#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3huy n LEU 5 N 0.00 -0.91 -0.51 -3.43 -0.00 -1.26 -4.98 117.00 105.91 3huy n LEU 5 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.02 3huy n LEU 5 Cb 0.00 -0.23 0.03 0.00 -0.00 0.00 0.00 43.42 43.22 3huy n LEU 5 CO 0.00 0.00 0.33 2.29 -0.00 0.00 0.00 177.39 180.01 3huy n LYS 6 N -0.42 1.24 -3.40 1.96 0.00 -1.26 -4.10 118.16 112.17 3huy n LYS 6 Ca 0.00 -0.20 -0.22 0.00 -0.00 0.00 0.00 58.31 57.89 3huy n LYS 6 Cb 0.23 -1.47 -0.09 0.00 -0.00 0.00 0.00 35.03 33.69 3huy n LYS 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3huy s LYS 7 N -1.25 0.60 0.02 -1.58 3.01 -1.26 -5.09 119.74 114.19 3huy s LYS 7 Ca 0.04 -1.04 0.00 0.00 -1.01 0.00 0.00 55.97 53.96 3huy s LYS 7 Cb 0.03 -0.95 0.00 0.00 -1.01 0.00 0.00 37.83 35.90 3huy s LYS 7 CO 0.01 -1.20 0.00 0.41 0.51 0.00 0.00 175.35 175.08 3huy n GLY 8 N 4.18 -2.95 1.70 -3.33 0.00 -1.26 -4.87 105.19 98.65 3huy n GLY 8 Ca 0.11 -2.06 0.01 0.00 0.00 0.00 0.00 46.02 44.08 3huy n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3huy n VAL 9 N -0.02 0.21 -0.01 1.61 0.31 -1.26 -4.91 118.33 114.26 3huy n VAL 9 Ca 0.00 -1.15 0.00 0.00 -0.01 0.00 0.00 64.34 63.18 3huy n VAL 9 Cb 0.00 0.97 0.00 0.00 -0.91 0.00 0.00 33.84 33.90 3huy n VAL 9 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 3huy n PHE 10 N 0.13 -0.01 -2.00 3.52 -1.74 -1.26 -3.96 117.46 112.14 3huy n PHE 10 Ca -0.01 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.46 3huy n PHE 10 Cb 1.00 -0.13 -0.03 0.00 1.52 0.00 0.00 39.48 41.84 3huy n PHE 10 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 3huy s VAL 11 N -0.01 3.55 0.03 1.97 0.11 -1.26 -4.59 120.40 120.20 3huy s VAL 11 Ca 0.00 0.65 -0.37 0.00 -2.93 0.00 0.00 61.98 59.32 3huy s VAL 11 Cb 0.00 -3.49 -0.17 0.00 -1.53 0.00 0.00 36.38 31.19 3huy s VAL 11 CO 0.00 -0.14 1.39 0.47 -3.33 0.00 0.00 175.10 173.49 3huy n ASP 12 N 7.94 1.68 -0.25 3.54 8.00 -1.26 -4.85 116.55 131.36 3huy n ASP 12 Ca 0.19 1.11 0.17 0.00 0.71 0.00 0.00 54.79 56.97 3huy n ASP 12 Cb 0.44 -1.17 0.47 0.00 -0.02 0.00 0.00 41.12 40.83 3huy n ASP 12 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 3huy h ASP 13 N 4.89 0.49 -0.75 -2.24 3.04 -2.01 -2.43 116.42 117.40 3huy h ASP 13 Ca -0.48 0.04 0.20 0.00 -3.24 0.00 0.00 57.03 53.56 3huy h ASP 13 Cb 1.34 -0.05 -0.04 0.00 -1.04 0.00 0.00 39.33 39.54 3huy h ASP 13 CO 0.80 0.21 0.53 0.45 -2.04 0.00 0.00 179.24 179.19 3huy h HIS 14 N 0.50 0.13 0.05 4.15 -0.00 -2.00 -2.63 115.15 115.35 3huy h HIS 14 Ca 0.46 0.00 -0.35 0.00 -0.00 0.00 0.00 60.37 60.49 3huy h HIS 14 Cb 1.01 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 28.34 3huy h HIS 14 CO -0.00 0.04 -2.02 1.28 -0.00 0.00 0.00 177.93 177.23 3huy n LEU 15 N -4.37 1.83 0.16 2.43 7.99 -0.92 -3.33 117.00 120.81 3huy n LEU 15 Ca 0.15 0.20 -0.15 0.00 -0.01 0.00 0.00 56.01 56.21 3huy n LEU 15 Cb 0.75 -0.50 -0.07 0.00 -0.11 0.00 0.00 43.42 43.48 3huy n LEU 15 CO 0.36 0.68 0.61 -0.07 -1.51 0.00 0.00 177.39 177.46 3huy h LEU 16 N 0.03 -1.08 -0.99 2.23 4.07 -1.56 3.15 115.31 121.16 3huy h LEU 16 Ca -0.42 0.11 0.35 0.00 0.08 0.00 0.00 57.88 58.00 3huy h LEU 16 Cb 2.03 0.39 -0.17 0.00 1.08 0.00 0.00 40.66 43.99 3huy h LEU 16 CO 0.05 -0.49 0.37 -0.08 -1.08 0.00 0.00 178.44 177.22 3huy h GLU 17 N -0.68 0.06 0.00 1.13 4.81 -1.63 4.13 114.58 122.40 3huy h GLU 17 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3huy h GLU 17 Cb 0.67 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.03 3huy h GLU 17 CO -0.16 0.04 -0.72 1.17 -0.73 0.00 0.00 179.01 178.61 3huy n LYS 18 N -5.30 0.22 0.00 1.92 3.00 -0.18 -0.49 118.16 117.33 3huy n LYS 18 Ca 0.31 0.04 0.11 0.00 -0.00 0.00 0.00 58.31 58.77 3huy n LYS 18 Cb 1.04 -1.61 -0.00 0.00 0.00 0.00 0.00 35.03 34.46 3huy n LYS 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.40 178.95 3huy n VAL 19 N -1.91 0.00 -0.06 3.15 3.14 1.03 -3.36 118.33 120.32 3huy n VAL 19 Ca 0.03 -0.21 -0.13 0.00 -2.96 0.00 0.00 64.34 61.07 3huy n VAL 19 Cb 0.41 1.18 -0.04 0.00 -1.06 0.00 0.00 33.84 34.32 3huy n VAL 19 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 3huy n LEU 20 N -0.28 1.35 -0.30 6.55 4.77 1.24 -2.88 117.00 127.46 3huy n LEU 20 Ca 0.09 0.22 0.24 0.00 -0.03 0.00 0.00 56.01 56.53 3huy n LEU 20 Cb 0.44 -0.53 0.55 0.00 -2.33 0.00 0.00 43.42 41.55 3huy n LEU 20 CO 0.31 0.02 1.23 -0.33 -1.33 0.00 0.00 177.39 177.29 3huy h GLU 21 N -0.60 0.32 -0.01 3.23 5.08 -0.96 2.21 114.58 123.86 3huy h GLU 21 Ca -0.25 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3huy h GLU 21 Cb 1.06 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.24 3huy h GLU 21 CO -0.15 0.21 -0.67 1.28 -1.00 0.00 0.00 179.01 178.68 3huy n LEU 22 N -4.53 1.19 -0.18 1.33 7.99 -1.21 -3.13 117.00 118.45 3huy n LEU 22 Ca 0.23 -0.44 0.15 0.00 -0.01 0.00 0.00 56.01 55.94 3huy n LEU 22 Cb 0.88 -0.06 0.67 0.00 -0.11 0.00 0.00 43.42 44.79 3huy n LEU 22 CO 0.29 0.25 0.92 -3.20 -1.51 0.00 0.00 177.39 174.15 3huy n ASN 23 N -0.99 0.63 -4.53 -1.43 5.15 0.69 -2.97 115.26 111.82 3huy n ASN 23 Ca 0.07 -0.92 -0.43 0.00 -0.60 0.00 0.00 54.58 52.69 3huy n ASN 23 Cb 0.37 -0.03 -0.01 0.00 -0.53 0.00 0.00 39.78 39.58 3huy n ASN 23 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3huy s ALA 24 N -2.24 3.34 0.00 5.20 0.00 0.19 -4.01 121.76 124.25 3huy s ALA 24 Ca 0.36 -2.84 0.00 0.00 0.00 0.00 0.00 51.96 49.48 3huy s ALA 24 Cb 0.21 -4.40 0.00 0.00 0.00 0.00 0.00 23.12 18.92 3huy s ALA 24 CO 0.41 -3.20 0.00 1.63 0.00 0.00 0.00 175.76 174.60 3huy n LYS 25 N 7.58 0.00 -2.82 0.00 5.02 -1.26 -4.62 118.16 122.05 3huy n LYS 25 Ca 0.38 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.65 3huy n LYS 25 Cb 0.47 -2.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.01 3huy n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3huy n GLY 26 N -2.08 -3.02 0.00 0.72 0.00 -1.16 -5.06 105.19 94.60 3huy n GLY 26 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.94 3huy n GLY 26 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3huy n GLU 27 N 1.81 0.00 0.00 1.61 4.71 -1.25 -5.08 120.64 122.45 3huy n GLU 27 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 56.95 3huy n GLU 27 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.79 3huy n GLU 27 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3huy n LYS 28 N -1.01 3.26 -0.84 3.49 4.76 -1.26 -5.07 118.16 121.48 3huy n LYS 28 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 3huy n LYS 28 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 3huy n LYS 28 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3huy n ARG 29 N 0.00 0.00 -1.68 1.97 -4.01 -1.26 -4.93 116.66 106.75 3huy n ARG 29 Ca 0.00 -0.77 -0.21 0.00 -1.04 0.00 0.00 57.85 55.83 3huy n ARG 29 Cb 0.00 0.19 -0.06 0.00 -3.04 0.00 0.00 32.46 29.55 3huy n ARG 29 CO 0.00 0.00 0.00 -1.17 -3.04 0.00 0.00 177.63 173.42 3huy s LEU 30 N 0.00 3.03 -0.46 2.89 0.20 -1.26 -4.72 118.68 118.37 3huy s LEU 30 Ca 0.04 0.11 0.07 0.00 0.69 0.00 0.00 54.13 55.04 3huy s LEU 30 Cb 0.04 -2.54 0.29 0.00 -0.43 0.00 0.00 46.19 43.56 3huy s LEU 30 CO -0.02 -3.43 0.98 0.00 -0.29 0.00 0.00 176.35 173.58 3huy n ILE 31 N 8.41 -0.06 -0.87 6.68 3.06 -1.26 -4.99 119.36 130.33 3huy n ILE 31 Ca 0.42 -1.94 -0.27 0.00 -2.50 0.00 0.00 62.75 58.47 3huy n ILE 31 Cb 0.46 1.14 -0.02 0.00 0.54 0.00 0.00 39.64 41.76 3huy n ILE 31 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 3huy n LYS 32 N 0.81 2.23 -0.56 9.51 5.02 -1.26 -1.27 118.16 132.65 3huy n LYS 32 Ca 0.10 -1.61 -0.29 0.00 -2.02 0.00 0.00 58.31 54.48 3huy n LYS 32 Cb 0.66 -2.56 0.23 0.00 -0.02 0.00 0.00 35.03 33.34 3huy n LYS 32 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3huy s THR 33 N 3.43 2.02 -0.02 -0.18 -1.32 -1.17 -4.90 115.64 113.49 3huy s THR 33 Ca 0.45 0.01 0.03 0.00 -1.21 0.00 0.00 61.69 60.96 3huy s THR 33 Cb 0.12 -2.02 0.04 0.00 -1.51 0.00 0.00 72.50 69.12 3huy s THR 33 CO -0.02 -0.01 0.89 0.79 -2.21 0.00 0.00 174.62 174.06 3huy n TRP 34 N -4.74 0.00 -2.34 9.09 8.01 -1.26 -3.19 117.44 123.01 3huy n TRP 34 Ca 0.06 -0.17 -0.40 0.00 -1.31 0.00 0.00 57.50 55.68 3huy n TRP 34 Cb 0.53 -0.05 0.02 0.00 -2.01 0.00 0.00 31.31 29.80 3huy n TRP 34 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 3huy n SER 35 N -0.23 7.47 0.23 -0.99 3.41 -1.26 -4.63 113.62 117.62 3huy n SER 35 Ca 0.02 -3.60 0.11 0.00 -0.26 0.00 0.00 58.87 55.14 3huy n SER 35 Cb 0.61 -1.19 0.50 0.00 -0.26 0.00 0.00 64.21 63.87 3huy n SER 35 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3huy h ARG 36 N 3.99 0.00 -0.16 4.33 0.11 -1.89 -3.19 114.38 117.57 3huy h ARG 36 Ca 0.57 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.65 3huy h ARG 36 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 3huy h ARG 36 CO 1.26 0.20 0.00 2.89 0.10 0.00 0.00 179.97 184.42 3huy n ARG 37 N -3.38 0.62 -4.50 0.08 -4.01 -1.26 -2.14 116.66 102.06 3huy n ARG 37 Ca -0.00 0.00 -0.24 0.00 -1.04 0.00 0.00 57.85 56.57 3huy n ARG 37 Cb 0.40 -1.08 -0.11 0.00 -3.04 0.00 0.00 32.46 28.64 3huy n ARG 37 CO 0.00 0.00 0.00 -1.12 -3.04 0.00 0.00 177.63 173.47 3huy s SER 38 N -1.12 3.10 -0.11 2.89 0.01 -1.20 -4.92 113.70 112.34 3huy s SER 38 Ca 0.00 -1.29 -0.30 0.00 1.31 0.00 0.00 55.95 55.67 3huy s SER 38 Cb 0.00 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.99 3huy s SER 38 CO 0.00 -0.43 1.01 -0.89 0.41 0.00 0.00 173.24 173.35 3huy s THR 39 N -2.95 4.76 0.08 1.44 2.01 -1.25 -3.21 115.64 116.52 3huy s THR 39 Ca 0.33 2.03 -0.32 0.00 0.31 0.00 0.00 61.69 64.05 3huy s THR 39 Cb 0.07 -4.31 -0.11 0.00 0.01 0.00 0.00 72.50 68.16 3huy s THR 39 CO 0.15 -0.01 1.83 -0.38 -0.69 0.00 0.00 174.62 175.52 3huy n ILE 40 N 4.61 0.40 -3.79 1.82 5.41 -0.39 -4.75 119.36 122.67 3huy n ILE 40 Ca 0.09 -0.07 -0.35 0.00 1.00 0.00 0.00 62.75 63.42 3huy n ILE 40 Cb 0.48 -2.03 -0.05 0.00 -0.71 0.00 0.00 39.64 37.33 3huy n ILE 40 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3huy s VAL 41 N 2.92 5.35 1.08 1.39 1.01 -1.26 -4.26 120.40 126.62 3huy s VAL 41 Ca 0.84 0.15 -0.14 0.00 0.00 0.00 0.00 61.98 62.83 3huy s VAL 41 Cb -0.53 -3.54 0.18 0.00 0.00 0.00 0.00 36.38 32.49 3huy s VAL 41 CO 0.40 0.41 0.71 -2.65 0.00 0.00 0.00 175.10 173.98 3huy n PRO 42 N 1.26 -1.54 0.00 2.72 -0.02 -1.26 -2.88 135.00 133.28 3huy n PRO 42 Ca -0.13 -0.41 0.00 0.00 -2.02 0.00 0.00 63.50 60.94 3huy n PRO 42 Cb 0.53 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3huy n PRO 42 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3huy n GLU 43 N -3.66 0.00 -2.17 -0.52 0.00 -1.26 -4.82 120.64 108.21 3huy n GLU 43 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.80 3huy n GLU 43 Cb 0.55 -0.67 0.00 0.00 0.00 0.00 0.00 31.44 31.32 3huy n GLU 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 3huy n MET 44 N 0.00 4.54 -3.58 5.31 1.56 -1.14 -4.94 117.12 118.86 3huy n MET 44 Ca 0.00 -3.67 -0.20 0.00 -0.27 0.00 0.00 57.70 53.57 3huy n MET 44 Cb 0.00 -2.65 -0.01 0.00 2.15 0.00 0.00 33.22 32.70 3huy n MET 44 CO 0.00 0.00 0.00 0.14 -0.73 0.00 0.00 175.97 175.38 3huy s VAL 45 N -1.36 3.97 0.00 1.12 -7.23 -1.26 -4.25 120.40 111.39 3huy s VAL 45 Ca 0.49 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 3huy s VAL 45 Cb 0.16 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 33.74 3huy s VAL 45 CO -0.07 -0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.16 3huy n GLY 46 N -1.56 1.10 3.19 2.32 0.00 -1.08 -4.80 105.19 104.36 3huy n GLY 46 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3huy n GLY 46 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3huy n HIS 47 N 0.00 0.82 -1.68 1.61 -0.00 -1.26 -4.91 115.22 109.80 3huy n HIS 47 Ca 0.00 -1.13 -0.45 0.00 -0.00 0.00 0.00 57.72 56.14 3huy n HIS 47 Cb 0.00 -1.17 -0.04 0.00 -0.00 0.00 0.00 29.99 28.78 3huy n HIS 47 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 3huy n THR 48 N 6.05 0.24 -4.02 1.59 -2.24 -1.24 -4.86 114.28 109.80 3huy n THR 48 Ca 0.41 -0.04 -0.30 0.00 -2.27 0.00 0.00 64.05 61.84 3huy n THR 48 Cb 0.32 -1.87 -0.06 0.00 -2.10 0.00 0.00 70.33 66.63 3huy n THR 48 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3huy s ILE 49 N 2.19 4.70 -1.07 2.28 1.09 -1.09 -4.75 121.20 124.55 3huy s ILE 49 Ca 0.82 -0.71 -0.02 0.00 -1.10 0.00 0.00 60.65 59.64 3huy s ILE 49 Cb -0.59 -3.28 0.30 0.00 -1.06 0.00 0.00 42.46 37.83 3huy s ILE 49 CO 0.39 0.11 1.74 0.00 -0.10 0.00 0.00 174.94 177.09 3huy n ALA 50 N 0.37 5.79 -1.65 9.38 0.00 -0.39 -2.55 120.51 131.46 3huy n ALA 50 Ca -0.08 -4.65 -0.43 0.00 0.00 0.00 0.00 53.44 48.28 3huy n ALA 50 Cb 0.52 -2.29 -0.01 0.00 0.00 0.00 0.00 19.45 17.66 3huy n ALA 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3huy n VAL 51 N 0.58 1.93 -2.77 0.00 0.31 -1.14 -3.06 118.33 114.17 3huy n VAL 51 Ca 0.40 -0.48 -0.42 0.00 -0.01 0.00 0.00 64.34 63.83 3huy n VAL 51 Cb 0.29 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.86 3huy n VAL 51 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3huy s TYR 52 N -1.02 3.42 -0.83 3.52 5.04 -1.19 -0.31 117.35 125.99 3huy s TYR 52 Ca 0.58 1.40 0.26 0.00 -2.44 0.00 0.00 57.07 56.87 3huy s TYR 52 Cb -0.63 -3.13 0.78 0.00 0.35 0.00 0.00 41.96 39.33 3huy s TYR 52 CO 0.61 -0.30 1.66 0.27 -1.34 0.00 0.00 175.55 176.45 3huy n ASN 53 N 5.47 0.51 0.00 4.32 6.94 -1.23 -4.82 115.26 126.45 3huy n ASN 53 Ca 0.08 0.33 0.00 0.00 -0.02 0.00 0.00 54.58 54.96 3huy n ASN 53 Cb 0.48 -0.34 0.00 0.00 -2.36 0.00 0.00 39.78 37.56 3huy n ASN 53 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3huy n GLY 54 N 1.40 2.11 0.75 4.83 0.00 -1.26 -4.23 105.19 108.79 3huy n GLY 54 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3huy n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3huy n LYS 55 N -0.09 0.00 -4.28 1.61 4.81 -1.26 -5.11 118.16 113.83 3huy n LYS 55 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.23 3huy n LYS 55 Cb 0.00 -0.00 -0.12 0.00 0.02 0.00 0.00 35.03 34.93 3huy n LYS 55 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 3huy s GLN 56 N -0.75 1.11 -0.12 1.64 -2.07 -1.26 -5.09 119.66 113.13 3huy s GLN 56 Ca 0.00 -1.23 -0.30 0.00 -1.82 0.00 0.00 55.36 52.00 3huy s GLN 56 Cb 0.00 -1.19 -0.08 0.00 -1.09 0.00 0.00 33.01 30.64 3huy s GLN 56 CO 0.00 0.26 2.08 0.72 -1.32 0.00 0.00 175.29 177.03 3huy n HIS 57 N 0.73 2.19 -2.96 9.60 8.25 -1.26 -3.52 115.22 128.25 3huy n HIS 57 Ca -0.17 -0.17 -0.42 0.00 -0.26 0.00 0.00 57.72 56.70 3huy n HIS 57 Cb 0.55 -2.73 -0.05 0.00 1.12 0.00 0.00 29.99 28.88 3huy n HIS 57 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3huy s VAL 58 N 6.20 4.79 -0.78 1.59 -7.23 0.58 -4.88 120.40 120.67 3huy s VAL 58 Ca 0.96 1.08 -0.16 0.00 -1.81 0.00 0.00 61.98 62.05 3huy s VAL 58 Cb -0.47 -4.15 -0.12 0.00 0.56 0.00 0.00 36.38 32.20 3huy s VAL 58 CO 0.41 -0.29 1.95 -0.81 -0.31 0.00 0.00 175.10 176.05 3huy n PRO 59 N 6.24 1.62 -2.35 4.82 -0.04 -1.26 -2.90 135.00 141.13 3huy n PRO 59 Ca 0.03 -1.65 -0.38 0.00 -0.04 0.00 0.00 63.50 61.46 3huy n PRO 59 Cb 0.48 -2.72 -0.03 0.00 -0.04 0.00 0.00 33.50 31.20 3huy n PRO 59 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3huy s VAL 60 N 4.50 3.28 0.00 0.52 0.11 -1.06 -4.94 120.40 122.81 3huy s VAL 60 Ca 0.50 1.07 0.00 0.00 -2.93 0.00 0.00 61.98 60.62 3huy s VAL 60 Cb 0.13 -3.60 0.00 0.00 -1.53 0.00 0.00 36.38 31.37 3huy s VAL 60 CO 0.07 0.09 0.00 0.00 -3.33 0.00 0.00 175.10 171.93 3huy n TYR 61 N 0.13 0.00 0.00 1.54 9.36 -1.26 -2.67 117.16 124.26 3huy n TYR 61 Ca 0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.26 3huy n TYR 61 Cb 0.47 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.18 3huy n TYR 61 CO 0.00 0.00 0.00 1.51 0.22 0.00 0.00 176.86 178.59 3huy n ILE 62 N 0.00 0.00 -2.53 2.97 0.13 -1.26 -3.60 119.36 115.07 3huy n ILE 62 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3huy n ILE 62 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 3huy n ILE 62 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 3huy n THR 63 N 0.00 0.00 -0.09 9.51 5.66 -1.26 -2.62 114.28 125.48 3huy n THR 63 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 3huy n THR 63 Cb 0.00 -0.97 -0.14 0.00 -1.55 0.00 0.00 70.33 67.67 3huy n THR 63 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 3huy n GLU 64 N -0.48 0.68 -0.17 1.09 0.28 -1.26 -4.12 120.64 116.65 3huy n GLU 64 Ca 0.00 0.11 -0.09 0.00 -0.16 0.00 0.00 57.16 57.02 3huy n GLU 64 Cb 0.00 -1.57 -0.04 0.00 1.43 0.00 0.00 31.44 31.26 3huy n GLU 64 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 3huy h ASN 65 N 0.01 -1.44 -3.36 -1.84 4.21 -2.06 -3.06 115.58 108.04 3huy h ASN 65 Ca -0.52 0.23 -0.57 0.00 1.21 0.00 0.00 56.30 56.65 3huy h ASN 65 Cb 2.07 0.65 -0.06 0.00 -1.12 0.00 0.00 38.32 39.86 3huy h ASN 65 CO -0.00 -0.35 1.04 0.00 -1.29 0.00 0.00 177.43 176.83 3huy s MET 66 N -5.85 3.59 0.00 0.81 0.23 -1.26 -4.63 119.30 112.19 3huy s MET 66 Ca -0.14 0.84 0.00 0.00 -1.03 0.00 0.00 55.69 55.36 3huy s MET 66 Cb 0.13 -4.01 0.00 0.00 -1.53 0.00 0.00 34.83 29.42 3huy s MET 66 CO 0.66 -1.55 0.00 0.28 -2.03 0.00 0.00 175.02 172.38 3huy n VAL 67 N 7.04 0.00 -0.20 5.16 0.31 -1.16 -4.28 118.33 125.20 3huy n VAL 67 Ca 0.15 0.00 0.31 0.00 -0.01 0.00 0.00 64.34 64.79 3huy n VAL 67 Cb 0.48 0.00 0.71 0.00 -0.91 0.00 0.00 33.84 34.13 3huy n VAL 67 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3huy h GLY 68 N 0.00 0.00 -1.57 2.92 0.00 -1.82 -3.24 103.07 99.36 3huy h GLY 68 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 3huy h GLY 68 CO 0.00 0.00 0.33 0.30 0.00 0.00 0.00 176.54 177.17 3huy s HIS 69 N -4.81 1.91 0.00 5.60 4.02 -1.26 -4.50 115.29 116.25 3huy s HIS 69 Ca -0.05 1.67 0.00 0.00 1.02 0.00 0.00 55.06 57.70 3huy s HIS 69 Cb 0.20 -3.42 0.00 0.00 -1.02 0.00 0.00 32.58 28.34 3huy s HIS 69 CO 0.70 -2.68 0.00 1.63 1.02 0.00 0.00 174.74 175.42 3huy n LYS 70 N -3.31 2.03 -0.01 1.40 4.76 -1.26 -1.26 118.16 120.51 3huy n LYS 70 Ca 0.13 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.68 3huy n LYS 70 Cb 0.51 0.00 -0.16 0.00 -1.84 0.00 0.00 35.03 33.54 3huy n LYS 70 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3huy n LEU 71 N 0.00 0.09 0.03 -0.35 4.77 -1.13 -4.16 117.00 116.25 3huy n LEU 71 Ca 0.00 -0.02 0.11 0.00 -0.03 0.00 0.00 56.01 56.07 3huy n LEU 71 Cb 0.00 -0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.54 3huy n LEU 71 CO 0.00 0.01 0.85 0.61 -1.33 0.00 0.00 177.39 177.53 3huy n GLY 72 N 1.27 -1.30 0.10 -0.72 0.00 -0.91 -2.36 105.19 101.27 3huy n GLY 72 Ca -0.03 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3huy n GLY 72 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3huy h GLU 73 N 0.00 0.00 -0.21 1.61 5.08 -1.88 -3.30 114.58 115.88 3huy h GLU 73 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3huy h GLU 73 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3huy h GLU 73 CO 0.00 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.20 3huy n PHE 74 N -2.33 0.53 -3.12 4.33 3.72 -1.00 -4.68 117.46 114.92 3huy n PHE 74 Ca 0.03 -0.74 -0.18 0.00 -0.05 0.00 0.00 57.45 56.51 3huy n PHE 74 Cb 0.46 -0.17 -0.02 0.00 -0.94 0.00 0.00 39.48 38.81 3huy n PHE 74 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3huy n ALA 75 N -0.38 2.30 -1.70 4.37 0.00 -1.16 -4.83 120.51 119.11 3huy n ALA 75 Ca 0.15 -3.45 -0.63 0.00 0.00 0.00 0.00 53.44 49.51 3huy n ALA 75 Cb 0.64 -0.92 -0.09 0.00 0.00 0.00 0.00 19.45 19.08 3huy n ALA 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3huy n PRO 76 N 0.21 0.48 0.17 0.00 -0.04 -1.26 -4.54 135.00 130.02 3huy n PRO 76 Ca 0.24 0.17 0.03 0.00 -0.04 0.00 0.00 63.50 63.91 3huy n PRO 76 Cb 0.66 -1.76 0.25 0.00 -0.04 0.00 0.00 33.50 32.61 3huy n PRO 76 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3huy h THR 77 N 5.25 1.04 -3.35 0.52 1.35 -1.89 -3.45 112.91 112.38 3huy h THR 77 Ca -0.43 -1.79 -0.58 0.00 -0.55 0.00 0.00 66.41 63.06 3huy h THR 77 Cb 1.35 2.06 -0.08 0.00 -1.73 0.00 0.00 68.15 69.75 3huy h THR 77 CO 0.98 0.46 -0.09 -0.13 -0.25 0.00 0.00 175.52 176.49 3huy s ARG 78 N -3.52 4.33 -0.60 4.72 0.52 -1.26 -4.94 118.95 118.20 3huy s ARG 78 Ca 0.00 0.51 -0.22 0.00 -0.52 0.00 0.00 55.73 55.50 3huy s ARG 78 Cb 0.11 -3.46 0.06 0.00 0.52 0.00 0.00 34.95 32.19 3huy s ARG 78 CO 0.71 0.10 0.89 0.99 0.02 0.00 0.00 175.30 178.02 3huy s THR 79 N 0.80 4.45 0.00 0.02 2.01 -1.26 -4.34 115.64 117.32 3huy s THR 79 Ca 0.27 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.04 3huy s THR 79 Cb -0.15 -4.58 0.00 0.00 0.01 0.00 0.00 72.50 67.78 3huy s THR 79 CO 0.11 -1.24 0.00 0.00 -0.69 0.00 0.00 174.62 172.80 3huy n TYR 80 N 7.33 0.00 0.00 4.92 -0.00 -1.26 -5.31 117.16 122.84 3huy n TYR 80 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.87 3huy n TYR 80 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.80 3huy n TYR 80 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.86 179.75