#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rg6 s THR 6 N 0.00 3.99 0.03 0.52 2.01 -1.26 -5.03 115.64 115.91 1rg6 s THR 6 Ca 0.00 1.43 -0.01 0.00 0.31 0.00 0.00 61.69 63.42 1rg6 s THR 6 Cb 0.00 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.57 1rg6 s THR 6 CO 0.00 0.11 -0.02 -0.62 -0.69 0.00 0.00 174.62 173.40 1rg6 s ASP 7 N 1.05 0.32 -0.18 3.53 -1.08 -1.26 -5.04 116.67 114.01 1rg6 s ASP 7 Ca 0.59 -0.66 0.16 0.00 -0.52 0.00 0.00 52.55 52.12 1rg6 s ASP 7 Cb -0.30 0.14 0.78 0.00 -1.46 0.00 0.00 42.92 42.09 1rg6 s ASP 7 CO 0.29 -0.41 1.70 0.00 0.52 0.00 0.00 175.17 177.27 1rg6 s SER 9 N -0.83 -0.79 0.27 0.00 1.04 -1.26 -3.48 113.70 108.64 1rg6 s SER 9 Ca 0.53 0.97 0.02 0.00 0.48 0.00 0.00 55.95 57.96 1rg6 s SER 9 Cb 0.38 -1.40 0.36 0.00 0.10 0.00 0.00 66.02 65.45 1rg6 s SER 9 CO 0.21 -5.21 1.67 0.40 0.98 0.00 0.00 173.24 171.29 1rg6 h ILE 10 N -3.32 1.29 -0.04 -1.02 2.04 -1.81 -3.22 117.51 111.44 1rg6 h ILE 10 Ca -0.47 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 63.98 1rg6 h ILE 10 Cb 1.34 1.53 -0.06 0.00 -0.74 0.00 0.00 36.82 38.89 1rg6 h ILE 10 CO 0.32 0.45 -0.39 0.58 0.00 0.00 0.00 178.15 179.11 1rg6 h VAL 11 N 0.37 0.19 -0.95 1.67 2.07 -1.91 -1.92 116.25 115.76 1rg6 h VAL 11 Ca 0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1rg6 h VAL 11 Cb 0.80 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 1rg6 h VAL 11 CO 0.06 0.00 0.63 0.28 0.02 0.00 0.00 177.57 178.56 1rg6 h SER 12 N -0.53 1.08 -0.93 0.57 0.02 -1.88 -2.73 113.55 109.16 1rg6 h SER 12 Ca 0.06 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1rg6 h SER 12 Cb 0.62 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.85 1rg6 h SER 12 CO -0.33 0.78 0.61 0.15 -1.14 0.00 0.00 176.83 176.91 1rg6 h PHE 13 N 1.28 1.16 -0.69 3.45 3.57 -1.40 -2.59 116.94 121.72 1rg6 h PHE 13 Ca 0.35 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.80 1rg6 h PHE 13 Cb -0.14 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 38.18 1rg6 h PHE 13 CO -0.00 0.73 0.13 -0.07 -2.23 0.00 0.00 178.31 176.87 1rg6 h LEU 14 N 1.25 1.08 -0.86 0.59 3.38 -1.06 -2.71 115.31 116.98 1rg6 h LEU 14 Ca 0.34 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1rg6 h LEU 14 Cb -0.14 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.28 1rg6 h LEU 14 CO -0.08 1.05 0.53 0.00 0.09 0.00 0.00 178.44 180.04 1rg6 h ALA 15 N 1.07 1.10 -0.22 1.53 0.00 -1.24 0.23 119.26 121.73 1rg6 h ALA 15 Ca 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1rg6 h ALA 15 Cb 0.42 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1rg6 h ALA 15 CO 0.01 0.56 0.15 0.00 0.00 0.00 0.00 179.25 179.96 1rg6 h ARG 16 N 1.19 0.29 -0.58 0.00 3.08 -1.16 -0.04 114.38 117.16 1rg6 h ARG 16 Ca 0.31 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1rg6 h ARG 16 Cb -0.06 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1rg6 h ARG 16 CO -0.06 0.19 0.00 -0.11 -1.07 0.00 0.00 179.97 178.92 1rg6 n LEU 17 N -4.51 3.14 -1.58 3.04 7.94 -0.74 -4.88 117.00 119.42 1rg6 n LEU 17 Ca 0.00 -1.58 -0.15 0.00 -1.11 0.00 0.00 56.01 53.17 1rg6 n LEU 17 Cb 0.07 -0.44 -0.02 0.00 0.53 0.00 0.00 43.42 43.56 1rg6 n LEU 17 CO 0.35 0.58 -0.18 0.61 -1.11 0.00 0.00 177.39 177.63 1rg6 n GLY 18 N 0.92 0.19 3.20 -3.96 0.00 -0.03 -5.00 105.19 100.52 1rg6 n GLY 18 Ca 0.17 -0.27 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 1rg6 n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rg6 n SER 20 N 2.01 -0.78 -0.00 0.00 3.41 -1.26 -2.64 113.62 114.35 1rg6 n SER 20 Ca -0.17 -1.72 0.05 0.00 -0.26 0.00 0.00 58.87 56.77 1rg6 n SER 20 Cb 0.54 0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 64.64 1rg6 n SER 20 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1rg6 n SER 21 N 0.00 2.63 -0.72 4.04 3.41 -1.26 -4.54 113.62 117.18 1rg6 n SER 21 Ca -0.22 -0.02 0.13 0.00 -0.26 0.00 0.00 58.87 58.50 1rg6 n SER 21 Cb 0.64 1.45 0.31 0.00 -0.26 0.00 0.00 64.21 66.35 1rg6 n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rg6 h LEU 23 N 3.54 1.14 -1.15 0.00 5.85 -1.96 -2.79 115.31 119.94 1rg6 h LEU 23 Ca 0.00 -0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.84 1rg6 h LEU 23 Cb 0.75 -0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.42 1rg6 h LEU 23 CO 0.00 0.83 0.60 0.44 -0.34 0.00 0.00 178.44 179.97 1rg6 h ASP 24 N 1.35 0.76 -0.89 1.25 3.32 -1.91 -1.47 116.42 118.83 1rg6 h ASP 24 Ca 0.37 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1rg6 h ASP 24 Cb -0.16 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.26 1rg6 h ASP 24 CO -0.08 0.37 0.47 1.88 -1.72 0.00 0.00 179.24 180.15 1rg6 h TYR 25 N 0.79 1.24 -0.68 4.55 0.05 -1.80 -2.55 116.97 118.57 1rg6 h TYR 25 Ca 0.49 -0.04 -0.08 0.00 0.05 0.00 0.00 58.73 59.15 1rg6 h TYR 25 Cb 0.70 -0.39 -0.03 0.00 1.01 0.00 0.00 36.73 38.02 1rg6 h TYR 25 CO -0.00 0.87 0.12 0.74 -1.05 0.00 0.00 178.16 178.83 1rg6 h PHE 26 N 1.25 1.20 -0.13 4.88 0.04 -1.37 -2.95 116.94 119.87 1rg6 h PHE 26 Ca 0.31 -0.16 -0.00 0.00 2.80 0.00 0.00 57.97 60.91 1rg6 h PHE 26 Cb 0.06 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 37.87 1rg6 h PHE 26 CO 0.01 1.00 0.07 1.79 -0.60 0.00 0.00 178.31 180.58 1rg6 h THR 27 N 1.06 1.11 0.00 -1.55 1.35 -1.10 -2.22 112.91 111.55 1rg6 h THR 27 Ca 0.21 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1rg6 h THR 27 Cb 0.44 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1rg6 h THR 27 CO 0.01 0.10 0.00 1.07 -0.25 0.00 0.00 175.52 176.45 1rg6 n THR 28 N -4.93 1.08 0.59 6.82 5.66 -1.01 -2.59 114.28 119.90 1rg6 n THR 28 Ca -0.05 0.27 0.11 0.00 -3.05 0.00 0.00 64.05 61.33 1rg6 n THR 28 Cb 0.08 -1.05 -0.09 0.00 -1.55 0.00 0.00 70.33 67.72 1rg6 n THR 28 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rg6 n GLN 29 N -1.48 0.27 -0.28 1.09 1.13 -0.88 -4.97 117.38 112.25 1rg6 n GLN 29 Ca 0.03 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 1rg6 n GLN 29 Cb 0.15 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 28.97 1rg6 n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rg6 n GLY 30 N 1.40 0.85 3.34 1.08 0.00 -1.05 -5.06 105.19 105.74 1rg6 n GLY 30 Ca 0.01 -0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 1rg6 n GLY 30 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rg6 s LEU 31 N 0.00 3.56 -0.06 0.99 1.02 -0.90 -4.96 118.68 118.33 1rg6 s LEU 31 Ca 0.00 -0.59 0.21 0.00 0.02 0.00 0.00 54.13 53.77 1rg6 s LEU 31 Cb 0.00 -1.84 0.42 0.00 0.02 0.00 0.00 46.19 44.79 1rg6 s LEU 31 CO 0.00 -0.13 1.18 0.35 0.02 0.00 0.00 176.35 177.77 1rg6 n THR 32 N 4.84 0.63 -3.76 5.49 -2.24 -1.26 -4.12 114.28 113.86 1rg6 n THR 32 Ca -0.16 -1.62 -0.13 0.00 -2.27 0.00 0.00 64.05 59.87 1rg6 n THR 32 Cb 0.49 0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 69.26 1rg6 n THR 32 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1rg6 s THR 33 N -0.92 0.02 0.49 4.28 -4.23 -1.26 -4.18 115.64 109.84 1rg6 s THR 33 Ca 0.35 -0.14 0.15 0.00 -1.18 0.00 0.00 61.69 60.86 1rg6 s THR 33 Cb 0.38 -0.52 0.29 0.00 1.34 0.00 0.00 72.50 73.98 1rg6 s THR 33 CO -0.14 -0.08 2.11 -0.29 -0.54 0.00 0.00 174.62 175.68 1rg6 h ILE 34 N 4.38 0.99 0.00 2.99 2.10 -1.77 -1.31 117.51 124.89 1rg6 h ILE 34 Ca -0.27 -0.05 -0.00 0.00 1.08 0.00 0.00 64.86 65.62 1rg6 h ILE 34 Cb 1.18 0.84 -0.00 0.00 -1.09 0.00 0.00 36.82 37.75 1rg6 h ILE 34 CO 0.32 0.03 -0.00 1.88 -1.08 0.00 0.00 178.15 179.30 1rg6 h TYR 35 N 0.14 0.00 0.00 2.19 0.05 -1.96 -1.06 116.97 116.33 1rg6 h TYR 35 Ca 0.07 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.78 1rg6 h TYR 35 Cb 0.12 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.85 1rg6 h TYR 35 CO -0.00 0.00 -0.34 1.96 -1.05 0.00 0.00 178.16 178.73 1rg6 h GLN 36 N 0.00 0.00 -0.39 4.88 1.08 -1.66 -3.12 115.11 115.91 1rg6 h GLN 36 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1rg6 h GLN 36 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1rg6 h GLN 36 CO 0.00 0.34 0.00 0.44 -0.95 0.00 0.00 178.83 178.66 1rg6 n ILE 37 N -3.68 1.21 -0.37 2.54 -5.35 -0.44 -4.65 119.36 108.62 1rg6 n ILE 37 Ca -0.01 -1.12 -0.02 0.00 -0.27 0.00 0.00 62.75 61.33 1rg6 n ILE 37 Cb 0.45 0.38 0.12 0.00 -1.74 0.00 0.00 39.64 38.84 1rg6 n ILE 37 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1rg6 h GLU 38 N 2.31 1.31 -0.00 6.28 5.08 -1.39 -3.08 114.58 125.10 1rg6 h GLU 38 Ca 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1rg6 h GLU 38 Cb 0.89 -0.30 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1rg6 h GLU 38 CO 0.04 0.87 -0.80 -2.39 -1.00 0.00 0.00 179.01 175.73 1rg6 n HIS 39 N -4.38 0.00 -1.78 4.33 1.44 -1.26 -4.98 115.22 108.59 1rg6 n HIS 39 Ca 0.12 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.42 1rg6 n HIS 39 Cb 0.01 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.12 1rg6 n HIS 39 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1rg6 s TYR 40 N -2.68 2.55 0.39 -1.40 1.51 -1.17 -5.01 117.35 111.55 1rg6 s TYR 40 Ca 0.09 1.16 0.06 0.00 -1.01 0.00 0.00 57.07 57.37 1rg6 s TYR 40 Cb 0.15 -4.04 0.06 0.00 -0.11 0.00 0.00 41.96 38.02 1rg6 s TYR 40 CO 0.72 -3.06 0.53 0.45 -1.11 0.00 0.00 175.55 173.08 1rg6 n SER 41 N 0.41 1.50 -0.24 2.29 2.88 -1.26 -4.93 113.62 114.27 1rg6 n SER 41 Ca 0.01 -2.07 -0.08 0.00 -1.33 0.00 0.00 58.87 55.41 1rg6 n SER 41 Cb 0.39 -0.27 0.04 0.00 -0.75 0.00 0.00 64.21 63.62 1rg6 n SER 41 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1rg6 h MET 42 N 0.00 1.05 -0.42 -1.46 2.86 -1.95 -2.36 114.93 112.65 1rg6 h MET 42 Ca -0.19 -0.24 -0.15 0.00 -2.06 0.00 0.00 59.70 57.06 1rg6 h MET 42 Cb 0.85 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1rg6 h MET 42 CO 0.27 0.93 -0.33 -0.44 1.06 0.00 0.00 176.91 178.40 1rg6 h ASP 43 N 0.98 1.01 -0.13 1.22 3.32 -1.97 -3.03 116.42 117.82 1rg6 h ASP 43 Ca 0.21 -0.44 -0.06 0.00 0.02 0.00 0.00 57.03 56.76 1rg6 h ASP 43 Cb 0.34 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1rg6 h ASP 43 CO -0.00 1.24 -0.09 0.44 -1.72 0.00 0.00 179.24 179.11 1rg6 h ASP 44 N 0.80 0.43 0.46 6.45 3.32 -1.92 -2.23 116.42 123.73 1rg6 h ASP 44 Ca 0.08 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1rg6 h ASP 44 Cb 0.92 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.36 1rg6 h ASP 44 CO 0.09 0.56 -0.12 0.25 -1.72 0.00 0.00 179.24 178.29 1rg6 h LEU 45 N 0.42 0.00 -0.37 1.55 6.46 -1.30 -3.04 115.31 119.03 1rg6 h LEU 45 Ca 0.08 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1rg6 h LEU 45 Cb 0.42 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.32 1rg6 h LEU 45 CO 0.02 0.12 0.20 0.00 -0.62 0.00 0.00 178.44 178.17 1rg6 h ALA 46 N 1.88 0.46 -0.32 1.25 0.00 -1.38 -1.56 119.26 119.59 1rg6 h ALA 46 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1rg6 h ALA 46 Cb 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1rg6 h ALA 46 CO 0.02 -0.15 0.54 1.03 0.00 0.00 0.00 179.25 180.69 1rg6 h SER 47 N 0.42 0.00 0.00 0.00 0.87 -1.67 0.79 113.55 113.96 1rg6 h SER 47 Ca 0.15 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1rg6 h SER 47 Cb 0.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1rg6 h SER 47 CO -0.08 0.00 0.00 -0.11 -0.53 0.00 0.00 176.83 176.11 1rg6 n LEU 48 N -3.31 0.00 0.00 2.23 7.94 -0.59 -4.83 117.00 118.44 1rg6 n LEU 48 Ca 0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 1rg6 n LEU 48 Cb 0.68 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.63 1rg6 n LEU 48 CO 0.20 0.00 0.00 0.29 -1.11 0.00 0.00 177.39 176.77 1rg6 n LYS 49 N -0.72 -0.07 -2.61 1.96 5.02 0.27 -4.84 118.16 117.18 1rg6 n LYS 49 Ca 0.07 0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 55.97 1rg6 n LYS 49 Cb 0.03 -2.92 -0.05 0.00 -0.02 0.00 0.00 35.03 32.07 1rg6 n LYS 49 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1rg6 s ILE 50 N -3.18 3.95 1.07 -0.18 1.01 -1.25 -5.01 121.20 117.61 1rg6 s ILE 50 Ca 0.00 1.80 -0.13 0.00 0.00 0.00 0.00 60.65 62.32 1rg6 s ILE 50 Cb 0.00 -4.15 0.19 0.00 0.01 0.00 0.00 42.46 38.52 1rg6 s ILE 50 CO 0.00 0.36 0.83 -0.81 0.00 0.00 0.00 174.94 175.32 1rg6 n PRO 51 N 1.96 -1.53 0.03 2.79 -0.04 -1.26 -4.72 135.00 132.23 1rg6 n PRO 51 Ca 0.01 -0.41 -0.06 0.00 -0.04 0.00 0.00 63.50 63.00 1rg6 n PRO 51 Cb 0.47 -2.12 0.12 0.00 -0.04 0.00 0.00 33.50 31.93 1rg6 n PRO 51 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1rg6 h GLU 52 N -2.25 0.46 0.00 0.54 5.08 -1.98 -2.85 114.58 113.58 1rg6 h GLU 52 Ca -0.53 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 57.58 1rg6 h GLU 52 Cb 1.31 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 1rg6 h GLU 52 CO 0.43 0.83 -0.00 0.37 -1.00 0.00 0.00 179.01 179.64 1rg6 h GLN 53 N 0.37 0.00 -0.01 2.33 4.15 -2.03 0.20 115.11 120.12 1rg6 h GLN 53 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1rg6 h GLN 53 Cb 0.95 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.64 1rg6 h GLN 53 CO 0.08 0.00 -0.57 1.19 -1.93 0.00 0.00 178.83 177.60 1rg6 n PHE 54 N -3.21 0.00 -0.11 3.99 3.01 -1.08 -4.02 117.46 116.05 1rg6 n PHE 54 Ca -0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.30 1rg6 n PHE 54 Cb 0.07 -0.06 -0.03 0.00 -0.01 0.00 0.00 39.48 39.45 1rg6 n PHE 54 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1rg6 h ARG 55 N 1.20 0.87 0.01 -1.08 3.08 -0.93 -2.55 114.38 114.97 1rg6 h ARG 55 Ca 0.00 -0.47 -0.21 0.00 0.07 0.00 0.00 59.98 59.37 1rg6 h ARG 55 Cb 0.60 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 1rg6 h ARG 55 CO 0.00 1.11 -0.92 1.25 -1.07 0.00 0.00 179.97 180.35 1rg6 h HIS 56 N 0.67 0.44 0.13 3.04 2.76 -1.73 -2.36 115.15 118.09 1rg6 h HIS 56 Ca 0.05 -0.25 -0.01 0.00 -2.20 0.00 0.00 60.37 57.97 1rg6 h HIS 56 Cb 0.97 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.88 1rg6 h HIS 56 CO 0.07 1.07 -0.06 0.00 -1.30 0.00 0.00 177.93 177.70 1rg6 h ALA 57 N 0.85 -0.18 -0.12 5.26 0.00 -1.68 -2.08 119.26 121.31 1rg6 h ALA 57 Ca -0.06 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1rg6 h ALA 57 Cb 1.55 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1rg6 h ALA 57 CO 0.15 -0.44 -0.28 0.82 0.00 0.00 0.00 179.25 179.51 1rg6 h ILE 58 N -0.50 1.38 -0.95 0.00 2.04 -1.57 -3.27 117.51 114.64 1rg6 h ILE 58 Ca -0.02 -1.57 0.01 0.00 1.00 0.00 0.00 64.86 64.29 1rg6 h ILE 58 Cb 0.40 2.09 -0.05 0.00 -0.74 0.00 0.00 36.82 38.52 1rg6 h ILE 58 CO 0.03 0.46 0.63 -0.25 0.00 0.00 0.00 178.15 179.02 1rg6 h TRP 59 N -0.02 1.20 -0.99 1.37 7.01 -1.51 -2.74 115.95 120.27 1rg6 h TRP 59 Ca -0.00 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.04 1rg6 h TRP 59 Cb 0.88 -0.41 -0.05 0.00 -2.10 0.00 0.00 29.16 27.48 1rg6 h TRP 59 CO 0.11 0.75 0.66 -0.22 -2.79 0.00 0.00 178.44 176.95 1rg6 h LYS 60 N 1.29 1.31 -0.04 2.65 3.64 -1.42 -1.88 116.57 122.11 1rg6 h LYS 60 Ca 0.35 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.56 1rg6 h LYS 60 Cb -0.14 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.37 1rg6 h LYS 60 CO -0.08 0.86 -0.39 0.78 -2.27 0.00 0.00 179.45 178.36 1rg6 h GLY 61 N 1.34 0.10 1.09 5.01 0.00 -1.54 -3.02 103.07 106.06 1rg6 h GLY 61 Ca 0.36 -0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.50 1rg6 h GLY 61 CO -0.08 0.08 -0.05 -2.22 0.00 0.00 0.00 176.54 174.27 1rg6 h ILE 62 N 0.08 1.27 -0.11 2.60 2.04 -1.19 -2.82 117.51 119.37 1rg6 h ILE 62 Ca 0.01 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1rg6 h ILE 62 Cb 0.73 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 1rg6 h ILE 62 CO 0.05 0.44 0.08 -0.07 0.00 0.00 0.00 178.15 178.65 1rg6 h LEU 63 N 0.96 0.13 -1.37 1.44 3.38 -1.36 -2.51 115.31 115.97 1rg6 h LEU 63 Ca 0.16 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1rg6 h LEU 63 Cb 0.62 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 1rg6 h LEU 63 CO 0.04 0.10 0.46 -0.78 0.09 0.00 0.00 178.44 178.34 1rg6 h ASP 64 N 0.16 0.69 -0.94 -0.43 1.82 -1.55 -2.07 116.42 114.10 1rg6 h ASP 64 Ca 0.04 -0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.69 1rg6 h ASP 64 Cb -0.02 -0.16 -0.05 0.00 0.68 0.00 0.00 39.33 39.79 1rg6 h ASP 64 CO -0.01 0.47 0.62 -0.74 -1.61 0.00 0.00 179.24 177.98 1rg6 h HIS 65 N 0.80 1.18 -0.71 0.28 2.76 -1.19 -2.31 115.15 115.97 1rg6 h HIS 65 Ca 0.28 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.47 1rg6 h HIS 65 Cb 0.11 -0.40 -0.03 0.00 1.55 0.00 0.00 27.41 28.64 1rg6 h HIS 65 CO -0.00 0.74 0.39 -0.09 -1.30 0.00 0.00 177.93 177.67 1rg6 h ARG 66 N 1.27 0.99 -0.79 5.26 2.43 -1.23 -2.67 114.38 119.64 1rg6 h ARG 66 Ca 0.35 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 1rg6 h ARG 66 Cb -0.14 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.18 1rg6 h ARG 66 CO -0.08 0.73 0.52 1.96 -1.51 0.00 0.00 179.97 181.59 1rg6 h GLN 67 N 0.98 1.04 -0.37 0.20 4.20 -1.31 -2.87 115.11 116.99 1rg6 h GLN 67 Ca 0.25 -0.06 -0.17 0.00 0.06 0.00 0.00 58.65 58.73 1rg6 h GLN 67 Cb 0.03 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.57 1rg6 h GLN 67 CO -0.04 0.69 -0.42 -0.07 -0.67 0.00 0.00 178.83 178.32 1rg6 h LEU 68 N 1.07 1.00 -8.59 1.46 3.38 -1.20 -3.44 115.31 108.98 1rg6 h LEU 68 Ca 0.29 -0.48 -0.70 0.00 0.09 0.00 0.00 57.88 57.08 1rg6 h LEU 68 Cb -0.12 -0.28 -0.30 0.00 0.09 0.00 0.00 40.66 40.05 1rg6 h LEU 68 CO -0.06 1.28 -0.88 -1.00 0.09 0.00 0.00 178.44 177.87 1rg6 s HIS 69 N -4.34 2.38 -0.07 1.13 3.76 -1.08 -5.11 115.29 111.96 1rg6 s HIS 69 Ca -0.11 -0.50 -0.22 0.00 -0.15 0.00 0.00 55.06 54.08 1rg6 s HIS 69 Cb 0.11 -1.54 -0.04 0.00 1.11 0.00 0.00 32.58 32.22 1rg6 s HIS 69 CO 0.88 -0.07 0.64 -2.00 -0.85 0.00 0.00 174.74 173.34 1rg6 s GLU 70 N -0.49 4.41 0.00 1.40 2.12 -1.26 -4.67 118.70 120.20 1rg6 s GLU 70 Ca 0.06 0.77 0.28 0.00 0.36 0.00 0.00 54.97 56.44 1rg6 s GLU 70 Cb -0.11 -3.44 1.01 0.00 0.26 0.00 0.00 34.13 31.85 1rg6 s GLU 70 CO 0.00 0.11 1.72 0.34 -0.54 0.00 0.00 175.26 176.90