#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3huy n ALA 20 N 0.00 0.00 -3.16 7.82 0.00 -1.26 -5.00 120.51 118.91 3huy n ALA 20 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 3huy n ALA 20 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 3huy n ALA 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3huy s LYS 21 N -2.32 2.90 0.11 0.00 -0.14 -1.26 -4.73 119.74 114.30 3huy s LYS 21 Ca 0.00 -0.86 -0.34 0.00 -1.36 0.00 0.00 55.97 53.41 3huy s LYS 21 Cb 0.00 -2.23 -0.13 0.00 -1.68 0.00 0.00 37.83 33.79 3huy s LYS 21 CO 0.00 0.20 1.56 0.28 -0.76 0.00 0.00 175.35 176.63 3huy h VAL 22 N 5.63 0.02 -0.63 3.17 2.07 -0.71 -2.88 116.25 122.92 3huy h VAL 22 Ca -0.21 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.42 3huy h VAL 22 Cb 1.23 0.02 -0.11 0.00 -1.52 0.00 0.00 31.29 30.91 3huy h VAL 22 CO 0.47 0.00 -0.19 1.17 0.02 0.00 0.00 177.57 179.04 3huy n LYS 23 N -5.47 -0.09 -2.09 1.57 3.00 -0.62 -0.68 118.16 113.77 3huy n LYS 23 Ca -0.08 0.97 -0.41 0.00 -0.00 0.00 0.00 58.31 58.80 3huy n LYS 23 Cb 0.40 -1.45 -0.00 0.00 0.00 0.00 0.00 35.03 33.98 3huy n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3huy n ALA 24 N -3.73 6.45 -1.21 3.14 0.00 -1.09 -3.73 120.51 120.34 3huy n ALA 24 Ca 0.09 -4.16 0.00 0.00 0.00 0.00 0.00 53.44 49.37 3huy n ALA 24 Cb 0.29 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 16.93 3huy n ALA 24 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3huy n THR 25 N 2.07 0.00 -3.82 0.00 -1.04 0.15 -4.79 114.28 106.85 3huy n THR 25 Ca 0.56 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.54 3huy n THR 25 Cb 0.27 1.15 0.00 0.00 -1.82 0.00 0.00 70.33 69.94 3huy n THR 25 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3huy s LEU 26 N 0.00 -0.07 0.00 -4.42 1.43 -1.24 -5.14 118.68 109.24 3huy s LEU 26 Ca 0.00 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.54 3huy s LEU 26 Cb 0.00 2.14 0.07 0.00 0.03 0.00 0.00 46.19 48.43 3huy s LEU 26 CO 0.00 -0.98 0.48 0.61 0.23 0.00 0.00 176.35 176.69 3huy n GLY 27 N -0.59 1.12 3.51 -3.19 0.00 -1.26 -4.98 105.19 99.80 3huy n GLY 27 Ca -0.05 -2.06 -0.61 0.00 0.00 0.00 0.00 46.02 43.30 3huy n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3huy n GLU 28 N -1.85 0.28 -4.08 1.61 2.13 -1.26 -4.93 120.64 112.55 3huy n GLU 28 Ca 0.08 0.09 -0.14 0.00 0.66 0.00 0.00 57.16 57.86 3huy n GLU 28 Cb 0.30 -1.69 -0.13 0.00 0.27 0.00 0.00 31.44 30.20 3huy n GLU 28 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 3huy s PHE 29 N 4.76 0.52 -0.68 4.31 -0.12 -1.26 -5.10 117.98 120.42 3huy s PHE 29 Ca 1.11 -0.32 -0.27 0.00 -0.05 0.00 0.00 56.93 57.39 3huy s PHE 29 Cb -1.37 -0.32 0.02 0.00 -0.63 0.00 0.00 43.02 40.72 3huy s PHE 29 CO 0.70 -0.06 1.40 0.34 -0.05 0.00 0.00 175.22 177.55 3huy s ASP 30 N -0.94 6.01 0.00 1.98 2.15 -1.26 -4.85 116.67 119.76 3huy s ASP 30 Ca -0.06 -0.15 0.00 0.00 0.43 0.00 0.00 52.55 52.78 3huy s ASP 30 Cb -0.06 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 3huy s ASP 30 CO 0.00 -1.90 0.85 0.00 -0.17 0.00 0.00 175.17 173.96 3huy n LEU 31 N 9.98 2.44 -0.03 -1.34 -0.00 -1.26 -2.37 117.00 124.43 3huy n LEU 31 Ca 0.08 -1.22 -0.03 0.00 -0.00 0.00 0.00 56.01 54.84 3huy n LEU 31 Cb 0.50 -0.48 -0.04 0.00 -0.00 0.00 0.00 43.42 43.39 3huy n LEU 31 CO 0.71 0.43 -0.67 -1.14 -0.00 0.00 0.00 177.39 176.72 3huy n ARG 32 N 0.40 2.92 -2.15 1.47 3.00 -1.26 -4.35 116.66 116.69 3huy n ARG 32 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.55 3huy n ARG 32 Cb 0.43 -1.13 -0.05 0.00 0.00 0.00 0.00 32.46 31.71 3huy n ARG 32 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3huy s ASP 33 N -3.70 5.41 0.14 6.15 3.68 -1.00 -4.82 116.67 122.54 3huy s ASP 33 Ca -0.03 -0.78 0.09 0.00 2.13 0.00 0.00 52.55 53.96 3huy s ASP 33 Cb 0.02 -2.56 0.51 0.00 -1.45 0.00 0.00 42.92 39.44 3huy s ASP 33 CO 0.20 -2.49 1.28 0.00 0.13 0.00 0.00 175.17 174.29 3huy n TYR 34 N 12.94 0.32 0.07 -5.34 0.18 -1.26 -2.78 117.16 121.29 3huy n TYR 34 Ca 0.38 0.17 0.09 0.00 1.88 0.00 0.00 57.90 60.42 3huy n TYR 34 Cb 0.48 -0.76 -0.04 0.00 -0.38 0.00 0.00 39.34 38.64 3huy n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 3huy n ARG 35 N -1.83 0.62 -0.28 -3.48 1.74 -1.26 -4.38 116.66 107.79 3huy n ARG 35 Ca -0.01 0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 3huy n ARG 35 Cb 0.02 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 3huy n ARG 35 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3huy n ASN 36 N -2.65 3.58 -0.08 0.55 6.94 -1.12 -4.62 115.26 117.86 3huy n ASN 36 Ca -0.03 -1.92 0.05 0.00 -0.02 0.00 0.00 54.58 52.66 3huy n ASN 36 Cb 0.61 -0.73 0.10 0.00 -2.36 0.00 0.00 39.78 37.40 3huy n ASN 36 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 3huy n VAL 37 N 1.38 -0.10 -0.22 3.53 0.24 -1.26 0.56 118.33 122.46 3huy n VAL 37 Ca 0.00 0.51 0.13 0.00 -2.04 0.00 0.00 64.34 62.94 3huy n VAL 37 Cb 0.37 -0.78 0.25 0.00 -1.47 0.00 0.00 33.84 32.21 3huy n VAL 37 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3huy n GLU 38 N -3.88 -0.05 -0.01 7.34 -0.58 -1.26 0.58 120.64 122.77 3huy n GLU 38 Ca 0.07 0.95 -0.00 0.00 -0.42 0.00 0.00 57.16 57.76 3huy n GLU 38 Cb 0.23 -1.56 -0.00 0.00 -0.57 0.00 0.00 31.44 29.54 3huy n GLU 38 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3huy h VAL 39 N 0.00 0.00 -0.70 2.62 2.07 -0.28 -3.37 116.25 116.58 3huy h VAL 39 Ca 0.44 -0.15 0.21 0.00 0.82 0.00 0.00 66.70 68.03 3huy h VAL 39 Cb 0.99 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.63 3huy h VAL 39 CO -0.58 0.00 0.09 0.18 0.02 0.00 0.00 177.57 177.28 3huy n LEU 40 N -2.44 -0.02 -0.44 2.57 4.77 -0.25 0.20 117.00 121.40 3huy n LEU 40 Ca -0.00 1.19 0.37 0.00 -0.03 0.00 0.00 56.01 57.54 3huy n LEU 40 Cb 0.01 -0.46 0.68 0.00 -2.33 0.00 0.00 43.42 41.32 3huy n LEU 40 CO 0.00 -1.23 1.31 0.50 -1.33 0.00 0.00 177.39 176.64 3huy h LYS 41 N 0.00 0.10 0.00 3.23 1.63 -0.03 0.84 116.57 122.34 3huy h LYS 41 Ca 0.46 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.25 3huy h LYS 41 Cb 1.02 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.63 3huy h LYS 41 CO -0.64 0.07 0.00 0.00 -3.45 0.00 0.00 179.45 175.43 3huy h ARG 42 N 0.11 0.00 -0.50 1.90 3.08 0.21 -2.85 114.38 116.33 3huy h ARG 42 Ca 0.73 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.78 3huy h ARG 42 Cb 2.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.56 3huy h ARG 42 CO -0.20 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 179.89 3huy n PHE 43 N -2.89 0.66 -4.43 3.04 3.01 0.29 -4.91 117.46 112.23 3huy n PHE 43 Ca 0.01 -0.33 -0.34 0.00 1.01 0.00 0.00 57.45 57.80 3huy n PHE 43 Cb 0.32 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.69 3huy n PHE 43 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3huy s LEU 44 N -1.03 3.43 0.00 4.37 1.43 -1.08 -3.32 118.68 122.48 3huy s LEU 44 Ca 0.34 0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.44 3huy s LEU 44 Cb 0.18 -1.82 0.09 0.00 0.03 0.00 0.00 46.19 44.67 3huy s LEU 44 CO 0.24 0.35 0.28 -1.54 0.23 0.00 0.00 176.35 175.91 3huy n SER 45 N 1.99 -1.72 0.05 2.29 3.41 0.48 -4.83 113.62 115.29 3huy n SER 45 Ca -0.17 -0.54 -0.13 0.00 -0.26 0.00 0.00 58.87 57.77 3huy n SER 45 Cb 0.53 -0.28 -0.08 0.00 -0.26 0.00 0.00 64.21 64.13 3huy n SER 45 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3huy h GLU 46 N 0.00 -0.06 0.20 4.33 4.39 -1.96 -3.15 114.58 118.33 3huy h GLU 46 Ca -0.11 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 3huy h GLU 46 Cb 0.36 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 3huy h GLU 46 CO 0.07 0.04 -0.14 1.15 -1.16 0.00 0.00 179.01 178.97 3huy h THR 47 N -0.15 0.70 0.00 1.13 2.02 -1.87 -3.44 112.91 111.31 3huy h THR 47 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3huy h THR 47 Cb 0.13 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3huy h THR 47 CO 0.01 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.51 3huy n GLY 48 N -1.26 -0.58 3.69 2.16 0.00 -1.19 -0.38 105.19 107.62 3huy n GLY 48 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3huy n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3huy n LYS 49 N 0.00 1.87 -0.49 1.61 4.76 -1.26 -4.53 118.16 120.12 3huy n LYS 49 Ca 0.00 0.66 -0.02 0.00 -2.87 0.00 0.00 58.31 56.08 3huy n LYS 49 Cb 0.00 -2.33 -0.03 0.00 -1.84 0.00 0.00 35.03 30.84 3huy n LYS 49 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 3huy n ILE 50 N -0.18 1.78 -1.04 -0.18 2.08 -1.26 -0.39 119.36 120.18 3huy n ILE 50 Ca 0.07 -0.57 0.00 0.00 0.56 0.00 0.00 62.75 62.81 3huy n ILE 50 Cb 0.39 -1.50 0.00 0.00 -0.75 0.00 0.00 39.64 37.78 3huy n ILE 50 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 3huy n LEU 51 N 1.79 0.00 -4.22 1.39 4.77 -1.21 -4.88 117.00 114.64 3huy n LEU 51 Ca 0.07 0.69 -0.34 0.00 -0.03 0.00 0.00 56.01 56.41 3huy n LEU 51 Cb 0.47 -1.04 0.15 0.00 -2.33 0.00 0.00 43.42 40.67 3huy n LEU 51 CO 0.03 -0.19 -0.86 -0.81 -1.33 0.00 0.00 177.39 174.23 3huy n PRO 52 N 0.81 -1.34 0.29 3.23 -0.04 -1.26 -4.82 135.00 131.86 3huy n PRO 52 Ca 0.00 -0.38 0.18 0.00 -0.04 0.00 0.00 63.50 63.26 3huy n PRO 52 Cb 0.00 -1.56 0.78 0.00 -0.04 0.00 0.00 33.50 32.68 3huy n PRO 52 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 3huy h ARG 53 N -1.88 0.00 0.00 0.54 9.65 -1.98 -3.33 114.38 117.37 3huy h ARG 53 Ca -0.51 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 3huy h ARG 53 Cb 1.37 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.95 3huy h ARG 53 CO 0.35 0.01 0.00 0.54 2.80 0.00 0.00 179.97 183.67 3huy n ARG 54 N -3.12 0.00 0.00 0.20 1.74 -1.26 -1.67 116.66 112.54 3huy n ARG 54 Ca -0.00 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 3huy n ARG 54 Cb 0.26 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 3huy n ARG 54 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3huy n ARG 55 N -1.13 0.00 -0.11 5.56 5.12 -1.25 -1.96 116.66 122.89 3huy n ARG 55 Ca 0.00 0.40 -0.13 0.00 -1.93 0.00 0.00 57.85 56.19 3huy n ARG 55 Cb 0.00 -1.53 -0.13 0.00 -1.16 0.00 0.00 32.46 29.64 3huy n ARG 55 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 3huy n THR 56 N -1.39 1.32 -3.14 0.55 5.66 -1.21 -0.26 114.28 115.81 3huy n THR 56 Ca 0.00 -0.63 -0.11 0.00 -3.05 0.00 0.00 64.05 60.25 3huy n THR 56 Cb 0.03 -0.98 0.05 0.00 -1.55 0.00 0.00 70.33 67.89 3huy n THR 56 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3huy n GLY 57 N 2.15 -1.11 3.54 1.09 0.00 -0.67 -1.59 105.19 108.60 3huy n GLY 57 Ca -0.37 0.53 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 3huy n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3huy s LEU 58 N -5.00 2.27 0.00 0.99 1.02 -1.26 -4.68 118.68 112.02 3huy s LEU 58 Ca 0.35 -1.49 -0.03 0.00 0.02 0.00 0.00 54.13 52.97 3huy s LEU 58 Cb -0.05 -0.46 0.13 0.00 0.02 0.00 0.00 46.19 45.83 3huy s LEU 58 CO 0.71 -0.69 0.84 -1.54 0.02 0.00 0.00 176.35 175.68 3huy n SER 59 N -0.97 0.79 -0.03 2.29 3.41 -1.26 -4.76 113.62 113.09 3huy n SER 59 Ca -0.06 -1.75 -0.05 0.00 -0.26 0.00 0.00 58.87 56.75 3huy n SER 59 Cb 0.66 -0.57 0.15 0.00 -0.26 0.00 0.00 64.21 64.19 3huy n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3huy h ALA 60 N -0.91 1.01 0.00 7.33 0.00 -2.01 -1.17 119.26 123.50 3huy h ALA 60 Ca -0.27 -0.36 -0.17 0.00 0.00 0.00 0.00 54.91 54.11 3huy h ALA 60 Cb 0.93 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 3huy h ALA 60 CO 0.26 0.59 -0.89 -0.22 0.00 0.00 0.00 179.25 178.99 3huy h LYS 61 N 0.53 0.00 0.00 0.00 3.64 -2.00 -3.22 116.57 115.52 3huy h LYS 61 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3huy h LYS 61 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 3huy h LYS 61 CO 0.05 0.68 0.00 0.39 -2.27 0.00 0.00 179.45 178.30 3huy n GLU 62 N -3.23 0.00 -0.35 1.90 1.02 -1.08 -3.22 120.64 115.68 3huy n GLU 62 Ca -0.01 0.36 -0.09 0.00 -0.02 0.00 0.00 57.16 57.40 3huy n GLU 62 Cb 0.85 -1.11 -0.08 0.00 -0.02 0.00 0.00 31.44 31.09 3huy n GLU 62 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3huy n GLN 63 N -1.59 -0.36 -0.38 3.49 -0.06 -0.46 -0.61 117.38 117.40 3huy n GLN 63 Ca 0.00 1.27 -0.06 0.00 -2.00 0.00 0.00 57.00 56.21 3huy n GLN 63 Cb 0.00 -1.87 -0.02 0.00 -4.06 0.00 0.00 30.24 24.29 3huy n GLN 63 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3huy h ARG 64 N 0.00 -0.02 0.08 3.69 3.08 -1.69 -0.38 114.38 119.13 3huy h ARG 64 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3huy h ARG 64 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3huy h ARG 64 CO -0.79 -0.01 -0.16 0.82 -1.07 0.00 0.00 179.97 178.75 3huy h ILE 65 N -0.02 0.00 -0.42 2.04 2.04 -0.83 -2.57 117.51 117.75 3huy h ILE 65 Ca 0.26 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.15 3huy h ILE 65 Cb 0.52 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.55 3huy h ILE 65 CO -0.94 0.00 -0.25 -0.11 0.00 0.00 0.00 178.15 176.85 3huy n LEU 66 N -3.36 -0.44 -0.03 1.44 7.94 -0.41 -0.15 117.00 121.98 3huy n LEU 66 Ca -0.03 0.82 -0.01 0.00 -1.11 0.00 0.00 56.01 55.68 3huy n LEU 66 Cb 0.14 -0.13 -0.01 0.00 0.53 0.00 0.00 43.42 43.94 3huy n LEU 66 CO 0.06 -0.65 0.50 0.00 -1.11 0.00 0.00 177.39 176.19 3huy h ALA 67 N 0.13 -0.17 0.00 1.96 0.00 -0.80 0.70 119.26 121.09 3huy h ALA 67 Ca 0.07 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3huy h ALA 67 Cb 0.17 0.93 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 3huy h ALA 67 CO -0.39 -0.21 -0.12 1.63 0.00 0.00 0.00 179.25 180.16 3huy n LYS 68 N -3.16 1.33 0.00 0.00 4.01 0.79 -1.02 118.16 120.11 3huy n LYS 68 Ca -0.00 -0.62 0.00 0.00 -0.51 0.00 0.00 58.31 57.18 3huy n LYS 68 Cb 0.03 -1.76 0.00 0.00 -0.51 0.00 0.00 35.03 32.79 3huy n LYS 68 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 3huy n THR 69 N 2.52 0.00 0.16 -0.18 -1.04 0.42 -4.78 114.28 111.38 3huy n THR 69 Ca 0.27 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 62.12 3huy n THR 69 Cb 0.62 -0.26 -0.08 0.00 -1.82 0.00 0.00 70.33 68.78 3huy n THR 69 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3huy h ILE 70 N 0.00 0.10 -0.72 12.58 1.08 0.20 -2.53 117.51 128.22 3huy h ILE 70 Ca 0.00 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.54 3huy h ILE 70 Cb 0.00 0.10 -0.10 0.00 -3.07 0.00 0.00 36.82 33.75 3huy h ILE 70 CO 0.00 0.00 -0.57 0.11 -0.69 0.00 0.00 178.15 177.00 3huy h LYS 71 N -0.76 -0.18 -0.68 2.37 1.57 -1.52 -1.25 116.57 116.13 3huy h LYS 71 Ca -0.00 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.89 3huy h LYS 71 Cb 0.74 0.04 -0.12 0.00 0.08 0.00 0.00 32.23 32.97 3huy h LYS 71 CO -0.21 -0.12 -0.43 0.00 -0.57 0.00 0.00 179.45 178.13 3huy h ARG 72 N -0.18 -0.16 -0.36 3.15 3.08 -1.75 0.65 114.38 118.81 3huy h ARG 72 Ca 0.12 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.26 3huy h ARG 72 Cb 0.49 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 3huy h ARG 72 CO -0.77 -0.11 0.25 0.00 -1.07 0.00 0.00 179.97 178.27 3huy h ALA 73 N 0.78 2.19 -0.04 0.04 0.00 -0.91 0.41 119.26 121.73 3huy h ALA 73 Ca 0.21 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3huy h ALA 73 Cb 0.56 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3huy h ALA 73 CO -0.75 -0.28 -0.33 0.00 0.00 0.00 0.00 179.25 177.89 3huy h ARG 74 N 0.12 0.08 0.03 0.00 3.08 0.14 -0.98 114.38 116.84 3huy h ARG 74 Ca 0.17 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 59.98 3huy h ARG 74 Cb 0.51 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 3huy h ARG 74 CO -0.02 0.40 -0.99 0.82 -1.07 0.00 0.00 179.97 179.12 3huy h ILE 75 N 0.07 1.61 -0.03 2.04 2.04 0.11 -3.04 117.51 120.31 3huy h ILE 75 Ca 0.01 -3.08 0.00 0.00 1.00 0.00 0.00 64.86 62.79 3huy h ILE 75 Cb 0.62 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 3huy h ILE 75 CO 0.05 0.89 0.00 0.18 0.00 0.00 0.00 178.15 179.26 3huy n LEU 76 N -3.49 0.43 0.00 1.44 7.99 -0.32 -4.85 117.00 118.20 3huy n LEU 76 Ca -0.02 -0.22 0.00 0.00 -0.01 0.00 0.00 56.01 55.76 3huy n LEU 76 Cb 0.90 -0.15 0.00 0.00 -0.11 0.00 0.00 43.42 44.06 3huy n LEU 76 CO 0.48 0.10 0.00 0.61 -1.51 0.00 0.00 177.39 177.07 3huy n GLY 77 N 0.42 0.01 0.00 -0.72 0.00 -0.67 -4.69 105.19 99.54 3huy n GLY 77 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 3huy n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3huy n LEU 78 N 0.00 0.00 -4.05 0.99 4.77 -0.62 -4.73 117.00 113.36 3huy n LEU 78 Ca 0.00 0.26 -0.18 0.00 -0.03 0.00 0.00 56.01 56.06 3huy n LEU 78 Cb 0.01 -0.26 -0.14 0.00 -2.33 0.00 0.00 43.42 40.70 3huy n LEU 78 CO 0.00 -0.01 -0.43 -0.76 -1.33 0.00 0.00 177.39 174.86 3huy s LEU 79 N -2.52 2.09 0.43 2.23 1.43 -1.04 -4.90 118.68 116.40 3huy s LEU 79 Ca 0.29 -0.28 -0.24 0.00 -1.03 0.00 0.00 54.13 52.86 3huy s LEU 79 Cb 0.19 -0.42 -0.08 0.00 0.03 0.00 0.00 46.19 45.91 3huy s LEU 79 CO 0.43 0.04 1.15 -2.16 0.23 0.00 0.00 176.35 176.04 3huy s PRO 80 N -0.64 3.92 0.19 1.29 0.04 -1.26 -4.49 135.00 134.06 3huy s PRO 80 Ca 0.01 1.76 0.22 0.00 0.04 0.00 0.00 61.00 63.02 3huy s PRO 80 Cb -0.05 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 3huy s PRO 80 CO 0.00 -0.41 1.04 0.74 0.04 0.00 0.00 177.00 178.41 3huy h PHE 81 N 2.33 0.00 -1.45 0.56 0.04 -1.92 -3.47 116.94 113.03 3huy h PHE 81 Ca -0.49 0.00 0.38 0.00 2.80 0.00 0.00 57.97 60.66 3huy h PHE 81 Cb 1.24 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.27 3huy h PHE 81 CO 0.55 0.08 0.95 0.99 -0.60 0.00 0.00 178.31 180.28 3huy s THR 82 N -3.30 0.00 -0.20 -1.55 2.01 -1.26 -4.87 115.64 106.47 3huy s THR 82 Ca -0.01 -0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.62 3huy s THR 82 Cb 0.09 -2.32 0.15 0.00 0.01 0.00 0.00 72.50 70.43 3huy s THR 82 CO 0.79 0.00 1.10 -1.83 -0.69 0.00 0.00 174.62 173.99 3huy s GLU 83 N -2.11 0.44 0.73 4.92 -1.05 0.49 -4.93 118.70 117.20 3huy s GLU 83 Ca 0.20 0.12 -0.11 0.00 -0.15 0.00 0.00 54.97 55.03 3huy s GLU 83 Cb 0.05 0.21 0.03 0.00 -0.44 0.00 0.00 34.13 33.97 3huy s GLU 83 CO -0.05 -0.13 1.08 0.15 0.95 0.00 0.00 175.26 177.26 3huy s LYS 84 N -1.02 2.66 -0.20 -4.83 -0.14 -1.26 -4.26 119.74 110.68 3huy s LYS 84 Ca 0.01 0.65 -0.27 0.00 -1.36 0.00 0.00 55.97 55.00 3huy s LYS 84 Cb -0.01 -1.98 -0.00 0.00 -1.68 0.00 0.00 37.83 34.16 3huy s LYS 84 CO -0.01 -1.22 0.92 -1.17 -0.76 0.00 0.00 175.35 173.11 3huy s LEU 85 N -5.53 4.13 -0.04 3.17 2.96 -1.26 -4.79 118.68 117.33 3huy s LEU 85 Ca 0.59 1.25 -0.27 0.00 -0.22 0.00 0.00 54.13 55.48 3huy s LEU 85 Cb -0.13 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.16 3huy s LEU 85 CO 0.54 -0.53 0.84 -0.69 -1.32 0.00 0.00 176.35 175.19 3huy s VAL 86 N 2.67 4.96 0.00 1.68 1.01 -1.26 -4.91 120.40 124.55 3huy s VAL 86 Ca 0.41 1.75 0.00 0.00 0.00 0.00 0.00 61.98 64.14 3huy s VAL 86 Cb -0.16 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.04 3huy s VAL 86 CO 0.10 0.20 0.00 -2.11 0.00 0.00 0.00 175.10 173.29 3huy n ARG 87 N 3.87 0.00 0.00 2.72 0.00 -1.26 -5.21 116.66 116.78 3huy n ARG 87 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 3huy n ARG 87 Cb 0.51 -0.18 0.00 0.00 -0.00 0.00 0.00 32.46 32.79 3huy n ARG 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80