#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 4.50 -1.43 0.52 2.01 -1.26 -4.54 115.64 115.44 1rg6 s THR 6 Ca 0.00 -0.15 -0.07 0.00 0.31 0.00 0.00 61.69 61.78 1rg6 s THR 6 Cb 0.00 -2.97 0.04 0.00 0.01 0.00 0.00 72.50 69.58 1rg6 s THR 6 CO 0.00 0.52 0.79 0.47 -0.69 0.00 0.00 174.62 175.71 1rg6 n ASP 7 N 3.05 -2.71 -3.57 3.53 8.00 -1.26 -4.79 116.55 118.80 1rg6 n ASP 7 Ca -0.18 -0.83 -0.40 0.00 0.71 0.00 0.00 54.79 54.10 1rg6 n ASP 7 Cb 0.53 -3.82 -0.04 0.00 -0.02 0.00 0.00 41.12 37.77 1rg6 n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rg6 n SER 9 N 6.55 -1.73 0.23 0.00 3.41 -1.26 -3.92 113.62 116.91 1rg6 n SER 9 Ca 0.50 -0.09 0.11 0.00 -0.26 0.00 0.00 58.87 59.14 1rg6 n SER 9 Cb 0.35 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 64.81 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 -1.86 0.46 0.64 -1.33 2.04 -1.81 -2.94 117.51 112.71 1rg6 h ILE 10 Ca 0.00 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 64.84 1rg6 h ILE 10 Cb 0.00 1.71 0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1rg6 h ILE 10 CO 0.00 0.18 -0.31 0.58 0.00 0.00 0.00 178.15 178.60 1rg6 h VAL 11 N 0.00 0.25 -1.01 1.67 2.07 -1.89 -2.50 116.25 114.84 1rg6 h VAL 11 Ca -0.00 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.27 1rg6 h VAL 11 Cb 0.69 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 1rg6 h VAL 11 CO 0.02 0.03 0.67 0.28 0.02 0.00 0.00 177.57 178.59 1rg6 h SER 12 N -1.06 1.16 -0.15 0.57 0.02 -1.89 -2.62 113.55 109.58 1rg6 h SER 12 Ca -0.09 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1rg6 h SER 12 Cb 0.70 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1rg6 h SER 12 CO 0.14 0.84 0.07 0.15 -1.14 0.00 0.00 176.83 176.89 1rg6 h PHE 13 N 1.37 0.14 -0.67 3.45 3.57 -1.48 -1.75 116.94 121.56 1rg6 h PHE 13 Ca 0.37 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.79 1rg6 h PHE 13 Cb -0.16 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.52 1rg6 h PHE 13 CO -0.00 0.08 0.09 -0.07 -2.23 0.00 0.00 178.31 176.18 1rg6 h LEU 14 N 0.16 1.08 -0.28 0.59 3.38 -1.32 -2.77 115.31 116.15 1rg6 h LEU 14 Ca 0.06 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1rg6 h LEU 14 Cb 0.01 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1rg6 h LEU 14 CO -0.04 1.07 0.18 0.00 0.09 0.00 0.00 178.44 179.74 1rg6 h ALA 15 N 1.04 0.35 -0.00 1.53 0.00 -1.07 1.01 119.26 122.12 1rg6 h ALA 15 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1rg6 h ALA 15 Cb 0.46 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1rg6 h ALA 15 CO 0.02 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.09 1rg6 h ARG 16 N 0.38 0.00 -0.63 0.00 2.47 -1.19 -0.21 114.38 115.20 1rg6 h ARG 16 Ca 0.10 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 1rg6 h ARG 16 Cb -0.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.28 1rg6 h ARG 16 CO -0.02 0.00 0.00 -0.11 0.56 0.00 0.00 179.97 180.40 1rg6 n LEU 17 N -4.46 3.82 -1.47 3.04 7.94 -0.77 -4.89 117.00 120.21 1rg6 n LEU 17 Ca -0.03 -1.93 -0.14 0.00 -1.11 0.00 0.00 56.01 52.80 1rg6 n LEU 17 Cb 0.09 -0.51 -0.02 0.00 0.53 0.00 0.00 43.42 43.51 1rg6 n LEU 17 CO 0.33 0.63 -0.17 0.61 -1.11 0.00 0.00 177.39 177.69 1rg6 n GLY 18 N 0.90 0.15 3.30 -3.96 0.00 -0.09 -5.00 105.19 100.48 1rg6 n GLY 18 Ca 0.20 -0.32 -0.30 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 2.29 -0.82 -0.01 0.00 2.88 -1.26 -2.25 113.62 114.45 1rg6 n SER 20 Ca -0.16 -1.57 -0.00 0.00 -1.33 0.00 0.00 58.87 55.80 1rg6 n SER 20 Cb 0.52 0.32 -0.03 0.00 -0.75 0.00 0.00 64.21 64.27 1rg6 n SER 20 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1rg6 n SER 21 N -0.46 4.02 -0.98 -3.46 7.64 -1.26 -4.62 113.62 114.49 1rg6 n SER 21 Ca -0.16 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.82 1rg6 n SER 21 Cb 0.65 0.85 0.27 0.00 -1.01 0.00 0.00 64.21 64.96 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 3.57 1.09 -1.06 0.00 5.85 -1.96 -2.58 115.31 120.24 1rg6 h LEU 23 Ca 0.00 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.79 1rg6 h LEU 23 Cb 0.80 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.51 1rg6 h LEU 23 CO 0.00 0.74 0.63 0.44 -0.34 0.00 0.00 178.44 179.91 1rg6 h ASP 24 N 1.26 0.98 -0.65 1.25 3.32 -1.94 -2.64 116.42 118.01 1rg6 h ASP 24 Ca 0.41 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1rg6 h ASP 24 Cb 0.03 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1rg6 h ASP 24 CO -0.13 0.61 0.33 1.88 -1.72 0.00 0.00 179.24 180.21 1rg6 h TYR 25 N 1.10 0.92 -0.68 4.55 0.05 -1.77 -0.46 116.97 120.67 1rg6 h TYR 25 Ca 0.43 -0.04 -0.08 0.00 0.05 0.00 0.00 58.73 59.09 1rg6 h TYR 25 Cb 0.23 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 1rg6 h TYR 25 CO -0.00 0.68 0.11 0.74 -1.05 0.00 0.00 178.16 178.64 1rg6 h PHE 26 N 0.89 1.20 -0.50 4.88 0.04 -1.54 -2.75 116.94 119.16 1rg6 h PHE 26 Ca 0.22 -0.17 -0.13 0.00 2.80 0.00 0.00 57.97 60.70 1rg6 h PHE 26 Cb 0.09 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 1rg6 h PHE 26 CO -0.00 1.00 -0.19 1.79 -0.60 0.00 0.00 178.31 180.30 1rg6 h THR 27 N 1.06 1.27 0.00 -1.55 1.35 -1.18 -0.80 112.91 113.05 1rg6 h THR 27 Ca 0.21 -1.36 -0.00 0.00 -0.55 0.00 0.00 66.41 64.71 1rg6 h THR 27 Cb 0.44 1.08 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1rg6 h THR 27 CO 0.01 0.47 -0.00 0.74 -0.25 0.00 0.00 175.52 176.49 1rg6 h THR 28 N 0.88 0.01 -0.01 6.82 2.02 -0.90 -2.78 112.91 118.95 1rg6 h THR 28 Ca 0.12 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1rg6 h THR 28 Cb 0.77 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1rg6 h THR 28 CO 0.06 0.00 -0.76 0.00 0.37 0.00 0.00 175.52 175.19 1rg6 n GLN 29 N -3.09 0.69 -0.06 6.66 1.13 -1.04 -4.97 117.38 116.71 1rg6 n GLN 29 Ca -0.01 -0.37 0.00 0.00 -1.94 0.00 0.00 57.00 54.67 1rg6 n GLN 29 Cb 0.19 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 29.09 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 0.55 3.52 1.08 0.00 -1.04 -5.05 105.19 105.69 1rg6 n GLY 30 Ca 0.06 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 4.55 -0.09 0.99 1.02 -0.33 -4.90 118.68 119.92 1rg6 s LEU 31 Ca 0.00 -0.32 0.15 0.00 0.02 0.00 0.00 54.13 53.98 1rg6 s LEU 31 Cb 0.00 -2.56 0.31 0.00 0.02 0.00 0.00 46.19 43.97 1rg6 s LEU 31 CO 0.00 -0.59 1.15 0.35 0.02 0.00 0.00 176.35 177.27 1rg6 n THR 32 N 5.55 1.08 -3.76 5.49 -2.24 -1.26 -3.68 114.28 115.46 1rg6 n THR 32 Ca -0.05 -1.77 -0.13 0.00 -2.27 0.00 0.00 64.05 59.83 1rg6 n THR 32 Cb 0.48 0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.88 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 -1.60 0.04 0.41 4.28 -4.23 -1.26 -4.06 115.64 109.22 1rg6 s THR 33 Ca 0.28 -0.36 0.19 0.00 -1.18 0.00 0.00 61.69 60.63 1rg6 s THR 33 Cb 0.29 -0.58 0.21 0.00 1.34 0.00 0.00 72.50 73.75 1rg6 s THR 33 CO -0.06 -0.20 1.98 -0.29 -0.54 0.00 0.00 174.62 175.51 1rg6 h ILE 34 N 4.04 0.92 -0.00 2.99 2.10 -1.77 -2.28 117.51 123.52 1rg6 h ILE 34 Ca -0.29 -0.75 0.00 0.00 1.08 0.00 0.00 64.86 64.90 1rg6 h ILE 34 Cb 1.18 1.43 -0.00 0.00 -1.09 0.00 0.00 36.82 38.34 1rg6 h ILE 34 CO 0.37 0.20 0.00 1.88 -1.08 0.00 0.00 178.15 179.52 1rg6 h TYR 35 N 0.00 0.00 -0.05 2.19 0.05 -1.96 -1.13 116.97 116.08 1rg6 h TYR 35 Ca -0.00 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 1rg6 h TYR 35 Cb 0.42 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1rg6 h TYR 35 CO 0.00 0.00 -0.49 1.96 -1.05 0.00 0.00 178.16 178.58 1rg6 h GLN 36 N 0.00 0.12 -0.66 4.88 1.08 -1.83 -3.10 115.11 115.60 1rg6 h GLN 36 Ca 0.00 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 1rg6 h GLN 36 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1rg6 h GLN 36 CO -0.00 0.58 0.00 0.44 -0.95 0.00 0.00 178.83 178.90 1rg6 n ILE 37 N -3.96 1.21 -0.30 2.54 -5.35 -0.48 -4.57 119.36 108.45 1rg6 n ILE 37 Ca -0.02 -1.06 -0.01 0.00 -0.27 0.00 0.00 62.75 61.40 1rg6 n ILE 37 Cb 0.52 0.40 0.18 0.00 -1.74 0.00 0.00 39.64 39.00 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 3.93 1.16 -0.00 6.28 5.08 -1.33 -2.94 114.58 126.75 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 1.07 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1rg6 h GLU 38 CO 0.06 0.77 -0.80 -2.39 -1.00 0.00 0.00 179.01 175.64 1rg6 n HIS 39 N -4.40 0.00 -1.80 4.33 1.44 -1.26 -4.97 115.22 108.55 1rg6 n HIS 39 Ca 0.10 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.40 1rg6 n HIS 39 Cb 0.02 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.13 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 -2.70 2.67 0.53 -1.40 1.51 -1.11 -5.01 117.35 111.83 1rg6 s TYR 40 Ca 0.10 1.01 0.09 0.00 -1.01 0.00 0.00 57.07 57.26 1rg6 s TYR 40 Cb 0.15 -4.03 0.06 0.00 -0.11 0.00 0.00 41.96 38.03 1rg6 s TYR 40 CO 0.73 -3.21 0.70 -1.12 -1.11 0.00 0.00 175.55 171.54 1rg6 s SER 41 N 0.11 5.22 0.25 2.29 0.01 -1.26 -4.94 113.70 115.38 1rg6 s SER 41 Ca 0.57 -0.76 -0.06 0.00 1.31 0.00 0.00 55.95 57.01 1rg6 s SER 41 Cb -0.47 0.04 0.26 0.00 0.21 0.00 0.00 66.02 66.06 1rg6 s SER 41 CO 0.57 -1.16 1.92 0.24 0.41 0.00 0.00 173.24 175.21 1rg6 h MET 42 N 0.35 1.32 -0.43 12.44 2.86 -1.95 -2.25 114.93 127.27 1rg6 h MET 42 Ca -0.33 -0.09 -0.15 0.00 -2.06 0.00 0.00 59.70 57.07 1rg6 h MET 42 Cb 1.29 -0.29 -0.01 0.00 0.06 0.00 0.00 31.60 32.64 1rg6 h MET 42 CO 0.43 0.88 -0.31 -0.44 1.06 0.00 0.00 176.91 178.53 1rg6 h ASP 43 N 1.36 1.02 -0.66 1.22 3.32 -1.96 -3.14 116.42 117.57 1rg6 h ASP 43 Ca 0.36 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 1rg6 h ASP 43 Cb -0.14 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.09 1rg6 h ASP 43 CO -0.08 1.24 0.27 0.44 -1.72 0.00 0.00 179.24 179.39 1rg6 h ASP 44 N 0.81 0.93 0.44 6.45 3.32 -1.85 -2.31 116.42 124.21 1rg6 h ASP 44 Ca 0.08 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1rg6 h ASP 44 Cb 0.90 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.21 1rg6 h ASP 44 CO 0.08 0.83 -0.07 0.25 -1.72 0.00 0.00 179.24 178.61 1rg6 h LEU 45 N 0.99 0.00 -0.44 1.55 5.85 -1.37 -2.99 115.31 118.89 1rg6 h LEU 45 Ca 0.23 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.01 1rg6 h LEU 45 Cb 0.19 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 1rg6 h LEU 45 CO -0.02 0.07 0.13 0.00 -0.34 0.00 0.00 178.44 178.29 1rg6 h ALA 46 N 1.93 0.52 -0.47 1.25 0.00 -1.43 0.26 119.26 121.32 1rg6 h ALA 46 Ca -0.00 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.11 1rg6 h ALA 46 Cb 0.31 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1rg6 h ALA 46 CO 0.01 -0.26 0.53 0.66 0.00 0.00 0.00 179.25 180.19 1rg6 h SER 47 N 0.29 0.00 0.00 0.00 4.64 -1.68 0.32 113.55 117.12 1rg6 h SER 47 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1rg6 h SER 47 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1rg6 h SER 47 CO -0.24 0.00 0.00 -0.11 -0.87 0.00 0.00 176.83 175.61 1rg6 n LEU 48 N -3.63 0.00 0.00 5.97 7.94 0.08 -4.84 117.00 122.52 1rg6 n LEU 48 Ca 0.09 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.99 1rg6 n LEU 48 Cb 0.72 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.67 1rg6 n LEU 48 CO 0.26 0.00 0.00 0.29 -1.11 0.00 0.00 177.39 176.83 1rg6 n LYS 49 N -0.90 -0.03 -2.61 1.96 5.02 0.11 -4.85 118.16 116.87 1rg6 n LYS 49 Ca 0.13 0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 56.01 1rg6 n LYS 49 Cb 0.06 -2.84 -0.04 0.00 -0.02 0.00 0.00 35.03 32.19 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 -2.77 4.22 0.97 -0.18 1.01 -1.25 -5.03 121.20 118.17 1rg6 s ILE 50 Ca 0.00 1.82 -0.12 0.00 0.00 0.00 0.00 60.65 62.35 1rg6 s ILE 50 Cb 0.00 -4.16 0.17 0.00 0.01 0.00 0.00 42.46 38.48 1rg6 s ILE 50 CO 0.00 0.27 1.08 -2.16 0.00 0.00 0.00 174.94 174.13 1rg6 s PRO 51 N 0.04 0.61 0.44 2.79 0.04 -1.26 -4.68 135.00 132.99 1rg6 s PRO 51 Ca 0.50 0.78 0.19 0.00 0.04 0.00 0.00 61.00 62.50 1rg6 s PRO 51 Cb -0.26 -1.74 1.03 0.00 0.04 0.00 0.00 34.50 33.57 1rg6 s PRO 51 CO 0.32 -2.67 1.94 0.93 0.04 0.00 0.00 177.00 177.55 1rg6 h GLU 52 N -1.86 0.00 -0.04 4.56 5.08 -1.99 -1.96 114.58 118.37 1rg6 h GLU 52 Ca -0.53 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1rg6 h GLU 52 Cb 1.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.55 1rg6 h GLU 52 CO 0.54 0.24 0.02 0.37 -1.00 0.00 0.00 179.01 179.18 1rg6 h GLN 53 N 0.00 0.06 0.00 2.33 4.15 -2.02 -2.20 115.11 117.43 1rg6 h GLN 53 Ca -0.00 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1rg6 h GLN 53 Cb 0.50 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1rg6 h GLN 53 CO 0.03 0.05 -1.71 1.19 -1.93 0.00 0.00 178.83 176.46 1rg6 n PHE 54 N -4.52 0.03 -0.23 3.99 3.72 -0.96 -4.05 117.46 115.45 1rg6 n PHE 54 Ca -0.02 0.01 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 1rg6 n PHE 54 Cb 0.10 -0.40 0.03 0.00 -0.94 0.00 0.00 39.48 38.27 1rg6 n PHE 54 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rg6 h ARG 55 N 0.00 1.10 0.02 -1.08 3.08 -0.72 -2.50 114.38 114.28 1rg6 h ARG 55 Ca 0.00 -0.33 -0.23 0.00 0.07 0.00 0.00 59.98 59.49 1rg6 h ARG 55 Cb 0.88 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 1rg6 h ARG 55 CO 0.00 1.04 -1.14 1.12 -1.07 0.00 0.00 179.97 179.92 1rg6 h HIS 56 N 1.02 0.06 -0.42 3.04 2.07 -1.73 -2.81 115.15 116.37 1rg6 h HIS 56 Ca 0.19 -0.04 -0.15 0.00 -2.85 0.00 0.00 60.37 57.51 1rg6 h HIS 56 Cb 0.52 -0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.49 1rg6 h HIS 56 CO 0.04 1.04 -0.34 0.00 -3.07 0.00 0.00 177.93 175.60 1rg6 h ALA 57 N 0.94 0.60 -0.02 6.11 0.00 -1.69 -2.80 119.26 122.40 1rg6 h ALA 57 Ca -0.07 -0.44 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 1rg6 h ALA 57 Cb 1.83 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.50 1rg6 h ALA 57 CO 0.13 0.68 -0.59 0.82 0.00 0.00 0.00 179.25 180.29 1rg6 h ILE 58 N 0.80 1.41 -0.95 0.00 2.04 -1.55 -3.33 117.51 115.92 1rg6 h ILE 58 Ca 0.08 -2.03 0.01 0.00 1.00 0.00 0.00 64.86 63.91 1rg6 h ILE 58 Cb 0.93 2.51 -0.05 0.00 -0.74 0.00 0.00 36.82 39.48 1rg6 h ILE 58 CO 0.09 0.60 0.63 -0.25 0.00 0.00 0.00 178.15 179.21 1rg6 h TRP 59 N -0.05 1.21 -0.97 1.37 7.01 -1.54 -2.86 115.95 120.12 1rg6 h TRP 59 Ca -0.07 0.02 0.01 0.00 2.11 0.00 0.00 58.89 60.97 1rg6 h TRP 59 Cb 1.29 -0.41 -0.05 0.00 -2.10 0.00 0.00 29.16 27.89 1rg6 h TRP 59 CO 0.14 0.77 0.64 0.87 -2.79 0.00 0.00 178.44 178.07 1rg6 h LYS 60 N 1.30 1.27 0.00 2.65 1.79 -1.60 -2.13 116.57 119.85 1rg6 h LYS 60 Ca 0.35 -0.08 -0.08 0.00 -2.18 0.00 0.00 60.65 58.66 1rg6 h LYS 60 Cb -0.14 -0.29 -0.01 0.00 -1.58 0.00 0.00 32.23 30.21 1rg6 h LYS 60 CO -0.07 0.84 -0.40 0.78 -1.08 0.00 0.00 179.45 179.51 1rg6 h GLY 61 N 1.31 0.00 1.08 3.86 0.00 -1.61 -3.15 103.07 104.56 1rg6 h GLY 61 Ca 0.36 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.56 1rg6 h GLY 61 CO -0.08 0.00 -0.22 -2.22 0.00 0.00 0.00 176.54 174.02 1rg6 h ILE 62 N 0.00 1.27 -0.12 2.60 2.04 -1.30 -2.88 117.51 119.13 1rg6 h ILE 62 Ca -0.00 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.48 1rg6 h ILE 62 Cb 0.75 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1rg6 h ILE 62 CO 0.05 0.47 0.08 -0.07 0.00 0.00 0.00 178.15 178.68 1rg6 h LEU 63 N 0.77 0.14 -1.01 1.44 3.38 -1.48 -2.63 115.31 115.92 1rg6 h LEU 63 Ca 0.10 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1rg6 h LEU 63 Cb 0.80 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 1rg6 h LEU 63 CO 0.07 0.10 0.66 0.44 0.09 0.00 0.00 178.44 179.80 1rg6 h ASP 64 N 0.16 1.16 -0.87 -0.43 3.32 -1.61 -2.25 116.42 115.90 1rg6 h ASP 64 Ca 0.04 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.07 1rg6 h ASP 64 Cb -0.02 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.20 1rg6 h ASP 64 CO -0.01 0.84 0.58 -0.74 -1.72 0.00 0.00 179.24 178.19 1rg6 h HIS 65 N 1.36 1.09 -0.73 4.55 2.76 -1.27 -2.04 115.15 120.88 1rg6 h HIS 65 Ca 0.37 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.57 1rg6 h HIS 65 Cb -0.15 -0.37 -0.04 0.00 1.55 0.00 0.00 27.41 28.40 1rg6 h HIS 65 CO 0.00 0.69 0.48 -0.09 -1.30 0.00 0.00 177.93 177.71 1rg6 h ARG 66 N 1.18 0.96 -0.31 5.26 2.43 -1.06 -1.70 114.38 121.14 1rg6 h ARG 66 Ca 0.32 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1rg6 h ARG 66 Cb -0.13 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.18 1rg6 h ARG 66 CO -0.07 0.64 0.20 1.96 -1.51 0.00 0.00 179.97 181.19 1rg6 h GLN 67 N 0.99 0.41 -0.19 0.20 4.20 -1.01 -1.76 115.11 117.95 1rg6 h GLN 67 Ca 0.27 -0.02 -0.13 0.00 0.06 0.00 0.00 58.65 58.82 1rg6 h GLN 67 Cb -0.11 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 1rg6 h GLN 67 CO -0.06 0.27 -0.45 -0.07 -0.67 0.00 0.00 178.83 177.85 1rg6 h LEU 68 N 0.42 0.49 -8.39 1.46 3.38 -0.85 -3.41 115.31 108.41 1rg6 h LEU 68 Ca 0.11 -0.23 -0.66 0.00 0.09 0.00 0.00 57.88 57.20 1rg6 h LEU 68 Cb -0.05 -0.14 -0.28 0.00 0.09 0.00 0.00 40.66 40.28 1rg6 h LEU 68 CO -0.02 0.88 -0.74 -1.00 0.09 0.00 0.00 178.44 177.64 1rg6 s HIS 69 N -4.13 2.92 -0.15 1.13 3.76 -0.66 -5.10 115.29 113.05 1rg6 s HIS 69 Ca -0.06 -0.99 -0.04 0.00 -0.15 0.00 0.00 55.06 53.82 1rg6 s HIS 69 Cb 0.12 -2.05 -0.03 0.00 1.11 0.00 0.00 32.58 31.74 1rg6 s HIS 69 CO 0.81 -0.53 -0.04 -2.00 -0.85 0.00 0.00 174.74 172.13 1rg6 s GLU 70 N 1.30 3.67 0.00 1.40 2.12 -1.26 -4.77 118.70 121.16 1rg6 s GLU 70 Ca 0.04 -0.51 0.31 0.00 0.36 0.00 0.00 54.97 55.17 1rg6 s GLU 70 Cb -0.14 -2.92 1.80 0.00 0.26 0.00 0.00 34.13 33.13 1rg6 s GLU 70 CO -0.03 0.25 2.17 1.19 -0.54 0.00 0.00 175.26 178.29