#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3huy n ASN 3 N 0.00 0.86 -2.36 1.61 6.94 -1.26 -5.13 115.26 115.92 3huy n ASN 3 Ca 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 54.58 54.56 3huy n ASN 3 Cb 0.00 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.42 3huy n ASN 3 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3huy n LYS 4 N 0.00 -4.80 -2.62 -3.83 5.02 -1.26 -5.01 118.16 105.66 3huy n LYS 4 Ca 0.00 3.49 -0.28 0.00 -2.02 0.00 0.00 58.31 59.50 3huy n LYS 4 Cb 0.00 -4.46 -0.00 0.00 -0.02 0.00 0.00 35.03 30.55 3huy n LYS 4 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3huy s ILE 5 N -0.56 4.89 -0.42 -0.18 -5.25 -1.26 -4.96 121.20 113.46 3huy s ILE 5 Ca -0.02 0.26 -0.43 0.00 -0.99 0.00 0.00 60.65 59.47 3huy s ILE 5 Cb 0.00 -3.86 -0.18 0.00 2.95 0.00 0.00 42.46 41.38 3huy s ILE 5 CO 0.06 -0.84 1.80 1.41 -1.79 0.00 0.00 174.94 175.58 3huy n HIS 6 N -2.21 1.72 0.13 1.37 8.25 -1.26 -4.72 115.22 118.50 3huy n HIS 6 Ca 0.01 0.81 0.08 0.00 -0.26 0.00 0.00 57.72 58.37 3huy n HIS 6 Cb 0.55 -2.34 0.44 0.00 1.12 0.00 0.00 29.99 29.76 3huy n HIS 6 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3huy n PRO 7 N 5.48 0.10 -0.01 -0.41 -0.04 -1.26 -2.07 135.00 136.80 3huy n PRO 7 Ca 0.35 0.59 -0.00 0.00 -0.04 0.00 0.00 63.50 64.41 3huy n PRO 7 Cb 0.03 -1.89 -0.00 0.00 -0.04 0.00 0.00 33.50 31.60 3huy n PRO 7 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3huy h ILE 8 N 0.00 0.00 0.00 0.52 1.08 -1.89 -2.21 117.51 115.02 3huy h ILE 8 Ca 0.00 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 3huy h ILE 8 Cb 0.09 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.84 3huy h ILE 8 CO 0.00 0.00 0.30 0.61 -0.69 0.00 0.00 178.15 178.37 3huy n GLY 9 N 1.89 -0.60 0.13 5.37 0.00 -1.05 0.44 105.19 111.37 3huy n GLY 9 Ca -0.00 0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 3huy n GLY 9 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3huy h PHE 10 N 0.00 0.58 -0.23 1.61 3.57 -1.47 -3.29 116.94 117.71 3huy h PHE 10 Ca 0.00 -0.43 0.00 0.00 3.53 0.00 0.00 57.97 61.07 3huy h PHE 10 Cb 0.61 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.32 3huy h PHE 10 CO 0.00 1.52 0.00 0.54 -2.23 0.00 0.00 178.31 178.14 3huy n ARG 11 N -3.89 1.89 -0.39 1.11 5.12 0.17 -4.59 116.66 116.08 3huy n ARG 11 Ca -0.21 -1.34 -0.07 0.00 -1.93 0.00 0.00 57.85 54.30 3huy n ARG 11 Cb 0.94 -1.40 -0.05 0.00 -1.16 0.00 0.00 32.46 30.78 3huy n ARG 11 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3huy n LEU 12 N 0.57 2.23 0.00 0.55 -0.00 0.16 -2.14 117.00 118.38 3huy n LEU 12 Ca 0.16 -1.66 0.00 0.00 -0.00 0.00 0.00 56.01 54.51 3huy n LEU 12 Cb 0.38 -0.61 0.00 0.00 -0.00 0.00 0.00 43.42 43.19 3huy n LEU 12 CO 0.13 0.23 0.00 0.61 -0.00 0.00 0.00 177.39 178.36 3huy n GLY 13 N 3.05 -1.99 0.28 -3.96 0.00 -1.17 -4.94 105.19 96.47 3huy n GLY 13 Ca 0.19 0.58 -0.02 0.00 0.00 0.00 0.00 46.02 46.77 3huy n GLY 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3huy h ILE 14 N 0.00 1.22 0.00 -0.61 2.10 -1.87 -3.45 117.51 114.90 3huy h ILE 14 Ca 0.00 -0.88 0.00 0.00 1.08 0.00 0.00 64.86 65.06 3huy h ILE 14 Cb 0.00 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 36.63 3huy h ILE 14 CO 0.00 0.31 0.00 0.41 -1.08 0.00 0.00 178.15 177.79 3huy n THR 15 N -4.25 0.00 0.00 2.19 -1.04 -0.91 -4.99 114.28 105.28 3huy n THR 15 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3huy n THR 15 Cb 0.26 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.77 3huy n THR 15 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3huy n ARG 16 N 0.00 0.00 -3.98 -2.82 3.00 -1.06 -4.75 116.66 107.05 3huy n ARG 16 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.85 57.64 3huy n ARG 16 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.44 3huy n ARG 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3huy s ASP 17 N 0.00 6.27 0.00 6.15 1.11 -1.26 -3.02 116.67 125.93 3huy s ASP 17 Ca 0.00 0.05 -0.36 0.00 0.18 0.00 0.00 52.55 52.42 3huy s ASP 17 Cb 0.00 -1.83 -0.14 0.00 1.07 0.00 0.00 42.92 42.01 3huy s ASP 17 CO 0.00 -0.07 1.62 0.79 1.18 0.00 0.00 175.17 178.69 3huy n TRP 18 N -1.39 2.05 0.20 4.23 8.01 -1.26 -4.85 117.44 124.43 3huy n TRP 18 Ca -0.09 0.35 0.05 0.00 -1.31 0.00 0.00 57.50 56.49 3huy n TRP 18 Cb 0.57 -2.50 0.41 0.00 -2.01 0.00 0.00 31.31 27.77 3huy n TRP 18 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.69 178.17 3huy h GLU 19 N 6.58 0.00 -3.36 -0.99 4.81 -1.96 -3.34 114.58 116.32 3huy h GLU 19 Ca -0.47 0.00 -0.62 0.00 -0.13 0.00 0.00 59.36 58.14 3huy h GLU 19 Cb 1.29 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 30.27 3huy h GLU 19 CO 0.89 0.34 -0.70 0.45 -0.73 0.00 0.00 179.01 179.26 3huy s SER 20 N -6.70 4.05 -0.18 1.04 0.15 -1.26 -1.76 113.70 109.03 3huy s SER 20 Ca -0.02 -2.64 -0.04 0.00 0.70 0.00 0.00 55.95 53.95 3huy s SER 20 Cb 0.13 -1.31 -0.02 0.00 -1.71 0.00 0.00 66.02 63.12 3huy s SER 20 CO 0.70 -0.28 -0.04 0.00 1.20 0.00 0.00 173.24 174.82 3huy s ARG 21 N 0.28 3.55 0.00 5.44 1.70 -1.07 -4.99 118.95 123.86 3huy s ARG 21 Ca 0.16 -0.57 0.00 0.00 -0.47 0.00 0.00 55.73 54.85 3huy s ARG 21 Cb -0.24 -2.94 0.00 0.00 -0.57 0.00 0.00 34.95 31.20 3huy s ARG 21 CO -0.03 0.07 0.00 -2.67 -1.08 0.00 0.00 175.30 171.60 3huy n TRP 22 N 4.02 0.00 -3.99 5.89 4.27 -1.26 -4.08 117.44 122.29 3huy n TRP 22 Ca -0.18 0.00 -0.33 0.00 -3.89 0.00 0.00 57.50 53.10 3huy n TRP 22 Cb 0.52 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.41 3huy n TRP 22 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 3huy s TYR 23 N -2.00 3.42 0.05 -2.67 5.04 -1.26 -5.05 117.35 114.88 3huy s TYR 23 Ca 0.00 0.28 -0.07 0.00 -2.44 0.00 0.00 57.07 54.84 3huy s TYR 23 Cb 0.00 -1.78 -0.01 0.00 0.35 0.00 0.00 41.96 40.52 3huy s TYR 23 CO 0.00 0.60 0.14 0.00 -1.34 0.00 0.00 175.55 174.95 3huy s ALA 24 N -1.28 -0.17 0.68 3.97 0.00 -1.26 -4.98 121.76 118.73 3huy s ALA 24 Ca 0.26 -0.51 -0.17 0.00 0.00 0.00 0.00 51.96 51.54 3huy s ALA 24 Cb -0.12 0.31 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 3huy s ALA 24 CO 0.17 -0.38 1.01 0.41 0.00 0.00 0.00 175.76 176.98 3huy n GLY 25 N 0.51 -0.27 0.29 0.00 0.00 -1.26 -4.78 105.19 99.68 3huy n GLY 25 Ca -0.18 -0.26 -0.06 0.00 0.00 0.00 0.00 46.02 45.52 3huy n GLY 25 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3huy h LYS 26 N 0.03 0.84 0.00 1.61 2.10 -2.01 -0.70 116.57 118.45 3huy h LYS 26 Ca -0.48 -0.25 0.00 0.00 -2.00 0.00 0.00 60.65 57.92 3huy h LYS 26 Cb 1.34 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 3huy h LYS 26 CO 0.49 0.87 0.00 1.63 -2.00 0.00 0.00 179.45 180.43 3huy n LYS 27 N -4.19 0.14 -1.06 0.07 5.02 -1.26 -3.76 118.16 113.11 3huy n LYS 27 Ca 0.02 0.03 0.04 0.00 -2.02 0.00 0.00 58.31 56.38 3huy n LYS 27 Cb 0.33 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.89 3huy n LYS 27 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 3huy n GLN 28 N -1.43 0.32 0.10 1.97 7.27 -0.90 -4.79 117.38 119.91 3huy n GLN 28 Ca 0.09 -2.02 -0.05 0.00 0.07 0.00 0.00 57.00 55.10 3huy n GLN 28 Cb 0.29 -0.44 0.10 0.00 2.41 0.00 0.00 30.24 32.60 3huy n GLN 28 CO 0.00 0.00 0.00 -0.92 0.07 0.00 0.00 177.06 176.21 3huy h TYR 29 N 0.72 0.19 0.00 3.69 3.20 -1.23 -3.18 116.97 120.36 3huy h TYR 29 Ca -0.13 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.66 3huy h TYR 29 Cb 1.60 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.84 3huy h TYR 29 CO 0.24 0.77 0.00 -2.13 -1.64 0.00 0.00 178.16 175.40 3huy n ARG 30 N -3.79 0.00 -0.26 1.82 0.63 -1.26 -1.90 116.66 111.90 3huy n ARG 30 Ca -0.02 0.05 0.09 0.00 -0.92 0.00 0.00 57.85 57.04 3huy n ARG 30 Cb 0.66 -0.93 0.18 0.00 0.45 0.00 0.00 32.46 32.82 3huy n ARG 30 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3huy n HIS 31 N -0.64 0.40 0.40 -0.14 -0.00 -1.26 -0.02 115.22 113.97 3huy n HIS 31 Ca 0.00 0.90 -0.16 0.00 -0.00 0.00 0.00 57.72 58.46 3huy n HIS 31 Cb 0.00 -1.01 -0.08 0.00 -0.00 0.00 0.00 29.99 28.90 3huy n HIS 31 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 3huy h LEU 32 N 0.00 -0.88 -1.74 2.41 3.38 -1.66 -0.30 115.31 116.51 3huy h LEU 32 Ca 0.42 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.42 3huy h LEU 32 Cb 0.79 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3huy h LEU 32 CO -0.72 -0.57 0.15 0.25 0.09 0.00 0.00 178.44 177.63 3huy h LEU 33 N -1.15 0.00 0.00 1.67 5.85 0.28 1.14 115.31 123.10 3huy h LEU 33 Ca -0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3huy h LEU 33 Cb 0.80 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.82 3huy h LEU 33 CO 0.17 0.00 -0.21 0.25 -0.34 0.00 0.00 178.44 178.32 3huy h LEU 34 N 0.00 0.00 -2.58 2.25 5.85 -0.66 -2.22 115.31 117.95 3huy h LEU 34 Ca 0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3huy h LEU 34 Cb 0.30 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3huy h LEU 34 CO 0.00 0.67 0.00 -0.08 -0.34 0.00 0.00 178.44 178.69 3huy h GLU 35 N -1.00 0.00 0.03 1.25 4.81 0.41 0.21 114.58 120.29 3huy h GLU 35 Ca -0.02 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.93 3huy h GLU 35 Cb 0.31 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 3huy h GLU 35 CO -0.01 0.00 -1.53 0.22 -0.73 0.00 0.00 179.01 176.96 3huy h ASP 36 N 0.00 0.11 0.98 1.04 -0.00 0.12 -3.27 116.42 115.41 3huy h ASP 36 Ca 0.00 -0.18 -0.19 0.00 -0.00 0.00 0.00 57.03 56.65 3huy h ASP 36 Cb 0.05 -0.04 -0.03 0.00 -0.00 0.00 0.00 39.33 39.31 3huy h ASP 36 CO 0.00 1.16 -1.07 1.56 -0.00 0.00 0.00 179.24 180.88 3huy h GLN 37 N 0.02 0.00 0.00 0.28 1.08 -0.36 -3.27 115.11 112.86 3huy h GLN 37 Ca -0.22 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.93 3huy h GLN 37 Cb 1.96 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.38 3huy h GLN 37 CO 0.11 0.66 -0.25 0.07 -0.95 0.00 0.00 178.83 178.47 3huy h ARG 38 N 0.00 0.00 0.22 1.46 0.11 -0.81 -3.10 114.38 112.26 3huy h ARG 38 Ca -0.09 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.98 3huy h ARG 38 Cb 1.69 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.77 3huy h ARG 38 CO 0.09 0.25 -0.11 0.82 0.10 0.00 0.00 179.97 181.12 3huy h ILE 39 N 0.00 0.00 -1.91 0.08 2.04 -1.61 -3.04 117.51 113.07 3huy h ILE 39 Ca -0.00 -0.07 0.56 0.00 1.00 0.00 0.00 64.86 66.34 3huy h ILE 39 Cb 0.50 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.50 3huy h ILE 39 CO 0.03 0.00 1.37 0.54 0.00 0.00 0.00 178.15 180.09 3huy n ARG 40 N -3.00 -0.00 -0.02 2.37 1.74 -1.21 0.12 116.66 116.66 3huy n ARG 40 Ca -0.04 1.06 -0.13 0.00 -0.77 0.00 0.00 57.85 57.98 3huy n ARG 40 Cb 0.12 -2.44 -0.09 0.00 -1.02 0.00 0.00 32.46 29.03 3huy n ARG 40 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3huy h GLY 41 N 0.00 0.05 0.35 -0.13 0.00 -1.46 -1.99 103.07 99.89 3huy h GLY 41 Ca 0.92 -0.05 0.09 0.00 0.00 0.00 0.00 47.33 48.29 3huy h GLY 41 CO -0.03 0.05 0.17 -2.00 0.00 0.00 0.00 176.54 174.73 3huy h LEU 42 N -0.38 0.12 0.31 3.11 5.85 0.94 -2.80 115.31 122.46 3huy h LEU 42 Ca 0.00 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 3huy h LEU 42 Cb 0.47 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3huy h LEU 42 CO 0.00 0.08 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.97 3huy h LEU 43 N 0.33 -0.35 -0.79 2.25 4.07 -1.57 -2.91 115.31 116.34 3huy h LEU 43 Ca 0.29 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.08 3huy h LEU 43 Cb 0.38 0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.21 3huy h LEU 43 CO -0.33 0.11 0.56 -0.33 -1.08 0.00 0.00 178.44 177.37 3huy h GLU 44 N -0.96 0.00 0.00 1.13 4.39 -1.31 0.76 114.58 118.58 3huy h GLU 44 Ca -0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.66 3huy h GLU 44 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3huy h GLU 44 CO 0.07 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.55 3huy n LYS 45 N -2.31 0.00 0.00 2.33 5.02 -1.06 -4.16 118.16 117.97 3huy n LYS 45 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 3huy n LYS 45 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.59 3huy n LYS 45 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3huy n GLU 46 N 0.00 0.44 0.00 1.97 1.02 -1.11 -1.31 120.64 121.66 3huy n GLU 46 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3huy n GLU 46 Cb 0.00 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 3huy n GLU 46 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3huy n LEU 47 N 0.25 0.60 -0.30 -4.62 7.94 0.25 -4.72 117.00 116.41 3huy n LEU 47 Ca 0.00 -0.73 0.06 0.00 -1.11 0.00 0.00 56.01 54.22 3huy n LEU 47 Cb 0.11 0.00 0.27 0.00 0.53 0.00 0.00 43.42 44.33 3huy n LEU 47 CO 0.00 0.15 1.24 0.22 -1.11 0.00 0.00 177.39 177.89 3huy h TYR 48 N 0.00 1.00 -0.49 1.96 3.20 -1.32 -1.17 116.97 120.16 3huy h TYR 48 Ca 0.00 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.04 3huy h TYR 48 Cb 0.05 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 37.97 3huy h TYR 48 CO 0.00 0.49 0.50 0.77 -1.64 0.00 0.00 178.16 178.28 3huy h SER 49 N 0.96 0.00 0.00 -2.11 0.02 -1.84 0.28 113.55 110.85 3huy h SER 49 Ca 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 3huy h SER 49 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 3huy h SER 49 CO -0.17 0.00 -1.58 0.00 -1.14 0.00 0.00 176.83 173.94 3huy n ALA 50 N -2.37 2.98 -2.60 3.77 0.00 -0.53 -4.99 120.51 116.76 3huy n ALA 50 Ca 0.09 -0.43 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 3huy n ALA 50 Cb 0.70 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.55 3huy n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3huy n GLY 51 N 1.49 -3.18 3.55 0.00 0.00 0.99 -2.90 105.19 105.13 3huy n GLY 51 Ca -0.02 0.61 -0.40 0.00 0.00 0.00 0.00 46.02 46.22 3huy n GLY 51 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3huy s LEU 52 N -1.75 3.23 0.00 0.99 2.34 -1.26 -3.24 118.68 118.99 3huy s LEU 52 Ca 0.07 -0.19 0.00 0.00 0.06 0.00 0.00 54.13 54.07 3huy s LEU 52 Cb -0.02 -2.55 0.00 0.00 -0.56 0.00 0.00 46.19 43.06 3huy s LEU 52 CO 0.68 -2.07 0.27 0.00 -1.06 0.00 0.00 176.35 174.17 3huy n ALA 53 N 10.85 1.70 0.00 1.48 0.00 -0.83 -4.66 120.51 129.06 3huy n ALA 53 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3huy n ALA 53 Cb 0.50 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3huy n ALA 53 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3huy n ARG 54 N -0.09 0.00 -2.56 0.00 0.63 -1.25 -4.79 116.66 108.60 3huy n ARG 54 Ca 0.00 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.77 3huy n ARG 54 Cb 0.05 0.00 0.02 0.00 0.45 0.00 0.00 32.46 32.98 3huy n ARG 54 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3huy n VAL 55 N -0.43 1.66 -1.59 5.15 0.31 -1.26 -2.55 118.33 119.62 3huy n VAL 55 Ca 0.00 -3.80 -0.51 0.00 -0.01 0.00 0.00 64.34 60.02 3huy n VAL 55 Cb 0.00 -0.10 -0.05 0.00 -0.91 0.00 0.00 33.84 32.78 3huy n VAL 55 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3huy n ASP 56 N -0.34 1.57 -4.01 4.52 2.03 -1.25 -4.87 116.55 114.20 3huy n ASP 56 Ca 0.23 1.13 -0.25 0.00 0.52 0.00 0.00 54.79 56.41 3huy n ASP 56 Cb 0.78 -1.21 -0.17 0.00 -0.72 0.00 0.00 41.12 39.80 3huy n ASP 56 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3huy s ILE 57 N 0.22 1.15 0.08 5.18 1.01 -0.72 -1.74 121.20 126.37 3huy s ILE 57 Ca 0.80 -0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.02 3huy s ILE 57 Cb -0.90 -1.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 3huy s ILE 57 CO 0.49 0.36 -0.11 -0.70 0.00 0.00 0.00 174.94 174.98 3huy s GLU 58 N 0.80 0.80 -0.06 2.79 2.12 -1.26 -2.61 118.70 121.29 3huy s GLU 58 Ca -0.12 -1.04 -0.10 0.00 0.36 0.00 0.00 54.97 54.07 3huy s GLU 58 Cb -0.15 -0.59 0.02 0.00 0.26 0.00 0.00 34.13 33.66 3huy s GLU 58 CO 0.02 0.11 0.24 1.03 -0.54 0.00 0.00 175.26 176.12 3huy s ARG 59 N -2.31 0.42 -0.14 4.30 0.52 -1.25 -0.49 118.95 120.00 3huy s ARG 59 Ca 0.01 0.07 0.15 0.00 -0.52 0.00 0.00 55.73 55.44 3huy s ARG 59 Cb -0.06 0.19 0.38 0.00 0.52 0.00 0.00 34.95 35.98 3huy s ARG 59 CO 0.01 -0.09 1.19 0.00 0.02 0.00 0.00 175.30 176.43 3huy n ALA 60 N 2.25 3.08 -0.28 2.13 0.00 -1.25 -4.73 120.51 121.71 3huy n ALA 60 Ca -0.17 -2.87 0.00 0.00 0.00 0.00 0.00 53.44 50.40 3huy n ALA 60 Cb 0.57 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.58 3huy n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3huy n ALA 61 N -0.77 0.00 0.00 0.00 0.00 -1.26 -4.84 120.51 113.64 3huy n ALA 61 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 3huy n ALA 61 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.23 3huy n ALA 61 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3huy n ASP 62 N 0.00 0.00 0.00 0.00 4.64 -1.26 -5.06 116.55 114.87 3huy n ASP 62 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3huy n ASP 62 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3huy n ASP 62 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3huy n ASN 63 N 0.00 0.00 -4.52 1.67 6.94 -1.14 -4.10 115.26 114.11 3huy n ASN 63 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 54.58 54.13 3huy n ASN 63 Cb 0.00 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.36 3huy n ASN 63 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 3huy s VAL 64 N 0.00 4.69 0.24 3.53 -7.23 -0.37 -3.78 120.40 117.49 3huy s VAL 64 Ca 0.00 0.22 -0.02 0.00 -1.81 0.00 0.00 61.98 60.37 3huy s VAL 64 Cb 0.00 -4.31 0.35 0.00 0.56 0.00 0.00 36.38 32.98 3huy s VAL 64 CO 0.00 -0.74 1.26 0.00 -0.31 0.00 0.00 175.10 175.31 3huy n ALA 65 N 6.61 0.32 -3.94 1.32 0.00 0.35 -2.38 120.51 122.79 3huy n ALA 65 Ca 0.00 0.87 -0.31 0.00 0.00 0.00 0.00 53.44 54.01 3huy n ALA 65 Cb 0.48 -0.59 -0.05 0.00 0.00 0.00 0.00 19.45 19.29 3huy n ALA 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3huy n VAL 66 N -5.21 -0.17 -1.32 0.00 0.31 -1.21 -3.27 118.33 107.46 3huy n VAL 66 Ca 0.16 0.00 -0.37 0.00 -0.01 0.00 0.00 64.34 64.13 3huy n VAL 66 Cb 0.53 -0.59 -0.08 0.00 -0.91 0.00 0.00 33.84 32.79 3huy n VAL 66 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3huy n THR 67 N -3.71 1.33 -1.69 2.52 -1.04 -0.71 -4.05 114.28 106.93 3huy n THR 67 Ca 0.08 -1.25 -0.37 0.00 -2.04 0.00 0.00 64.05 60.46 3huy n THR 67 Cb 0.47 -2.19 -0.03 0.00 -1.82 0.00 0.00 70.33 66.77 3huy n THR 67 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3huy s VAL 68 N 8.26 3.10 -1.56 12.58 1.01 -1.23 -3.90 120.40 138.66 3huy s VAL 68 Ca 0.65 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.59 3huy s VAL 68 Cb 0.09 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 3huy s VAL 68 CO 0.17 -0.23 2.73 1.41 0.00 0.00 0.00 175.10 179.18 3huy n HIS 69 N 14.66 2.72 -1.36 5.22 8.25 -1.06 -2.65 115.22 141.00 3huy n HIS 69 Ca 0.32 -3.05 -0.30 0.00 -0.26 0.00 0.00 57.72 54.43 3huy n HIS 69 Cb 0.53 -2.47 0.12 0.00 1.12 0.00 0.00 29.99 29.29 3huy n HIS 69 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3huy s VAL 70 N 2.20 2.79 -0.11 1.59 1.01 -1.15 -1.96 120.40 124.77 3huy s VAL 70 Ca 0.63 0.26 0.09 0.00 0.00 0.00 0.00 61.98 62.96 3huy s VAL 70 Cb 0.17 -2.86 -0.13 0.00 0.00 0.00 0.00 36.38 33.56 3huy s VAL 70 CO -0.07 -0.34 0.03 0.00 0.00 0.00 0.00 175.10 174.73 3huy n ALA 71 N -3.69 1.74 -3.02 5.51 0.00 -1.20 -0.91 120.51 118.93 3huy n ALA 71 Ca 0.07 -0.70 -0.24 0.00 0.00 0.00 0.00 53.44 52.57 3huy n ALA 71 Cb 0.56 0.03 -0.04 0.00 0.00 0.00 0.00 19.45 20.00 3huy n ALA 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3huy n LYS 72 N -2.40 2.57 0.07 0.00 4.81 -1.14 -4.42 118.16 117.65 3huy n LYS 72 Ca -0.17 -4.43 0.10 0.00 -0.87 0.00 0.00 58.31 52.94 3huy n LYS 72 Cb 0.84 -2.08 0.42 0.00 0.02 0.00 0.00 35.03 34.23 3huy n LYS 72 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3huy n PRO 73 N -0.07 0.11 0.00 1.64 -0.04 -1.26 -3.20 135.00 132.18 3huy n PRO 73 Ca 0.29 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 3huy n PRO 73 Cb 0.47 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 3huy n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3huy n GLY 74 N 0.05 -0.09 0.05 0.55 0.00 -1.26 0.20 105.19 104.69 3huy n GLY 74 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 3huy n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3huy n VAL 75 N -1.06 0.71 1.27 1.61 0.31 -1.19 -4.29 118.33 115.69 3huy n VAL 75 Ca 0.00 -0.51 0.13 0.00 -0.01 0.00 0.00 64.34 63.95 3huy n VAL 75 Cb 0.01 -0.48 0.44 0.00 -0.91 0.00 0.00 33.84 32.90 3huy n VAL 75 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 3huy n VAL 76 N -2.38 0.00 -0.05 2.52 0.24 0.13 -3.96 118.33 114.83 3huy n VAL 76 Ca -0.17 -0.10 -0.03 0.00 -2.04 0.00 0.00 64.34 62.00 3huy n VAL 76 Cb 0.81 0.24 -0.10 0.00 -1.47 0.00 0.00 33.84 33.32 3huy n VAL 76 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3huy n ILE 77 N -0.80 0.61 0.00 1.34 5.41 -1.07 -2.25 119.36 122.60 3huy n ILE 77 Ca 0.12 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.42 3huy n ILE 77 Cb 0.33 -0.46 0.00 0.00 -0.71 0.00 0.00 39.64 38.80 3huy n ILE 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3huy n GLY 78 N 2.13 1.48 2.74 7.39 0.00 -1.25 -0.09 105.19 117.58 3huy n GLY 78 Ca -0.15 -0.67 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 3huy n GLY 78 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3huy s ARG 79 N 0.00 -0.04 0.00 1.61 1.70 -1.26 -4.83 118.95 116.12 3huy s ARG 79 Ca 0.00 0.32 0.00 0.00 -0.47 0.00 0.00 55.73 55.58 3huy s ARG 79 Cb 0.00 -0.36 0.00 0.00 -0.57 0.00 0.00 34.95 34.02 3huy s ARG 79 CO 0.00 -0.25 0.00 0.41 -1.08 0.00 0.00 175.30 174.38 3huy n GLY 80 N 4.78 1.26 0.00 3.88 0.00 -1.26 -3.58 105.19 110.27 3huy n GLY 80 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3huy n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3huy n GLY 81 N 0.00 -1.56 0.00 -0.02 0.00 -1.26 -5.10 105.19 97.25 3huy n GLY 81 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.57 3huy n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3huy n GLU 82 N 0.00 1.88 0.14 1.61 1.02 -0.95 -4.55 120.64 119.79 3huy n GLU 82 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 3huy n GLU 82 Cb 0.00 -0.65 -0.16 0.00 -0.02 0.00 0.00 31.44 30.62 3huy n GLU 82 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3huy h ARG 83 N 0.00 0.50 0.02 3.49 9.65 -0.79 -2.99 114.38 124.26 3huy h ARG 83 Ca 0.00 -0.85 -0.26 0.00 -1.10 0.00 0.00 59.98 57.77 3huy h ARG 83 Cb 0.23 0.32 0.02 0.00 -1.39 0.00 0.00 29.97 29.14 3huy h ARG 83 CO 0.00 1.41 -1.05 0.97 2.80 0.00 0.00 179.97 184.09 3huy h ILE 84 N 0.14 1.31 -0.85 1.20 2.10 -1.23 -3.14 117.51 117.03 3huy h ILE 84 Ca -0.24 -2.33 0.18 0.00 1.08 0.00 0.00 64.86 63.55 3huy h ILE 84 Cb 2.14 2.44 -0.16 0.00 -1.09 0.00 0.00 36.82 40.15 3huy h ILE 84 CO 0.27 0.71 -0.18 -0.09 -1.08 0.00 0.00 178.15 177.78 3huy h ARG 85 N 0.34 0.01 -1.69 2.19 9.65 -1.80 1.85 114.38 124.93 3huy h ARG 85 Ca -0.13 -0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.53 3huy h ARG 85 Cb 1.71 -0.00 -0.09 0.00 -1.39 0.00 0.00 29.97 30.19 3huy h ARG 85 CO 0.20 0.01 0.28 1.33 2.80 0.00 0.00 179.97 184.59 3huy n VAL 86 N -5.53 2.54 0.00 0.20 0.24 -1.13 -3.38 118.33 111.27 3huy n VAL 86 Ca 0.13 -1.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.13 3huy n VAL 86 Cb 0.46 -1.40 0.00 0.00 -1.47 0.00 0.00 33.84 31.43 3huy n VAL 86 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3huy n LEU 87 N 0.74 0.00 -0.26 1.34 4.77 0.60 -4.56 117.00 119.63 3huy n LEU 87 Ca 0.21 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.31 3huy n LEU 87 Cb 0.55 0.04 0.39 0.00 -2.33 0.00 0.00 43.42 42.07 3huy n LEU 87 CO 0.26 -0.27 1.22 0.03 -1.33 0.00 0.00 177.39 177.30 3huy h ARG 88 N 0.00 0.65 -0.12 3.23 3.08 -0.61 0.29 114.38 120.89 3huy h ARG 88 Ca 0.00 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 3huy h ARG 88 Cb 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.91 3huy h ARG 88 CO 0.00 0.43 -0.34 1.05 -1.07 0.00 0.00 179.97 180.04 3huy h GLU 89 N 0.67 0.44 -0.86 0.04 -0.00 -1.79 -2.54 114.58 110.54 3huy h GLU 89 Ca 0.45 -0.31 0.21 0.00 -0.00 0.00 0.00 59.36 59.70 3huy h GLU 89 Cb 0.75 0.05 -0.12 0.00 -0.00 0.00 0.00 28.75 29.43 3huy h GLU 89 CO -0.20 0.93 0.34 0.93 -0.00 0.00 0.00 179.01 181.01 3huy h GLU 90 N 0.03 0.35 0.02 1.06 4.39 -0.72 2.24 114.58 121.95 3huy h GLU 90 Ca -0.01 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 3huy h GLU 90 Cb 0.95 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 3huy h GLU 90 CO 0.07 0.23 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.08 3huy h LEU 91 N 0.36 -0.02 -1.78 1.33 3.38 -1.29 -2.76 115.31 114.54 3huy h LEU 91 Ca 0.53 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3huy h LEU 91 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3huy h LEU 91 CO -0.53 0.51 0.00 0.00 0.09 0.00 0.00 178.44 178.51 3huy h ALA 92 N 0.41 1.00 0.21 1.53 0.00 -0.67 -2.97 119.26 118.77 3huy h ALA 92 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3huy h ALA 92 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3huy h ALA 92 CO 0.00 0.00 -0.10 -0.22 0.00 0.00 0.00 179.25 178.93 3huy h LYS 93 N 0.00 -0.27 -1.02 0.00 3.64 0.39 -3.10 116.57 116.21 3huy h LYS 93 Ca 0.00 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 59.64 3huy h LYS 93 Cb 0.19 0.06 -0.10 0.00 -0.41 0.00 0.00 32.23 31.96 3huy h LYS 93 CO 0.00 -0.18 0.63 1.37 -2.27 0.00 0.00 179.45 179.00 3huy h LEU 94 N -0.34 0.57 -7.53 5.20 8.10 -1.42 -3.41 115.31 116.49 3huy h LEU 94 Ca -0.03 0.10 -0.16 0.00 0.11 0.00 0.00 57.88 57.90 3huy h LEU 94 Cb 0.21 0.01 -0.25 0.00 -0.44 0.00 0.00 40.66 40.19 3huy h LEU 94 CO 0.05 0.12 -0.44 -0.89 -4.11 0.00 0.00 178.44 173.17 3huy s THR 95 N -5.63 0.01 0.38 0.15 2.01 -1.13 -5.15 115.64 106.28 3huy s THR 95 Ca -0.10 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 61.78 3huy s THR 95 Cb 0.26 -0.36 -0.03 0.00 0.01 0.00 0.00 72.50 72.37 3huy s THR 95 CO 0.80 -0.06 0.61 -0.83 -0.69 0.00 0.00 174.62 174.44 3huy s GLY 96 N -0.16 1.38 0.00 4.40 0.00 -1.18 -3.77 107.32 108.00 3huy s GLY 96 Ca -0.03 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.87 3huy s GLY 96 CO 0.01 -0.73 0.00 1.17 0.00 0.00 0.00 173.10 173.55 3huy n LYS 97 N -1.91 0.00 -2.03 2.90 4.81 -1.26 -5.04 118.16 115.62 3huy n LYS 97 Ca -0.03 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 56.98 3huy n LYS 97 Cb 0.56 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.58 3huy n LYS 97 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 3huy s ASN 98 N 0.00 5.85 -0.51 3.14 3.04 -1.26 -4.93 114.94 120.27 3huy s ASN 98 Ca 0.00 1.15 -0.02 0.00 0.04 0.00 0.00 52.86 54.04 3huy s ASN 98 Cb 0.00 -2.53 0.13 0.00 -1.54 0.00 0.00 41.25 37.32 3huy s ASN 98 CO 0.00 -1.77 0.30 0.68 -3.04 0.00 0.00 177.10 173.27 3huy s VAL 99 N 7.05 3.35 0.00 -5.21 -7.23 -1.26 -1.24 120.40 115.86 3huy s VAL 99 Ca 0.77 -2.59 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 3huy s VAL 99 Cb -0.21 -3.25 0.00 0.00 0.56 0.00 0.00 36.38 33.48 3huy s VAL 99 CO 0.32 -0.78 0.00 0.00 -0.31 0.00 0.00 175.10 174.33 3huy n ALA 100 N 3.95 0.00 0.00 1.32 0.00 -1.00 -4.91 120.51 119.87 3huy n ALA 100 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3huy n ALA 100 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 3huy n ALA 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3huy n LEU 101 N 0.00 0.00 -4.55 0.00 0.00 -1.20 -4.62 117.00 106.63 3huy n LEU 101 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 56.01 55.70 3huy n LEU 101 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.38 3huy n LEU 101 CO 0.00 0.00 1.54 0.20 0.00 0.00 0.00 177.39 179.13 3huy s ASN 102 N 0.00 4.89 -0.62 1.96 0.01 -1.25 -4.78 114.94 115.15 3huy s ASN 102 Ca 0.00 0.10 -0.17 0.00 -0.71 0.00 0.00 52.86 52.08 3huy s ASN 102 Cb 0.00 -2.54 -0.15 0.00 0.41 0.00 0.00 41.25 38.97 3huy s ASN 102 CO 0.00 -2.80 1.83 0.52 -1.51 0.00 0.00 177.10 175.14 3huy n VAL 103 N 7.78 1.52 -1.47 1.60 0.31 -1.26 -3.54 118.33 123.27 3huy n VAL 103 Ca 0.33 -1.16 -0.48 0.00 -0.01 0.00 0.00 64.34 63.02 3huy n VAL 103 Cb 0.50 -2.14 -0.07 0.00 -0.91 0.00 0.00 33.84 31.21 3huy n VAL 103 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3huy n GLN 104 N 6.25 1.06 -2.13 5.55 1.13 -1.08 -4.78 117.38 123.39 3huy n GLN 104 Ca 0.43 0.26 -0.37 0.00 -1.94 0.00 0.00 57.00 55.38 3huy n GLN 104 Cb 0.30 -2.55 0.00 0.00 0.11 0.00 0.00 30.24 28.10 3huy n GLN 104 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3huy s GLU 105 N 6.62 3.57 -0.40 -1.09 2.12 -1.26 -2.95 118.70 125.32 3huy s GLU 105 Ca 1.10 1.90 -0.16 0.00 0.36 0.00 0.00 54.97 58.17 3huy s GLU 105 Cb -0.78 -2.35 0.01 0.00 0.26 0.00 0.00 34.13 31.27 3huy s GLU 105 CO 0.46 -0.74 0.35 0.08 -0.54 0.00 0.00 175.26 174.87 3huy s VAL 106 N -1.48 5.18 0.10 3.70 1.01 -0.09 -4.94 120.40 123.88 3huy s VAL 106 Ca 0.66 -0.40 -0.21 0.00 0.00 0.00 0.00 61.98 62.03 3huy s VAL 106 Cb -0.32 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 3huy s VAL 106 CO 0.38 -0.29 1.36 1.56 0.00 0.00 0.00 175.10 178.11 3huy h GLN 107 N 8.63 -0.04 -5.22 2.72 4.20 -1.93 -3.40 115.11 120.07 3huy h GLN 107 Ca -0.28 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 57.79 3huy h GLN 107 Cb 1.12 0.01 -0.26 0.00 0.30 0.00 0.00 27.48 28.66 3huy h GLN 107 CO 0.74 -0.03 -0.73 1.21 -0.67 0.00 0.00 178.83 179.36 3huy s ASN 108 N -4.60 4.31 -0.15 1.46 3.84 -1.26 -5.01 114.94 113.52 3huy s ASN 108 Ca -0.08 -0.29 -0.26 0.00 0.21 0.00 0.00 52.86 52.44 3huy s ASN 108 Cb 0.07 -1.69 -0.24 0.00 -0.55 0.00 0.00 41.25 38.83 3huy s ASN 108 CO 0.41 0.12 0.60 -0.65 -2.79 0.00 0.00 177.10 174.79 3huy h PRO 109 N 7.09 0.02 -0.79 0.43 0.11 -1.95 -3.28 132.00 133.62 3huy h PRO 109 Ca -0.32 -0.04 0.19 0.00 0.11 0.00 0.00 66.00 65.95 3huy h PRO 109 Cb 1.19 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 3huy h PRO 109 CO 0.59 1.02 0.54 -0.91 -0.21 0.00 0.00 178.00 179.03 3huy h ASN 110 N -0.95 0.23 -0.08 -2.05 2.35 -1.95 0.49 115.58 113.62 3huy h ASN 110 Ca -0.12 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3huy h ASN 110 Cb 1.15 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.49 3huy h ASN 110 CO -0.05 0.10 0.00 0.18 -1.65 0.00 0.00 177.43 176.01 3huy n LEU 111 N -4.42 0.92 -4.48 1.61 4.77 -1.25 -4.65 117.00 109.51 3huy n LEU 111 Ca 0.16 -0.37 -0.43 0.00 -0.03 0.00 0.00 56.01 55.34 3huy n LEU 111 Cb 0.70 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.65 3huy n LEU 111 CO 0.34 0.19 0.04 -0.55 -1.33 0.00 0.00 177.39 176.08 3huy s SER 112 N -1.65 6.16 0.04 -1.43 0.15 0.17 -4.98 113.70 112.15 3huy s SER 112 Ca 0.32 -0.75 -0.27 0.00 0.70 0.00 0.00 55.95 55.96 3huy s SER 112 Cb 0.16 -2.20 -0.17 0.00 -1.71 0.00 0.00 66.02 62.11 3huy s SER 112 CO 0.26 -0.53 1.43 0.00 1.20 0.00 0.00 173.24 175.61 3huy h ALA 113 N 8.68 -0.41 -0.08 5.45 0.00 -1.85 -1.24 119.26 129.81 3huy h ALA 113 Ca -0.27 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.51 3huy h ALA 113 Cb 1.11 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 3huy h ALA 113 CO 0.77 -0.63 0.24 -1.35 0.00 0.00 0.00 179.25 178.28 3huy h PRO 114 N -0.62 0.00 0.09 0.00 0.11 -1.82 -2.48 132.00 127.28 3huy h PRO 114 Ca -0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 3huy h PRO 114 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 3huy h PRO 114 CO 0.07 0.00 -0.04 -0.07 -0.21 0.00 0.00 178.00 177.75 3huy h LEU 115 N 0.00 -0.10 -2.23 2.35 3.38 -1.73 -3.24 115.31 113.75 3huy h LEU 115 Ca 0.04 -0.43 0.05 0.00 0.09 0.00 0.00 57.88 57.63 3huy h LEU 115 Cb 0.51 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3huy h LEU 115 CO -0.00 0.56 0.23 0.58 0.09 0.00 0.00 178.44 179.90 3huy h VAL 116 N -0.93 0.36 0.08 1.22 2.07 -0.79 0.94 116.25 119.21 3huy h VAL 116 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 3huy h VAL 116 Cb 0.53 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 3huy h VAL 116 CO 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.57 3huy h ALA 117 N 1.70 -0.11 -0.11 1.67 0.00 -1.60 -0.77 119.26 120.03 3huy h ALA 117 Ca 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3huy h ALA 117 Cb 0.55 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3huy h ALA 117 CO -0.00 -0.35 -0.01 1.96 0.00 0.00 0.00 179.25 180.85 3huy h GLN 118 N -0.54 0.15 0.00 0.00 4.20 -1.16 0.10 115.11 117.87 3huy h GLN 118 Ca -0.01 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3huy h GLN 118 Cb 0.45 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.20 3huy h GLN 118 CO 0.02 0.19 0.00 -2.13 -0.67 0.00 0.00 178.83 176.23 3huy n ARG 119 N -4.43 0.00 -0.18 1.46 0.63 0.17 -1.95 116.66 112.37 3huy n ARG 119 Ca -0.01 0.51 0.19 0.00 -0.92 0.00 0.00 57.85 57.61 3huy n ARG 119 Cb 0.15 -1.44 0.55 0.00 0.45 0.00 0.00 32.46 32.17 3huy n ARG 119 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3huy h VAL 120 N 0.00 0.72 -0.52 5.15 2.07 -0.91 0.25 116.25 123.01 3huy h VAL 120 Ca 0.00 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.47 3huy h VAL 120 Cb 0.00 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.08 3huy h VAL 120 CO 0.00 0.06 0.22 0.00 0.02 0.00 0.00 177.57 177.87 3huy h ALA 121 N 1.63 0.66 -0.05 1.67 0.00 -0.65 0.92 119.26 123.43 3huy h ALA 121 Ca 0.40 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3huy h ALA 121 Cb 1.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3huy h ALA 121 CO -0.12 -0.16 0.00 0.39 0.00 0.00 0.00 179.25 179.36 3huy n GLU 122 N -4.95 0.00 -0.31 0.00 1.02 0.05 -2.27 120.64 114.18 3huy n GLU 122 Ca 0.05 0.58 0.06 0.00 -0.02 0.00 0.00 57.16 57.83 3huy n GLU 122 Cb 0.19 -1.49 0.13 0.00 -0.02 0.00 0.00 31.44 30.25 3huy n GLU 122 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3huy n GLN 123 N -2.15 -0.08 -0.11 3.49 6.02 -1.06 0.49 117.38 123.99 3huy n GLN 123 Ca 0.00 1.34 -0.06 0.00 -0.01 0.00 0.00 57.00 58.28 3huy n GLN 123 Cb 0.00 -2.02 0.01 0.00 1.02 0.00 0.00 30.24 29.25 3huy n GLN 123 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3huy h ILE 124 N 0.00 0.44 0.00 5.09 2.04 -0.63 0.35 117.51 124.80 3huy h ILE 124 Ca 0.42 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.28 3huy h ILE 124 Cb 0.67 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 3huy h ILE 124 CO -0.88 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 176.65 3huy n GLU 125 N -5.37 0.13 -0.08 2.37 1.02 0.18 -1.03 120.64 117.86 3huy n GLU 125 Ca 0.02 0.34 0.06 0.00 -0.02 0.00 0.00 57.16 57.56 3huy n GLU 125 Cb 0.28 -1.74 0.23 0.00 -0.02 0.00 0.00 31.44 30.18 3huy n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3huy n ARG 126 N -1.99 1.47 -3.86 3.49 1.74 0.12 -4.89 116.66 112.74 3huy n ARG 126 Ca 0.03 -0.72 -0.25 0.00 -0.77 0.00 0.00 57.85 56.14 3huy n ARG 126 Cb 0.23 -1.23 0.01 0.00 -1.02 0.00 0.00 32.46 30.44 3huy n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3huy n ARG 127 N 0.02 -4.29 -3.96 5.56 3.00 -0.20 -4.96 116.66 111.84 3huy n ARG 127 Ca 0.10 0.52 -0.26 0.00 -0.01 0.00 0.00 57.85 58.20 3huy n ARG 127 Cb 0.19 -4.98 -0.03 0.00 0.00 0.00 0.00 32.46 27.64 3huy n ARG 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 3huy s PHE 128 N -3.69 3.45 -0.48 -1.55 0.40 -1.03 -5.00 117.98 110.08 3huy s PHE 128 Ca 0.16 0.10 -0.29 0.00 -0.60 0.00 0.00 56.93 56.30 3huy s PHE 128 Cb -0.08 -1.65 -0.09 0.00 0.51 0.00 0.00 43.02 41.71 3huy s PHE 128 CO 0.85 0.52 2.38 0.00 0.70 0.00 0.00 175.22 179.67 3huy n ALA 129 N -0.54 0.96 0.11 5.36 0.00 -1.26 -4.79 120.51 120.35 3huy n ALA 129 Ca -0.07 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.70 3huy n ALA 129 Cb 0.54 -2.92 -0.06 0.00 0.00 0.00 0.00 19.45 17.01 3huy n ALA 129 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3huy h VAL 130 N 7.54 0.00 -1.00 0.00 2.07 -1.95 -1.18 116.25 121.73 3huy h VAL 130 Ca -0.25 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.48 3huy h VAL 130 Cb 1.28 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 3huy h VAL 130 CO 1.13 0.00 0.62 -0.09 0.02 0.00 0.00 177.57 179.25 3huy h ARG 131 N -0.49 0.59 0.76 1.57 2.43 -1.92 -1.89 114.38 115.42 3huy h ARG 131 Ca -0.02 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 3huy h ARG 131 Cb 0.46 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 3huy h ARG 131 CO -0.11 0.39 -0.42 -0.09 -1.51 0.00 0.00 179.97 178.22 3huy h ARG 132 N 0.60 -1.05 -0.39 0.20 2.43 -1.82 -0.51 114.38 113.84 3huy h ARG 132 Ca 0.58 0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.93 3huy h ARG 132 Cb 1.12 0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 3huy h ARG 132 CO -0.34 -0.70 0.35 0.00 -1.51 0.00 0.00 179.97 177.77 3huy h ALA 133 N -1.36 2.16 0.00 2.80 0.00 -0.66 -2.30 119.26 119.91 3huy h ALA 133 Ca -0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3huy h ALA 133 Cb 0.86 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3huy h ALA 133 CO 0.13 -0.55 -0.23 0.82 0.00 0.00 0.00 179.25 179.43 3huy h ILE 134 N 0.00 1.02 0.00 0.00 1.08 -1.07 0.45 117.51 119.00 3huy h ILE 134 Ca 0.18 -1.84 0.00 0.00 -0.39 0.00 0.00 64.86 62.82 3huy h ILE 134 Cb 0.88 1.99 0.00 0.00 -3.07 0.00 0.00 36.82 36.63 3huy h ILE 134 CO -0.00 0.34 0.00 1.17 -0.69 0.00 0.00 178.15 178.97 3huy n LYS 135 N -4.63 0.53 -0.04 2.37 3.00 -0.23 0.04 118.16 119.20 3huy n LYS 135 Ca -0.10 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.15 3huy n LYS 135 Cb 0.36 -1.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.35 3huy n LYS 135 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 3huy n GLN 136 N -0.50 0.21 0.17 1.64 7.27 -0.88 -4.33 117.38 120.96 3huy n GLN 136 Ca 0.00 0.05 0.06 0.00 0.07 0.00 0.00 57.00 57.18 3huy n GLN 136 Cb 0.00 -1.14 0.14 0.00 2.41 0.00 0.00 30.24 31.65 3huy n GLN 136 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3huy h ALA 137 N -0.03 0.81 0.00 1.69 0.00 0.12 0.52 119.26 122.38 3huy h ALA 137 Ca -0.19 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 3huy h ALA 137 Cb 1.28 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 3huy h ALA 137 CO -0.04 0.42 -0.13 0.28 0.00 0.00 0.00 179.25 179.78 3huy h VAL 138 N 0.00 0.27 0.20 0.00 2.07 -0.63 -2.03 116.25 116.13 3huy h VAL 138 Ca -0.00 -1.08 -0.32 0.00 0.82 0.00 0.00 66.70 66.12 3huy h VAL 138 Cb 1.18 1.87 0.03 0.00 -1.52 0.00 0.00 31.29 32.85 3huy h VAL 138 CO 0.04 0.13 -1.38 -0.61 0.02 0.00 0.00 177.57 175.77 3huy h GLN 139 N 0.00 0.52 -0.97 1.57 5.75 -1.57 -3.18 115.11 117.22 3huy h GLN 139 Ca -0.00 -0.83 0.30 0.00 -0.15 0.00 0.00 58.65 57.96 3huy h GLN 139 Cb 0.86 0.30 -0.18 0.00 1.07 0.00 0.00 27.48 29.53 3huy h GLN 139 CO 0.02 1.39 0.12 -2.13 -2.65 0.00 0.00 178.83 175.58 3huy n ARG 140 N -3.71 -0.07 0.02 1.69 3.00 0.11 -2.18 116.66 115.52 3huy n ARG 140 Ca -0.15 1.44 -0.19 0.00 -0.00 0.00 0.00 57.85 58.95 3huy n ARG 140 Cb 1.06 -2.34 -0.14 0.00 0.00 0.00 0.00 32.46 31.04 3huy n ARG 140 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 3huy h VAL 141 N 0.00 1.51 0.00 5.15 2.07 -1.57 -3.20 116.25 120.21 3huy h VAL 141 Ca 0.64 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.67 3huy h VAL 141 Cb 1.41 3.18 0.00 0.00 -1.52 0.00 0.00 31.29 34.36 3huy h VAL 141 CO -0.88 0.69 0.00 0.23 0.02 0.00 0.00 177.57 177.63 3huy n MET 142 N -4.19 0.88 0.04 1.57 2.81 -0.93 -2.61 117.12 114.70 3huy n MET 142 Ca -0.15 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.74 3huy n MET 142 Cb 0.77 -1.09 0.00 0.00 -0.71 0.00 0.00 33.22 32.19 3huy n MET 142 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3huy n GLU 143 N 0.51 0.00 -0.52 0.03 1.02 -1.20 -4.71 120.64 115.76 3huy n GLU 143 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 3huy n GLU 143 Cb 0.42 -0.24 -0.07 0.00 -0.02 0.00 0.00 31.44 31.53 3huy n GLU 143 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3huy n SER 144 N -3.07 3.37 -3.12 1.62 3.41 -1.07 -4.75 113.62 110.01 3huy n SER 144 Ca 0.00 -2.04 -0.00 0.00 -0.26 0.00 0.00 58.87 56.56 3huy n SER 144 Cb 0.14 -0.84 -0.00 0.00 -0.26 0.00 0.00 64.21 63.25 3huy n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3huy n GLY 145 N 2.32 -0.19 2.89 5.00 0.00 -1.22 -4.74 105.19 109.26 3huy n GLY 145 Ca 0.18 0.05 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 3huy n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3huy n ALA 146 N 1.90 0.54 -0.01 4.61 0.00 -1.15 -4.97 120.51 121.43 3huy n ALA 146 Ca -0.01 -1.78 -0.01 0.00 0.00 0.00 0.00 53.44 51.64 3huy n ALA 146 Cb 0.25 1.27 -0.02 0.00 0.00 0.00 0.00 19.45 20.96 3huy n ALA 146 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3huy n LYS 147 N -0.72 2.91 -3.58 0.00 4.76 -0.54 -4.92 118.16 116.06 3huy n LYS 147 Ca -0.01 0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.27 3huy n LYS 147 Cb 0.53 -1.06 -0.06 0.00 -1.84 0.00 0.00 35.03 32.60 3huy n LYS 147 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3huy s GLY 148 N -3.48 -0.46 -0.18 0.72 0.00 -1.01 -1.97 107.32 100.94 3huy s GLY 148 Ca -0.02 0.94 -0.09 0.00 0.00 0.00 0.00 44.72 45.55 3huy s GLY 148 CO 0.09 0.63 0.43 0.00 0.00 0.00 0.00 173.10 174.24 3huy s ALA 149 N -1.53 -1.11 -0.24 3.20 0.00 -0.92 -1.66 121.76 119.51 3huy s ALA 149 Ca -0.10 1.58 -0.06 0.00 0.00 0.00 0.00 51.96 53.38 3huy s ALA 149 Cb -0.01 -1.01 0.12 0.00 0.00 0.00 0.00 23.12 22.21 3huy s ALA 149 CO 0.06 -0.34 0.49 0.21 0.00 0.00 0.00 175.76 176.17 3huy s LYS 150 N 1.58 0.41 0.29 0.00 2.20 -0.92 -1.88 119.74 121.43 3huy s LYS 150 Ca -0.08 1.04 0.09 0.00 -0.36 0.00 0.00 55.97 56.65 3huy s LYS 150 Cb -0.09 0.34 -0.04 0.00 -1.51 0.00 0.00 37.83 36.53 3huy s LYS 150 CO -0.13 -0.35 0.09 0.08 -0.36 0.00 0.00 175.35 174.67 3huy s VAL 151 N 2.70 3.54 -0.08 4.02 1.01 -0.89 -1.57 120.40 129.13 3huy s VAL 151 Ca 0.03 -1.73 -0.03 0.00 0.00 0.00 0.00 61.98 60.24 3huy s VAL 151 Cb -0.13 -3.01 0.04 0.00 0.00 0.00 0.00 36.38 33.28 3huy s VAL 151 CO -0.16 -0.31 0.16 -0.63 0.00 0.00 0.00 175.10 174.16 3huy s ILE 152 N -2.31 -0.10 0.00 2.22 1.01 -0.97 -2.78 121.20 118.27 3huy s ILE 152 Ca 0.34 0.21 0.04 0.00 0.00 0.00 0.00 60.65 61.24 3huy s ILE 152 Cb -0.06 -0.27 -0.03 0.00 0.01 0.00 0.00 42.46 42.11 3huy s ILE 152 CO 0.22 0.09 -0.09 -0.69 0.00 0.00 0.00 174.94 174.46 3huy s VAL 153 N 1.43 3.46 0.00 2.92 1.01 -1.26 -2.22 120.40 125.73 3huy s VAL 153 Ca -0.07 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.08 3huy s VAL 153 Cb -0.12 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.78 3huy s VAL 153 CO -0.06 0.40 0.00 -1.54 0.00 0.00 0.00 175.10 173.90 3huy n SER 154 N 1.62 0.00 -4.60 3.32 3.41 -1.15 -2.72 113.62 113.50 3huy n SER 154 Ca -0.16 0.00 -0.47 0.00 -0.26 0.00 0.00 58.87 57.98 3huy n SER 154 Cb 0.52 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.43 3huy n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3huy n GLY 155 N 5.00 1.14 0.93 5.00 0.00 -1.24 -3.44 105.19 112.58 3huy n GLY 155 Ca 0.00 0.85 0.00 0.00 0.00 0.00 0.00 46.02 46.87 3huy n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3huy n ARG 156 N 7.70 0.00 -2.42 1.61 1.74 -1.26 -4.64 116.66 119.40 3huy n ARG 156 Ca 0.29 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.95 3huy n ARG 156 Cb 0.33 -1.74 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 3huy n ARG 156 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3huy s ILE 157 N -2.67 4.10 0.00 0.55 1.01 -1.25 -2.33 121.20 120.61 3huy s ILE 157 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 60.65 62.13 3huy s ILE 157 Cb 0.00 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.52 3huy s ILE 157 CO 0.00 0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.61 3huy n GLY 158 N 3.31 0.62 3.18 6.18 0.00 -1.26 -3.59 105.19 113.63 3huy n GLY 158 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3huy n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3huy n GLY 159 N -2.76 3.00 3.06 -0.02 0.00 -0.99 -4.99 105.19 102.49 3huy n GLY 159 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3huy n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3huy n ALA 160 N 0.00 -5.22 0.08 4.61 0.00 -1.24 -4.91 120.51 113.84 3huy n ALA 160 Ca 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 53.44 52.46 3huy n ALA 160 Cb 0.00 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.27 3huy n ALA 160 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3huy h GLU 161 N -1.14 0.00 -5.78 0.00 5.08 -1.94 -3.43 114.58 107.37 3huy h GLU 161 Ca -0.43 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.32 3huy h GLU 161 Cb 1.34 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.47 3huy h GLU 161 CO 0.25 0.63 0.37 -1.14 -1.00 0.00 0.00 179.01 178.11 3huy s GLN 162 N -2.83 3.72 0.18 2.33 2.00 -1.26 -4.94 119.66 118.86 3huy s GLN 162 Ca 0.01 0.27 -0.33 0.00 -2.00 0.00 0.00 55.36 53.31 3huy s GLN 162 Cb 0.09 -3.82 -0.13 0.00 0.80 0.00 0.00 33.01 29.95 3huy s GLN 162 CO 0.79 -0.87 1.67 0.00 -0.50 0.00 0.00 175.29 176.38 3huy n ALA 163 N 6.43 2.20 -3.00 1.58 0.00 -1.26 -4.05 120.51 122.42 3huy n ALA 163 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3huy n ALA 163 Cb 0.48 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.48 3huy n ALA 163 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3huy n ARG 164 N 3.82 2.74 -3.64 0.00 0.63 -1.22 -4.72 116.66 114.27 3huy n ARG 164 Ca 0.17 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 57.06 3huy n ARG 164 Cb 0.32 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.17 3huy n ARG 164 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3huy s THR 165 N 2.04 0.00 -0.25 5.15 2.01 -1.25 -3.71 115.64 119.61 3huy s THR 165 Ca 0.00 0.00 0.11 0.00 0.31 0.00 0.00 61.69 62.11 3huy s THR 165 Cb 0.00 -1.00 0.26 0.00 0.01 0.00 0.00 72.50 71.77 3huy s THR 165 CO 0.00 0.00 1.18 1.21 -0.69 0.00 0.00 174.62 176.32 3huy n GLU 166 N 2.58 2.43 0.00 4.92 4.07 -1.10 -4.98 120.64 128.56 3huy n GLU 166 Ca -0.14 -2.22 0.00 0.00 -0.06 0.00 0.00 57.16 54.73 3huy n GLU 166 Cb 0.57 -1.39 0.00 0.00 -0.06 0.00 0.00 31.44 30.56 3huy n GLU 166 CO 0.00 0.00 0.00 1.87 -0.06 0.00 0.00 177.13 178.94 3huy n TRP 167 N -0.60 0.00 -3.62 4.31 -0.00 -1.26 -4.86 117.44 111.42 3huy n TRP 167 Ca 0.12 0.00 -0.18 0.00 -0.00 0.00 0.00 57.50 57.43 3huy n TRP 167 Cb 0.54 0.00 -0.15 0.00 -0.00 0.00 0.00 31.31 31.70 3huy n TRP 167 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3huy s ALA 168 N 0.00 -0.12 -0.02 5.87 0.00 -1.12 -5.05 121.76 121.32 3huy s ALA 168 Ca 0.00 0.39 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 3huy s ALA 168 Cb 0.00 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.17 3huy s ALA 168 CO 0.00 -0.80 0.27 0.00 0.00 0.00 0.00 175.76 175.24 3huy s ALA 169 N 2.29 -0.69 0.05 0.00 0.00 -1.26 -2.10 121.76 120.04 3huy s ALA 169 Ca 0.04 0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.28 3huy s ALA 169 Cb -0.13 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 3huy s ALA 169 CO -0.08 -0.24 -0.05 -1.14 0.00 0.00 0.00 175.76 174.25 3huy s GLN 170 N -1.22 0.53 3.56 0.00 0.74 -0.79 -5.01 119.66 117.48 3huy s GLN 170 Ca -0.13 -0.90 0.00 0.00 0.05 0.00 0.00 55.36 54.38 3huy s GLN 170 Cb -0.05 -0.07 0.00 0.00 1.10 0.00 0.00 33.01 33.98 3huy s GLN 170 CO 0.03 -0.02 0.00 0.41 -0.55 0.00 0.00 175.29 175.17 3huy n GLY 171 N 1.00 0.48 3.08 2.59 0.00 -1.26 -2.15 105.19 108.92 3huy n GLY 171 Ca -0.20 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 3huy n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3huy s ARG 172 N 0.00 0.57 -0.46 1.61 0.52 -0.83 -4.92 118.95 115.43 3huy s ARG 172 Ca 0.00 -0.83 0.07 0.00 -0.52 0.00 0.00 55.73 54.45 3huy s ARG 172 Cb 0.00 -0.30 0.24 0.00 0.52 0.00 0.00 34.95 35.40 3huy s ARG 172 CO 0.00 0.05 0.75 0.28 0.02 0.00 0.00 175.30 176.40 3huy n VAL 173 N 1.30 -0.24 -2.21 3.52 0.31 -1.26 -3.06 118.33 116.69 3huy n VAL 173 Ca -0.22 -2.25 -0.31 0.00 -0.01 0.00 0.00 64.34 61.55 3huy n VAL 173 Cb 0.55 0.37 -0.04 0.00 -0.91 0.00 0.00 33.84 33.81 3huy n VAL 173 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3huy s PRO 174 N 0.15 2.88 0.00 5.55 0.04 -1.26 -4.80 135.00 137.55 3huy s PRO 174 Ca 0.33 -0.55 0.00 0.00 0.04 0.00 0.00 61.00 60.82 3huy s PRO 174 Cb 0.19 -5.15 0.00 0.00 0.04 0.00 0.00 34.50 29.58 3huy s PRO 174 CO -0.19 -3.02 0.65 1.28 0.04 0.00 0.00 177.00 175.76 3huy n LEU 175 N 12.40 1.76 0.00 -3.56 4.32 -1.26 -2.95 117.00 127.71 3huy n LEU 175 Ca 0.38 -0.88 0.00 0.00 -0.02 0.00 0.00 56.01 55.49 3huy n LEU 175 Cb 0.48 -0.41 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 3huy n LEU 175 CO 0.62 0.32 -0.39 1.41 -1.22 0.00 0.00 177.39 178.13 3huy n HIS 176 N 0.37 0.00 -2.12 -1.77 8.25 -1.26 -5.01 115.22 113.68 3huy n HIS 176 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 3huy n HIS 176 Cb 0.32 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 3huy n HIS 176 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3huy s THR 177 N -1.78 3.51 0.02 1.59 2.01 -1.15 -4.94 115.64 114.89 3huy s THR 177 Ca 0.00 0.89 -0.25 0.00 0.31 0.00 0.00 61.69 62.64 3huy s THR 177 Cb 0.00 -3.57 -0.17 0.00 0.01 0.00 0.00 72.50 68.76 3huy s THR 177 CO 0.00 -0.01 1.34 -0.07 -0.69 0.00 0.00 174.62 175.19 3huy h LEU 178 N 8.58 -0.24 -2.66 4.42 -0.00 -1.95 -3.01 115.31 120.45 3huy h LEU 178 Ca -0.39 -0.21 0.00 0.00 -0.00 0.00 0.00 57.88 57.28 3huy h LEU 178 Cb 1.18 0.06 -0.00 0.00 -0.00 0.00 0.00 40.66 41.91 3huy h LEU 178 CO 0.92 0.09 0.01 0.08 -0.00 0.00 0.00 178.44 179.53 3huy h ARG 179 N -0.59 0.00 -0.39 1.13 0.11 -1.94 -3.25 114.38 109.45 3huy h ARG 179 Ca -0.03 0.00 0.07 0.00 0.10 0.00 0.00 59.98 60.12 3huy h ARG 179 Cb 0.43 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.45 3huy h ARG 179 CO 0.05 0.00 -0.13 0.00 0.10 0.00 0.00 179.97 179.98 3huy n ALA 180 N -2.23 -0.00 -2.60 0.08 0.00 -1.14 -4.34 120.51 110.29 3huy n ALA 180 Ca -0.03 0.40 -0.06 0.00 0.00 0.00 0.00 53.44 53.75 3huy n ALA 180 Cb 0.08 -0.20 -0.05 0.00 0.00 0.00 0.00 19.45 19.29 3huy n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3huy n ASN 181 N -4.59 -0.83 -4.11 0.00 5.15 -1.23 -3.58 115.26 106.07 3huy n ASN 181 Ca 0.05 1.38 -0.12 0.00 -0.60 0.00 0.00 54.58 55.29 3huy n ASN 181 Cb 0.17 -5.23 -0.11 0.00 -0.53 0.00 0.00 39.78 34.08 3huy n ASN 181 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3huy s ILE 182 N -0.65 0.59 -0.13 -1.44 1.01 -1.26 -2.61 121.20 116.71 3huy s ILE 182 Ca -0.28 -1.45 -0.09 0.00 0.00 0.00 0.00 60.65 58.83 3huy s ILE 182 Cb 0.02 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 3huy s ILE 182 CO 0.75 -0.60 0.17 -0.62 0.00 0.00 0.00 174.94 174.64 3huy s ASP 183 N -2.22 6.39 0.00 3.58 3.68 -0.68 -4.85 116.67 122.56 3huy s ASP 183 Ca -0.01 0.46 0.00 0.00 2.13 0.00 0.00 52.55 55.13 3huy s ASP 183 Cb -0.03 -2.10 0.00 0.00 -1.45 0.00 0.00 42.92 39.34 3huy s ASP 183 CO -0.02 0.33 0.00 0.00 0.13 0.00 0.00 175.17 175.61 3huy n TYR 184 N 2.41 0.00 -1.58 -5.34 9.36 -1.25 -1.48 117.16 119.27 3huy n TYR 184 Ca -0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.04 3huy n TYR 184 Cb 0.54 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.25 3huy n TYR 184 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3huy n GLY 185 N 3.12 -4.85 2.91 2.98 0.00 -1.26 -3.66 105.19 104.42 3huy n GLY 185 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 3huy n GLY 185 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3huy s PHE 186 N -0.78 0.45 0.27 1.61 5.36 -1.26 -2.38 117.98 121.25 3huy s PHE 186 Ca 0.00 -0.08 0.03 0.00 -0.96 0.00 0.00 56.93 55.92 3huy s PHE 186 Cb 0.00 -0.37 -0.06 0.00 -0.34 0.00 0.00 43.02 42.25 3huy s PHE 186 CO 0.00 -0.07 0.03 0.00 -1.46 0.00 0.00 175.22 173.72 3huy s ALA 187 N 0.34 2.04 0.24 11.12 0.00 0.06 -4.98 121.76 130.59 3huy s ALA 187 Ca -0.04 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.02 3huy s ALA 187 Cb -0.07 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.67 3huy s ALA 187 CO -0.00 -0.29 0.00 1.28 0.00 0.00 0.00 175.76 176.74 3huy n LEU 188 N -0.54 0.00 -2.63 0.00 7.99 -1.26 0.43 117.00 120.99 3huy n LEU 188 Ca -0.03 0.00 -0.04 0.00 -0.01 0.00 0.00 56.01 55.93 3huy n LEU 188 Cb 0.65 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.95 3huy n LEU 188 CO 0.39 -0.09 0.61 0.00 -1.51 0.00 0.00 177.39 176.79 3huy n ALA 189 N -3.00 -2.14 -0.33 -1.18 0.00 -0.62 -4.50 120.51 108.74 3huy n ALA 189 Ca 0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 53.44 52.95 3huy n ALA 189 Cb 0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 3huy n ALA 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3huy n ARG 190 N -0.51 0.00 0.00 0.00 1.74 -1.26 -3.64 116.66 112.98 3huy n ARG 190 Ca -0.26 -0.24 0.00 0.00 -0.77 0.00 0.00 57.85 56.58 3huy n ARG 190 Cb 0.65 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 3huy n ARG 190 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3huy n THR 191 N 3.76 0.00 0.70 0.55 -2.24 -1.22 -4.98 114.28 110.84 3huy n THR 191 Ca 0.02 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 3huy n THR 191 Cb 0.03 -0.81 0.07 0.00 -2.10 0.00 0.00 70.33 67.52 3huy n THR 191 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3huy n THR 192 N -2.44 0.14 -0.14 4.28 -2.24 -1.26 -3.89 114.28 108.73 3huy n THR 192 Ca 0.00 -0.17 0.10 0.00 -2.27 0.00 0.00 64.05 61.71 3huy n THR 192 Cb 0.00 0.26 0.29 0.00 -2.10 0.00 0.00 70.33 68.79 3huy n THR 192 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3huy n TYR 193 N -1.84 0.97 0.00 4.78 0.18 -1.26 -5.03 117.16 114.96 3huy n TYR 193 Ca 0.03 -0.46 0.00 0.00 1.88 0.00 0.00 57.90 59.35 3huy n TYR 193 Cb 0.41 -0.04 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 3huy n TYR 193 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3huy n GLY 194 N 1.45 0.58 2.98 -7.48 0.00 -1.25 -5.06 105.19 96.40 3huy n GLY 194 Ca 0.22 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 3huy n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3huy s VAL 195 N 0.00 0.02 0.10 1.61 1.01 -1.26 -3.39 120.40 118.49 3huy s VAL 195 Ca 0.00 -0.20 0.10 0.00 0.00 0.00 0.00 61.98 61.87 3huy s VAL 195 Cb 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.17 3huy s VAL 195 CO 0.00 -0.11 -0.25 -0.76 0.00 0.00 0.00 175.10 173.98 3huy s LEU 196 N -0.33 2.27 0.05 3.92 2.01 -1.24 -4.68 118.68 120.67 3huy s LEU 196 Ca -0.04 -0.68 0.08 0.00 0.01 0.00 0.00 54.13 53.51 3huy s LEU 196 Cb -0.03 -1.14 -0.03 0.00 0.01 0.00 0.00 46.19 45.01 3huy s LEU 196 CO 0.00 0.17 -0.23 -0.83 1.01 0.00 0.00 176.35 176.47 3huy s GLY 197 N -1.76 1.48 -0.06 -3.19 0.00 -1.26 -1.59 107.32 100.94 3huy s GLY 197 Ca 0.11 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.59 3huy s GLY 197 CO 0.04 -1.14 -0.05 0.14 0.00 0.00 0.00 173.10 172.10 3huy s VAL 198 N -0.86 0.64 0.20 1.40 1.01 0.17 -2.93 120.40 120.03 3huy s VAL 198 Ca 0.13 -0.14 0.08 0.00 0.00 0.00 0.00 61.98 62.05 3huy s VAL 198 Cb -0.10 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 3huy s VAL 198 CO 0.03 0.27 -0.01 -0.54 0.00 0.00 0.00 175.10 174.86 3huy s LYS 199 N 1.21 2.36 -0.00 2.72 1.02 -0.94 -0.76 119.74 125.35 3huy s LYS 199 Ca -0.06 -1.18 0.00 0.00 0.02 0.00 0.00 55.97 54.75 3huy s LYS 199 Cb -0.14 -2.30 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 3huy s LYS 199 CO -0.02 0.43 -0.01 0.00 -0.92 0.00 0.00 175.35 174.84 3huy s ALA 200 N -1.86 0.11 -0.14 5.17 0.00 -1.00 -2.28 121.76 121.76 3huy s ALA 200 Ca 0.28 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 52.19 3huy s ALA 200 Cb -0.09 -0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.03 3huy s ALA 200 CO 0.19 0.02 -0.01 0.71 0.00 0.00 0.00 175.76 176.67 3huy s TYR 201 N 0.05 1.11 -0.36 0.00 1.51 -0.61 -3.96 117.35 115.08 3huy s TYR 201 Ca -0.00 -0.66 0.03 0.00 -1.01 0.00 0.00 57.07 55.43 3huy s TYR 201 Cb -0.01 -1.04 0.10 0.00 -0.11 0.00 0.00 41.96 40.90 3huy s TYR 201 CO -0.00 -0.50 0.09 0.42 -1.11 0.00 0.00 175.55 174.44 3huy s ILE 202 N 1.83 2.45 0.10 2.71 -1.09 -0.55 -2.16 121.20 124.49 3huy s ILE 202 Ca 0.02 -2.37 -0.30 0.00 -2.23 0.00 0.00 60.65 55.76 3huy s ILE 202 Cb -0.14 -2.78 -0.06 0.00 -1.58 0.00 0.00 42.46 37.89 3huy s ILE 202 CO -0.07 -0.63 1.20 0.12 -1.23 0.00 0.00 174.94 174.33 3huy s PHE 203 N 0.85 3.44 0.00 3.97 5.36 -0.66 -1.69 117.98 129.25 3huy s PHE 203 Ca 0.11 1.33 0.00 0.00 -0.96 0.00 0.00 56.93 57.41 3huy s PHE 203 Cb -0.20 -3.43 0.00 0.00 -0.34 0.00 0.00 43.02 39.06 3huy s PHE 203 CO -0.07 -1.27 0.00 1.28 -1.46 0.00 0.00 175.22 173.70 3huy n LEU 204 N 3.51 0.00 0.00 6.12 4.77 -1.07 -1.47 117.00 128.85 3huy n LEU 204 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3huy n LEU 204 Cb 0.46 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3huy n LEU 204 CO 0.56 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 3huy n GLY 205 N 3.27 5.14 0.00 -0.72 0.00 -1.24 -4.63 105.19 107.02 3huy n GLY 205 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 3huy n GLY 205 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3huy n GLU 206 N 0.00 0.00 -1.58 1.61 1.02 -1.26 -4.12 120.64 116.31 3huy n GLU 206 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3huy n GLU 206 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3huy n GLU 206 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3huy n VAL 207 N 0.00 0.00 0.00 2.62 0.31 -1.26 -4.96 118.33 115.04 3huy n VAL 207 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3huy n VAL 207 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 3huy n VAL 207 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81