#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkf s LYS 3 N 0.00 0.61 3.13 -1.08 3.01 -1.26 -4.45 119.74 119.70 1vkf s LYS 3 Ca 0.00 0.91 0.00 0.00 -1.01 0.00 0.00 55.97 55.87 1vkf s LYS 3 Cb 0.00 0.19 0.00 0.00 -1.01 0.00 0.00 37.83 37.01 1vkf s LYS 3 CO 0.00 -0.12 0.00 0.41 0.51 0.00 0.00 175.35 176.15 1vkf n GLY 4 N 3.56 0.55 3.77 -3.33 0.00 -0.97 -4.78 105.19 104.00 1vkf n GLY 4 Ca -0.18 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.40 1vkf n GLY 4 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vkf s ILE 5 N 0.00 5.43 -0.15 -0.61 -1.09 -1.26 -0.90 121.20 122.63 1vkf s ILE 5 Ca 0.00 0.19 -0.03 0.00 -2.23 0.00 0.00 60.65 58.58 1vkf s ILE 5 Cb 0.00 -3.45 -0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1vkf s ILE 5 CO 0.00 0.49 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.52 1vkf s ILE 6 N 0.01 3.86 -0.26 2.92 1.01 0.76 -4.73 121.20 124.77 1vkf s ILE 6 Ca 0.10 -0.38 -0.29 0.00 0.00 0.00 0.00 60.65 60.08 1vkf s ILE 6 Cb -0.11 -2.68 0.01 0.00 0.01 0.00 0.00 42.46 39.69 1vkf s ILE 6 CO -0.00 0.51 1.11 0.00 0.00 0.00 0.00 174.94 176.55 1vkf s ALA 7 N 0.23 3.58 -0.05 9.38 0.00 -0.53 -1.65 121.76 132.73 1vkf s ALA 7 Ca -0.03 0.12 -0.14 0.00 0.00 0.00 0.00 51.96 51.91 1vkf s ALA 7 Cb -0.14 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.30 1vkf s ALA 7 CO 0.03 -1.30 0.38 0.00 0.00 0.00 0.00 175.76 174.87 1vkf s ALA 8 N 3.52 3.67 -0.14 0.00 0.00 -0.46 -0.10 121.76 128.26 1vkf s ALA 8 Ca 0.47 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1vkf s ALA 8 Cb -0.15 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.60 1vkf s ALA 8 CO 0.12 0.37 -0.13 -0.51 0.00 0.00 0.00 175.76 175.61 1vkf s LEU 9 N -0.63 1.62 0.22 0.00 1.43 -0.45 -4.03 118.68 116.83 1vkf s LEU 9 Ca 0.22 -0.45 0.24 0.00 -1.03 0.00 0.00 54.13 53.12 1vkf s LEU 9 Cb -0.16 -1.11 0.44 0.00 0.03 0.00 0.00 46.19 45.39 1vkf s LEU 9 CO 0.11 -0.05 1.48 -0.50 0.23 0.00 0.00 176.35 177.61 1vkf h TRP 10 N 7.95 0.00 0.00 0.29 4.06 -1.91 0.98 115.95 127.31 1vkf h TRP 10 Ca -0.36 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.59 1vkf h TRP 10 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 1vkf h TRP 10 CO 0.47 0.00 0.00 -0.40 -3.56 0.00 0.00 178.44 174.95 1vkf n ASP 11 N -2.43 0.00 -1.53 -3.49 5.68 -1.26 -4.34 116.55 109.17 1vkf n ASP 11 Ca 0.04 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.37 1vkf n ASP 11 Cb 0.47 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.42 1vkf n ASP 11 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1vkf n ASP 13 N 0.00 -7.92 -3.78 -1.12 8.00 -1.26 -4.99 116.55 105.49 1vkf n ASP 13 Ca 0.00 1.69 -0.24 0.00 0.71 0.00 0.00 54.79 56.95 1vkf n ASP 13 Cb 0.00 -4.96 0.03 0.00 -0.02 0.00 0.00 41.12 36.17 1vkf n ASP 13 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1vkf n SER 14 N -3.06 -2.44 -4.44 -2.24 7.64 -1.26 -4.97 113.62 102.85 1vkf n SER 14 Ca -0.02 -0.81 -0.40 0.00 1.01 0.00 0.00 58.87 58.65 1vkf n SER 14 Cb 0.52 -3.99 -0.11 0.00 -1.01 0.00 0.00 64.21 59.61 1vkf n SER 14 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1vkf s ILE 15 N -3.55 4.79 0.00 0.44 1.01 -1.26 -5.02 121.20 117.61 1vkf s ILE 15 Ca 0.23 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.36 1vkf s ILE 15 Cb -0.12 -3.53 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1vkf s ILE 15 CO 0.82 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 176.30 1vkf n GLY 16 N 5.03 0.45 3.77 6.18 0.00 -1.26 -5.03 105.19 114.33 1vkf n GLY 16 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 1vkf n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vkf s GLU 17 N 2.45 4.12 -0.29 1.61 2.02 -1.26 -5.04 118.70 122.31 1vkf s GLU 17 Ca 0.00 1.71 0.02 0.00 0.02 0.00 0.00 54.97 56.72 1vkf s GLU 17 Cb 0.00 -2.65 0.08 0.00 0.10 0.00 0.00 34.13 31.67 1vkf s GLU 17 CO 0.00 -0.23 -0.00 0.42 0.02 0.00 0.00 175.26 175.47 1vkf s ILE 18 N -1.49 1.87 0.00 -1.63 1.01 -1.26 -5.03 121.20 114.67 1vkf s ILE 18 Ca 0.57 -1.79 -0.24 0.00 0.00 0.00 0.00 60.65 59.19 1vkf s ILE 18 Cb -0.27 -2.24 -0.18 0.00 0.01 0.00 0.00 42.46 39.78 1vkf s ILE 18 CO 0.34 -0.37 1.32 -0.33 0.00 0.00 0.00 174.94 175.90 1vkf h GLU 19 N 7.80 0.10 -6.97 2.79 3.07 -1.96 -3.45 114.58 115.96 1vkf h GLU 19 Ca -0.12 -0.05 -0.55 0.00 -0.50 0.00 0.00 59.36 58.14 1vkf h GLU 19 Cb 1.04 -0.00 0.12 0.00 -0.84 0.00 0.00 28.75 29.07 1vkf h GLU 19 CO 0.47 0.53 0.68 -2.30 -1.40 0.00 0.00 179.01 177.00 1vkf n PRO 20 N -4.79 2.23 0.16 2.33 -0.02 -1.26 -4.93 135.00 128.73 1vkf n PRO 20 Ca -0.08 0.79 0.05 0.00 -2.02 0.00 0.00 63.50 62.25 1vkf n PRO 20 Cb 0.26 -2.61 0.11 0.00 -0.02 0.00 0.00 33.50 31.25 1vkf n PRO 20 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1vkf h ASP 21 N 2.28 0.00 -3.34 2.55 3.32 -1.87 -3.45 116.42 115.91 1vkf h ASP 21 Ca -0.51 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 55.90 1vkf h ASP 21 Cb 1.27 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.60 1vkf h ASP 21 CO 0.61 0.39 -0.69 -0.69 -1.72 0.00 0.00 179.24 177.14 1vkf s VAL 22 N -3.10 3.70 -0.06 -1.35 1.01 -1.26 -1.46 120.40 117.88 1vkf s VAL 22 Ca 0.04 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1vkf s VAL 22 Cb 0.08 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 1vkf s VAL 22 CO 0.72 0.51 -0.24 -0.69 0.00 0.00 0.00 175.10 175.40 1vkf s VAL 23 N 0.24 1.94 -0.38 2.92 1.01 0.27 -1.45 120.40 124.94 1vkf s VAL 23 Ca -0.04 -1.00 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 1vkf s VAL 23 Cb -0.14 -1.65 0.05 0.00 0.00 0.00 0.00 36.38 34.64 1vkf s VAL 23 CO 0.03 0.54 0.20 -0.36 0.00 0.00 0.00 175.10 175.52 1vkf s PHE 24 N -0.11 3.28 -0.47 5.22 0.40 0.86 -1.44 117.98 125.72 1vkf s PHE 24 Ca -0.04 -1.26 -0.25 0.00 -0.60 0.00 0.00 56.93 54.78 1vkf s PHE 24 Cb -0.14 -2.57 0.03 0.00 0.51 0.00 0.00 43.02 40.85 1vkf s PHE 24 CO 0.04 -0.74 0.88 -1.17 0.70 0.00 0.00 175.22 174.93 1vkf s LEU 25 N 1.48 4.09 0.03 -0.37 2.96 0.29 -1.35 118.68 125.81 1vkf s LEU 25 Ca 0.01 0.01 0.23 0.00 -0.22 0.00 0.00 54.13 54.16 1vkf s LEU 25 Cb -0.21 -3.09 0.15 0.00 0.50 0.00 0.00 46.19 43.54 1vkf s LEU 25 CO 0.04 -1.02 1.13 0.18 -1.32 0.00 0.00 176.35 175.36 1vkf n LEU 26 N 7.05 0.65 -3.72 -0.68 4.77 0.34 -1.07 117.00 124.34 1vkf n LEU 26 Ca 0.05 -0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.79 1vkf n LEU 26 Cb 0.48 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 1vkf n LEU 26 CO 0.62 0.11 0.10 -0.75 -1.33 0.00 0.00 177.39 176.14 1vkf s LYS 27 N -3.10 0.56 0.00 3.23 2.20 -1.25 -4.60 119.74 116.78 1vkf s LYS 27 Ca 0.07 0.41 0.00 0.00 -0.36 0.00 0.00 55.97 56.08 1vkf s LYS 27 Cb 0.16 0.27 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1vkf s LYS 27 CO 0.78 -0.10 0.00 0.45 -0.36 0.00 0.00 175.35 176.12 1vkf n SER 28 N 2.41 0.00 -3.45 1.43 2.88 -0.93 -4.67 113.62 111.30 1vkf n SER 28 Ca -0.15 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.27 1vkf n SER 28 Cb 0.57 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.01 1vkf n SER 28 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1vkf s ASP 29 N 2.00 -0.54 0.52 -3.46 1.47 -1.26 -0.47 116.67 114.93 1vkf s ASP 29 Ca 0.00 -0.04 0.30 0.00 1.18 0.00 0.00 52.55 53.99 1vkf s ASP 29 Cb 0.00 0.59 1.42 0.00 -0.34 0.00 0.00 42.92 44.59 1vkf s ASP 29 CO 0.00 -0.97 2.03 0.16 0.68 0.00 0.00 175.17 177.08 1vkf h ILE 30 N 2.03 0.40 0.21 2.11 3.07 -1.37 -0.17 117.51 123.80 1vkf h ILE 30 Ca -0.34 -0.61 -0.31 0.00 1.55 0.00 0.00 64.86 65.16 1vkf h ILE 30 Cb 1.30 1.44 0.04 0.00 -0.27 0.00 0.00 36.82 39.32 1vkf h ILE 30 CO 0.38 0.11 -1.33 -0.07 -1.05 0.00 0.00 178.15 176.19 1vkf h LEU 31 N 0.00 0.80 -0.08 0.16 3.38 -1.97 -3.39 115.31 114.21 1vkf h LEU 31 Ca -0.00 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.06 1vkf h LEU 31 Cb 0.43 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1vkf h LEU 31 CO 0.01 1.65 -0.89 0.59 0.09 0.00 0.00 178.44 179.90 1vkf n ASN 32 N -3.80 1.01 -0.21 -0.43 3.02 -1.02 -4.56 115.26 109.27 1vkf n ASN 32 Ca -0.16 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.39 1vkf n ASN 32 Cb 1.04 0.95 0.09 0.00 -0.61 0.00 0.00 39.78 41.25 1vkf n ASN 32 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1vkf h LEU 33 N 0.20 -0.39 -1.18 3.41 5.85 -1.23 0.84 115.31 122.82 1vkf h LEU 33 Ca 0.00 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.89 1vkf h LEU 33 Cb 0.48 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 1vkf h LEU 33 CO 0.00 -0.15 0.53 0.07 -0.34 0.00 0.00 178.44 178.55 1vkf h LYS 34 N 0.07 1.08 -0.27 1.25 2.10 -1.80 0.81 116.57 119.81 1vkf h LYS 34 Ca 0.32 -0.07 -0.04 0.00 -2.00 0.00 0.00 60.65 58.86 1vkf h LYS 34 Cb 0.51 -0.24 -0.01 0.00 -0.90 0.00 0.00 32.23 31.58 1vkf h LYS 34 CO -0.57 0.73 0.03 0.74 -2.00 0.00 0.00 179.45 178.37 1vkf h PHE 35 N 1.11 0.49 -0.69 0.07 0.04 -1.23 -2.14 116.94 114.60 1vkf h PHE 35 Ca 0.30 -0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.93 1vkf h PHE 35 Cb -0.11 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 37.88 1vkf h PHE 35 CO 0.00 0.58 0.15 0.45 -0.60 0.00 0.00 178.31 178.89 1vkf h HIS 36 N 0.25 1.16 -0.55 -0.55 3.86 -0.36 -1.91 115.15 117.06 1vkf h HIS 36 Ca 0.08 -0.14 -0.09 0.00 -1.16 0.00 0.00 60.37 59.05 1vkf h HIS 36 Cb 0.36 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 1vkf h HIS 36 CO 0.03 0.96 -0.02 -0.07 0.86 0.00 0.00 177.93 179.68 1vkf h LEU 37 N 1.04 0.97 -0.40 2.43 3.38 -0.84 -2.36 115.31 119.53 1vkf h LEU 37 Ca 0.21 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1vkf h LEU 37 Cb 0.39 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1vkf h LEU 37 CO 0.00 1.05 0.21 0.50 0.09 0.00 0.00 178.44 180.29 1vkf h LYS 38 N 0.86 0.57 -0.58 1.13 3.64 -1.18 0.33 116.57 121.34 1vkf h LYS 38 Ca 0.15 -0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.55 1vkf h LYS 38 Cb 0.56 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1vkf h LYS 38 CO 0.03 0.48 0.20 0.82 -2.27 0.00 0.00 179.45 178.71 1vkf h ILE 39 N 0.51 0.77 -0.08 2.00 2.04 -1.23 0.19 117.51 121.72 1vkf h ILE 39 Ca 0.14 -0.13 -0.24 0.00 1.00 0.00 0.00 64.86 65.63 1vkf h ILE 39 Cb 0.09 0.36 0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1vkf h ILE 39 CO -0.02 0.07 -0.90 -0.07 0.00 0.00 0.00 178.15 177.23 1vkf h LEU 40 N 0.38 0.89 -0.82 1.44 3.38 -0.92 -3.04 115.31 116.62 1vkf h LEU 40 Ca 0.29 -0.64 -0.12 0.00 0.09 0.00 0.00 57.88 57.49 1vkf h LEU 40 Cb 0.35 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1vkf h LEU 40 CO -0.30 1.44 -0.59 0.11 0.09 0.00 0.00 178.44 179.19 1vkf h LYS 41 N 0.45 0.00 0.00 1.13 1.79 -0.13 -1.90 116.57 117.90 1vkf h LYS 41 Ca -0.09 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 1vkf h LYS 41 Cb 1.54 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.18 1vkf h LYS 41 CO 0.18 0.59 -0.06 -0.44 -1.08 0.00 0.00 179.45 178.64 1vkf h ASP 42 N 0.00 0.00 -0.21 0.86 3.32 -0.59 -0.46 116.42 119.35 1vkf h ASP 42 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1vkf h ASP 42 Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1vkf h ASP 42 CO 0.08 0.06 0.00 0.54 -1.72 0.00 0.00 179.24 178.19 1vkf n ARG 43 N -3.36 1.69 -1.12 3.56 1.74 -0.74 -4.94 116.66 113.49 1vkf n ARG 43 Ca -0.02 -1.05 -0.00 0.00 -0.77 0.00 0.00 57.85 56.02 1vkf n ARG 43 Cb 0.21 -1.34 -0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1vkf n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vkf n GLY 44 N 1.07 0.39 3.87 -0.13 0.00 -0.18 -5.04 105.19 105.17 1vkf n GLY 44 Ca 0.14 -1.06 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 1vkf n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkf s LYS 45 N -2.24 3.78 -0.10 1.61 -0.14 -1.04 -4.99 119.74 116.61 1vkf s LYS 45 Ca 0.00 0.20 -0.22 0.00 -1.36 0.00 0.00 55.97 54.59 1vkf s LYS 45 Cb 0.00 -2.84 -0.03 0.00 -1.68 0.00 0.00 37.83 33.27 1vkf s LYS 45 CO 0.00 0.45 0.66 0.99 -0.76 0.00 0.00 175.35 176.68 1vkf s THR 46 N -1.60 5.06 -0.12 2.17 2.01 -0.54 -4.49 115.64 118.13 1vkf s THR 46 Ca 0.40 1.33 0.01 0.00 0.31 0.00 0.00 61.69 63.74 1vkf s THR 46 Cb -0.13 -3.99 0.02 0.00 0.01 0.00 0.00 72.50 68.41 1vkf s THR 46 CO 0.21 0.24 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.56 1vkf s VAL 47 N 0.98 1.34 -0.12 3.82 1.01 -1.26 -0.57 120.40 125.61 1vkf s VAL 47 Ca 0.34 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 1vkf s VAL 47 Cb -0.17 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1vkf s VAL 47 CO 0.15 0.42 0.09 -0.36 0.00 0.00 0.00 175.10 175.40 1vkf s PHE 48 N 1.36 3.41 -0.13 5.22 0.40 -0.52 -0.50 117.98 127.22 1vkf s PHE 48 Ca 0.00 0.36 -0.00 0.00 -0.60 0.00 0.00 56.93 56.69 1vkf s PHE 48 Cb -0.13 -1.92 -0.02 0.00 0.51 0.00 0.00 43.02 41.46 1vkf s PHE 48 CO -0.06 0.56 -0.11 0.08 0.70 0.00 0.00 175.22 176.39 1vkf s VAL 49 N -0.75 3.23 0.82 -0.44 1.01 -0.44 -0.55 120.40 123.29 1vkf s VAL 49 Ca 0.13 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.38 1vkf s VAL 49 Cb -0.12 -2.36 0.08 0.00 0.00 0.00 0.00 36.38 33.98 1vkf s VAL 49 CO 0.03 0.53 1.17 -0.62 0.00 0.00 0.00 175.10 176.21 1vkf s ASP 50 N 0.22 4.44 0.00 3.32 -1.08 -0.23 -0.66 116.67 122.68 1vkf s ASP 50 Ca -0.07 0.80 0.00 0.00 -0.52 0.00 0.00 52.55 52.76 1vkf s ASP 50 Cb -0.15 -1.31 0.00 0.00 -1.46 0.00 0.00 42.92 40.00 1vkf s ASP 50 CO 0.05 -1.95 0.00 0.47 0.52 0.00 0.00 175.17 174.26 1vkf n ASP 52 N -3.35 0.00 -0.42 -0.34 8.00 -1.26 -3.37 116.55 115.80 1vkf n ASP 52 Ca 0.08 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.65 1vkf n ASP 52 Cb 0.61 0.00 0.19 0.00 -0.02 0.00 0.00 41.12 41.89 1vkf n ASP 52 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1vkf n PHE 53 N 0.00 0.02 -2.90 1.24 3.72 -1.26 -4.92 117.46 113.36 1vkf n PHE 53 Ca 0.00 -1.32 -0.43 0.00 -0.05 0.00 0.00 57.45 55.65 1vkf n PHE 53 Cb 0.00 -0.22 -0.05 0.00 -0.94 0.00 0.00 39.48 38.28 1vkf n PHE 53 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1vkf s VAL 54 N -3.11 4.49 0.22 -4.37 1.01 -1.22 -2.18 120.40 115.24 1vkf s VAL 54 Ca 0.36 0.22 -0.32 0.00 0.00 0.00 0.00 61.98 62.24 1vkf s VAL 54 Cb 0.34 -4.47 -0.12 0.00 0.00 0.00 0.00 36.38 32.13 1vkf s VAL 54 CO -0.03 -1.00 1.71 0.20 0.00 0.00 0.00 175.10 175.98 1vkf s ASN 55 N 2.69 6.38 0.00 3.32 0.01 0.37 -1.43 114.94 126.28 1vkf s ASN 55 Ca 0.29 2.88 0.00 0.00 -0.71 0.00 0.00 52.86 55.31 1vkf s ASN 55 Cb -0.13 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.92 1vkf s ASN 55 CO 0.19 -0.97 0.00 0.61 -1.51 0.00 0.00 177.10 175.42 1vkf n GLY 56 N 3.81 1.26 3.87 0.66 0.00 -1.26 -1.05 105.19 112.48 1vkf n GLY 56 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1vkf n GLY 56 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1vkf s LEU 57 N 0.00 4.33 0.00 0.99 2.96 -0.51 -4.88 118.68 121.57 1vkf s LEU 57 Ca 0.00 0.80 0.00 0.00 -0.22 0.00 0.00 54.13 54.71 1vkf s LEU 57 Cb 0.00 -3.07 0.00 0.00 0.50 0.00 0.00 46.19 43.62 1vkf s LEU 57 CO 0.00 0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.78 1vkf n GLY 58 N 0.77 2.03 3.62 7.98 0.00 -1.26 -4.91 105.19 113.41 1vkf n GLY 58 Ca -0.07 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.72 1vkf n GLY 58 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1vkf s GLU 59 N 3.44 1.97 0.06 1.61 -1.05 -1.26 -4.87 118.70 118.59 1vkf s GLU 59 Ca 0.00 -1.99 0.00 0.00 -0.15 0.00 0.00 54.97 52.83 1vkf s GLU 59 Cb 0.00 -1.73 0.00 0.00 -0.44 0.00 0.00 34.13 31.96 1vkf s GLU 59 CO 0.00 0.01 0.00 0.41 0.95 0.00 0.00 175.26 176.63 1vkf n GLY 60 N -0.95 -2.37 0.24 -3.83 0.00 -1.26 -4.52 105.19 92.49 1vkf n GLY 60 Ca -0.04 -2.03 -0.07 0.00 0.00 0.00 0.00 46.02 43.88 1vkf n GLY 60 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vkf h GLU 61 N 0.00 0.77 -0.51 1.61 4.81 -1.95 -1.86 114.58 117.45 1vkf h GLU 61 Ca 0.00 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 1vkf h GLU 61 Cb 0.00 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1vkf h GLU 61 CO 0.00 0.56 -0.01 0.93 -0.73 0.00 0.00 179.01 179.77 1vkf h GLU 62 N 0.76 0.86 -0.43 1.92 3.07 -1.99 -1.23 114.58 117.54 1vkf h GLU 62 Ca 0.20 -0.24 -0.02 0.00 -0.50 0.00 0.00 59.36 58.80 1vkf h GLU 62 Cb -0.00 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.80 1vkf h GLU 62 CO -0.04 0.86 0.19 0.00 -1.40 0.00 0.00 179.01 178.63 1vkf h ALA 63 N 1.19 0.56 -0.19 3.43 0.00 -1.68 0.20 119.26 122.76 1vkf h ALA 63 Ca 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1vkf h ALA 63 Cb 0.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1vkf h ALA 63 CO 0.02 0.14 0.11 0.82 0.00 0.00 0.00 179.25 180.34 1vkf h ILE 64 N 0.55 1.09 -0.70 0.00 2.04 -1.13 -1.90 117.51 117.46 1vkf h ILE 64 Ca 0.15 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1vkf h ILE 64 Cb 0.15 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1vkf h ILE 64 CO -0.02 0.09 0.40 -0.07 0.00 0.00 0.00 178.15 178.55 1vkf h LEU 65 N 0.22 0.84 -0.45 1.44 3.38 -1.15 -1.63 115.31 117.97 1vkf h LEU 65 Ca 0.07 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1vkf h LEU 65 Cb 0.04 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1vkf h LEU 65 CO -0.01 0.66 0.24 0.15 0.09 0.00 0.00 178.44 179.57 1vkf h PHE 66 N 0.96 0.44 -0.44 1.13 3.04 -0.61 -0.12 116.94 121.36 1vkf h PHE 66 Ca 0.25 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 62.16 1vkf h PHE 66 Cb -0.01 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.35 1vkf h PHE 66 CO 0.00 0.23 0.06 0.28 -2.02 0.00 0.00 178.31 176.87 1vkf h VAL 67 N 0.47 1.25 -0.41 1.41 2.07 -0.81 -0.32 116.25 119.92 1vkf h VAL 67 Ca 0.19 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1vkf h VAL 67 Cb 0.08 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1vkf h VAL 67 CO -0.12 0.32 0.26 0.50 0.02 0.00 0.00 177.57 178.55 1vkf h LYS 68 N 0.58 0.54 0.00 1.57 3.11 -1.14 -2.51 116.57 118.73 1vkf h LYS 68 Ca 0.13 -0.04 -0.07 0.00 -2.81 0.00 0.00 60.65 57.87 1vkf h LYS 68 Cb 0.39 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.49 1vkf h LYS 68 CO 0.01 0.37 -0.32 0.87 -2.81 0.00 0.00 179.45 177.57 1vkf h LYS 69 N 0.55 0.00 0.00 1.90 1.57 -0.76 -1.20 116.57 118.63 1vkf h LYS 69 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1vkf h LYS 69 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1vkf h LYS 69 CO -0.03 0.32 0.00 0.00 -0.57 0.00 0.00 179.45 179.17 1vkf h ALA 70 N 1.68 1.00 0.00 3.86 0.00 -0.62 -3.46 119.26 121.72 1vkf h ALA 70 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1vkf h ALA 70 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1vkf h ALA 70 CO 0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1vkf n GLY 71 N 0.02 0.96 3.77 0.00 0.00 -0.45 -4.51 105.19 104.97 1vkf n GLY 71 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1vkf n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vkf s ALA 72 N -1.76 3.14 -0.50 4.61 0.00 -1.08 -4.93 121.76 121.24 1vkf s ALA 72 Ca 0.00 1.06 0.24 0.00 0.00 0.00 0.00 51.96 53.25 1vkf s ALA 72 Cb 0.00 -3.42 0.38 0.00 0.00 0.00 0.00 23.12 20.08 1vkf s ALA 72 CO 0.00 -0.68 1.49 -0.44 0.00 0.00 0.00 175.76 176.13 1vkf h ASP 73 N 2.50 0.00 -5.75 0.00 3.32 -1.14 -3.42 116.42 111.92 1vkf h ASP 73 Ca -0.49 -0.03 0.31 0.00 0.02 0.00 0.00 57.03 56.84 1vkf h ASP 73 Cb 1.24 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.70 1vkf h ASP 73 CO 0.62 0.02 0.82 -0.83 -1.72 0.00 0.00 179.24 178.15 1vkf s GLY 74 N -4.01 -0.28 0.10 2.75 0.00 -1.18 -4.20 107.32 100.50 1vkf s GLY 74 Ca 0.06 0.39 0.09 0.00 0.00 0.00 0.00 44.72 45.26 1vkf s GLY 74 CO 0.69 2.01 -0.22 -0.26 0.00 0.00 0.00 173.10 175.31 1vkf s ILE 75 N -2.31 1.83 -0.06 0.90 -5.25 -0.40 -1.32 121.20 114.58 1vkf s ILE 75 Ca 0.19 -1.55 0.02 0.00 -0.99 0.00 0.00 60.65 58.33 1vkf s ILE 75 Cb 0.02 -1.64 -0.03 0.00 2.95 0.00 0.00 42.46 43.77 1vkf s ILE 75 CO -0.02 0.00 -0.11 -0.63 -1.79 0.00 0.00 174.94 172.39 1vkf s ILE 76 N -1.10 3.32 0.14 8.37 1.01 0.17 -0.50 121.20 132.61 1vkf s ILE 76 Ca 0.08 -0.62 -0.18 0.00 0.00 0.00 0.00 60.65 59.93 1vkf s ILE 76 Cb -0.10 -2.33 0.04 0.00 0.01 0.00 0.00 42.46 40.08 1vkf s ILE 76 CO 0.04 0.59 0.47 0.28 0.00 0.00 0.00 174.94 176.32 1vkf s THR 77 N -0.67 0.05 -2.29 2.92 -1.32 -0.72 -4.28 115.64 109.33 1vkf s THR 77 Ca 0.10 -0.44 0.22 0.00 -1.21 0.00 0.00 61.69 60.36 1vkf s THR 77 Cb -0.11 -1.17 0.05 0.00 -1.51 0.00 0.00 72.50 69.76 1vkf s THR 77 CO 0.01 -0.21 1.12 0.00 -2.21 0.00 0.00 174.62 173.34 1vkf n ILE 78 N -0.28 0.00 -3.37 5.08 3.06 -1.26 -0.50 119.36 122.09 1vkf n ILE 78 Ca -0.16 -0.34 -0.41 0.00 -2.50 0.00 0.00 62.75 59.34 1vkf n ILE 78 Cb 0.64 1.33 -0.09 0.00 0.54 0.00 0.00 39.64 42.06 1vkf n ILE 78 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 1vkf s LYS 79 N -2.27 3.44 0.40 9.51 1.02 -1.26 -4.84 119.74 125.75 1vkf s LYS 79 Ca 0.21 -0.49 0.14 0.00 0.02 0.00 0.00 55.97 55.85 1vkf s LYS 79 Cb 0.18 -3.85 0.98 0.00 -0.52 0.00 0.00 37.83 34.62 1vkf s LYS 79 CO 0.47 -0.62 1.90 -1.35 -0.92 0.00 0.00 175.35 174.83 1vkf h PRO 80 N 8.53 0.49 -0.60 -1.68 0.11 -1.96 -1.77 132.00 135.12 1vkf h PRO 80 Ca -0.29 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.70 1vkf h PRO 80 Cb 1.13 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1vkf h PRO 80 CO 0.73 0.32 -0.01 0.87 -0.21 0.00 0.00 178.00 179.70 1vkf h LYS 81 N 0.51 1.05 -0.64 1.05 6.56 -2.00 -1.34 116.57 121.77 1vkf h LYS 81 Ca 0.40 -0.34 -0.01 0.00 -1.06 0.00 0.00 60.65 59.65 1vkf h LYS 81 Cb 0.83 -0.10 -0.03 0.00 -0.57 0.00 0.00 32.23 32.36 1vkf h LYS 81 CO -0.15 1.03 0.37 -0.91 -2.06 0.00 0.00 179.45 177.74 1vkf h ASN 82 N 0.96 0.78 -0.15 0.86 2.35 -1.74 -1.92 115.58 116.71 1vkf h ASN 82 Ca 0.17 -0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.85 1vkf h ASN 82 Cb 0.57 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 1vkf h ASN 82 CO 0.03 0.62 0.08 0.22 -1.65 0.00 0.00 177.43 176.73 1vkf h TYR 83 N 0.86 0.15 -0.71 1.19 5.03 -1.06 -0.56 116.97 121.88 1vkf h TYR 83 Ca 0.23 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.57 1vkf h TYR 83 Cb -0.00 -0.05 -0.04 0.00 1.55 0.00 0.00 36.73 38.19 1vkf h TYR 83 CO -0.01 0.09 0.45 0.28 -1.32 0.00 0.00 178.16 177.65 1vkf h VAL 84 N 0.17 1.13 -0.27 1.81 2.07 -1.10 -1.10 116.25 118.96 1vkf h VAL 84 Ca 0.06 -0.31 -0.18 0.00 0.82 0.00 0.00 66.70 67.09 1vkf h VAL 84 Cb -0.00 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1vkf h VAL 84 CO -0.03 0.16 -0.55 0.58 0.02 0.00 0.00 177.57 177.75 1vkf h VAL 85 N 0.90 1.28 -0.44 2.57 2.07 -1.16 -1.63 116.25 119.84 1vkf h VAL 85 Ca 0.28 -1.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.03 1vkf h VAL 85 Cb -0.02 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1vkf h VAL 85 CO -0.09 0.57 0.21 0.00 0.02 0.00 0.00 177.57 178.27 1vkf h ALA 86 N 0.75 0.57 -0.63 1.67 0.00 -0.81 -2.68 119.26 118.14 1vkf h ALA 86 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1vkf h ALA 86 Cb 1.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1vkf h ALA 86 CO 0.12 0.14 0.35 -0.22 0.00 0.00 0.00 179.25 179.64 1vkf h LYS 87 N 0.58 0.87 -0.03 0.00 3.64 -1.02 -0.14 116.57 120.46 1vkf h LYS 87 Ca 0.15 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1vkf h LYS 87 Cb 0.13 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1vkf h LYS 87 CO -0.02 0.65 -0.09 0.87 -2.27 0.00 0.00 179.45 178.59 1vkf h LYS 88 N 0.85 0.04 -0.11 1.90 1.57 -1.18 -0.34 116.57 119.30 1vkf h LYS 88 Ca 0.22 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1vkf h LYS 88 Cb 0.02 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1vkf h LYS 88 CO -0.04 0.13 0.00 0.09 -0.57 0.00 0.00 179.45 179.06 1vkf n ASN 89 N -4.41 1.14 -2.18 0.86 3.02 -0.86 -4.93 115.26 107.89 1vkf n ASN 89 Ca -0.02 -1.60 -0.16 0.00 -0.03 0.00 0.00 54.58 52.76 1vkf n ASN 89 Cb 0.18 -0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.30 1vkf n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkf n GLY 90 N 1.03 -0.22 3.55 7.41 0.00 -0.14 -5.01 105.19 111.81 1vkf n GLY 90 Ca 0.16 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1vkf n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vkf s ILE 91 N -2.96 4.69 0.29 -0.61 1.01 -0.12 -5.01 121.20 118.48 1vkf s ILE 91 Ca 0.18 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 1vkf s ILE 91 Cb -0.08 -3.17 -0.12 0.00 0.01 0.00 0.00 42.46 39.09 1vkf s ILE 91 CO 0.23 0.37 1.43 -2.65 0.00 0.00 0.00 174.94 174.32 1vkf n PRO 92 N 4.42 2.28 -3.96 2.79 -0.02 -1.26 -3.89 135.00 135.37 1vkf n PRO 92 Ca -0.16 0.81 -0.10 0.00 -2.02 0.00 0.00 63.50 62.03 1vkf n PRO 92 Cb 0.52 -2.48 -0.11 0.00 -0.02 0.00 0.00 33.50 31.40 1vkf n PRO 92 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vkf s ALA 93 N -0.38 0.04 -0.08 3.55 0.00 -1.26 -1.27 121.76 122.36 1vkf s ALA 93 Ca 0.63 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 52.13 1vkf s ALA 93 Cb -0.58 0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.69 1vkf s ALA 93 CO 0.53 -0.16 -0.15 0.08 0.00 0.00 0.00 175.76 176.07 1vkf s VAL 94 N -1.35 1.36 -0.23 0.00 1.01 0.34 -4.56 120.40 116.96 1vkf s VAL 94 Ca -0.15 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 1vkf s VAL 94 Cb -0.09 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 1vkf s VAL 94 CO -0.01 0.41 0.22 -0.22 0.00 0.00 0.00 175.10 175.50 1vkf s LEU 95 N 0.73 4.13 0.42 3.92 2.96 -0.76 -1.75 118.68 128.33 1vkf s LEU 95 Ca -0.13 0.22 -0.23 0.00 -0.22 0.00 0.00 54.13 53.77 1vkf s LEU 95 Cb -0.16 -2.21 -0.09 0.00 0.50 0.00 0.00 46.19 44.23 1vkf s LEU 95 CO 0.03 0.03 1.03 -0.13 -1.32 0.00 0.00 176.35 175.99 1vkf s ARG 96 N 1.10 4.11 -0.13 1.98 0.52 0.34 -0.90 118.95 125.97 1vkf s ARG 96 Ca 0.10 1.42 -0.04 0.00 -0.52 0.00 0.00 55.73 56.69 1vkf s ARG 96 Cb -0.14 -2.40 0.06 0.00 0.52 0.00 0.00 34.95 32.99 1vkf s ARG 96 CO 0.05 -0.18 0.22 0.12 0.02 0.00 0.00 175.30 175.53 1vkf s PHE 97 N -1.79 -0.30 -0.45 -0.53 2.19 0.14 -4.72 117.98 112.52 1vkf s PHE 97 Ca 0.60 0.68 -0.18 0.00 0.33 0.00 0.00 56.93 58.36 1vkf s PHE 97 Cb -0.19 -0.19 0.04 0.00 -1.31 0.00 0.00 43.02 41.37 1vkf s PHE 97 CO 0.24 -0.38 0.52 -0.06 1.83 0.00 0.00 175.22 177.37 1vkf s PHE 98 N 2.35 3.13 -1.03 10.12 0.08 -1.26 -1.67 117.98 129.70 1vkf s PHE 98 Ca 0.03 -0.42 -0.12 0.00 0.12 0.00 0.00 56.93 56.55 1vkf s PHE 98 Cb -0.13 -3.17 0.24 0.00 -0.57 0.00 0.00 43.02 39.39 1vkf s PHE 98 CO -0.08 -0.83 1.06 0.00 -0.10 0.00 0.00 175.22 175.26 1vkf s ALA 99 N 2.34 4.38 -0.16 5.36 0.00 -0.05 -4.76 121.76 128.87 1vkf s ALA 99 Ca 0.14 -3.57 0.11 0.00 0.00 0.00 0.00 51.96 48.64 1vkf s ALA 99 Cb -0.18 -3.65 -0.23 0.00 0.00 0.00 0.00 23.12 19.06 1vkf s ALA 99 CO 0.13 -2.35 0.22 1.28 0.00 0.00 0.00 175.76 175.05 1vkf n LEU 100 N 3.67 1.03 -3.76 0.00 4.77 -1.26 -4.61 117.00 116.83 1vkf n LEU 100 Ca 0.23 0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 56.23 1vkf n LEU 100 Cb 0.42 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 1vkf n LEU 100 CO 0.45 0.58 0.34 1.51 -1.33 0.00 0.00 177.39 178.94 1vkf s ASP 101 N -6.00 -0.28 0.39 -1.43 1.47 -1.26 -5.06 116.67 104.50 1vkf s ASP 101 Ca -0.14 -0.51 0.15 0.00 1.18 0.00 0.00 52.55 53.23 1vkf s ASP 101 Cb 0.07 0.63 0.79 0.00 -0.34 0.00 0.00 42.92 44.07 1vkf s ASP 101 CO 0.78 -1.14 1.84 0.77 0.68 0.00 0.00 175.17 178.10 1vkf h SER 102 N 2.12 0.00 -0.08 2.11 4.64 -1.99 -1.30 113.55 119.05 1vkf h SER 102 Ca -0.26 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.97 1vkf h SER 102 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1vkf h SER 102 CO 0.33 0.35 -0.29 0.11 -0.87 0.00 0.00 176.83 176.46 1vkf h LYS 103 N 0.00 0.33 -0.70 4.77 1.57 -1.99 -1.89 116.57 118.66 1vkf h LYS 103 Ca -0.00 -0.26 0.09 0.00 -1.87 0.00 0.00 60.65 58.61 1vkf h LYS 103 Cb 0.66 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 32.95 1vkf h LYS 103 CO 0.05 0.89 0.34 0.00 -0.57 0.00 0.00 179.45 180.16 1vkf h ALA 104 N 0.45 0.96 -0.31 3.86 0.00 -1.79 -1.68 119.26 120.76 1vkf h ALA 104 Ca -0.01 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1vkf h ALA 104 Cb 0.93 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1vkf h ALA 104 CO 0.06 -0.06 0.05 0.28 0.00 0.00 0.00 179.25 179.58 1vkf h VAL 105 N 0.58 1.23 0.03 0.00 2.07 -1.30 -1.88 116.25 116.99 1vkf h VAL 105 Ca 0.35 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 67.10 1vkf h VAL 105 Cb 0.37 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1vkf h VAL 105 CO -0.27 0.26 -0.14 -0.33 0.02 0.00 0.00 177.57 177.10 1vkf h GLU 106 N 0.33 -0.24 -0.90 1.57 5.08 -0.99 0.12 114.58 119.54 1vkf h GLU 106 Ca 0.09 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1vkf h GLU 106 Cb 0.33 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.59 1vkf h GLU 106 CO 0.00 -0.16 0.60 0.00 -1.00 0.00 0.00 179.01 178.45 1vkf h ARG 107 N -0.25 1.17 -0.54 2.33 3.08 -1.28 -2.20 114.38 116.68 1vkf h ARG 107 Ca 0.04 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 1vkf h ARG 107 Cb 0.30 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1vkf h ARG 107 CO -0.11 0.78 -0.10 0.78 -1.07 0.00 0.00 179.97 180.24 1vkf h GLY 108 N 1.21 1.10 0.87 0.04 0.00 -0.98 -2.05 103.07 103.27 1vkf h GLY 108 Ca 0.33 -0.88 0.02 0.00 0.00 0.00 0.00 47.33 46.80 1vkf h GLY 108 CO -0.08 0.81 0.25 -2.22 0.00 0.00 0.00 176.54 175.30 1vkf h ILE 109 N 0.91 1.03 -0.69 2.60 2.04 -0.64 0.43 117.51 123.19 1vkf h ILE 109 Ca 0.14 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.77 1vkf h ILE 109 Cb 0.67 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1vkf h ILE 109 CO 0.05 0.09 0.20 -0.33 0.00 0.00 0.00 178.15 178.16 1vkf h GLU 110 N 0.51 1.08 -0.44 2.37 5.08 -1.13 0.16 114.58 122.21 1vkf h GLU 110 Ca 0.18 -0.23 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 1vkf h GLU 110 Cb 0.03 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1vkf h GLU 110 CO -0.09 0.93 -0.25 0.37 -1.00 0.00 0.00 179.01 178.97 1vkf h GLN 111 N 1.03 0.95 -0.94 2.33 4.15 -1.15 -1.10 115.11 120.39 1vkf h GLN 111 Ca 0.22 -0.43 0.03 0.00 0.77 0.00 0.00 58.65 59.24 1vkf h GLN 111 Cb 0.32 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.94 1vkf h GLN 111 CO -0.00 1.10 0.61 0.82 -1.93 0.00 0.00 178.83 179.42 1vkf h ILE 112 N 0.79 1.18 -0.14 2.39 2.04 0.64 -0.97 117.51 123.43 1vkf h ILE 112 Ca 0.09 -0.41 -0.11 0.00 1.00 0.00 0.00 64.86 65.43 1vkf h ILE 112 Cb 0.83 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1vkf h ILE 112 CO 0.07 0.22 -0.33 -0.33 0.00 0.00 0.00 178.15 177.78 1vkf h GLU 113 N 1.21 0.48 -0.00 2.37 5.08 -0.58 -1.20 114.58 121.93 1vkf h GLU 113 Ca 0.36 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1vkf h GLU 113 Cb -0.04 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1vkf h GLU 113 CO -0.11 0.94 0.00 1.15 -1.00 0.00 0.00 179.01 179.99 1vkf h THR 114 N 0.09 1.10 -0.00 1.13 2.02 -1.06 -3.12 112.91 113.06 1vkf h THR 114 Ca -0.00 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1vkf h THR 114 Cb 0.94 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.64 1vkf h THR 114 CO 0.07 0.07 -0.14 0.18 0.37 0.00 0.00 175.52 176.08 1vkf n LEU 115 N -5.03 0.16 -2.17 2.58 4.77 -0.38 -4.94 117.00 111.99 1vkf n LEU 115 Ca -0.07 0.33 -0.08 0.00 -0.03 0.00 0.00 56.01 56.15 1vkf n LEU 115 Cb 0.08 -0.41 0.04 0.00 -2.33 0.00 0.00 43.42 40.81 1vkf n LEU 115 CO 0.33 0.04 0.05 0.61 -1.33 0.00 0.00 177.39 177.09 1vkf n GLY 116 N 1.48 0.05 3.62 -0.72 0.00 -0.86 -4.99 105.19 103.77 1vkf n GLY 116 Ca 0.07 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1vkf n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vkf s VAL 117 N -3.17 4.77 -0.13 1.61 1.01 -0.51 -4.94 120.40 119.04 1vkf s VAL 117 Ca 0.01 1.25 0.17 0.00 0.00 0.00 0.00 61.98 63.41 1vkf s VAL 117 Cb -0.00 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 32.08 1vkf s VAL 117 CO 0.35 -0.26 0.82 0.47 0.00 0.00 0.00 175.10 176.49 1vkf n ASP 118 N 6.24 0.85 -3.87 3.32 8.00 -1.26 -4.87 116.55 124.96 1vkf n ASP 118 Ca 0.04 0.37 -0.23 0.00 0.71 0.00 0.00 54.79 55.69 1vkf n ASP 118 Cb 0.48 0.19 -0.17 0.00 -0.02 0.00 0.00 41.12 41.60 1vkf n ASP 118 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1vkf s VAL 119 N -2.94 0.67 -0.04 2.53 1.01 -1.26 -1.82 120.40 118.55 1vkf s VAL 119 Ca -0.03 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 61.87 1vkf s VAL 119 Cb 0.09 -0.72 -0.01 0.00 0.00 0.00 0.00 36.38 35.74 1vkf s VAL 119 CO 0.81 0.28 -0.18 -0.69 0.00 0.00 0.00 175.10 175.32 1vkf s VAL 120 N 1.38 1.50 -0.28 2.92 1.01 -0.09 -1.83 120.40 125.01 1vkf s VAL 120 Ca -0.03 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 1vkf s VAL 120 Cb -0.13 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 1vkf s VAL 120 CO -0.03 0.43 0.15 -0.70 0.00 0.00 0.00 175.10 174.95 1vkf s GLU 121 N -0.06 3.68 -0.16 2.72 2.12 -0.08 -0.54 118.70 126.37 1vkf s GLU 121 Ca -0.02 -0.49 -0.05 0.00 0.36 0.00 0.00 54.97 54.77 1vkf s GLU 121 Cb -0.11 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.70 1vkf s GLU 121 CO 0.02 -0.26 -0.01 0.08 -0.54 0.00 0.00 175.26 174.55 1vkf s VAL 122 N 1.68 4.15 0.04 3.70 1.01 0.73 -0.68 120.40 131.02 1vkf s VAL 122 Ca 0.06 -0.26 0.07 0.00 0.00 0.00 0.00 61.98 61.85 1vkf s VAL 122 Cb -0.16 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 1vkf s VAL 122 CO 0.08 0.48 -0.20 -0.76 0.00 0.00 0.00 175.10 174.70 1vkf s LEU 123 N 0.37 2.15 0.85 3.92 1.02 -0.67 -1.78 118.68 124.54 1vkf s LEU 123 Ca -0.02 -0.49 -0.12 0.00 0.02 0.00 0.00 54.13 53.52 1vkf s LEU 123 Cb -0.14 -0.93 0.10 0.00 0.02 0.00 0.00 46.19 45.24 1vkf s LEU 123 CO 0.02 0.16 1.13 -2.16 0.02 0.00 0.00 176.35 175.51 1vkf s PRO 124 N -1.08 1.68 0.39 1.29 0.04 -1.26 -0.88 135.00 135.19 1vkf s PRO 124 Ca 0.07 0.39 0.06 0.00 0.04 0.00 0.00 61.00 61.56 1vkf s PRO 124 Cb -0.08 -1.89 0.80 0.00 0.04 0.00 0.00 34.50 33.36 1vkf s PRO 124 CO 0.01 -1.85 2.04 0.78 0.04 0.00 0.00 177.00 178.03 1vkf h GLY 125 N -1.25 0.68 1.93 0.56 0.00 0.09 -2.85 103.07 102.23 1vkf h GLY 125 Ca -0.48 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 46.60 1vkf h GLY 125 CO 0.62 0.24 0.03 0.00 0.00 0.00 0.00 176.54 177.43 1vkf h ALA 126 N 1.70 1.54 -0.11 3.60 0.00 -1.89 -1.33 119.26 122.77 1vkf h ALA 126 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vkf h ALA 126 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1vkf h ALA 126 CO -0.04 -0.04 0.00 1.33 0.00 0.00 0.00 179.25 180.50 1vkf n VAL 127 N -3.80 0.20 -0.36 0.00 0.24 -1.08 -4.57 118.33 108.97 1vkf n VAL 127 Ca -0.02 -0.60 -0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1vkf n VAL 127 Cb 0.11 1.15 0.15 0.00 -1.47 0.00 0.00 33.84 33.78 1vkf n VAL 127 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1vkf h ALA 128 N 2.89 1.34 -0.93 2.33 0.00 -1.28 -2.38 119.26 121.24 1vkf h ALA 128 Ca 0.00 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1vkf h ALA 128 Cb 0.66 -0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1vkf h ALA 128 CO 0.00 0.59 0.60 -1.35 0.00 0.00 0.00 179.25 179.09 1vkf h PRO 129 N 1.27 1.03 -0.44 0.00 0.11 -1.81 -0.55 132.00 131.62 1vkf h PRO 129 Ca 0.38 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.41 1vkf h PRO 129 Cb -0.06 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.79 1vkf h PRO 129 CO -0.10 0.68 0.22 0.87 -0.21 0.00 0.00 178.00 179.46 1vkf h LYS 130 N 1.06 0.63 -0.46 1.05 1.57 -1.75 -2.51 116.57 116.17 1vkf h LYS 130 Ca 0.40 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 59.01 1vkf h LYS 130 Cb 0.19 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1vkf h LYS 130 CO -0.15 0.53 -0.04 0.28 -0.57 0.00 0.00 179.45 179.50 1vkf h VAL 131 N 0.58 1.27 -0.94 0.50 2.07 -1.20 -3.20 116.25 115.32 1vkf h VAL 131 Ca 0.15 -1.12 0.02 0.00 0.82 0.00 0.00 66.70 66.58 1vkf h VAL 131 Cb 0.10 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1vkf h VAL 131 CO -0.02 0.38 0.62 0.00 0.02 0.00 0.00 177.57 178.57 1vkf h ALA 132 N 0.90 1.21 -0.04 1.67 0.00 -0.98 -1.06 119.26 120.95 1vkf h ALA 132 Ca 0.12 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1vkf h ALA 132 Cb 0.56 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1vkf h ALA 132 CO 0.03 0.55 0.03 0.00 0.00 0.00 0.00 179.25 179.86 1vkf h ARG 133 N 1.24 0.00 -0.01 0.00 3.08 -1.44 -2.26 114.38 114.99 1vkf h ARG 133 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.40 1vkf h ARG 133 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.96 1vkf h ARG 133 CO -0.09 0.00 -0.52 1.63 -1.07 0.00 0.00 179.97 179.92 1vkf n LYS 134 N -4.26 0.49 -3.10 0.04 5.02 -0.42 -4.28 118.16 111.65 1vkf n LYS 134 Ca -0.02 -0.34 -0.23 0.00 -2.02 0.00 0.00 58.31 55.70 1vkf n LYS 134 Cb 0.13 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.61 1vkf n LYS 134 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1vkf n ILE 135 N -0.96 1.30 -1.79 -0.18 -5.35 -0.86 -5.11 119.36 106.42 1vkf n ILE 135 Ca 0.08 -5.01 -0.39 0.00 -0.27 0.00 0.00 62.75 57.16 1vkf n ILE 135 Cb 0.36 -0.93 0.03 0.00 -1.74 0.00 0.00 39.64 37.37 1vkf n ILE 135 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1vkf s PRO 136 N -2.80 3.40 0.00 6.28 0.04 -1.20 -2.32 135.00 138.40 1vkf s PRO 136 Ca 0.44 2.33 0.00 0.00 0.04 0.00 0.00 61.00 63.80 1vkf s PRO 136 Cb 0.30 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1vkf s PRO 136 CO -0.10 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.33 1vkf n GLY 137 N 0.65 1.38 3.65 0.56 0.00 -1.26 -5.04 105.19 105.13 1vkf n GLY 137 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1vkf n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkf s ARG 138 N -0.34 2.70 -0.15 1.61 0.52 -0.98 -5.09 118.95 117.22 1vkf s ARG 138 Ca 0.00 -0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 54.27 1vkf s ARG 138 Cb 0.00 -2.61 -0.01 0.00 0.52 0.00 0.00 34.95 32.85 1vkf s ARG 138 CO 0.00 0.62 1.16 0.99 0.02 0.00 0.00 175.30 178.09 1vkf s THR 139 N -1.04 4.44 -0.15 0.02 2.01 -0.75 -4.99 115.64 115.18 1vkf s THR 139 Ca 0.18 1.74 -0.04 0.00 0.31 0.00 0.00 61.69 63.89 1vkf s THR 139 Cb -0.11 -4.12 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 1vkf s THR 139 CO 0.09 -0.10 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.18 1vkf s VAL 140 N 2.98 3.88 -0.18 3.82 1.01 -1.26 -0.91 120.40 129.75 1vkf s VAL 140 Ca 0.51 -0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.08 1vkf s VAL 140 Cb -0.20 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1vkf s VAL 140 CO 0.14 0.50 -0.01 -0.63 0.00 0.00 0.00 175.10 175.10 1vkf s ILE 141 N 0.34 4.06 0.10 2.22 1.01 0.30 -1.91 121.20 127.32 1vkf s ILE 141 Ca -0.04 -0.29 -0.17 0.00 0.00 0.00 0.00 60.65 60.15 1vkf s ILE 141 Cb -0.14 -2.81 -0.07 0.00 0.01 0.00 0.00 42.46 39.45 1vkf s ILE 141 CO 0.03 0.46 0.56 0.00 0.00 0.00 0.00 174.94 176.00 1vkf s ALA 142 N 0.59 3.58 -0.11 9.38 0.00 -0.05 -0.20 121.76 134.96 1vkf s ALA 142 Ca -0.01 -0.03 -0.22 0.00 0.00 0.00 0.00 51.96 51.70 1vkf s ALA 142 Cb -0.14 -2.59 0.05 0.00 0.00 0.00 0.00 23.12 20.44 1vkf s ALA 142 CO 0.02 0.42 0.53 0.00 0.00 0.00 0.00 175.76 176.74 1vkf s ALA 143 N -1.26 -1.35 0.00 0.00 0.00 -0.73 -0.61 121.76 117.80 1vkf s ALA 143 Ca 0.33 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.47 1vkf s ALA 143 Cb -0.18 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.57 1vkf s ALA 143 CO 0.19 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.06 1vkf n GLY 144 N 1.81 2.02 2.41 0.00 0.00 -1.26 -1.43 105.19 108.74 1vkf n GLY 144 Ca -0.17 -1.09 -0.17 0.00 0.00 0.00 0.00 46.02 44.58 1vkf n GLY 144 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vkf n LEU 145 N 0.00 -1.57 -4.52 0.99 4.77 -1.26 -1.08 117.00 114.33 1vkf n LEU 145 Ca 0.00 0.18 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 1vkf n LEU 145 Cb 0.00 -2.51 -0.05 0.00 -2.33 0.00 0.00 43.42 38.53 1vkf n LEU 145 CO 0.00 -0.50 0.67 -0.69 -1.33 0.00 0.00 177.39 175.54 1vkf s VAL 146 N -2.77 4.50 -0.12 4.08 1.01 -1.26 -4.87 120.40 120.97 1vkf s VAL 146 Ca 0.00 0.28 0.13 0.00 0.00 0.00 0.00 61.98 62.39 1vkf s VAL 146 Cb 0.00 -4.46 -0.19 0.00 0.00 0.00 0.00 36.38 31.74 1vkf s VAL 146 CO 0.00 -0.97 0.10 -0.62 0.00 0.00 0.00 175.10 173.62 1vkf n GLU 147 N 7.14 1.45 -4.44 2.72 1.02 -1.26 -4.94 120.64 122.33 1vkf n GLU 147 Ca 0.01 -0.03 -0.22 0.00 -0.02 0.00 0.00 57.16 56.90 1vkf n GLU 147 Cb 0.48 -1.36 -0.10 0.00 -0.02 0.00 0.00 31.44 30.43 1vkf n GLU 147 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1vkf s THR 148 N -2.48 1.85 0.46 2.62 -4.23 -1.26 -4.98 115.64 107.62 1vkf s THR 148 Ca -0.07 -2.18 0.18 0.00 -1.18 0.00 0.00 61.69 58.43 1vkf s THR 148 Cb 0.05 -2.39 0.22 0.00 1.34 0.00 0.00 72.50 71.73 1vkf s THR 148 CO 0.59 -0.35 2.05 -0.08 -0.54 0.00 0.00 174.62 176.29 1vkf h GLU 149 N 2.29 0.00 -0.31 3.99 4.81 -1.98 -2.23 114.58 121.15 1vkf h GLU 149 Ca -0.40 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.71 1vkf h GLU 149 Cb 1.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1vkf h GLU 149 CO 0.66 0.13 -0.26 0.93 -0.73 0.00 0.00 179.01 179.74 1vkf h GLU 150 N 0.00 0.72 -0.29 1.92 3.07 -1.99 -1.12 114.58 116.89 1vkf h GLU 150 Ca -0.00 -0.37 -0.02 0.00 -0.50 0.00 0.00 59.36 58.48 1vkf h GLU 150 Cb 0.25 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1vkf h GLU 150 CO 0.02 0.98 0.11 0.93 -1.40 0.00 0.00 179.01 179.65 1vkf h GLU 151 N 0.48 0.43 -0.41 2.33 5.08 -1.90 -2.49 114.58 118.11 1vkf h GLU 151 Ca 0.05 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1vkf h GLU 151 Cb 0.83 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 1vkf h GLU 151 CO 0.07 0.45 0.15 0.00 -1.00 0.00 0.00 179.01 178.69 1vkf h ALA 152 N 0.96 0.53 -0.91 3.43 0.00 -1.32 -1.38 119.26 120.57 1vkf h ALA 152 Ca 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1vkf h ALA 152 Cb 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1vkf h ALA 152 CO -0.01 0.15 0.51 0.00 0.00 0.00 0.00 179.25 179.90 1vkf h ARG 153 N 0.52 1.26 -0.44 0.00 3.08 -1.14 -0.14 114.38 117.53 1vkf h ARG 153 Ca 0.14 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1vkf h ARG 153 Cb 0.21 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1vkf h ARG 153 CO -0.01 0.91 0.08 1.49 -1.07 0.00 0.00 179.97 181.37 1vkf h GLU 154 N 1.27 0.72 -0.51 0.04 4.57 -1.29 -3.00 114.58 116.38 1vkf h GLU 154 Ca 0.32 -0.19 -0.05 0.00 -1.18 0.00 0.00 59.36 58.26 1vkf h GLU 154 Cb 0.01 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 1vkf h GLU 154 CO -0.05 0.74 0.11 0.82 -1.18 0.00 0.00 179.01 179.45 1vkf h ILE 155 N 0.58 1.24 0.00 2.32 2.04 -0.53 -2.85 117.51 120.31 1vkf h ILE 155 Ca 0.13 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1vkf h ILE 155 Cb 0.37 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1vkf h ILE 155 CO 0.01 0.32 0.00 0.18 0.00 0.00 0.00 178.15 178.66 1vkf n LEU 156 N -4.43 0.00 0.23 1.44 4.77 -0.13 -1.28 117.00 117.60 1vkf n LEU 156 Ca 0.02 0.28 0.08 0.00 -0.03 0.00 0.00 56.01 56.36 1vkf n LEU 156 Cb 0.24 -0.28 0.56 0.00 -2.33 0.00 0.00 43.42 41.60 1vkf n LEU 156 CO 0.40 -0.16 0.87 0.11 -1.33 0.00 0.00 177.39 177.29 1vkf h LYS 157 N 0.00 0.00 0.00 3.23 1.57 -1.37 -3.37 116.57 116.64 1vkf h LYS 157 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vkf h LYS 157 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1vkf h LYS 157 CO 0.00 0.22 -0.54 0.72 -0.57 0.00 0.00 179.45 179.28 1vkf n HIS 158 N -3.83 0.00 -4.25 -1.35 8.25 -0.41 -5.05 115.22 108.58 1vkf n HIS 158 Ca -0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.30 1vkf n HIS 158 Cb 0.31 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.32 1vkf n HIS 158 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1vkf s VAL 159 N -1.49 1.09 0.12 1.59 -7.23 -0.96 -4.85 120.40 108.68 1vkf s VAL 159 Ca 0.00 -2.04 -0.10 0.00 -1.81 0.00 0.00 61.98 58.03 1vkf s VAL 159 Cb 0.00 -1.88 -0.14 0.00 0.56 0.00 0.00 36.38 34.92 1vkf s VAL 159 CO 0.00 -0.72 1.35 0.28 -0.31 0.00 0.00 175.10 175.70 1vkf h SER 160 N 2.77 0.85 -5.10 4.85 0.02 -1.69 -3.40 113.55 111.85 1vkf h SER 160 Ca -0.37 -0.55 -0.05 0.00 -0.84 0.00 0.00 61.79 59.99 1vkf h SER 160 Cb 1.19 -0.25 -0.12 0.00 0.14 0.00 0.00 62.40 63.36 1vkf h SER 160 CO 0.64 1.33 -0.06 0.00 -1.14 0.00 0.00 176.83 177.60 1vkf s ALA 161 N -3.76 -0.83 -0.07 3.77 0.00 -1.23 -2.28 121.76 117.36 1vkf s ALA 161 Ca -0.09 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.70 1vkf s ALA 161 Cb 0.09 0.77 -0.00 0.00 0.00 0.00 0.00 23.12 23.98 1vkf s ALA 161 CO 0.89 -0.70 -0.20 0.42 0.00 0.00 0.00 175.76 176.16 1vkf s ILE 162 N -3.85 1.74 -0.17 0.00 1.01 -0.08 -0.87 121.20 118.99 1vkf s ILE 162 Ca 0.07 -0.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.78 1vkf s ILE 162 Cb 0.01 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 1vkf s ILE 162 CO -0.07 0.49 0.11 -0.55 0.00 0.00 0.00 174.94 174.91 1vkf s SER 163 N 0.20 6.06 -0.11 3.58 0.15 0.22 -0.17 113.70 123.62 1vkf s SER 163 Ca -0.11 0.26 -0.27 0.00 0.70 0.00 0.00 55.95 56.53 1vkf s SER 163 Cb -0.15 -2.01 0.06 0.00 -1.71 0.00 0.00 66.02 62.21 1vkf s SER 163 CO 0.05 0.26 0.64 0.28 1.20 0.00 0.00 173.24 175.67 1vkf s THR 164 N -0.11 0.01 -2.54 6.45 -1.32 -0.66 -4.25 115.64 113.21 1vkf s THR 164 Ca 0.09 -0.05 0.24 0.00 -1.21 0.00 0.00 61.69 60.76 1vkf s THR 164 Cb -0.12 -0.94 0.41 0.00 -1.51 0.00 0.00 72.50 70.35 1vkf s THR 164 CO 0.00 -0.03 1.50 -1.54 -2.21 0.00 0.00 174.62 172.35 1vkf n SER 165 N 1.55 2.34 -4.61 8.08 3.41 -1.26 -1.36 113.62 121.78 1vkf n SER 165 Ca -0.18 -1.79 -0.43 0.00 -0.26 0.00 0.00 58.87 56.22 1vkf n SER 165 Cb 0.56 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.40 1vkf n SER 165 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1vkf s SER 166 N -1.75 6.05 0.62 4.04 0.15 -1.26 -4.87 113.70 116.68 1vkf s SER 166 Ca 0.34 1.44 0.34 0.00 0.70 0.00 0.00 55.95 58.77 1vkf s SER 166 Cb 0.20 -2.53 2.01 0.00 -1.71 0.00 0.00 66.02 63.99 1vkf s SER 166 CO 0.30 -1.56 2.28 0.03 1.20 0.00 0.00 173.24 175.49 1vkf h ARG 167 N 12.19 0.00 -0.17 5.44 -0.00 -1.98 -1.84 114.38 128.01 1vkf h ARG 167 Ca -0.34 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 59.07 1vkf h ARG 167 Cb 1.17 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.13 1vkf h ARG 167 CO 1.02 0.00 -0.18 0.82 0.00 0.00 0.00 179.97 181.63 1vkf h ILE 168 N 0.00 1.34 0.00 2.04 2.04 -1.99 -3.18 117.51 117.76 1vkf h ILE 168 Ca 0.01 -1.35 -0.10 0.00 1.00 0.00 0.00 64.86 64.42 1vkf h ILE 168 Cb 0.04 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1vkf h ILE 168 CO -0.00 0.40 -0.48 -0.07 0.00 0.00 0.00 178.15 178.01 1vkf h LEU 169 N 0.07 0.00 -1.65 1.44 3.38 -1.79 -2.54 115.31 114.22 1vkf h LEU 169 Ca 0.03 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.15 1vkf h LEU 169 Cb 0.72 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 1vkf h LEU 169 CO 0.04 0.48 0.49 -0.50 0.09 0.00 0.00 178.44 179.04 1vkf h TRP 170 N 0.00 0.40 -1.41 1.13 4.06 -1.34 -3.47 115.95 115.33 1vkf h TRP 170 Ca -0.00 0.01 -0.72 0.00 2.06 0.00 0.00 58.89 60.23 1vkf h TRP 170 Cb 0.93 -0.13 -0.13 0.00 -1.00 0.00 0.00 29.16 28.83 1vkf h TRP 170 CO 0.00 0.15 1.93 1.63 -3.56 0.00 0.00 178.44 178.59 1vkf n LYS 171 N -4.46 3.31 0.00 0.49 5.02 -0.96 -4.51 118.16 117.05 1vkf n LYS 171 Ca 0.14 -3.49 0.00 0.00 -2.02 0.00 0.00 58.31 52.94 1vkf n LYS 171 Cb 0.55 -3.18 0.00 0.00 -0.02 0.00 0.00 35.03 32.38 1vkf n LYS 171 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05