#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 0.86 -0.18 0.54 1.02 -1.26 -2.23 119.74 118.48 1iml s LYS 2 Ca 0.00 -1.21 -0.24 0.00 0.02 0.00 0.00 55.97 54.54 1iml s LYS 2 Cb 0.00 -0.47 -0.02 0.00 -0.52 0.00 0.00 37.83 36.83 1iml s LYS 2 CO 0.00 0.06 0.76 0.00 -0.92 0.00 0.00 175.35 175.25 1iml h PRO 4 N 7.41 0.04 0.04 0.00 0.14 -1.89 -1.18 132.00 136.56 1iml h PRO 4 Ca -0.29 -0.01 -0.00 0.00 0.14 0.00 0.00 66.00 65.84 1iml h PRO 4 Cb 1.13 -0.01 0.00 0.00 0.14 0.00 0.00 31.00 32.27 1iml h PRO 4 CO 0.82 0.16 -0.02 -0.22 0.14 0.00 0.00 178.00 178.88 1iml h LYS 5 N 0.04 -0.05 0.00 0.86 3.11 -1.92 -3.42 116.57 115.19 1iml h LYS 5 Ca 0.01 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.76 1iml h LYS 5 Cb 0.23 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.46 1iml h LYS 5 CO 0.02 -0.03 -1.95 0.00 -2.81 0.00 0.00 179.45 174.67 1iml n ASP 7 N -2.45 -3.60 -2.32 0.00 8.00 -0.45 -5.06 116.55 110.67 1iml n ASP 7 Ca -0.10 -0.25 -0.06 0.00 0.71 0.00 0.00 54.79 55.08 1iml n ASP 7 Cb 0.71 -2.18 -0.01 0.00 -0.02 0.00 0.00 41.12 39.62 1iml n ASP 7 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1iml n LYS 8 N -2.11 1.36 -3.95 -1.24 4.01 -1.26 -4.91 118.16 110.06 1iml n LYS 8 Ca -0.03 -0.77 -0.28 0.00 -0.51 0.00 0.00 58.31 56.72 1iml n LYS 8 Cb 0.54 0.30 -0.04 0.00 -0.51 0.00 0.00 35.03 35.32 1iml n LYS 8 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 1iml s GLU 9 N -2.37 3.37 -0.24 1.97 8.01 -1.26 0.59 118.70 128.76 1iml s GLU 9 Ca 0.02 -0.57 0.01 0.00 0.01 0.00 0.00 54.97 54.43 1iml s GLU 9 Cb 0.00 -2.95 0.04 0.00 -4.31 0.00 0.00 34.13 26.91 1iml s GLU 9 CO 0.01 0.55 -0.10 0.08 0.01 0.00 0.00 175.26 175.81 1iml s VAL 10 N -1.65 2.43 0.65 2.63 1.01 -0.95 -4.87 120.40 119.65 1iml s VAL 10 Ca 0.34 -1.30 -0.09 0.00 0.00 0.00 0.00 61.98 60.92 1iml s VAL 10 Cb -0.12 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.98 1iml s VAL 10 CO 0.28 0.14 1.02 -0.72 0.00 0.00 0.00 175.10 175.81 1iml s TYR 11 N 1.22 3.35 0.07 5.22 -0.85 -1.26 -4.82 117.35 120.28 1iml s TYR 11 Ca -0.03 0.94 -0.37 0.00 -0.52 0.00 0.00 57.07 57.10 1iml s TYR 11 Cb -0.18 -2.90 -0.19 0.00 0.38 0.00 0.00 41.96 39.07 1iml s TYR 11 CO -0.06 -0.98 1.58 0.74 -1.52 0.00 0.00 175.55 175.30 1iml h PHE 12 N -0.44 -1.27 0.00 -3.49 -1.00 -1.98 0.04 116.94 108.80 1iml h PHE 12 Ca -0.45 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.32 1iml h PHE 12 Cb 1.24 0.45 0.00 0.00 3.61 0.00 0.00 35.95 41.25 1iml h PHE 12 CO 0.51 -0.71 0.00 0.00 -1.61 0.00 0.00 178.31 176.50 1iml n ALA 13 N -2.71 2.14 -1.95 2.45 0.00 -1.26 0.58 120.51 119.77 1iml n ALA 13 Ca -0.15 -0.06 -0.33 0.00 0.00 0.00 0.00 53.44 52.90 1iml n ALA 13 Cb 0.49 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.70 3.04 -5.09 0.00 1.02 -0.56 -4.93 120.64 112.43 1iml n GLU 14 Ca 0.06 -3.82 -0.31 0.00 -0.02 0.00 0.00 57.16 53.06 1iml n GLU 14 Cb 0.32 -2.27 -0.15 0.00 -0.02 0.00 0.00 31.44 29.32 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 -3.81 2.11 -0.03 3.49 1.70 0.20 -3.86 118.95 118.75 1iml s ARG 15 Ca 0.54 -0.93 0.01 0.00 -0.47 0.00 0.00 55.73 54.88 1iml s ARG 15 Cb 0.44 -2.10 0.02 0.00 -0.57 0.00 0.00 34.95 32.74 1iml s ARG 15 CO -0.20 0.56 -0.02 0.14 -1.08 0.00 0.00 175.30 174.71 1iml s VAL 16 N -0.70 0.29 -0.01 4.99 -7.23 0.12 -4.90 120.40 112.96 1iml s VAL 16 Ca 0.11 -0.01 -0.06 0.00 -1.81 0.00 0.00 61.98 60.21 1iml s VAL 16 Cb -0.10 -0.34 -0.05 0.00 0.56 0.00 0.00 36.38 36.45 1iml s VAL 16 CO 0.00 0.15 0.25 -0.89 -0.31 0.00 0.00 175.10 174.31 1iml s THR 17 N 0.80 5.33 -0.29 5.32 2.01 -1.26 0.59 115.64 128.14 1iml s THR 17 Ca -0.09 0.15 -0.16 0.00 0.31 0.00 0.00 61.69 61.90 1iml s THR 17 Cb -0.12 -3.55 0.16 0.00 0.01 0.00 0.00 72.50 69.00 1iml s THR 17 CO -0.01 0.39 1.04 -0.55 -0.69 0.00 0.00 174.62 174.80 1iml s SER 18 N -1.65 -0.41 -1.12 3.53 0.15 -0.93 -4.84 113.70 108.43 1iml s SER 18 Ca 0.26 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.56 1iml s SER 18 Cb -0.13 1.16 0.00 0.00 -1.71 0.00 0.00 66.02 65.34 1iml s SER 18 CO 0.15 -0.10 0.00 0.18 1.20 0.00 0.00 173.24 174.67 1iml n LEU 19 N 3.55 -0.28 0.00 3.45 7.99 -1.26 -2.08 117.00 128.37 1iml n LEU 19 Ca -0.18 0.26 0.00 0.00 -0.01 0.00 0.00 56.01 56.08 1iml n LEU 19 Cb 0.57 -2.67 0.00 0.00 -0.11 0.00 0.00 43.42 41.21 1iml n LEU 19 CO 0.03 -1.04 0.00 0.61 -1.51 0.00 0.00 177.39 175.48 1iml n GLY 20 N 0.27 3.25 3.57 -0.72 0.00 -1.26 -5.01 105.19 105.29 1iml n GLY 20 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.54 2.70 1.01 1.61 3.01 -0.88 -4.90 119.74 121.76 1iml s LYS 21 Ca 0.00 -0.58 -0.17 0.00 -1.01 0.00 0.00 55.97 54.21 1iml s LYS 21 Cb 0.00 -2.55 0.22 0.00 -1.01 0.00 0.00 37.83 34.48 1iml s LYS 21 CO 0.00 0.65 1.28 -0.51 0.51 0.00 0.00 175.35 177.28 1iml s ASP 22 N -0.85 2.64 0.26 2.83 1.01 -1.26 -2.20 116.67 119.11 1iml s ASP 22 Ca 0.13 0.35 -0.11 0.00 0.71 0.00 0.00 52.55 53.63 1iml s ASP 22 Cb -0.11 -0.44 -0.01 0.00 1.01 0.00 0.00 42.92 43.38 1iml s ASP 22 CO 0.02 -3.03 0.46 0.26 0.21 0.00 0.00 175.17 173.08 1iml s TRP 23 N -3.70 0.50 0.25 4.23 0.52 0.20 -4.17 118.94 116.77 1iml s TRP 23 Ca 0.73 -0.85 -0.13 0.00 0.02 0.00 0.00 56.10 55.88 1iml s TRP 23 Cb -0.05 0.11 -0.08 0.00 -1.15 0.00 0.00 33.47 32.30 1iml s TRP 23 CO 0.54 -0.99 0.62 -1.01 0.02 0.00 0.00 176.95 176.12 1iml s HIS 24 N -3.88 3.44 0.14 -1.98 3.76 -1.26 0.13 115.29 115.64 1iml s HIS 24 Ca 0.25 1.04 -0.16 0.00 -0.15 0.00 0.00 55.06 56.03 1iml s HIS 24 Cb -0.00 -2.39 0.00 0.00 1.11 0.00 0.00 32.58 31.31 1iml s HIS 24 CO 0.11 0.23 1.76 -0.09 -0.85 0.00 0.00 174.74 175.89 1iml h ARG 25 N 2.60 0.55 -0.36 1.40 9.65 -1.91 -1.69 114.38 124.62 1iml h ARG 25 Ca -0.47 -0.06 -0.05 0.00 -1.10 0.00 0.00 59.98 58.29 1iml h ARG 25 Cb 1.17 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.63 1iml h ARG 25 CO 0.67 0.43 -0.00 -1.00 2.80 0.00 0.00 179.97 182.87 1iml h PRO 26 N 0.51 0.57 -0.09 0.20 0.13 -1.93 -3.31 132.00 128.08 1iml h PRO 26 Ca 0.14 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 65.10 1iml h PRO 26 Cb 0.04 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.09 1iml h PRO 26 CO -0.02 0.60 -0.12 0.00 -0.23 0.00 0.00 178.00 178.23 1iml s LEU 28 N -9.08 2.61 0.02 0.00 2.96 -1.01 -4.81 118.68 109.35 1iml s LEU 28 Ca -0.15 -0.71 -0.07 0.00 -0.22 0.00 0.00 54.13 52.98 1iml s LEU 28 Cb 0.04 -2.58 -0.00 0.00 0.50 0.00 0.00 46.19 44.15 1iml s LEU 28 CO 0.73 -4.27 0.14 -1.59 -1.32 0.00 0.00 176.35 170.04 1iml s LYS 29 N 8.35 0.55 0.28 1.98 -2.85 -1.26 -1.76 119.74 125.04 1iml s LYS 29 Ca 0.83 -0.53 -0.29 0.00 -1.00 0.00 0.00 55.97 54.98 1iml s LYS 29 Cb -0.07 0.22 -0.10 0.00 -2.06 0.00 0.00 37.83 35.83 1iml s LYS 29 CO 0.14 -0.14 1.24 0.00 0.10 0.00 0.00 175.35 176.68 1iml h GLU 31 N 3.99 0.00 0.24 0.00 4.39 -1.93 -0.76 114.58 120.52 1iml h GLU 31 Ca -0.47 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.22 1iml h GLU 31 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1iml h GLU 31 CO 0.69 0.17 -0.12 -0.22 -1.16 0.00 0.00 179.01 178.37 1iml h LYS 32 N 0.00 -0.32 0.00 2.33 1.63 -1.91 -3.43 116.57 114.87 1iml h LYS 32 Ca -0.09 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1iml h LYS 32 Cb 1.33 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 33.03 1iml h LYS 32 CO 0.03 -0.21 -1.56 0.00 -3.45 0.00 0.00 179.45 174.26 1iml n GLY 34 N 1.77 0.27 3.82 0.00 0.00 -0.29 -5.02 105.19 105.75 1iml n GLY 34 Ca -0.02 -0.28 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1iml n GLY 34 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iml s LYS 35 N -5.27 3.69 0.54 1.61 2.47 -1.26 -4.83 119.74 116.69 1iml s LYS 35 Ca 0.18 -0.17 -0.22 0.00 -1.56 0.00 0.00 55.97 54.20 1iml s LYS 35 Cb -0.08 -3.26 -0.05 0.00 -1.46 0.00 0.00 37.83 32.98 1iml s LYS 35 CO 0.30 0.61 1.36 0.99 0.16 0.00 0.00 175.35 178.77 1iml s THR 36 N -0.54 2.08 0.15 3.43 2.01 -1.26 -1.95 115.64 119.55 1iml s THR 36 Ca 0.12 0.06 0.07 0.00 0.31 0.00 0.00 61.69 62.25 1iml s THR 36 Cb -0.12 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 1iml s THR 36 CO 0.02 -0.00 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.18 1iml s LEU 37 N -3.48 3.34 0.42 4.42 1.43 -0.72 -4.88 118.68 119.21 1iml s LEU 37 Ca 0.71 -0.33 0.08 0.00 -1.03 0.00 0.00 54.13 53.55 1iml s LEU 37 Cb -0.41 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 43.78 1iml s LEU 37 CO 0.48 0.12 0.41 -0.89 0.23 0.00 0.00 176.35 176.70 1iml s THR 38 N -1.58 2.68 0.21 5.49 2.01 -1.26 -4.98 115.64 118.22 1iml s THR 38 Ca 0.26 -1.29 0.34 0.00 0.31 0.00 0.00 61.69 61.31 1iml s THR 38 Cb -0.10 -2.97 0.34 0.00 0.01 0.00 0.00 72.50 69.78 1iml s THR 38 CO 0.18 0.00 2.03 -1.28 -0.69 0.00 0.00 174.62 174.86 1iml h SER 39 N 0.95 0.00 0.00 3.53 0.87 -1.99 -3.22 113.55 113.70 1iml h SER 39 Ca -0.41 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.03 1iml h SER 39 Cb 1.27 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 63.12 1iml h SER 39 CO 0.55 0.00 0.02 0.61 -0.53 0.00 0.00 176.83 177.48 1iml n GLY 40 N -0.98 -0.90 0.07 5.77 0.00 -1.26 -4.93 105.19 102.96 1iml n GLY 40 Ca -0.02 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.50 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 0.18 -1.85 0.00 -0.02 0.00 -1.21 -5.10 105.19 97.18 1iml n GLY 41 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.07 -1.31 -2.80 1.61 -0.00 -1.26 -1.78 115.22 109.62 1iml n HIS 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1iml n HIS 42 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.50 1iml n HIS 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1iml n ALA 43 N -3.00 0.00 -3.56 1.59 0.00 0.20 -3.91 120.51 111.82 1iml n ALA 43 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1iml n ALA 43 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1iml n ALA 43 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iml s GLU 44 N -0.54 0.51 0.41 0.00 -6.30 -1.26 0.15 118.70 111.66 1iml s GLU 44 Ca 0.00 -0.14 0.04 0.00 -2.50 0.00 0.00 54.97 52.37 1iml s GLU 44 Cb 0.00 0.23 -0.05 0.00 0.00 0.00 0.00 34.13 34.31 1iml s GLU 44 CO 0.00 -0.21 0.03 -3.38 0.02 0.00 0.00 175.26 171.72 1iml s HIS 45 N -2.45 2.15 -0.76 5.30 0.00 -0.93 -4.94 115.29 113.65 1iml s HIS 45 Ca 0.07 -0.88 -0.26 0.00 -3.00 0.00 0.00 55.06 50.99 1iml s HIS 45 Cb -0.01 -1.55 -0.12 0.00 -4.00 0.00 0.00 32.58 26.91 1iml s HIS 45 CO -0.06 0.20 2.35 -1.21 -1.00 0.00 0.00 174.74 175.03 1iml s GLU 46 N -3.79 1.78 0.00 -0.38 0.41 -1.26 -1.22 118.70 114.23 1iml s GLU 46 Ca 0.28 0.53 0.00 0.00 -0.41 0.00 0.00 54.97 55.36 1iml s GLU 46 Cb 0.07 -4.78 0.00 0.00 -1.78 0.00 0.00 34.13 27.64 1iml s GLU 46 CO 0.14 -4.16 0.00 0.41 -0.49 0.00 0.00 175.26 171.16 1iml n GLY 47 N 6.69 0.78 3.36 -1.39 0.00 -1.26 -5.13 105.19 108.24 1iml n GLY 47 Ca 0.44 0.01 -0.13 0.00 0.00 0.00 0.00 46.02 46.35 1iml n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iml s LYS 48 N 0.00 0.53 1.02 1.61 -2.85 -0.36 -4.20 119.74 115.50 1iml s LYS 48 Ca 0.00 0.67 -0.13 0.00 -1.00 0.00 0.00 55.97 55.51 1iml s LYS 48 Cb 0.00 0.24 0.20 0.00 -2.06 0.00 0.00 37.83 36.21 1iml s LYS 48 CO 0.00 -0.07 1.09 -1.25 0.10 0.00 0.00 175.35 175.21 1iml s PRO 49 N 0.37 0.22 0.00 1.78 0.04 -1.26 -2.20 135.00 133.94 1iml s PRO 49 Ca -0.01 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1iml s PRO 49 Cb -0.04 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.79 1iml s PRO 49 CO -0.01 -2.87 0.00 0.66 0.04 0.00 0.00 177.00 174.82 1iml n TYR 50 N -4.27 -0.34 -1.71 0.56 4.02 0.12 -3.96 117.16 111.57 1iml n TYR 50 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.51 1iml n TYR 50 Cb 0.57 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.88 1iml n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1iml h ASN 52 N 3.83 0.22 -5.01 0.00 -1.24 -1.47 -1.74 115.58 110.16 1iml h ASN 52 Ca -0.47 -0.02 0.06 0.00 0.71 0.00 0.00 56.30 56.59 1iml h ASN 52 Cb 1.26 -0.06 -0.08 0.00 0.73 0.00 0.00 38.32 40.17 1iml h ASN 52 CO 0.72 0.22 0.28 -1.00 -1.29 0.00 0.00 177.43 176.37 1iml s HIS 53 N -5.11 -0.31 -0.57 0.67 3.76 -1.26 -4.20 115.29 108.27 1iml s HIS 53 Ca -0.06 -0.03 0.24 0.00 -0.15 0.00 0.00 55.06 55.06 1iml s HIS 53 Cb 0.17 0.64 0.93 0.00 1.11 0.00 0.00 32.58 35.43 1iml s HIS 53 CO 0.71 -1.00 1.71 -0.35 -0.85 0.00 0.00 174.74 174.96 1iml n PRO 54 N -0.42 0.19 -0.28 8.40 -0.04 -1.26 -4.87 135.00 136.71 1iml n PRO 54 Ca -0.09 0.36 -0.04 0.00 -0.04 0.00 0.00 63.50 63.70 1iml n PRO 54 Cb 0.61 -1.83 0.07 0.00 -0.04 0.00 0.00 33.50 32.32 1iml n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iml h TYR 56 N 1.04 1.16 0.00 0.00 5.03 -1.50 -1.80 116.97 120.91 1iml h TYR 56 Ca 0.29 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.59 1iml h TYR 56 Cb -0.10 -0.38 0.00 0.00 1.55 0.00 0.00 36.73 37.80 1iml h TYR 56 CO -0.02 0.78 -0.28 0.45 -1.32 0.00 0.00 178.16 177.77 1iml n SER 57 N -4.36 0.49 -0.02 -2.11 2.88 0.29 -2.10 113.62 108.69 1iml n SER 57 Ca 0.10 0.24 -0.16 0.00 -1.33 0.00 0.00 58.87 57.72 1iml n SER 57 Cb 0.07 -0.22 -0.12 0.00 -0.75 0.00 0.00 64.21 63.19 1iml n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iml h ALA 58 N 2.76 0.01 0.21 -1.46 0.00 0.97 -3.37 119.26 118.38 1iml h ALA 58 Ca 0.00 -0.51 -0.31 0.00 0.00 0.00 0.00 54.91 54.09 1iml h ALA 58 Cb 0.62 0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.46 1iml h ALA 58 CO 0.00 0.12 -1.41 0.52 0.00 0.00 0.00 179.25 178.48 1iml h MET 59 N -0.58 0.44 -5.41 0.00 2.07 -1.40 -3.45 114.93 106.60 1iml h MET 59 Ca -0.04 -0.75 -0.07 0.00 -2.07 0.00 0.00 59.70 56.76 1iml h MET 59 Cb 1.11 0.28 -0.01 0.00 -1.87 0.00 0.00 31.60 31.11 1iml h MET 59 CO 0.06 1.36 0.21 -0.06 1.07 0.00 0.00 176.91 179.55 1iml s PHE 60 N -2.55 1.20 0.00 -0.22 0.40 -0.89 -4.85 117.98 111.08 1iml s PHE 60 Ca -0.12 1.82 0.00 0.00 -0.60 0.00 0.00 56.93 58.03 1iml s PHE 60 Cb 0.04 -3.51 0.00 0.00 0.51 0.00 0.00 43.02 40.06 1iml s PHE 60 CO 0.89 -1.65 0.00 0.41 0.70 0.00 0.00 175.22 175.56 1iml n GLY 61 N 6.76 4.36 0.08 4.36 0.00 -1.26 -4.98 105.19 114.50 1iml n GLY 61 Ca 0.45 -1.91 0.06 0.00 0.00 0.00 0.00 46.02 44.63 1iml n GLY 61 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iml n PRO 62 N 0.00 0.08 -1.79 1.61 -0.02 -1.26 -4.83 135.00 128.78 1iml n PRO 62 Ca 0.00 0.51 -0.37 0.00 -2.02 0.00 0.00 63.50 61.61 1iml n PRO 62 Cb 0.00 -1.71 0.05 0.00 -0.02 0.00 0.00 33.50 31.82 1iml n PRO 62 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1iml s LYS 63 N -3.24 2.86 0.00 -0.52 2.20 -1.26 -5.00 119.74 114.79 1iml s LYS 63 Ca 0.01 2.11 0.00 0.00 -0.36 0.00 0.00 55.97 57.73 1iml s LYS 63 Cb 0.05 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.33 1iml s LYS 63 CO 0.16 -1.37 0.00 0.41 -0.36 0.00 0.00 175.35 174.18 1iml n GLY 64 N 0.78 4.34 0.00 5.54 0.00 -1.26 -5.10 105.19 109.49 1iml n GLY 64 Ca 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1iml n GLY 64 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1iml n PHE 65 N 0.00 0.00 0.00 1.61 7.35 -1.26 -5.17 117.46 119.99 1iml n PHE 65 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1iml n PHE 65 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1iml n PHE 65 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1iml n GLY 66 N 0.00 -0.04 0.00 7.13 0.00 -1.26 -4.85 105.19 106.16 1iml n GLY 66 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1iml n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1iml n ARG 67 N 0.00 0.00 0.00 1.61 0.00 -1.26 -5.06 116.66 111.95 1iml n ARG 67 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 1iml n ARG 67 Cb 0.00 -1.11 0.00 0.00 -0.00 0.00 0.00 32.46 31.35 1iml n ARG 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1iml n GLY 68 N -0.47 -0.50 0.00 2.89 0.00 -1.26 -5.17 105.19 100.67 1iml n GLY 68 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 1.39 0.00 -0.02 0.00 -1.26 -5.19 105.19 100.11 1iml n GLY 69 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1iml n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iml n ALA 70 N -3.00 0.00 -1.12 4.61 0.00 -1.26 -5.14 120.51 114.61 1iml n ALA 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1iml n ALA 70 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1iml n ALA 70 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1iml n GLU 71 N 0.00 0.00 0.00 0.00 1.02 -1.26 -5.14 120.64 115.27 1iml n GLU 71 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1iml n GLU 71 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1iml n GLU 71 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1iml n SER 72 N -1.00 0.00 -0.62 1.62 3.41 -1.26 -5.02 113.62 110.76 1iml n SER 72 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1iml n SER 72 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1iml n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iml n HIS 73 N -0.31 0.00 -3.54 7.33 1.44 -1.26 -5.12 115.22 113.76 1iml n HIS 73 Ca 0.00 -0.15 -0.38 0.00 -2.01 0.00 0.00 57.72 55.18 1iml n HIS 73 Cb 0.00 0.32 -0.06 0.00 0.12 0.00 0.00 29.99 30.37 1iml n HIS 73 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1iml s THR 74 N 0.00 5.12 0.00 0.61 2.01 -1.26 -4.43 115.64 117.69 1iml s THR 74 Ca 0.00 0.75 0.00 0.00 0.31 0.00 0.00 61.69 62.75 1iml s THR 74 Cb 0.00 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.84 1iml s THR 74 CO 0.00 0.56 0.00 0.49 -0.69 0.00 0.00 174.62 174.98 1iml n PHE 75 N 2.06 0.00 -0.27 4.92 3.72 -1.26 -5.18 117.46 121.46 1iml n PHE 75 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1iml n PHE 75 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 1iml n PHE 75 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34