#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 0.13 -0.12 0.52 -1.32 -1.26 -5.15 115.64 108.44 1rg6 s THR 6 Ca 0.00 -1.10 -0.04 0.00 -1.21 0.00 0.00 61.69 59.34 1rg6 s THR 6 Cb 0.00 -0.57 -0.04 0.00 -1.51 0.00 0.00 72.50 70.39 1rg6 s THR 6 CO 0.00 -0.60 0.03 1.51 -2.21 0.00 0.00 174.62 173.35 1rg6 s ASP 7 N -1.80 5.43 -0.25 8.08 -4.77 -1.26 -5.00 116.67 117.11 1rg6 s ASP 7 Ca -0.11 0.14 0.11 0.00 -3.30 0.00 0.00 52.55 49.40 1rg6 s ASP 7 Cb -0.06 -1.71 0.48 0.00 -1.09 0.00 0.00 42.92 40.55 1rg6 s ASP 7 CO -0.03 0.31 1.41 0.00 0.70 0.00 0.00 175.17 177.56 1rg6 n SER 9 N -1.03 -3.79 -0.12 0.00 3.41 -1.26 -3.96 113.62 106.87 1rg6 n SER 9 Ca 0.28 -0.71 -0.12 0.00 -0.26 0.00 0.00 58.87 58.06 1rg6 n SER 9 Cb 0.94 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 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 -3.36 1.27 -0.12 -1.33 2.04 -1.82 -3.17 117.51 111.02 1rg6 h ILE 10 Ca -0.34 -1.49 0.05 0.00 1.00 0.00 0.00 64.86 64.08 1rg6 h ILE 10 Cb 1.11 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 38.42 1rg6 h ILE 10 CO 0.20 0.50 -0.34 0.58 0.00 0.00 0.00 178.15 179.10 1rg6 h VAL 11 N 0.77 0.26 -1.01 1.67 2.07 -1.90 -2.05 116.25 116.06 1rg6 h VAL 11 Ca 0.08 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.61 1rg6 h VAL 11 Cb 0.90 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 1rg6 h VAL 11 CO 0.08 0.00 0.67 0.28 0.02 0.00 0.00 177.57 178.62 1rg6 h SER 12 N -0.42 1.16 -0.54 0.57 0.02 -1.91 -2.91 113.55 109.51 1rg6 h SER 12 Ca 0.09 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1rg6 h SER 12 Cb 0.56 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 1rg6 h SER 12 CO -0.35 0.84 0.36 0.15 -1.14 0.00 0.00 176.83 176.68 1rg6 h PHE 13 N 1.37 0.69 -0.95 3.45 3.57 -1.37 -2.74 116.94 120.96 1rg6 h PHE 13 Ca 0.37 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.88 1rg6 h PHE 13 Cb -0.16 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.31 1rg6 h PHE 13 CO -0.00 0.44 0.57 -0.07 -2.23 0.00 0.00 178.31 177.01 1rg6 h LEU 14 N 0.74 1.14 -0.74 0.59 3.38 -1.20 -2.29 115.31 116.93 1rg6 h LEU 14 Ca 0.20 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1rg6 h LEU 14 Cb -0.08 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.34 1rg6 h LEU 14 CO -0.04 0.88 0.46 0.00 0.09 0.00 0.00 178.44 179.83 1rg6 h ALA 15 N 1.32 0.94 0.00 1.53 0.00 -1.35 0.88 119.26 122.58 1rg6 h ALA 15 Ca 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1rg6 h ALA 15 Cb -0.05 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 1rg6 h ALA 15 CO -0.06 0.39 -0.06 0.00 0.00 0.00 0.00 179.25 179.52 1rg6 h ARG 16 N 1.01 0.00 -0.65 0.00 3.08 -1.14 -0.86 114.38 115.81 1rg6 h ARG 16 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1rg6 h ARG 16 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1rg6 h ARG 16 CO -0.05 0.06 0.00 -0.11 -1.07 0.00 0.00 179.97 178.80 1rg6 n LEU 17 N -4.37 4.20 -1.33 3.04 7.94 -0.57 -4.90 117.00 121.00 1rg6 n LEU 17 Ca -0.03 -2.12 -0.13 0.00 -1.11 0.00 0.00 56.01 52.63 1rg6 n LEU 17 Cb 0.15 -0.53 -0.02 0.00 0.53 0.00 0.00 43.42 43.55 1rg6 n LEU 17 CO 0.34 0.77 -0.15 0.61 -1.11 0.00 0.00 177.39 177.85 1rg6 n GLY 18 N 1.18 0.22 3.55 -3.96 0.00 -0.33 -5.01 105.19 100.84 1rg6 n GLY 18 Ca 0.23 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 0.42 0.00 0.29 0.00 3.41 -1.26 -2.86 113.62 113.62 1rg6 n SER 20 Ca -0.13 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.63 1rg6 n SER 20 Cb 0.54 0.00 0.89 0.00 -0.26 0.00 0.00 64.21 65.38 1rg6 n SER 20 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1rg6 h SER 21 N 0.00 0.00 -0.27 4.04 0.02 -1.99 -1.06 113.55 114.29 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 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1rg6 h LEU 23 N 2.11 1.13 -1.28 0.00 5.85 -1.58 -2.67 115.31 118.86 1rg6 h LEU 23 Ca 0.00 -0.02 0.17 0.00 0.84 0.00 0.00 57.88 58.87 1rg6 h LEU 23 Cb 0.47 -0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.15 1rg6 h LEU 23 CO 0.00 0.80 0.60 -0.78 -0.34 0.00 0.00 178.44 178.71 1rg6 h ASP 24 N 1.32 0.62 -0.74 1.25 1.82 -1.81 -1.89 116.42 116.99 1rg6 h ASP 24 Ca 0.38 0.05 -0.05 0.00 -0.39 0.00 0.00 57.03 57.03 1rg6 h ASP 24 Cb -0.09 -0.06 -0.03 0.00 0.68 0.00 0.00 39.33 39.83 1rg6 h ASP 24 CO -0.10 0.27 0.26 1.88 -1.61 0.00 0.00 179.24 179.94 1rg6 h TYR 25 N 0.63 1.16 -0.31 0.28 0.05 -1.80 -2.20 116.97 114.78 1rg6 h TYR 25 Ca 0.49 -0.10 -0.14 0.00 0.05 0.00 0.00 58.73 59.02 1rg6 h TYR 25 Cb 0.91 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 38.30 1rg6 h TYR 25 CO -0.00 0.90 -0.35 0.74 -1.05 0.00 0.00 178.16 178.40 1rg6 h PHE 26 N 1.08 0.96 -0.59 4.88 -1.00 -1.46 -3.01 116.94 117.80 1rg6 h PHE 26 Ca 0.24 -0.30 -0.09 0.00 2.81 0.00 0.00 57.97 60.63 1rg6 h PHE 26 Cb 0.27 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.61 1rg6 h PHE 26 CO 0.02 1.08 -0.00 0.00 -1.61 0.00 0.00 178.31 177.80 1rg6 h THR 27 N 0.56 1.26 0.00 -1.55 1.03 -1.42 -2.32 112.91 110.47 1rg6 h THR 27 Ca 0.04 -1.14 0.00 0.00 -0.01 0.00 0.00 66.41 65.30 1rg6 h THR 27 Cb 0.94 0.81 0.00 0.00 -1.07 0.00 0.00 68.15 68.84 1rg6 h THR 27 CO 0.09 0.41 0.00 0.74 -0.01 0.00 0.00 175.52 176.75 1rg6 h THR 28 N 0.94 0.00 -0.00 0.00 2.02 -1.39 -2.94 112.91 111.53 1rg6 h THR 28 Ca 0.17 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1rg6 h THR 28 Cb 0.55 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1rg6 h THR 28 CO 0.03 0.00 -0.88 0.00 0.37 0.00 0.00 175.52 175.04 1rg6 n GLN 29 N -2.68 0.13 -0.56 6.66 1.13 -0.94 -4.96 117.38 116.17 1rg6 n GLN 29 Ca 0.01 -0.10 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1rg6 n GLN 29 Cb 0.22 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.07 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 1.49 0.68 3.48 1.08 0.00 -1.10 -5.04 105.19 105.78 1rg6 n GLY 30 Ca 0.05 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 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 4.69 -0.05 0.99 1.43 -0.92 -4.91 118.68 119.91 1rg6 s LEU 31 Ca 0.00 -0.64 0.19 0.00 -1.03 0.00 0.00 54.13 52.66 1rg6 s LEU 31 Cb 0.00 -2.12 0.37 0.00 0.03 0.00 0.00 46.19 44.47 1rg6 s LEU 31 CO 0.00 -0.31 1.16 0.35 0.23 0.00 0.00 176.35 177.78 1rg6 n THR 32 N 5.10 0.57 -3.76 5.49 -2.24 -1.26 -4.32 114.28 113.86 1rg6 n THR 32 Ca -0.12 -1.43 -0.13 0.00 -2.27 0.00 0.00 64.05 60.10 1rg6 n THR 32 Cb 0.48 0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 69.22 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 -0.84 -0.00 0.42 4.28 -4.23 -1.26 -4.28 115.64 109.72 1rg6 s THR 33 Ca 0.31 0.01 0.13 0.00 -1.18 0.00 0.00 61.69 60.96 1rg6 s THR 33 Cb 0.33 -0.46 0.15 0.00 1.34 0.00 0.00 72.50 73.86 1rg6 s THR 33 CO -0.12 0.00 1.92 -0.29 -0.54 0.00 0.00 174.62 175.60 1rg6 h ILE 34 N 4.69 1.19 0.00 2.99 2.10 -1.80 -2.12 117.51 124.55 1rg6 h ILE 34 Ca -0.27 -0.88 -0.00 0.00 1.08 0.00 0.00 64.86 64.79 1rg6 h ILE 34 Cb 1.19 1.47 -0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1rg6 h ILE 34 CO 0.30 0.25 -0.00 1.88 -1.08 0.00 0.00 178.15 179.50 1rg6 h TYR 35 N 0.01 0.00 -0.00 2.19 0.05 -1.95 -0.81 116.97 116.46 1rg6 h TYR 35 Ca -0.00 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.67 1rg6 h TYR 35 Cb 0.45 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 1rg6 h TYR 35 CO 0.00 0.00 -0.50 1.96 -1.05 0.00 0.00 178.16 178.57 1rg6 h GLN 36 N 0.00 0.00 -0.31 4.88 1.08 -1.80 -3.17 115.11 115.79 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 0.50 0.00 0.44 -0.95 0.00 0.00 178.83 178.82 1rg6 n ILE 37 N -3.95 1.44 -0.27 2.54 -5.35 -0.39 -4.60 119.36 108.78 1rg6 n ILE 37 Ca -0.02 -1.30 -0.00 0.00 -0.27 0.00 0.00 62.75 61.16 1rg6 n ILE 37 Cb 0.51 0.24 0.20 0.00 -1.74 0.00 0.00 39.64 38.86 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 1.90 1.10 0.00 6.28 5.08 -1.30 -2.80 114.58 124.84 1rg6 h GLU 38 Ca 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1rg6 h GLU 38 Cb 0.97 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1rg6 h GLU 38 CO 0.08 0.73 -1.24 0.72 -1.00 0.00 0.00 179.01 178.30 1rg6 n HIS 39 N -4.41 0.04 -1.78 4.33 8.25 -1.26 -4.96 115.22 115.43 1rg6 n HIS 39 Ca 0.10 0.01 -0.41 0.00 -0.26 0.00 0.00 57.72 57.16 1rg6 n HIS 39 Cb 0.03 -0.20 -0.00 0.00 1.12 0.00 0.00 29.99 30.93 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 -1.76 3.02 -3.16 4.41 4.02 -1.06 -5.01 117.16 117.62 1rg6 n TYR 40 Ca 0.02 0.44 -0.18 0.00 -0.01 0.00 0.00 57.90 58.17 1rg6 n TYR 40 Cb 0.41 -2.54 0.05 0.00 -0.02 0.00 0.00 39.34 37.24 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 0.46 1.95 -0.29 7.72 7.64 -1.26 -4.94 113.62 124.90 1rg6 n SER 41 Ca 0.01 -2.39 -0.05 0.00 1.01 0.00 0.00 58.87 57.45 1rg6 n SER 41 Cb 0.39 -0.32 0.07 0.00 -1.01 0.00 0.00 64.21 63.34 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 1.20 -0.55 1.43 2.86 -1.95 -2.19 114.93 115.73 1rg6 h MET 42 Ca -0.25 -0.21 -0.12 0.00 -2.06 0.00 0.00 59.70 57.06 1rg6 h MET 42 Cb 1.09 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 1rg6 h MET 42 CO 0.36 0.96 -0.11 -0.44 1.06 0.00 0.00 176.91 178.74 1rg6 h ASP 43 N 1.17 1.05 -0.20 1.22 3.32 -1.96 -2.90 116.42 118.12 1rg6 h ASP 43 Ca 0.27 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 1rg6 h ASP 43 Cb 0.20 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1rg6 h ASP 43 CO -0.02 1.16 -0.02 0.44 -1.72 0.00 0.00 179.24 179.07 1rg6 h ASP 44 N 0.93 0.47 0.74 6.45 3.32 -1.88 -2.47 116.42 123.97 1rg6 h ASP 44 Ca 0.14 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 1rg6 h ASP 44 Cb 0.69 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 1rg6 h ASP 44 CO 0.05 0.55 -0.13 0.25 -1.72 0.00 0.00 179.24 178.24 1rg6 h LEU 45 N 0.47 0.00 -0.49 1.55 5.85 -1.19 -3.11 115.31 118.39 1rg6 h LEU 45 Ca 0.10 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1rg6 h LEU 45 Cb 0.34 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1rg6 h LEU 45 CO 0.01 0.13 0.25 0.00 -0.34 0.00 0.00 178.44 178.49 1rg6 h ALA 46 N 1.87 0.62 -0.45 1.25 0.00 -1.40 -0.58 119.26 120.58 1rg6 h ALA 46 Ca -0.00 0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.05 1rg6 h ALA 46 Cb 0.53 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1rg6 h ALA 46 CO 0.02 -0.09 0.57 1.03 0.00 0.00 0.00 179.25 180.78 1rg6 h SER 47 N 0.49 0.00 0.00 0.00 0.87 -1.70 0.23 113.55 113.45 1rg6 h SER 47 Ca 0.21 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 1rg6 h SER 47 Cb 0.11 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1rg6 h SER 47 CO -0.14 0.00 0.00 -0.11 -0.53 0.00 0.00 176.83 176.05 1rg6 n LEU 48 N -3.48 0.00 0.00 2.23 0.00 -0.22 -4.84 117.00 110.68 1rg6 n LEU 48 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.09 1rg6 n LEU 48 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.17 1rg6 n LEU 48 CO 0.24 0.00 0.00 0.29 0.00 0.00 0.00 177.39 177.92 1rg6 n LYS 49 N -0.60 -0.88 -2.67 1.96 5.02 0.80 -4.81 118.16 116.98 1rg6 n LYS 49 Ca 0.04 0.22 -0.41 0.00 -2.02 0.00 0.00 58.31 56.14 1rg6 n LYS 49 Cb 0.02 -3.93 -0.05 0.00 -0.02 0.00 0.00 35.03 31.04 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 -1.62 4.11 1.02 -0.18 1.01 -1.25 -5.03 121.20 119.25 1rg6 s ILE 50 Ca 0.00 1.93 -0.14 0.00 0.00 0.00 0.00 60.65 62.44 1rg6 s ILE 50 Cb 0.00 -4.23 0.20 0.00 0.01 0.00 0.00 42.46 38.44 1rg6 s ILE 50 CO 0.00 0.38 1.11 -2.16 0.00 0.00 0.00 174.94 174.28 1rg6 s PRO 51 N -0.67 0.28 0.42 2.79 0.04 -1.26 -4.73 135.00 131.88 1rg6 s PRO 51 Ca 0.45 0.32 0.16 0.00 0.04 0.00 0.00 61.00 61.97 1rg6 s PRO 51 Cb -0.26 -1.74 0.93 0.00 0.04 0.00 0.00 34.50 33.47 1rg6 s PRO 51 CO 0.33 -2.79 1.91 0.93 0.04 0.00 0.00 177.00 177.42 1rg6 h GLU 52 N -1.93 0.00 0.00 4.56 5.08 -1.99 -1.68 114.58 118.63 1rg6 h GLU 52 Ca -0.52 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1rg6 h GLU 52 Cb 1.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 1rg6 h GLU 52 CO 0.55 0.27 -0.01 0.37 -1.00 0.00 0.00 179.01 179.19 1rg6 h GLN 53 N 0.00 0.00 0.00 2.33 4.15 -2.02 -1.81 115.11 117.76 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 0.51 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1rg6 h GLN 53 CO 0.04 0.01 -1.08 1.19 -1.93 0.00 0.00 178.83 177.05 1rg6 n PHE 54 N -4.35 0.00 -0.04 3.99 3.01 -0.91 -4.02 117.46 115.14 1rg6 n PHE 54 Ca -0.03 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.29 1rg6 n PHE 54 Cb 0.09 -0.09 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 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 0.00 0.36 0.00 -1.08 3.08 -0.43 -2.37 114.38 113.94 1rg6 h ARG 55 Ca 0.00 -0.24 -0.16 0.00 0.07 0.00 0.00 59.98 59.66 1rg6 h ARG 55 Cb 0.53 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 1rg6 h ARG 55 CO 0.00 0.84 -0.74 1.12 -1.07 0.00 0.00 179.97 180.12 1rg6 h HIS 56 N -0.07 0.00 -0.11 3.04 2.07 -1.75 -2.71 115.15 115.61 1rg6 h HIS 56 Ca 0.00 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.41 1rg6 h HIS 56 Cb 0.83 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.82 1rg6 h HIS 56 CO 0.11 0.74 -0.36 0.00 -3.07 0.00 0.00 177.93 175.35 1rg6 h ALA 57 N 1.26 0.19 -0.16 6.11 0.00 -1.69 -2.52 119.26 122.44 1rg6 h ALA 57 Ca -0.01 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 1rg6 h ALA 57 Cb 1.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1rg6 h ALA 57 CO 0.10 0.27 -0.38 0.82 0.00 0.00 0.00 179.25 180.05 1rg6 h ILE 58 N 0.02 1.35 -0.94 0.00 2.04 -1.52 -3.20 117.51 115.24 1rg6 h ILE 58 Ca -0.01 -1.64 0.01 0.00 1.00 0.00 0.00 64.86 64.22 1rg6 h ILE 58 Cb 0.98 1.97 -0.05 0.00 -0.74 0.00 0.00 36.82 38.99 1rg6 h ILE 58 CO 0.08 0.50 0.62 -0.25 0.00 0.00 0.00 178.15 179.10 1rg6 h TRP 59 N 0.19 1.18 -1.01 1.37 7.01 -1.57 -2.53 115.95 120.59 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 0.99 -0.40 -0.05 0.00 -2.10 0.00 0.00 29.16 27.60 1rg6 h TRP 59 CO 0.10 0.75 0.67 -0.22 -2.79 0.00 0.00 178.44 176.94 1rg6 h LYS 60 N 1.28 1.32 -0.03 2.65 3.64 -1.45 -2.43 116.57 121.55 1rg6 h LYS 60 Ca 0.35 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.49 1rg6 h LYS 60 Cb -0.15 -0.30 -0.01 0.00 -0.41 0.00 0.00 32.23 31.36 1rg6 h LYS 60 CO -0.08 0.87 -0.70 0.78 -2.27 0.00 0.00 179.45 178.05 1rg6 h GLY 61 N 1.36 0.19 1.12 5.01 0.00 -1.47 -3.22 103.07 106.06 1rg6 h GLY 61 Ca 0.37 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.29 1rg6 h GLY 61 CO -0.08 0.24 -0.29 -2.22 0.00 0.00 0.00 176.54 174.18 1rg6 h ILE 62 N 0.11 1.27 -0.49 2.60 2.04 -1.07 -2.94 117.51 119.03 1rg6 h ILE 62 Ca -0.02 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 1rg6 h ILE 62 Cb 1.25 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1rg6 h ILE 62 CO 0.10 0.50 0.31 0.17 0.00 0.00 0.00 178.15 179.23 1rg6 h LEU 63 N 0.82 0.58 -1.21 1.44 8.10 -1.48 -2.41 115.31 121.16 1rg6 h LEU 63 Ca 0.09 -0.04 0.04 0.00 0.11 0.00 0.00 57.88 58.07 1rg6 h LEU 63 Cb 0.88 -0.15 -0.05 0.00 -0.44 0.00 0.00 40.66 40.91 1rg6 h LEU 63 CO 0.08 0.45 0.55 0.44 -4.11 0.00 0.00 178.44 175.85 1rg6 h ASP 64 N 0.66 0.89 -0.83 0.17 3.32 -1.56 -1.54 116.42 117.54 1rg6 h ASP 64 Ca 0.18 -0.01 0.24 0.00 0.02 0.00 0.00 57.03 57.46 1rg6 h ASP 64 Cb -0.03 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1rg6 h ASP 64 CO -0.04 0.61 0.67 -0.74 -1.72 0.00 0.00 179.24 178.02 1rg6 h HIS 65 N 1.03 0.00 -0.35 4.55 2.76 -1.25 0.26 115.15 122.16 1rg6 h HIS 65 Ca 0.33 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.35 1rg6 h HIS 65 Cb 0.04 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.00 1rg6 h HIS 65 CO -0.00 0.00 -0.37 0.00 -1.30 0.00 0.00 177.93 176.26 1rg6 h ARG 66 N 0.00 0.86 -0.69 5.26 3.08 -1.34 -3.15 114.38 118.41 1rg6 h ARG 66 Ca 0.39 -0.47 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1rg6 h ARG 66 Cb 1.72 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.76 1rg6 h ARG 66 CO -0.00 1.11 0.12 1.96 -1.07 0.00 0.00 179.97 182.09 1rg6 h GLN 67 N 0.66 1.13 0.00 0.04 4.20 -1.05 -2.83 115.11 117.27 1rg6 h GLN 67 Ca 0.05 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 1rg6 h GLN 67 Cb 0.96 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.61 1rg6 h GLN 67 CO 0.09 1.02 -0.02 1.37 -0.67 0.00 0.00 178.83 180.62 1rg6 h LEU 68 N 1.06 0.00 -8.67 1.46 8.10 -1.60 -3.42 115.31 112.24 1rg6 h LEU 68 Ca 0.21 0.00 -0.59 0.00 0.11 0.00 0.00 57.88 57.61 1rg6 h LEU 68 Cb 0.43 0.00 -0.10 0.00 -0.44 0.00 0.00 40.66 40.56 1rg6 h LEU 68 CO 0.01 0.02 0.66 -2.28 -4.11 0.00 0.00 178.44 172.75 1rg6 s HIS 69 N -3.49 2.89 0.31 0.17 2.46 -1.07 -5.01 115.29 111.55 1rg6 s HIS 69 Ca 0.03 0.45 -0.29 0.00 0.47 0.00 0.00 55.06 55.72 1rg6 s HIS 69 Cb 0.08 -4.08 -0.10 0.00 -0.13 0.00 0.00 32.58 28.34 1rg6 s HIS 69 CO 0.60 -1.15 1.29 -2.00 -2.47 0.00 0.00 174.74 171.01 1rg6 s GLU 70 N 3.92 4.39 0.00 2.88 2.12 -1.26 -4.96 118.70 125.79 1rg6 s GLU 70 Ca 0.39 2.15 0.10 0.00 0.36 0.00 0.00 54.97 57.98 1rg6 s GLU 70 Cb -0.09 -3.10 0.62 0.00 0.26 0.00 0.00 34.13 31.82 1rg6 s GLU 70 CO 0.28 -0.15 1.06 1.97 -0.54 0.00 0.00 175.26 177.88