#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 0.85 -0.05 0.52 -4.23 -1.26 -5.15 115.64 106.32 1rg6 s THR 6 Ca 0.00 -1.98 0.07 0.00 -1.18 0.00 0.00 61.69 58.60 1rg6 s THR 6 Cb 0.00 -1.74 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 1rg6 s THR 6 CO 0.00 -0.83 -0.25 -1.81 -0.54 0.00 0.00 174.62 171.19 1rg6 s ASP 7 N -3.09 3.07 -0.37 3.99 1.01 -1.26 -5.02 116.67 115.00 1rg6 s ASP 7 Ca 0.14 -0.50 0.05 0.00 0.71 0.00 0.00 52.55 52.95 1rg6 s ASP 7 Cb 0.04 -0.71 0.46 0.00 1.01 0.00 0.00 42.92 43.72 1rg6 s ASP 7 CO -0.03 0.26 1.40 0.00 0.21 0.00 0.00 175.17 177.01 1rg6 n SER 9 N -0.80 -3.05 -0.12 0.00 3.41 -1.26 -3.32 113.62 108.48 1rg6 n SER 9 Ca 0.47 -0.47 -0.09 0.00 -0.26 0.00 0.00 58.87 58.53 1rg6 n SER 9 Cb 0.90 -0.98 0.07 0.00 -0.26 0.00 0.00 64.21 63.93 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 -2.92 1.27 -0.43 -1.33 2.04 -1.83 -3.24 117.51 111.06 1rg6 h ILE 10 Ca -0.44 -1.32 0.09 0.00 1.00 0.00 0.00 64.86 64.19 1rg6 h ILE 10 Cb 1.19 1.14 -0.09 0.00 -0.74 0.00 0.00 36.82 38.33 1rg6 h ILE 10 CO 0.30 0.45 -0.13 0.58 0.00 0.00 0.00 178.15 179.35 1rg6 h VAL 11 N 0.75 0.52 -1.01 1.67 2.07 -1.90 -1.60 116.25 116.75 1rg6 h VAL 11 Ca 0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.64 1rg6 h VAL 11 Cb 0.72 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 1rg6 h VAL 11 CO 0.06 0.00 0.67 0.28 0.02 0.00 0.00 177.57 178.59 1rg6 h SER 12 N -0.03 1.16 0.00 0.57 0.02 -1.91 -2.64 113.55 110.72 1rg6 h SER 12 Ca 0.21 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1rg6 h SER 12 Cb 0.35 -0.29 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1rg6 h SER 12 CO -0.46 0.84 -0.00 0.15 -1.14 0.00 0.00 176.83 176.21 1rg6 h PHE 13 N 1.37 -0.00 -0.97 3.45 3.57 -1.36 -2.33 116.94 120.67 1rg6 h PHE 13 Ca 0.37 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.87 1rg6 h PHE 13 Cb -0.16 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 1rg6 h PHE 13 CO 0.00 -0.00 0.60 -0.07 -2.23 0.00 0.00 178.31 176.61 1rg6 h LEU 14 N -0.00 1.15 -0.25 0.59 3.38 -1.31 -2.75 115.31 116.12 1rg6 h LEU 14 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1rg6 h LEU 14 Cb 0.00 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1rg6 h LEU 14 CO -0.00 0.86 0.16 0.00 0.09 0.00 0.00 178.44 179.56 1rg6 h ALA 15 N 1.33 0.31 0.00 1.53 0.00 -1.12 0.86 119.26 122.18 1rg6 h ALA 15 Ca 0.35 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1rg6 h ALA 15 Cb -0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1rg6 h ALA 15 CO -0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 179.25 178.97 1rg6 h ARG 16 N 0.34 0.00 -0.61 0.00 3.08 -1.14 0.61 114.38 116.66 1rg6 h ARG 16 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1rg6 h ARG 16 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1rg6 h ARG 16 CO -0.02 0.00 0.00 -0.11 -1.07 0.00 0.00 179.97 178.77 1rg6 n LEU 17 N -4.20 3.60 -1.50 3.04 7.94 -0.83 -4.90 117.00 120.16 1rg6 n LEU 17 Ca -0.03 -1.81 -0.14 0.00 -1.11 0.00 0.00 56.01 52.93 1rg6 n LEU 17 Cb 0.09 -0.47 -0.01 0.00 0.53 0.00 0.00 43.42 43.56 1rg6 n LEU 17 CO 0.31 0.72 -0.17 0.61 -1.11 0.00 0.00 177.39 177.74 1rg6 n GLY 18 N 1.16 -0.03 3.31 -3.96 0.00 0.21 -5.01 105.19 100.87 1rg6 n GLY 18 Ca 0.20 -0.32 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 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 1.29 -0.49 -0.00 0.00 7.64 -1.26 -2.43 113.62 118.37 1rg6 n SER 20 Ca -0.18 -1.01 0.02 0.00 1.01 0.00 0.00 58.87 58.70 1rg6 n SER 20 Cb 0.53 0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.87 1rg6 n SER 20 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1rg6 n SER 21 N -0.12 4.04 -0.85 6.43 7.64 -1.26 -4.61 113.62 124.89 1rg6 n SER 21 Ca -0.12 -0.02 0.12 0.00 1.01 0.00 0.00 58.87 59.87 1rg6 n SER 21 Cb 0.49 1.16 0.24 0.00 -1.01 0.00 0.00 64.21 65.09 1rg6 n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rg6 h LEU 23 N 3.89 1.13 -1.38 0.00 5.85 -1.97 -2.70 115.31 120.13 1rg6 h LEU 23 Ca 0.00 -0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.83 1rg6 h LEU 23 Cb 0.83 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.52 1rg6 h LEU 23 CO 0.00 0.82 0.54 0.44 -0.34 0.00 0.00 178.44 179.90 1rg6 h ASP 24 N 1.33 0.58 -0.61 1.25 3.32 -1.93 -2.09 116.42 118.28 1rg6 h ASP 24 Ca 0.36 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.40 1rg6 h ASP 24 Cb -0.15 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 1rg6 h ASP 24 CO -0.08 0.31 0.20 1.88 -1.72 0.00 0.00 179.24 179.83 1rg6 h TYR 25 N 0.62 0.96 -0.47 4.55 0.05 -1.80 -1.14 116.97 119.75 1rg6 h TYR 25 Ca 0.41 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 59.03 1rg6 h TYR 25 Cb 0.70 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 38.14 1rg6 h TYR 25 CO -0.00 0.79 0.04 0.74 -1.05 0.00 0.00 178.16 178.67 1rg6 h PHE 26 N 0.86 0.86 -0.71 4.88 0.04 -1.48 -2.76 116.94 118.63 1rg6 h PHE 26 Ca 0.20 -0.14 -0.07 0.00 2.80 0.00 0.00 57.97 60.76 1rg6 h PHE 26 Cb 0.27 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 1rg6 h PHE 26 CO 0.02 0.82 0.17 1.79 -0.60 0.00 0.00 178.31 180.50 1rg6 h THR 27 N 0.66 1.26 0.00 -1.55 1.35 -1.33 -1.20 112.91 112.10 1rg6 h THR 27 Ca 0.14 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1rg6 h THR 27 Cb 0.45 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 1rg6 h THR 27 CO 0.02 0.38 0.00 0.74 -0.25 0.00 0.00 175.52 176.41 1rg6 h THR 28 N 1.08 0.00 -0.00 6.82 2.02 -1.06 -2.89 112.91 118.88 1rg6 h THR 28 Ca 0.22 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.10 1rg6 h THR 28 Cb 0.38 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1rg6 h THR 28 CO 0.00 0.00 -0.79 0.00 0.37 0.00 0.00 175.52 175.11 1rg6 n GLN 29 N -2.90 0.66 -0.02 6.66 1.13 -0.86 -4.97 117.38 117.08 1rg6 n GLN 29 Ca -0.00 -0.32 0.00 0.00 -1.94 0.00 0.00 57.00 54.74 1rg6 n GLN 29 Cb 0.21 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 29.11 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 1.44 0.53 3.50 1.08 0.00 -0.99 -5.05 105.19 105.70 1rg6 n GLY 30 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 4.72 -0.06 0.99 1.43 -0.51 -4.90 118.68 120.34 1rg6 s LEU 31 Ca 0.00 -0.51 0.10 0.00 -1.03 0.00 0.00 54.13 52.68 1rg6 s LEU 31 Cb 0.00 -2.42 0.16 0.00 0.03 0.00 0.00 46.19 43.97 1rg6 s LEU 31 CO 0.00 -0.54 1.08 0.35 0.23 0.00 0.00 176.35 177.47 1rg6 n THR 32 N 5.42 0.83 -3.99 5.49 -2.24 -1.26 -3.59 114.28 114.95 1rg6 n THR 32 Ca -0.07 -1.10 -0.09 0.00 -2.27 0.00 0.00 64.05 60.52 1rg6 n THR 32 Cb 0.48 0.22 -0.11 0.00 -2.10 0.00 0.00 70.33 68.82 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 -1.26 0.12 0.08 4.28 -4.23 -1.26 -3.80 115.64 109.57 1rg6 s THR 33 Ca 0.17 -0.97 0.20 0.00 -1.18 0.00 0.00 61.69 59.90 1rg6 s THR 33 Cb 0.15 -0.35 0.16 0.00 1.34 0.00 0.00 72.50 73.80 1rg6 s THR 33 CO -0.00 -0.53 1.71 -0.29 -0.54 0.00 0.00 174.62 174.96 1rg6 h ILE 34 N 4.55 0.76 -0.35 2.99 2.10 -1.78 -3.26 117.51 122.51 1rg6 h ILE 34 Ca -0.32 -1.52 -0.16 0.00 1.08 0.00 0.00 64.86 63.94 1rg6 h ILE 34 Cb 1.21 1.97 -0.01 0.00 -1.09 0.00 0.00 36.82 38.90 1rg6 h ILE 34 CO 0.43 0.34 -0.41 0.10 -1.08 0.00 0.00 178.15 177.53 1rg6 h TYR 35 N 0.00 1.06 0.00 2.19 -0.00 -1.96 -3.12 116.97 115.13 1rg6 h TYR 35 Ca -0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 58.73 58.37 1rg6 h TYR 35 Cb 0.95 -0.22 -0.00 0.00 0.00 0.00 0.00 36.73 37.45 1rg6 h TYR 35 CO 0.00 1.13 -0.15 -0.56 -0.00 0.00 0.00 178.16 178.59 1rg6 h GLN 36 N 0.71 0.00 -0.37 0.10 3.07 -1.99 -1.54 115.11 115.09 1rg6 h GLN 36 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.79 1rg6 h GLN 36 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.55 1rg6 h GLN 36 CO 0.10 0.15 0.00 0.44 0.09 0.00 0.00 178.83 179.60 1rg6 n ILE 37 N -3.46 0.49 -0.21 1.86 -5.35 -1.18 -4.25 119.36 107.26 1rg6 n ILE 37 Ca -0.01 -0.42 0.01 0.00 -0.27 0.00 0.00 62.75 62.05 1rg6 n ILE 37 Cb 0.31 0.13 0.25 0.00 -1.74 0.00 0.00 39.64 38.59 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 1.75 0.98 0.00 6.28 5.08 -1.32 -3.07 114.58 124.27 1rg6 h GLU 38 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1rg6 h GLU 38 Cb 0.49 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1rg6 h GLU 38 CO 0.02 0.65 -1.04 -2.39 -1.00 0.00 0.00 179.01 175.26 1rg6 n HIS 39 N -4.42 0.00 -1.78 4.33 1.44 -1.26 -4.99 115.22 108.54 1rg6 n HIS 39 Ca 0.08 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.38 1rg6 n HIS 39 Cb 0.04 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.05 1rg6 n HIS 39 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1rg6 n TYR 40 N -1.57 2.98 -3.65 -1.40 4.02 -1.16 -5.01 117.16 111.37 1rg6 n TYR 40 Ca 0.01 0.44 -0.23 0.00 -0.01 0.00 0.00 57.90 58.11 1rg6 n TYR 40 Cb 0.30 -2.53 -0.00 0.00 -0.02 0.00 0.00 39.34 37.09 1rg6 n TYR 40 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1rg6 s SER 41 N -0.18 4.83 0.19 7.72 0.01 -1.26 -4.98 113.70 120.02 1rg6 s SER 41 Ca 0.54 -1.03 -0.13 0.00 1.31 0.00 0.00 55.95 56.65 1rg6 s SER 41 Cb -0.47 0.09 0.10 0.00 0.21 0.00 0.00 66.02 65.95 1rg6 s SER 41 CO 0.63 -1.00 1.85 0.24 0.41 0.00 0.00 173.24 175.37 1rg6 h MET 42 N 0.75 0.81 -0.98 12.44 2.86 -1.95 -1.80 114.93 127.07 1rg6 h MET 42 Ca -0.37 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.22 1rg6 h MET 42 Cb 1.29 -0.18 -0.05 0.00 0.06 0.00 0.00 31.60 32.72 1rg6 h MET 42 CO 0.55 0.55 0.63 -0.44 1.06 0.00 0.00 176.91 179.25 1rg6 h ASP 43 N 0.83 1.15 0.03 1.22 3.32 -1.98 -1.65 116.42 119.34 1rg6 h ASP 43 Ca 0.22 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 1rg6 h ASP 43 Cb -0.08 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.17 1rg6 h ASP 43 CO -0.05 0.85 -0.22 0.44 -1.72 0.00 0.00 179.24 178.55 1rg6 h ASP 44 N 1.34 0.32 0.26 6.45 3.32 -1.84 -2.81 116.42 123.47 1rg6 h ASP 44 Ca 0.36 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 1rg6 h ASP 44 Cb -0.11 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1rg6 h ASP 44 CO -0.07 0.55 -0.32 0.25 -1.72 0.00 0.00 179.24 177.93 1rg6 h LEU 45 N 0.30 0.09 -0.63 1.55 5.85 -0.45 -3.11 115.31 118.90 1rg6 h LEU 45 Ca 0.05 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.83 1rg6 h LEU 45 Cb 0.55 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 1rg6 h LEU 45 CO 0.04 0.41 0.26 0.00 -0.34 0.00 0.00 178.44 178.81 1rg6 h ALA 46 N 1.60 0.83 -0.55 1.25 0.00 -1.25 0.48 119.26 121.62 1rg6 h ALA 46 Ca 0.01 0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.15 1rg6 h ALA 46 Cb 0.61 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1rg6 h ALA 46 CO 0.04 -0.15 0.61 1.03 0.00 0.00 0.00 179.25 180.78 1rg6 h SER 47 N 0.46 0.00 0.00 0.00 0.87 -1.69 0.32 113.55 113.51 1rg6 h SER 47 Ca 0.31 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1rg6 h SER 47 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1rg6 h SER 47 CO -0.29 0.00 0.00 -0.11 -0.53 0.00 0.00 176.83 175.90 1rg6 n LEU 48 N -3.61 0.00 0.00 2.23 7.94 0.16 -4.84 117.00 118.88 1rg6 n LEU 48 Ca 0.11 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 1rg6 n LEU 48 Cb 0.82 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.77 1rg6 n LEU 48 CO 0.27 0.00 0.00 0.29 -1.11 0.00 0.00 177.39 176.84 1rg6 n LYS 49 N -0.77 -0.49 -2.69 1.96 5.02 0.11 -4.81 118.16 116.49 1rg6 n LYS 49 Ca 0.09 0.12 -0.39 0.00 -2.02 0.00 0.00 58.31 56.11 1rg6 n LYS 49 Cb 0.04 -3.49 -0.06 0.00 -0.02 0.00 0.00 35.03 31.51 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 -1.79 3.97 0.99 -0.18 1.01 -1.25 -5.04 121.20 118.91 1rg6 s ILE 50 Ca 0.00 1.86 -0.13 0.00 0.00 0.00 0.00 60.65 62.38 1rg6 s ILE 50 Cb 0.00 -4.13 0.18 0.00 0.01 0.00 0.00 42.46 38.52 1rg6 s ILE 50 CO 0.00 0.35 1.11 -2.16 0.00 0.00 0.00 174.94 174.23 1rg6 s PRO 51 N -1.55 0.49 0.35 2.79 0.04 -1.26 -4.72 135.00 131.14 1rg6 s PRO 51 Ca 0.45 0.42 0.15 0.00 0.04 0.00 0.00 61.00 62.05 1rg6 s PRO 51 Cb -0.25 -1.75 0.65 0.00 0.04 0.00 0.00 34.50 33.19 1rg6 s PRO 51 CO 0.31 -2.67 1.75 0.93 0.04 0.00 0.00 177.00 177.37 1rg6 h GLU 52 N -1.84 0.00 -0.00 4.56 5.08 -2.00 -2.74 114.58 117.64 1rg6 h GLU 52 Ca -0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 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 0.58 0.43 0.00 0.37 -1.00 0.00 0.00 179.01 179.40 1rg6 h GLN 53 N 0.00 0.00 -0.00 2.33 4.15 -2.02 -1.66 115.11 117.90 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 0.83 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.52 1rg6 h GLN 53 CO 0.06 0.00 -0.84 1.19 -1.93 0.00 0.00 178.83 177.31 1rg6 n PHE 54 N -4.14 0.00 -0.05 3.99 3.01 -1.08 -3.97 117.46 115.22 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 0.09 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.48 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 0.18 0.30 0.00 -1.08 3.08 -1.01 -2.31 114.38 113.54 1rg6 h ARG 55 Ca 0.00 -0.17 -0.15 0.00 0.07 0.00 0.00 59.98 59.74 1rg6 h ARG 55 Cb 0.46 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1rg6 h ARG 55 CO 0.00 0.72 -0.79 1.12 -1.07 0.00 0.00 179.97 179.95 1rg6 h HIS 56 N -0.09 0.00 -0.23 3.04 2.07 -1.77 -2.60 115.15 115.57 1rg6 h HIS 56 Ca 0.02 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.44 1rg6 h HIS 56 Cb 0.67 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.64 1rg6 h HIS 56 CO 0.09 0.66 -0.24 0.00 -3.07 0.00 0.00 177.93 175.37 1rg6 h ALA 57 N 1.34 0.33 -0.13 6.11 0.00 -1.68 -2.44 119.26 122.79 1rg6 h ALA 57 Ca -0.03 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.32 1rg6 h ALA 57 Cb 1.54 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.26 1rg6 h ALA 57 CO 0.08 0.31 -0.62 0.82 0.00 0.00 0.00 179.25 179.84 1rg6 h ILE 58 N 0.26 1.33 -0.81 0.00 2.04 -1.51 -3.24 117.51 115.57 1rg6 h ILE 58 Ca 0.03 -1.89 0.01 0.00 1.00 0.00 0.00 64.86 64.01 1rg6 h ILE 58 Cb 0.80 2.10 -0.04 0.00 -0.74 0.00 0.00 36.82 38.95 1rg6 h ILE 58 CO 0.06 0.58 0.54 -0.25 0.00 0.00 0.00 178.15 179.08 1rg6 h TRP 59 N 0.30 1.02 -1.00 1.37 7.01 -1.50 -2.51 115.95 120.64 1rg6 h TRP 59 Ca -0.04 0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.99 1rg6 h TRP 59 Cb 1.26 -0.34 -0.05 0.00 -2.10 0.00 0.00 29.16 27.93 1rg6 h TRP 59 CO 0.10 0.64 0.66 -0.22 -2.79 0.00 0.00 178.44 176.83 1rg6 h LYS 60 N 1.10 1.31 -0.06 2.65 3.64 -1.46 -2.17 116.57 121.57 1rg6 h LYS 60 Ca 0.30 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.48 1rg6 h LYS 60 Cb -0.13 -0.30 -0.01 0.00 -0.41 0.00 0.00 32.23 31.38 1rg6 h LYS 60 CO -0.06 0.87 -0.49 0.78 -2.27 0.00 0.00 179.45 178.28 1rg6 h GLY 61 N 1.35 0.17 1.10 5.01 0.00 -1.52 -3.13 103.07 106.05 1rg6 h GLY 61 Ca 0.37 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 47.40 1rg6 h GLY 61 CO -0.08 0.16 -0.09 -2.22 0.00 0.00 0.00 176.54 174.31 1rg6 h ILE 62 N 0.13 1.27 -0.19 2.60 2.04 -1.16 -2.98 117.51 119.22 1rg6 h ILE 62 Ca 0.01 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.61 1rg6 h ILE 62 Cb 0.91 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1rg6 h ILE 62 CO 0.07 0.45 0.13 -0.07 0.00 0.00 0.00 178.15 178.72 1rg6 h LEU 63 N 0.93 0.22 -1.05 1.44 3.38 -1.42 -2.65 115.31 116.15 1rg6 h LEU 63 Ca 0.15 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1rg6 h LEU 63 Cb 0.67 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1rg6 h LEU 63 CO 0.05 0.16 0.64 0.44 0.09 0.00 0.00 178.44 179.82 1rg6 h ASP 64 N 0.26 1.11 -1.01 -0.43 3.32 -1.60 -2.35 116.42 115.72 1rg6 h ASP 64 Ca 0.07 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.11 1rg6 h ASP 64 Cb -0.03 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.19 1rg6 h ASP 64 CO -0.02 0.80 0.67 -0.74 -1.72 0.00 0.00 179.24 178.23 1rg6 h HIS 65 N 1.30 1.26 -0.47 4.55 2.76 -1.32 -2.52 115.15 120.72 1rg6 h HIS 65 Ca 0.36 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.42 1rg6 h HIS 65 Cb -0.14 -0.43 -0.01 0.00 1.55 0.00 0.00 27.41 28.38 1rg6 h HIS 65 CO -0.00 0.79 -0.25 0.00 -1.30 0.00 0.00 177.93 177.16 1rg6 h ARG 66 N 1.35 0.99 -0.73 5.26 2.47 -1.13 -2.66 114.38 119.94 1rg6 h ARG 66 Ca 0.37 -0.45 -0.06 0.00 -1.26 0.00 0.00 59.98 58.59 1rg6 h ARG 66 Cb -0.14 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.13 1rg6 h ARG 66 CO -0.09 1.12 0.24 1.96 0.56 0.00 0.00 179.97 183.76 1rg6 h GLN 67 N 0.85 1.14 -0.02 0.04 4.20 -1.07 -2.94 115.11 117.30 1rg6 h GLN 67 Ca 0.10 -0.24 -0.18 0.00 0.06 0.00 0.00 58.65 58.39 1rg6 h GLN 67 Cb 0.84 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 1rg6 h GLN 67 CO 0.07 0.96 -0.78 1.37 -0.67 0.00 0.00 178.83 179.78 1rg6 h LEU 68 N 1.08 0.25 -8.70 1.46 8.10 -1.49 -3.41 115.31 112.61 1rg6 h LEU 68 Ca 0.24 -0.18 -0.67 0.00 0.11 0.00 0.00 57.88 57.38 1rg6 h LEU 68 Cb 0.30 -0.08 -0.20 0.00 -0.44 0.00 0.00 40.66 40.24 1rg6 h LEU 68 CO -0.01 0.94 -0.52 -2.28 -4.11 0.00 0.00 178.44 172.46 1rg6 s HIS 69 N -3.39 3.20 -0.05 0.17 2.46 -1.01 -5.07 115.29 111.60 1rg6 s HIS 69 Ca -0.03 -0.27 0.06 0.00 0.47 0.00 0.00 55.06 55.29 1rg6 s HIS 69 Cb 0.11 -2.40 -0.01 0.00 -0.13 0.00 0.00 32.58 30.14 1rg6 s HIS 69 CO 0.82 -0.35 -0.24 -2.00 -2.47 0.00 0.00 174.74 170.50 1rg6 s GLU 70 N 1.69 2.51 0.00 2.88 2.12 -1.26 -4.70 118.70 121.95 1rg6 s GLU 70 Ca 0.06 -0.89 0.31 0.00 0.36 0.00 0.00 54.97 54.81 1rg6 s GLU 70 Cb -0.17 -2.18 1.69 0.00 0.26 0.00 0.00 34.13 33.73 1rg6 s GLU 70 CO 0.09 0.42 2.11 1.19 -0.54 0.00 0.00 175.26 178.52