49 -0.07 0.00 1.24 0.00 0.00 39.78 41.50 1iml n ASN 52 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1iml s HIS 53 N -2.24 1.09 -0.05 1.20 3.76 -1.26 -2.54 115.29 115.25 1iml s HIS 53 Ca -0.08 -1.28 0.25 0.00 -0.15 0.00 0.00 55.06 53.80 1iml s HIS 53 Cb 0.03 -0.27 1.37 0.00 1.11 0.00 0.00 32.58 34.82 1iml s HIS 53 CO 0.37 -0.94 1.77 -1.00 -0.85 0.00 0.00 174.74 174.09 1iml h PRO 54 N 2.27 0.00 0.02 8.40 0.13 -2.00 -3.44 132.00 137.37 1iml h PRO 54 Ca -0.29 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1iml h PRO 54 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1iml h PRO 54 CO 0.41 0.00 -0.04 0.00 -0.23 0.00 0.00 178.00 178.14 1iml h TYR 56 N -0.08 1.01 0.00 0.00 3.20 -1.74 -1.99 116.97 117.36 1iml h TYR 56 Ca 0.01 -0.28 -0.01 0.00 3.14 0.00 0.00 58.73 61.59 1iml h TYR 56 Cb 0.09 -0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.14 1iml h TYR 56 CO -0.11 1.07 -0.06 1.03 -1.64 0.00 0.00 178.16 178.45 1iml h SER 57 N 0.66 0.00 -0.62 -2.11 0.87 -1.35 -0.71 113.55 110.29 1iml h SER 57 Ca 0.07 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 1iml h SER 57 Cb 0.85 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.78 1iml h SER 57 CO 0.07 0.06 0.36 0.00 -0.53 0.00 0.00 176.83 176.80 1iml h ALA 58 N 1.94 0.79 0.13 6.23 0.00 -0.28 -2.99 119.26 125.07 1iml h ALA 58 Ca -0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.52 1iml h ALA 58 Cb 0.49 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1iml h ALA 58 CO 0.01 0.27 -1.58 0.52 0.00 0.00 0.00 179.25 178.47 1iml h MET 59 N 0.83 0.27 -4.70 0.00 2.86 -1.63 -3.45 114.93 109.11 1iml h MET 59 Ca 0.22 -0.46 -0.70 0.00 -2.06 0.00 0.00 59.70 56.70 1iml h MET 59 Cb -0.01 0.17 -0.20 0.00 0.06 0.00 0.00 31.60 31.63 1iml h MET 59 CO -0.04 1.22 0.05 -0.06 1.06 0.00 0.00 176.91 179.14 1iml s PHE 60 N -2.51 3.04 0.00 -0.22 0.40 -0.28 -4.80 117.98 113.62 1iml s PHE 60 Ca -0.20 -0.86 0.00 0.00 -0.60 0.00 0.00 56.93 55.27 1iml s PHE 60 Cb 0.05 -3.81 0.00 0.00 0.51 0.00 0.00 43.02 39.77 1iml s PHE 60 CO 0.78 -1.17 0.00 0.41 0.70 0.00 0.00 175.22 175.94 1iml n GLY 61 N 5.24 0.05 0.00 4.36 0.00 -1.25 -4.17 105.19 109.42 1iml n GLY 61 Ca -0.09 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1iml n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1iml n PRO 62 N 0.00 1.86 -3.12 1.61 -0.05 -1.26 -5.06 135.00 128.98 1iml n PRO 62 Ca 0.00 0.00 -0.04 0.00 -0.05 0.00 0.00 63.50 63.41 1iml n PRO 62 Cb 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 33.50 33.43 1iml n PRO 62 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 175.50 173.86 1iml s LYS 63 N 0.00 0.86 0.00 0.54 -2.85 -1.26 -5.13 119.74 111.91 1iml s LYS 63 Ca 0.00 -0.65 0.00 0.00 -1.00 0.00 0.00 55.97 54.32 1iml s LYS 63 Cb 0.00 -0.13 0.00 0.00 -2.06 0.00 0.00 37.83 35.64 1iml s LYS 63 CO 0.00 -1.24 0.00 0.41 0.10 0.00 0.00 175.35 174.62 1iml n GLY 64 N 3.93 4.52 5.21 0.59 0.00 -1.26 -4.99 105.19 113.19 1iml n GLY 64 Ca 0.14 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1iml n GLY 64 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1iml n PHE 65 N 0.00 0.00 -0.55 1.61 3.72 -1.26 -4.43 117.46 116.55 1iml n PHE 65 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1iml n PHE 65 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1iml n PHE 65 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iml n GLY 66 N 0.00 2.32 3.65 1.37 0.00 -1.26 -5.17 105.19 106.11 1iml n GLY 66 Ca 0.00 -1.81 -0.03 0.00 0.00 0.00 0.00 46.02 44.18 1iml n GLY 66 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1iml s ARG 67 N 4.39 0.09 0.00 1.61 6.06 -1.26 -5.03 118.95 124.81 1iml s ARG 67 Ca 0.00 0.11 0.00 0.00 -2.50 0.00 0.00 55.73 53.34 1iml s ARG 67 Cb 0.00 0.04 0.00 0.00 0.06 0.00 0.00 34.95 35.05 1iml s ARG 67 CO 0.00 -0.01 0.00 0.41 -2.50 0.00 0.00 175.30 173.20 1iml n GLY 68 N 1.69 1.06 2.31 8.12 0.00 -1.26 -5.08 105.19 112.03 1iml n GLY 68 Ca -0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1iml n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iml n GLY 69 N -0.05 3.71 3.65 -0.02 0.00 -1.26 -4.87 105.19 106.35 1iml n GLY 69 Ca 0.00 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.49 1iml n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iml s ALA 70 N -1.71 3.59 0.00 4.61 0.00 -1.26 -4.66 121.76 122.33 1iml s ALA 70 Ca 0.37 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1iml s ALA 70 Cb 0.15 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1iml s ALA 70 CO -0.07 -1.28 0.00 -1.91 0.00 0.00 0.00 175.76 172.50 1iml n GLU 71 N 6.65 0.00 0.00 0.00 4.07 -1.26 -3.91 120.64 126.19 1iml n GLU 71 Ca 0.13 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.23 1iml n GLU 71 Cb 0.46 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.84 1iml n GLU 71 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1iml n SER 72 N 0.91 0.00 -1.36 4.31 2.88 -1.26 -5.16 113.62 113.93 1iml n SER 72 Ca 0.00 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.72 1iml n SER 72 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1iml n SER 72 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1iml n HIS 73 N -0.56 -3.47 0.18 0.66 8.25 -1.25 -4.40 115.22 114.62 1iml n HIS 73 Ca 0.00 1.77 0.07 0.00 -0.26 0.00 0.00 57.72 59.30 1iml n HIS 73 Cb 0.00 -3.15 0.12 0.00 1.12 0.00 0.00 29.99 28.07 1iml n HIS 73 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1iml h THR 74 N -1.28 0.50 -3.98 1.59 1.03 -1.98 -3.47 112.91 105.32 1iml h THR 74 Ca -0.02 -1.66 -0.52 0.00 -0.01 0.00 0.00 66.41 64.20 1iml h THR 74 Cb 1.26 2.21 0.07 0.00 -1.07 0.00 0.00 68.15 70.62 1iml h THR 74 CO 0.03 0.28 0.53 0.12 -0.01 0.00 0.00 175.52 176.46 1iml s PHE 75 N -3.11 2.86 0.00 0.00 5.36 -1.26 -5.22 117.98 116.60 1iml s PHE 75 Ca 0.05 1.50 0.00 0.00 -0.96 0.00 0.00 56.93 57.52 1iml s PHE 75 Cb 0.07 -3.49 0.00 0.00 -0.34 0.00 0.00 43.02 39.26 1iml s PHE 75 CO 0.71 -1.72 0.00 1.17 -1.46 0.00 0.00 175.22 173.92