#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rg6 n THR 6 N 0.00 0.00 -4.08 0.52 -2.24 -1.26 -4.90 114.28 102.32 1rg6 n THR 6 Ca 0.00 -0.08 -0.07 0.00 -2.27 0.00 0.00 64.05 61.63 1rg6 n THR 6 Cb 0.00 0.09 -0.10 0.00 -2.10 0.00 0.00 70.33 68.22 1rg6 n THR 6 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1rg6 s ASP 7 N -2.52 0.48 -0.22 3.42 -4.77 -1.26 -5.04 116.67 106.76 1rg6 s ASP 7 Ca 0.26 -0.99 0.15 0.00 -3.30 0.00 0.00 52.55 48.68 1rg6 s ASP 7 Cb 0.20 0.20 0.71 0.00 -1.09 0.00 0.00 42.92 42.94 1rg6 s ASP 7 CO 0.50 -0.60 1.62 0.00 0.70 0.00 0.00 175.17 177.40 1rg6 n SER 9 N 0.17 -0.94 -0.13 0.00 3.41 -1.26 -3.69 113.62 111.18 1rg6 n SER 9 Ca 0.25 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.74 1rg6 n SER 9 Cb 1.08 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.02 1rg6 n SER 9 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1rg6 h ILE 10 N -1.45 1.27 -0.24 -1.33 1.08 -1.81 -3.14 117.51 111.89 1rg6 h ILE 10 Ca 0.00 -1.52 0.01 0.00 -0.39 0.00 0.00 64.86 62.96 1rg6 h ILE 10 Cb 0.00 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 1rg6 h ILE 10 CO 0.00 0.51 0.14 0.58 -0.69 0.00 0.00 178.15 178.69 1rg6 h VAL 11 N 0.79 1.03 -0.41 1.67 2.07 -1.90 -2.37 116.25 117.13 1rg6 h VAL 11 Ca 0.07 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1rg6 h VAL 11 Cb 0.94 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1rg6 h VAL 11 CO 0.09 0.05 0.27 -1.28 0.02 0.00 0.00 177.57 176.72 1rg6 h SER 12 N 0.29 0.46 -0.86 0.57 0.87 -1.82 -2.82 113.55 110.25 1rg6 h SER 12 Ca 0.09 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1rg6 h SER 12 Cb -0.01 -0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 61.79 1rg6 h SER 12 CO -0.04 0.34 0.57 0.15 -0.53 0.00 0.00 176.83 177.32 1rg6 h PHE 13 N 0.55 1.09 -0.49 2.24 3.57 -1.47 -2.86 116.94 119.56 1rg6 h PHE 13 Ca 0.15 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 1rg6 h PHE 13 Cb -0.06 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 38.30 1rg6 h PHE 13 CO -0.05 0.68 0.21 -0.07 -2.23 0.00 0.00 178.31 176.86 1rg6 h LEU 14 N 1.17 0.66 -0.69 0.59 3.38 -1.19 -2.81 115.31 116.43 1rg6 h LEU 14 Ca 0.32 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1rg6 h LEU 14 Cb -0.13 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1rg6 h LEU 14 CO -0.07 0.63 0.45 0.00 0.09 0.00 0.00 178.44 179.55 1rg6 h ALA 15 N 1.06 0.87 0.00 1.53 0.00 -1.30 1.00 119.26 122.42 1rg6 h ALA 15 Ca 0.17 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1rg6 h ALA 15 Cb 0.16 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1rg6 h ALA 15 CO -0.02 0.29 -0.08 0.00 0.00 0.00 0.00 179.25 179.44 1rg6 h ARG 16 N 0.93 0.00 -0.68 0.00 2.47 -1.35 -1.87 114.38 113.89 1rg6 h ARG 16 Ca 0.25 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 1rg6 h ARG 16 Cb -0.10 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.22 1rg6 h ARG 16 CO -0.06 0.08 0.00 -0.11 0.56 0.00 0.00 179.97 180.45 1rg6 n LEU 17 N -4.42 4.69 -1.11 3.04 7.94 -0.69 -4.92 117.00 121.53 1rg6 n LEU 17 Ca -0.03 -2.36 -0.10 0.00 -1.11 0.00 0.00 56.01 52.41 1rg6 n LEU 17 Cb 0.16 -0.57 -0.01 0.00 0.53 0.00 0.00 43.42 43.52 1rg6 n LEU 17 CO 0.35 0.84 -0.13 0.61 -1.11 0.00 0.00 177.39 177.95 1rg6 n GLY 18 N 1.24 0.23 3.69 -3.96 0.00 -0.70 -5.02 105.19 100.67 1rg6 n GLY 18 Ca 0.26 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.44 0.00 0.25 0.00 2.88 -1.26 -3.22 113.62 111.83 1rg6 n SER 20 Ca -0.09 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.58 1rg6 n SER 20 Cb 0.56 0.00 0.61 0.00 -0.75 0.00 0.00 64.21 64.63 1rg6 n SER 20 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1rg6 h SER 21 N 0.00 0.00 -0.04 -3.46 0.02 -1.99 -2.49 113.55 105.59 1rg6 h SER 21 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rg6 h SER 21 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1rg6 h SER 21 CO 0.00 0.13 0.00 0.00 -1.14 0.00 0.00 176.83 175.82 1rg6 h LEU 23 N 2.32 1.15 -1.36 0.00 5.85 -1.83 -2.59 115.31 118.85 1rg6 h LEU 23 Ca 0.00 -0.03 0.23 0.00 0.84 0.00 0.00 57.88 58.92 1rg6 h LEU 23 Cb 0.50 -0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.15 1rg6 h LEU 23 CO 0.00 0.83 0.63 0.44 -0.34 0.00 0.00 178.44 180.01 1rg6 h ASP 24 N 1.36 0.49 -0.73 1.25 3.32 -1.80 -0.59 116.42 119.72 1rg6 h ASP 24 Ca 0.37 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.42 1rg6 h ASP 24 Cb -0.15 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 1rg6 h ASP 24 CO -0.08 0.16 0.20 1.88 -1.72 0.00 0.00 179.24 179.68 1rg6 h TYR 25 N 0.47 1.21 -0.37 4.55 0.05 -1.77 -2.07 116.97 119.04 1rg6 h TYR 25 Ca 0.54 -0.14 -0.17 0.00 0.05 0.00 0.00 58.73 59.02 1rg6 h TYR 25 Cb 1.26 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 38.65 1rg6 h TYR 25 CO -0.00 0.97 -0.42 0.74 -1.05 0.00 0.00 178.16 178.40 1rg6 h PHE 26 N 1.10 1.13 -0.27 4.88 0.04 -1.22 -3.06 116.94 119.55 1rg6 h PHE 26 Ca 0.23 -0.35 -0.11 0.00 2.80 0.00 0.00 57.97 60.54 1rg6 h PHE 26 Cb 0.35 -0.23 -0.00 0.00 2.20 0.00 0.00 35.95 38.26 1rg6 h PHE 26 CO 0.03 1.18 -0.28 0.00 -0.60 0.00 0.00 178.31 178.65 1rg6 h THR 27 N 0.75 1.31 0.00 -1.55 1.03 -1.34 -1.78 112.91 111.33 1rg6 h THR 27 Ca 0.05 -1.45 0.00 0.00 -0.01 0.00 0.00 66.41 65.01 1rg6 h THR 27 Cb 1.02 1.63 0.00 0.00 -1.07 0.00 0.00 68.15 69.72 1rg6 h THR 27 CO 0.10 0.46 0.00 0.00 -0.01 0.00 0.00 175.52 176.07 1rg6 h THR 28 N 0.39 0.00 -0.01 0.00 1.03 -1.44 -2.83 112.91 110.06 1rg6 h THR 28 Ca 0.04 -0.22 0.00 0.00 -0.01 0.00 0.00 66.41 66.22 1rg6 h THR 28 Cb 0.84 0.95 0.00 0.00 -1.07 0.00 0.00 68.15 68.87 1rg6 h THR 28 CO 0.07 0.00 -0.59 0.00 -0.01 0.00 0.00 175.52 174.99 1rg6 n GLN 29 N -2.34 0.49 -0.39 0.00 1.13 -1.14 -4.95 117.38 110.17 1rg6 n GLN 29 Ca 0.01 -0.36 0.00 0.00 -1.94 0.00 0.00 57.00 54.71 1rg6 n GLN 29 Cb 0.21 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.06 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 1.45 0.84 3.28 1.08 0.00 -1.07 -5.07 105.19 105.70 1rg6 n GLY 30 Ca 0.07 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 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 3.30 -0.07 0.99 1.02 -0.68 -4.96 118.68 118.28 1rg6 s LEU 31 Ca 0.00 -0.68 0.15 0.00 0.02 0.00 0.00 54.13 53.62 1rg6 s LEU 31 Cb 0.00 -1.75 0.30 0.00 0.02 0.00 0.00 46.19 44.76 1rg6 s LEU 31 CO 0.00 -0.11 1.13 0.35 0.02 0.00 0.00 176.35 177.74 1rg6 n THR 32 N 4.77 0.77 -3.71 5.49 -2.24 -1.26 -4.01 114.28 114.09 1rg6 n THR 32 Ca -0.16 -1.43 -0.14 0.00 -2.27 0.00 0.00 64.05 60.05 1rg6 n THR 32 Cb 0.48 0.41 -0.09 0.00 -2.10 0.00 0.00 70.33 69.03 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 -1.15 0.01 0.40 4.28 -4.23 -1.26 -3.97 115.64 109.73 1rg6 s THR 33 Ca 0.26 -0.08 0.11 0.00 -1.18 0.00 0.00 61.69 60.79 1rg6 s THR 33 Cb 0.27 -0.67 0.17 0.00 1.34 0.00 0.00 72.50 73.61 1rg6 s THR 33 CO -0.07 -0.05 1.94 -0.29 -0.54 0.00 0.00 174.62 175.61 1rg6 h ILE 34 N 4.20 1.16 -0.01 2.99 2.10 -1.73 -2.12 117.51 124.10 1rg6 h ILE 34 Ca -0.28 -0.71 0.00 0.00 1.08 0.00 0.00 64.86 64.95 1rg6 h ILE 34 Cb 1.17 1.22 -0.00 0.00 -1.09 0.00 0.00 36.82 38.12 1rg6 h ILE 34 CO 0.26 0.22 0.02 1.88 -1.08 0.00 0.00 178.15 179.45 1rg6 h TYR 35 N 0.17 0.00 -0.09 2.19 0.05 -1.95 -0.55 116.97 116.80 1rg6 h TYR 35 Ca 0.04 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.70 1rg6 h TYR 35 Cb 0.34 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.07 1rg6 h TYR 35 CO 0.00 0.00 -0.47 1.96 -1.05 0.00 0.00 178.16 178.60 1rg6 h GLN 36 N 0.00 0.22 -0.48 4.88 1.08 -1.80 -3.18 115.11 115.83 1rg6 h GLN 36 Ca 0.01 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1rg6 h GLN 36 Cb 0.06 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1rg6 h GLN 36 CO -0.00 0.65 0.00 0.44 -0.95 0.00 0.00 178.83 178.97 1rg6 n ILE 37 N -3.98 0.91 -0.36 2.54 -5.35 -0.28 -4.53 119.36 108.32 1rg6 n ILE 37 Ca -0.02 -0.96 -0.03 0.00 -0.27 0.00 0.00 62.75 61.48 1rg6 n ILE 37 Cb 0.52 0.58 0.10 0.00 -1.74 0.00 0.00 39.64 39.10 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 3.08 1.30 0.00 6.28 5.08 -1.36 -2.98 114.58 125.97 1rg6 h GLU 38 Ca 0.00 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1rg6 h GLU 38 Cb 0.84 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1rg6 h GLU 38 CO 0.00 0.90 -1.53 0.72 -1.00 0.00 0.00 179.01 178.10 1rg6 n HIS 39 N -4.36 0.47 -1.78 4.33 8.25 -1.26 -4.93 115.22 115.94 1rg6 n HIS 39 Ca 0.11 0.14 -0.41 0.00 -0.26 0.00 0.00 57.72 57.30 1rg6 n HIS 39 Cb 0.05 -0.73 -0.00 0.00 1.12 0.00 0.00 29.99 30.43 1rg6 n HIS 39 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1rg6 n TYR 40 N -2.47 3.03 -3.15 4.41 4.02 -1.13 -5.01 117.16 116.86 1rg6 n TYR 40 Ca -0.02 0.44 -0.05 0.00 -0.01 0.00 0.00 57.90 58.26 1rg6 n TYR 40 Cb 0.57 -2.54 0.01 0.00 -0.02 0.00 0.00 39.34 37.36 1rg6 n TYR 40 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1rg6 n SER 41 N 0.45 0.71 -0.27 7.72 7.64 -1.26 -4.92 113.62 123.69 1rg6 n SER 41 Ca 0.01 -1.37 -0.06 0.00 1.01 0.00 0.00 58.87 58.46 1rg6 n SER 41 Cb 0.39 -0.08 0.06 0.00 -1.01 0.00 0.00 64.21 63.57 1rg6 n SER 41 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 1rg6 h MET 42 N 0.00 1.10 -0.52 1.43 2.86 -1.95 -2.26 114.93 115.59 1rg6 h MET 42 Ca -0.07 -0.18 -0.12 0.00 -2.06 0.00 0.00 59.70 57.27 1rg6 h MET 42 Cb 0.29 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 1rg6 h MET 42 CO 0.10 0.87 -0.16 -0.44 1.06 0.00 0.00 176.91 178.34 1rg6 h ASP 43 N 1.06 1.04 -0.49 1.22 3.32 -1.96 -2.96 116.42 117.66 1rg6 h ASP 43 Ca 0.25 -0.37 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 1rg6 h ASP 43 Cb 0.16 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1rg6 h ASP 43 CO -0.03 1.18 0.19 0.44 -1.72 0.00 0.00 179.24 179.30 1rg6 h ASP 44 N 0.90 0.73 0.58 6.45 3.32 -1.88 -2.43 116.42 124.09 1rg6 h ASP 44 Ca 0.13 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1rg6 h ASP 44 Cb 0.74 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1rg6 h ASP 44 CO 0.06 0.68 -0.33 0.25 -1.72 0.00 0.00 179.24 178.18 1rg6 h LEU 45 N 0.78 0.00 -0.31 1.55 5.85 -1.25 -3.16 115.31 118.78 1rg6 h LEU 45 Ca 0.18 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1rg6 h LEU 45 Cb 0.20 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 1rg6 h LEU 45 CO -0.01 0.33 0.10 0.00 -0.34 0.00 0.00 178.44 178.51 1rg6 h ALA 46 N 1.67 0.35 -0.25 1.25 0.00 -1.31 -0.23 119.26 120.74 1rg6 h ALA 46 Ca -0.00 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.02 1rg6 h ALA 46 Cb 0.71 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1rg6 h ALA 46 CO 0.04 -0.31 0.44 1.03 0.00 0.00 0.00 179.25 180.46 1rg6 h SER 47 N 0.23 0.00 0.00 0.00 0.87 -1.65 -0.54 113.55 112.46 1rg6 h SER 47 Ca 0.14 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1rg6 h SER 47 Cb 0.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1rg6 h SER 47 CO -0.15 0.00 0.00 -0.11 -0.53 0.00 0.00 176.83 176.04 1rg6 n LEU 48 N -3.33 0.00 0.00 2.23 7.94 -0.10 -4.83 117.00 118.92 1rg6 n LEU 48 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1rg6 n LEU 48 Cb 0.56 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.51 1rg6 n LEU 48 CO 0.21 0.00 0.00 1.17 -1.11 0.00 0.00 177.39 177.66 1rg6 n LYS 49 N -0.83 0.00 -2.64 1.96 4.81 -0.21 -4.78 118.16 116.47 1rg6 n LYS 49 Ca 0.08 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.14 1rg6 n LYS 49 Cb 0.04 -1.49 -0.05 0.00 0.02 0.00 0.00 35.03 33.55 1rg6 n LYS 49 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1rg6 s ILE 50 N -3.12 3.90 1.08 3.15 1.01 -1.25 -5.03 121.20 120.94 1rg6 s ILE 50 Ca 0.00 1.62 -0.13 0.00 0.00 0.00 0.00 60.65 62.14 1rg6 s ILE 50 Cb 0.00 -3.92 0.24 0.00 0.01 0.00 0.00 42.46 38.79 1rg6 s ILE 50 CO 0.00 0.17 1.06 -2.16 0.00 0.00 0.00 174.94 174.01 1rg6 s PRO 51 N -2.02 -0.27 0.43 2.79 0.04 -1.26 -4.70 135.00 130.01 1rg6 s PRO 51 Ca 0.51 0.67 0.23 0.00 0.04 0.00 0.00 61.00 62.45 1rg6 s PRO 51 Cb -0.23 -1.64 0.91 0.00 0.04 0.00 0.00 34.50 33.58 1rg6 s PRO 51 CO 0.29 -3.24 1.83 0.93 0.04 0.00 0.00 177.00 176.85 1rg6 h GLU 52 N -2.27 0.00 0.00 4.56 5.08 -1.97 -3.11 114.58 116.87 1rg6 h GLU 52 Ca -0.58 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.76 1rg6 h GLU 52 Cb 1.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.58 1rg6 h GLU 52 CO 0.54 0.26 -0.10 0.37 -1.00 0.00 0.00 179.01 179.08 1rg6 h GLN 53 N 0.00 0.00 -0.01 2.33 4.15 -2.03 -2.46 115.11 117.09 1rg6 h GLN 53 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1rg6 h GLN 53 Cb 0.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1rg6 h GLN 53 CO 0.03 0.10 -0.62 1.19 -1.93 0.00 0.00 178.83 177.60 1rg6 n PHE 54 N -3.90 0.00 -0.10 3.99 3.01 -1.18 -4.05 117.46 115.23 1rg6 n PHE 54 Ca -0.02 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.30 1rg6 n PHE 54 Cb 0.19 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.63 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 1.72 0.91 0.15 -1.08 3.08 -1.48 -2.26 114.38 115.42 1rg6 h ARG 55 Ca 0.00 -0.53 -0.29 0.00 0.07 0.00 0.00 59.98 59.23 1rg6 h ARG 55 Cb 0.68 0.04 0.02 0.00 0.08 0.00 0.00 29.97 30.79 1rg6 h ARG 55 CO 0.00 1.18 -1.27 1.25 -1.07 0.00 0.00 179.97 180.06 1rg6 h HIS 56 N 0.72 0.74 -0.36 3.04 2.76 -1.75 -2.35 115.15 117.94 1rg6 h HIS 56 Ca 0.04 -0.51 -0.10 0.00 -2.20 0.00 0.00 60.37 57.60 1rg6 h HIS 56 Cb 1.08 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.99 1rg6 h HIS 56 CO 0.07 1.38 -0.17 0.00 -1.30 0.00 0.00 177.93 177.91 1rg6 h ALA 57 N 0.43 0.51 -0.01 5.26 0.00 -1.70 -2.38 119.26 121.37 1rg6 h ALA 57 Ca -0.17 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.21 1rg6 h ALA 57 Cb 1.97 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.65 1rg6 h ALA 57 CO 0.23 0.44 -0.67 0.82 0.00 0.00 0.00 179.25 180.07 1rg6 h ILE 58 N 0.55 1.39 -0.66 0.00 2.04 -1.52 -3.27 117.51 116.04 1rg6 h ILE 58 Ca 0.08 -2.08 0.01 0.00 1.00 0.00 0.00 64.86 63.87 1rg6 h ILE 58 Cb 0.71 2.50 -0.03 0.00 -0.74 0.00 0.00 36.82 39.26 1rg6 h ILE 58 CO 0.05 0.61 0.44 -0.25 0.00 0.00 0.00 178.15 179.00 1rg6 h TRP 59 N 0.02 0.83 -1.00 1.37 7.01 -1.47 -2.31 115.95 120.40 1rg6 h TRP 59 Ca -0.08 0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.95 1rg6 h TRP 59 Cb 1.36 -0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 28.09 1rg6 h TRP 59 CO 0.13 0.53 0.66 -0.22 -2.79 0.00 0.00 178.44 176.75 1rg6 h LYS 60 N 0.90 1.32 -0.04 2.65 3.64 -1.47 -1.79 116.57 121.78 1rg6 h LYS 60 Ca 0.24 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 1rg6 h LYS 60 Cb -0.10 -0.30 -0.01 0.00 -0.41 0.00 0.00 32.23 31.41 1rg6 h LYS 60 CO -0.05 0.87 -0.39 0.78 -2.27 0.00 0.00 179.45 178.39 1rg6 h GLY 61 N 1.36 0.09 0.97 5.01 0.00 -1.48 -3.03 103.07 105.98 1rg6 h GLY 61 Ca 0.37 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.55 1rg6 h GLY 61 CO -0.08 0.07 0.01 -2.22 0.00 0.00 0.00 176.54 174.33 1rg6 h ILE 62 N 0.07 1.26 -0.05 2.60 2.04 -1.14 -2.62 117.51 119.67 1rg6 h ILE 62 Ca 0.01 -1.01 0.00 0.00 1.00 0.00 0.00 64.86 64.86 1rg6 h ILE 62 Cb 0.73 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1rg6 h ILE 62 CO 0.05 0.35 0.04 -0.07 0.00 0.00 0.00 178.15 178.52 1rg6 h LEU 63 N 0.60 0.06 -1.02 1.44 3.38 -1.37 -2.85 115.31 115.55 1rg6 h LEU 63 Ca 0.12 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1rg6 h LEU 63 Cb 0.47 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1rg6 h LEU 63 CO 0.02 0.05 0.67 0.44 0.09 0.00 0.00 178.44 179.70 1rg6 h ASP 64 N 0.07 1.15 -0.27 -0.43 3.32 -1.52 -2.74 116.42 116.01 1rg6 h ASP 64 Ca 0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1rg6 h ASP 64 Cb -0.01 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 1rg6 h ASP 64 CO -0.00 0.83 0.17 -0.74 -1.72 0.00 0.00 179.24 177.78 1rg6 h HIS 65 N 1.36 0.33 -0.44 4.55 2.76 -1.26 -2.39 115.15 120.05 1rg6 h HIS 65 Ca 0.37 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.55 1rg6 h HIS 65 Cb -0.16 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 28.67 1rg6 h HIS 65 CO -0.00 0.20 0.29 -0.09 -1.30 0.00 0.00 177.93 177.04 1rg6 h ARG 66 N 0.35 0.58 -0.86 5.26 9.65 -1.28 -2.46 114.38 125.61 1rg6 h ARG 66 Ca 0.10 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 1rg6 h ARG 66 Cb -0.03 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.37 1rg6 h ARG 66 CO -0.03 0.39 0.55 1.96 2.80 0.00 0.00 179.97 185.64 1rg6 h GLN 67 N 0.60 1.15 -0.18 0.20 1.08 -1.29 -2.58 115.11 114.09 1rg6 h GLN 67 Ca 0.16 -0.08 -0.13 0.00 -1.45 0.00 0.00 58.65 57.14 1rg6 h GLN 67 Cb -0.07 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 27.10 1rg6 h GLN 67 CO -0.03 0.78 -0.46 -0.07 -0.95 0.00 0.00 178.83 178.10 1rg6 h LEU 68 N 1.18 0.48 -8.62 1.46 3.38 -1.17 -3.40 115.31 108.61 1rg6 h LEU 68 Ca 0.31 -0.22 -0.66 0.00 0.09 0.00 0.00 57.88 57.40 1rg6 h LEU 68 Cb -0.10 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 40.36 1rg6 h LEU 68 CO -0.06 0.87 -0.00 -2.28 0.09 0.00 0.00 178.44 177.06 1rg6 s HIS 69 N -4.11 3.12 -0.31 1.13 2.46 -0.95 -5.03 115.29 111.60 1rg6 s HIS 69 Ca -0.06 -0.07 -0.11 0.00 0.47 0.00 0.00 55.06 55.29 1rg6 s HIS 69 Cb 0.12 -3.12 -0.02 0.00 -0.13 0.00 0.00 32.58 29.43 1rg6 s HIS 69 CO 0.81 -0.74 0.18 -2.00 -2.47 0.00 0.00 174.74 170.52 1rg6 s GLU 70 N 2.54 3.57 0.00 2.88 2.56 -1.26 -4.85 118.70 124.14 1rg6 s GLU 70 Ca 0.19 -0.57 0.03 0.00 0.00 0.00 0.00 54.97 54.62 1rg6 s GLU 70 Cb -0.15 -3.64 0.02 0.00 2.00 0.00 0.00 34.13 32.36 1rg6 s GLU 70 CO 0.16 -0.34 0.58 0.34 -0.56 0.00 0.00 175.26 175.44