#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 0.84 -0.29 0.54 0.00 -1.26 -2.25 119.74 117.31 1iml s LYS 2 Ca 0.00 -0.99 -0.25 0.00 0.00 0.00 0.00 55.97 54.72 1iml s LYS 2 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 37.83 37.02 1iml s LYS 2 CO 0.00 0.18 0.87 0.00 0.00 0.00 0.00 175.35 176.40 1iml h PRO 4 N 8.00 0.00 0.00 0.00 0.14 -1.88 -1.54 132.00 136.72 1iml h PRO 4 Ca -0.23 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.91 1iml h PRO 4 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.23 1iml h PRO 4 CO 0.92 0.00 0.00 1.17 0.14 0.00 0.00 178.00 180.23 1iml n LYS 5 N -3.09 0.00 0.03 0.86 0.00 -1.25 -4.58 118.16 110.13 1iml n LYS 5 Ca -0.03 0.33 0.07 0.00 0.00 0.00 0.00 58.31 58.68 1iml n LYS 5 Cb 0.10 -0.85 -0.09 0.00 0.00 0.00 0.00 35.03 34.18 1iml n LYS 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iml n ASP 7 N -2.57 -3.93 -1.48 0.00 -0.08 -0.58 -5.07 116.55 102.84 1iml n ASP 7 Ca -0.06 -0.16 0.00 0.00 -1.51 0.00 0.00 54.79 53.06 1iml n ASP 7 Cb 0.67 -2.42 0.00 0.00 2.34 0.00 0.00 41.12 41.71 1iml n ASP 7 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1iml n LYS 8 N -1.75 1.67 -4.04 -0.67 4.81 -1.26 -4.93 118.16 111.99 1iml n LYS 8 Ca -0.01 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.13 1iml n LYS 8 Cb 0.52 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.52 1iml n LYS 8 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1iml s GLU 9 N -1.57 2.97 -0.29 1.64 8.01 -1.26 -0.77 118.70 127.42 1iml s GLU 9 Ca 0.00 -0.71 -0.04 0.00 0.01 0.00 0.00 54.97 54.23 1iml s GLU 9 Cb 0.00 -2.75 0.03 0.00 -4.31 0.00 0.00 34.13 27.10 1iml s GLU 9 CO 0.00 0.55 0.02 0.08 0.01 0.00 0.00 175.26 175.92 1iml s VAL 10 N -1.52 3.36 0.49 2.63 1.01 -0.95 -4.90 120.40 120.52 1iml s VAL 10 Ca 0.31 -1.07 -0.19 0.00 0.00 0.00 0.00 61.98 61.03 1iml s VAL 10 Cb -0.12 -2.82 -0.08 0.00 0.00 0.00 0.00 36.38 33.37 1iml s VAL 10 CO 0.23 0.01 1.01 -0.47 0.00 0.00 0.00 175.10 175.88 1iml s TYR 11 N 1.36 3.14 0.10 5.22 5.04 -1.26 -4.94 117.35 126.01 1iml s TYR 11 Ca -0.01 1.56 -0.22 0.00 -2.44 0.00 0.00 57.07 55.96 1iml s TYR 11 Cb -0.18 -2.96 -0.13 0.00 0.35 0.00 0.00 41.96 39.04 1iml s TYR 11 CO -0.00 -0.64 1.74 0.74 -1.34 0.00 0.00 175.55 176.05 1iml h PHE 12 N 1.36 0.08 0.00 4.97 0.04 -1.98 -1.72 116.94 119.69 1iml h PHE 12 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.29 1iml h PHE 12 Cb 1.21 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.33 1iml h PHE 12 CO 0.59 0.06 0.00 0.00 -0.60 0.00 0.00 178.31 178.36 1iml n ALA 13 N -2.11 2.62 0.31 2.45 0.00 -1.26 0.58 120.51 123.10 1iml n ALA 13 Ca -0.06 -0.19 0.09 0.00 0.00 0.00 0.00 53.44 53.29 1iml n ALA 13 Cb 0.03 -1.50 0.16 0.00 0.00 0.00 0.00 19.45 18.14 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 -1.04 2.14 -2.41 0.00 1.02 -0.66 -4.99 120.64 114.70 1iml n GLU 14 Ca 0.22 -1.98 -0.33 0.00 -0.02 0.00 0.00 57.16 55.05 1iml n GLU 14 Cb 0.12 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.11 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 -1.32 3.81 -0.14 3.49 1.04 0.20 0.95 118.95 126.97 1iml s ARG 15 Ca 0.30 1.12 -0.11 0.00 -1.04 0.00 0.00 55.73 56.00 1iml s ARG 15 Cb 0.18 -2.11 0.04 0.00 -2.04 0.00 0.00 34.95 31.02 1iml s ARG 15 CO 0.25 -0.40 0.37 0.14 -0.04 0.00 0.00 175.30 175.62 1iml s VAL 16 N -2.38 -0.01 -0.09 4.99 -7.23 -0.44 -4.73 120.40 110.50 1iml s VAL 16 Ca 0.62 0.03 0.01 0.00 -1.81 0.00 0.00 61.98 60.84 1iml s VAL 16 Cb -0.12 -0.53 -0.02 0.00 0.56 0.00 0.00 36.38 36.26 1iml s VAL 16 CO 0.27 0.01 -0.12 -0.89 -0.31 0.00 0.00 175.10 174.07 1iml s THR 17 N 0.57 3.22 -0.30 5.32 2.01 -1.26 0.60 115.64 125.80 1iml s THR 17 Ca -0.03 -0.63 -0.21 0.00 0.31 0.00 0.00 61.69 61.12 1iml s THR 17 Cb -0.05 -2.32 0.19 0.00 0.01 0.00 0.00 72.50 70.34 1iml s THR 17 CO -0.03 0.56 1.35 -0.55 -0.69 0.00 0.00 174.62 175.25 1iml s SER 18 N -0.21 -0.08 -2.14 3.53 0.15 -0.88 -4.30 113.70 109.76 1iml s SER 18 Ca 0.01 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.81 1iml s SER 18 Cb -0.13 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 1iml s SER 18 CO 0.03 -0.02 0.00 0.18 1.20 0.00 0.00 173.24 174.62 1iml n LEU 19 N 2.22 -1.59 -0.31 3.45 7.99 -1.26 -2.21 117.00 125.29 1iml n LEU 19 Ca -0.13 0.43 -0.04 0.00 -0.01 0.00 0.00 56.01 56.26 1iml n LEU 19 Cb 0.57 -2.88 -0.02 0.00 -0.11 0.00 0.00 43.42 40.98 1iml n LEU 19 CO 0.03 -0.95 -0.04 0.61 -1.51 0.00 0.00 177.39 175.53 1iml n GLY 20 N -0.51 0.69 3.14 -0.72 0.00 -1.26 -5.01 105.19 101.52 1iml n GLY 20 Ca -0.22 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 1iml n GLY 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iml s LYS 21 N -1.90 0.69 0.80 1.61 0.00 -0.94 -5.12 119.74 114.88 1iml s LYS 21 Ca 0.00 -1.02 -0.07 0.00 0.00 0.00 0.00 55.97 54.88 1iml s LYS 21 Cb 0.00 0.26 0.14 0.00 0.00 0.00 0.00 37.83 38.24 1iml s LYS 21 CO 0.00 -0.18 1.11 -0.51 0.00 0.00 0.00 175.35 175.77 1iml s ASP 22 N -2.72 3.99 0.37 0.03 1.01 -1.26 -2.07 116.67 116.02 1iml s ASP 22 Ca 0.04 -0.05 -0.04 0.00 0.71 0.00 0.00 52.55 53.21 1iml s ASP 22 Cb 0.05 -0.25 0.02 0.00 1.01 0.00 0.00 42.92 43.74 1iml s ASP 22 CO -0.09 -2.12 0.55 0.26 0.21 0.00 0.00 175.17 173.97 1iml s TRP 23 N -3.41 0.97 0.15 4.23 0.52 0.20 -4.21 118.94 117.39 1iml s TRP 23 Ca 0.68 -1.27 -0.04 0.00 0.02 0.00 0.00 56.10 55.49 1iml s TRP 23 Cb -0.05 0.08 -0.05 0.00 -1.15 0.00 0.00 33.47 32.29 1iml s TRP 23 CO 0.47 -1.26 0.37 -1.01 0.02 0.00 0.00 176.95 175.54 1iml s HIS 24 N -2.74 3.48 0.05 -1.98 3.76 -1.26 -1.33 115.29 115.27 1iml s HIS 24 Ca 0.28 0.50 -0.34 0.00 -0.15 0.00 0.00 55.06 55.35 1iml s HIS 24 Cb -0.02 -1.96 -0.19 0.00 1.11 0.00 0.00 32.58 31.52 1iml s HIS 24 CO 0.20 0.43 1.48 -0.09 -0.85 0.00 0.00 174.74 175.91 1iml h ARG 25 N 2.67 -1.09 -0.16 1.40 2.43 0.29 -2.75 114.38 117.18 1iml h ARG 25 Ca -0.46 0.07 0.05 0.00 -0.81 0.00 0.00 59.98 58.83 1iml h ARG 25 Cb 1.17 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 30.96 1iml h ARG 25 CO 0.72 -0.72 0.32 -1.00 -1.51 0.00 0.00 179.97 177.78 1iml h PRO 26 N -1.20 0.00 0.00 0.20 0.13 -1.96 -3.12 132.00 126.04 1iml h PRO 26 Ca -0.12 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.99 1iml h PRO 26 Cb 0.87 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 1iml h PRO 26 CO 0.19 0.00 -0.14 0.00 -0.23 0.00 0.00 178.00 177.82 1iml s LEU 28 N -8.30 3.12 -0.00 0.00 2.96 -1.09 -4.87 118.68 110.49 1iml s LEU 28 Ca -0.13 0.17 -0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1iml s LEU 28 Cb -0.01 -2.54 -0.00 0.00 0.50 0.00 0.00 46.19 44.14 1iml s LEU 28 CO 0.42 -3.18 0.07 -1.59 -1.32 0.00 0.00 176.35 170.75 1iml s LYS 29 N 8.06 0.30 0.15 1.98 -2.85 -1.26 -2.10 119.74 124.02 1iml s LYS 29 Ca 0.85 -0.29 -0.31 0.00 -1.00 0.00 0.00 55.97 55.21 1iml s LYS 29 Cb -0.12 0.12 -0.11 0.00 -2.06 0.00 0.00 37.83 35.66 1iml s LYS 29 CO 0.12 -0.06 1.81 0.00 0.10 0.00 0.00 175.35 177.32 1iml n GLU 31 N 5.23 2.38 0.04 0.00 2.13 -1.17 -1.32 120.64 127.94 1iml n GLU 31 Ca 0.17 -2.25 0.00 0.00 0.66 0.00 0.00 57.16 55.75 1iml n GLU 31 Cb 0.37 -1.92 0.00 0.00 0.27 0.00 0.00 31.44 30.16 1iml n GLU 31 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1iml n LYS 32 N -0.45 0.00 -0.02 5.31 4.76 -1.26 -4.89 118.16 121.61 1iml n LYS 32 Ca 0.39 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.87 1iml n LYS 32 Cb 1.28 -0.40 -0.11 0.00 -1.84 0.00 0.00 35.03 33.96 1iml n LYS 32 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1iml n GLY 34 N 1.81 0.01 3.64 0.00 0.00 -0.43 -5.03 105.19 105.19 1iml n GLY 34 Ca -0.06 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 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 -4.54 4.07 0.26 1.61 2.47 -1.26 -4.87 119.74 117.47 1iml s LYS 35 Ca 0.03 -0.12 -0.31 0.00 -1.56 0.00 0.00 55.97 54.01 1iml s LYS 35 Cb -0.00 -3.58 -0.11 0.00 -1.46 0.00 0.00 37.83 32.68 1iml s LYS 35 CO 0.37 -0.05 1.60 0.99 0.16 0.00 0.00 175.35 178.42 1iml s THR 36 N 1.39 2.19 -0.11 3.43 2.01 -1.26 -1.79 115.64 121.49 1iml s THR 36 Ca 0.11 0.15 -0.10 0.00 0.31 0.00 0.00 61.69 62.16 1iml s THR 36 Cb -0.15 -3.09 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 1iml s THR 36 CO 0.07 0.02 0.21 -0.76 -0.69 0.00 0.00 174.62 173.47 1iml s LEU 37 N 0.05 4.38 0.65 4.42 1.43 -0.89 -4.93 118.68 123.80 1iml s LEU 37 Ca 0.66 0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 54.14 1iml s LEU 37 Cb -0.47 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 43.53 1iml s LEU 37 CO 0.42 0.34 1.29 -0.89 0.23 0.00 0.00 176.35 177.74 1iml s THR 38 N -0.76 2.05 -0.37 5.49 2.01 -1.26 -4.84 115.64 117.97 1iml s THR 38 Ca 0.16 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 62.02 1iml s THR 38 Cb -0.13 -2.99 -0.17 0.00 0.01 0.00 0.00 72.50 69.22 1iml s THR 38 CO 0.05 -0.01 1.64 -0.24 -0.69 0.00 0.00 174.62 175.37 1iml n SER 39 N -1.96 1.87 0.00 3.53 2.88 -1.26 -4.54 113.62 114.15 1iml n SER 39 Ca 0.16 -2.40 0.00 0.00 -1.33 0.00 0.00 58.87 55.30 1iml n SER 39 Cb 0.48 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 1iml n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1iml n GLY 40 N 4.42 4.62 2.09 0.46 0.00 -1.26 -4.86 105.19 110.66 1iml n GLY 40 Ca 0.36 -1.26 -0.01 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.93 0.50 0.00 -0.02 0.00 -1.26 -4.95 105.19 97.52 1iml n GLY 41 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.91 0.00 -2.73 1.61 -0.00 -1.26 -1.70 115.22 108.22 1iml n HIS 42 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 1iml n HIS 42 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.05 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 -3.75 1.59 0.00 0.20 -3.90 120.51 111.64 1iml n ALA 43 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1iml n ALA 43 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1iml n ALA 43 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1iml s GLU 44 N -0.69 0.83 -0.26 0.00 -1.05 -1.26 -1.15 118.70 115.11 1iml s GLU 44 Ca 0.00 -0.49 -0.01 0.00 -0.15 0.00 0.00 54.97 54.33 1iml s GLU 44 Cb 0.00 0.26 0.08 0.00 -0.44 0.00 0.00 34.13 34.04 1iml s GLU 44 CO 0.00 -0.38 0.05 -3.38 0.95 0.00 0.00 175.26 172.49 1iml s HIS 45 N -2.61 1.76 -1.35 4.83 -3.43 0.13 -4.85 115.29 109.77 1iml s HIS 45 Ca 0.17 -1.56 -0.07 0.00 -0.80 0.00 0.00 55.06 52.79 1iml s HIS 45 Cb 0.01 -1.56 0.02 0.00 -1.43 0.00 0.00 32.58 29.62 1iml s HIS 45 CO 0.00 -0.79 1.08 0.39 -2.00 0.00 0.00 174.74 173.43 1iml n GLU 46 N 4.84 -7.09 0.00 -0.38 4.71 -1.26 -2.18 120.64 119.27 1iml n GLU 46 Ca -0.06 0.78 0.00 0.00 -0.01 0.00 0.00 57.16 57.87 1iml n GLU 46 Cb 0.44 -5.77 0.00 0.00 -1.01 0.00 0.00 31.44 25.10 1iml n GLU 46 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1iml n GLY 47 N -1.75 2.60 3.34 0.62 0.00 -1.26 -5.05 105.19 103.69 1iml n GLY 47 Ca -0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.47 3.00 0.78 1.61 1.02 -0.93 -3.89 119.74 120.87 1iml s LYS 48 Ca 0.00 -1.54 -0.12 0.00 0.02 0.00 0.00 55.97 54.33 1iml s LYS 48 Cb 0.00 -4.26 0.07 0.00 -0.52 0.00 0.00 37.83 33.12 1iml s LYS 48 CO 0.00 -1.32 1.13 -1.25 -0.92 0.00 0.00 175.35 173.00 1iml s PRO 49 N 1.86 1.99 0.25 -1.68 0.04 -1.26 -0.69 135.00 135.52 1iml s PRO 49 Ca 0.05 1.43 -0.04 0.00 0.04 0.00 0.00 61.00 62.48 1iml s PRO 49 Cb -0.27 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.44 1iml s PRO 49 CO 0.05 -1.88 0.41 0.66 0.04 0.00 0.00 177.00 176.27 1iml n TYR 50 N -3.37 -1.42 -1.71 0.56 4.02 -0.30 -3.02 117.16 111.93 1iml n TYR 50 Ca 0.11 -1.52 -0.43 0.00 -0.01 0.00 0.00 57.90 56.04 1iml n TYR 50 Cb 0.52 0.47 -0.02 0.00 -0.02 0.00 0.00 39.34 40.29 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 4.80 0.00 -5.09 0.00 -1.24 -1.44 -1.87 115.58 110.74 1iml h ASN 52 Ca -0.46 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.50 1iml h ASN 52 Cb 1.24 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 40.17 1iml h ASN 52 CO 0.80 0.45 -0.07 -1.00 -1.29 0.00 0.00 177.43 176.32 1iml s HIS 53 N -3.94 -0.15 -0.38 0.67 3.76 -1.26 -3.17 115.29 110.82 1iml s HIS 53 Ca -0.02 -0.17 0.27 0.00 -0.15 0.00 0.00 55.06 54.99 1iml s HIS 53 Cb 0.13 0.26 0.96 0.00 1.11 0.00 0.00 32.58 35.04 1iml s HIS 53 CO 0.73 -0.74 1.78 -1.00 -0.85 0.00 0.00 174.74 174.67 1iml h PRO 54 N 2.35 0.00 0.31 8.40 0.13 -1.96 -3.47 132.00 137.76 1iml h PRO 54 Ca -0.33 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1iml h PRO 54 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1iml h PRO 54 CO 0.45 0.00 -0.17 0.00 -0.23 0.00 0.00 178.00 178.05 1iml h TYR 56 N -0.46 0.24 0.00 0.00 3.20 -1.51 -1.77 116.97 116.67 1iml h TYR 56 Ca -0.04 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1iml h TYR 56 Cb 0.37 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 1iml h TYR 56 CO -0.08 0.20 -0.03 0.66 -1.64 0.00 0.00 178.16 177.27 1iml h SER 57 N 0.21 0.00 0.00 -2.11 4.64 -1.41 0.56 113.55 115.44 1iml h SER 57 Ca 0.06 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 1iml h SER 57 Cb 0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1iml h SER 57 CO -0.01 0.03 -0.46 0.00 -0.87 0.00 0.00 176.83 175.53 1iml h ALA 58 N 1.97 0.09 0.00 5.18 0.00 0.98 -3.42 119.26 124.05 1iml h ALA 58 Ca -0.00 -0.66 -0.25 0.00 0.00 0.00 0.00 54.91 54.00 1iml h ALA 58 Cb 0.30 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1iml h ALA 58 CO 0.00 0.28 -1.94 -1.33 0.00 0.00 0.00 179.25 176.27 1iml n MET 59 N -4.58 1.36 -0.65 0.00 2.81 -0.86 -4.99 117.12 110.20 1iml n MET 59 Ca -0.15 0.03 -0.01 0.00 -1.81 0.00 0.00 57.70 55.75 1iml n MET 59 Cb 0.46 -1.34 0.01 0.00 -0.71 0.00 0.00 33.22 31.63 1iml n MET 59 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1iml n PHE 60 N -2.66 -3.43 -4.39 2.03 3.01 0.19 -5.08 117.46 107.13 1iml n PHE 60 Ca -0.25 -0.09 -0.28 0.00 1.01 0.00 0.00 57.45 57.84 1iml n PHE 60 Cb 0.90 -0.04 -0.12 0.00 -0.01 0.00 0.00 39.48 40.21 1iml n PHE 60 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1iml s GLY 61 N -2.60 1.66 0.38 1.37 0.00 -1.21 -4.43 107.32 102.49 1iml s GLY 61 Ca 0.04 -1.54 -0.28 0.00 0.00 0.00 0.00 44.72 42.94 1iml s GLY 61 CO 0.02 -1.55 1.44 -1.55 0.00 0.00 0.00 173.10 171.47 1iml n PRO 62 N 0.53 2.52 0.02 2.90 -0.04 -1.26 -4.81 135.00 134.86 1iml n PRO 62 Ca -0.15 0.89 0.11 0.00 -0.04 0.00 0.00 63.50 64.31 1iml n PRO 62 Cb 0.55 -2.60 -0.10 0.00 -0.04 0.00 0.00 33.50 31.30 1iml n PRO 62 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1iml n LYS 63 N 0.37 0.57 -0.33 0.54 0.00 -1.26 -5.01 118.16 113.05 1iml n LYS 63 Ca 0.02 -0.09 -0.31 0.00 0.00 0.00 0.00 58.31 57.94 1iml n LYS 63 Cb 0.39 -1.60 0.29 0.00 0.00 0.00 0.00 35.03 34.10 1iml n LYS 63 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1iml s GLY 64 N -4.31 1.40 0.39 3.14 0.00 -1.26 -4.99 107.32 101.70 1iml s GLY 64 Ca -0.04 -0.79 -0.07 0.00 0.00 0.00 0.00 44.72 43.82 1iml s GLY 64 CO 0.87 0.22 0.31 0.69 0.00 0.00 0.00 173.10 175.19 1iml n PHE 65 N -5.69 -3.06 0.00 1.90 3.72 -1.26 -5.07 117.46 107.99 1iml n PHE 65 Ca 0.12 -0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.24 1iml n PHE 65 Cb 0.60 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 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 -0.27 -1.93 3.79 1.37 0.00 -1.26 -5.16 105.19 101.72 1iml n GLY 66 Ca 0.04 0.99 0.00 0.00 0.00 0.00 0.00 46.02 47.06 1iml n GLY 66 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1iml s ARG 67 N 0.00 0.70 -0.02 1.61 1.70 -1.26 -5.19 118.95 116.49 1iml s ARG 67 Ca 0.00 -0.42 -0.30 0.00 -0.47 0.00 0.00 55.73 54.54 1iml s ARG 67 Cb 0.00 0.22 0.11 0.00 -0.57 0.00 0.00 34.95 34.71 1iml s ARG 67 CO 0.00 -0.32 1.14 0.20 -1.08 0.00 0.00 175.30 175.23 1iml s GLY 68 N -3.27 -0.35 0.00 3.88 0.00 -1.26 -5.18 107.32 101.14 1iml s GLY 68 Ca 0.19 0.84 0.00 0.00 0.00 0.00 0.00 44.72 45.75 1iml s GLY 68 CO -0.00 0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.94 1iml n GLY 69 N -0.35 0.69 3.42 0.20 0.00 -1.26 -5.13 105.19 102.76 1iml n GLY 69 Ca -0.06 0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.00 3.23 0.31 4.61 0.00 -1.26 -5.06 121.76 122.59 1iml s ALA 70 Ca 0.00 -1.39 -0.29 0.00 0.00 0.00 0.00 51.96 50.28 1iml s ALA 70 Cb 0.00 -2.32 -0.10 0.00 0.00 0.00 0.00 23.12 20.69 1iml s ALA 70 CO 0.00 -0.90 1.31 -1.21 0.00 0.00 0.00 175.76 174.96 1iml s GLU 71 N 1.59 4.37 0.13 0.00 0.41 -1.26 -5.01 118.70 118.93 1iml s GLU 71 Ca 0.04 2.19 0.01 0.00 -0.41 0.00 0.00 54.97 56.80 1iml s GLU 71 Cb -0.17 -3.09 -0.04 0.00 -1.78 0.00 0.00 34.13 29.04 1iml s GLU 71 CO 0.05 -0.19 -0.03 0.45 -0.49 0.00 0.00 175.26 175.05 1iml s SER 72 N -0.35 1.08 0.54 -0.19 0.15 -1.26 -5.01 113.70 108.67 1iml s SER 72 Ca 0.50 -1.09 0.30 0.00 0.70 0.00 0.00 55.95 56.36 1iml s SER 72 Cb -0.39 0.12 1.55 0.00 -1.71 0.00 0.00 66.02 65.59 1iml s SER 72 CO 0.50 -0.53 2.10 0.45 1.20 0.00 0.00 173.24 176.96 1iml h HIS 73 N 2.85 0.00 -5.51 3.44 3.86 -2.01 -3.46 115.15 114.32 1iml h HIS 73 Ca -0.36 0.00 -0.39 0.00 -1.16 0.00 0.00 60.37 58.46 1iml h HIS 73 Cb 1.18 0.00 0.12 0.00 1.06 0.00 0.00 27.41 29.78 1iml h HIS 73 CO 0.55 0.09 -0.65 -2.37 0.86 0.00 0.00 177.93 176.41 1iml n THR 74 N -3.55 -2.77 0.00 2.45 5.66 -1.26 -3.13 114.28 111.67 1iml n THR 74 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1iml n THR 74 Cb 0.22 -3.86 0.00 0.00 -1.55 0.00 0.00 70.33 65.14 1iml n THR 74 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1iml n PHE 75 N -4.89 0.00 -0.53 1.09 3.72 -1.26 -5.33 117.46 110.26 1iml n PHE 75 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1iml n PHE 75 Cb 0.57 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.11 1iml n PHE 75 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07