#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vjf s THR 3 N 0.00 2.98 0.24 -0.18 -4.23 -1.26 -4.95 115.64 108.25 1vjf s THR 3 Ca 0.00 -0.42 -0.04 0.00 -1.18 0.00 0.00 61.69 60.05 1vjf s THR 3 Cb 0.00 -3.17 0.21 0.00 1.34 0.00 0.00 72.50 70.88 1vjf s THR 3 CO 0.00 -0.14 1.78 -0.09 -0.54 0.00 0.00 174.62 175.63 1vjf h ARG 4 N -0.08 0.63 -0.59 3.99 2.43 -1.97 -0.70 114.38 118.10 1vjf h ARG 4 Ca -0.44 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.67 1vjf h ARG 4 Cb 1.29 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 30.66 1vjf h ARG 4 CO 0.57 0.42 0.28 0.00 -1.51 0.00 0.00 179.97 179.73 1vjf h ALA 5 N 1.49 1.38 -0.54 2.80 0.00 -1.94 -1.30 119.26 121.14 1vjf h ALA 5 Ca 0.40 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 1vjf h ALA 5 Cb 0.47 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1vjf h ALA 5 CO -0.30 0.49 0.14 -0.44 0.00 0.00 0.00 179.25 179.13 1vjf h ASP 6 N 0.84 0.82 -0.11 0.00 3.32 -1.64 -0.82 116.42 118.83 1vjf h ASP 6 Ca 0.21 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 57.03 1vjf h ASP 6 Cb 0.09 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1vjf h ASP 6 CO -0.03 0.84 0.04 0.25 -1.72 0.00 0.00 179.24 178.63 1vjf h LEU 7 N 0.77 0.06 -1.18 1.55 5.85 -0.67 -1.56 115.31 120.13 1vjf h LEU 7 Ca 0.17 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1vjf h LEU 7 Cb 0.33 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1vjf h LEU 7 CO 0.00 0.05 -0.27 -0.26 -0.34 0.00 0.00 178.44 177.62 1vjf h PHE 8 N 0.10 0.24 -0.72 1.25 0.04 -1.12 0.10 116.94 116.83 1vjf h PHE 8 Ca 0.04 -0.05 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1vjf h PHE 8 Cb 0.01 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.07 1vjf h PHE 8 CO -0.09 0.48 0.25 0.00 -0.60 0.00 0.00 178.31 178.35 1vjf h ALA 9 N 1.52 1.09 -0.16 2.45 0.00 -0.79 0.21 119.26 123.57 1vjf h ALA 9 Ca 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1vjf h ALA 9 Cb 0.59 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1vjf h ALA 9 CO 0.04 0.63 0.08 0.35 0.00 0.00 0.00 179.25 180.36 1vjf h PHE 10 N 1.06 0.23 -0.39 0.00 3.57 -0.67 -1.41 116.94 119.34 1vjf h PHE 10 Ca 0.24 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 1vjf h PHE 10 Cb 0.25 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.87 1vjf h PHE 10 CO 0.02 0.26 0.12 0.74 -2.23 0.00 0.00 178.31 177.21 1vjf h PHE 11 N 0.14 0.20 -0.57 0.41 0.04 -0.74 -2.48 116.94 113.94 1vjf h PHE 11 Ca 0.06 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 1vjf h PHE 11 Cb 0.11 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 1vjf h PHE 11 CO -0.03 0.07 0.33 -0.44 -0.60 0.00 0.00 178.31 177.64 1vjf h ASP 12 N 0.26 0.69 -0.48 2.17 3.32 -0.77 0.42 116.42 122.03 1vjf h ASP 12 Ca 0.18 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.22 1vjf h ASP 12 Cb 0.18 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1vjf h ASP 12 CO -0.20 0.56 0.32 0.00 -1.72 0.00 0.00 179.24 178.20 1vjf h ALA 13 N 1.16 1.91 -0.36 3.45 0.00 -0.91 -2.90 119.26 121.61 1vjf h ALA 13 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1vjf h ALA 13 Cb 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1vjf h ALA 13 CO -0.04 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.95 1vjf n HIS 14 N -4.48 0.47 -1.59 0.00 8.25 -0.80 -4.98 115.22 112.09 1vjf n HIS 14 Ca 0.06 -0.36 -0.07 0.00 -0.26 0.00 0.00 57.72 57.09 1vjf n HIS 14 Cb 0.23 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.31 1vjf n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vjf n GLY 15 N 0.91 0.57 3.52 -1.41 0.00 -0.04 -4.91 105.19 103.82 1vjf n GLY 15 Ca 0.14 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 1vjf n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vjf s VAL 16 N -2.30 4.61 0.34 1.61 1.01 -0.15 -5.00 120.40 120.53 1vjf s VAL 16 Ca 0.00 0.21 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 1vjf s VAL 16 Cb 0.00 -4.38 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 1vjf s VAL 16 CO 0.00 -0.86 0.77 -1.81 0.00 0.00 0.00 175.10 173.20 1vjf s ASP 17 N 2.45 6.79 0.03 3.32 1.01 -1.26 -4.34 116.67 124.67 1vjf s ASP 17 Ca 0.27 1.34 -0.05 0.00 0.71 0.00 0.00 52.55 54.82 1vjf s ASP 17 Cb -0.14 -2.40 -0.01 0.00 1.01 0.00 0.00 42.92 41.39 1vjf s ASP 17 CO 0.20 -0.23 0.08 -1.38 0.21 0.00 0.00 175.17 174.04 1vjf s HIS 18 N -2.03 0.19 -0.05 4.23 -3.43 -1.26 -4.46 115.29 108.49 1vjf s HIS 18 Ca 0.55 -0.46 0.00 0.00 -0.80 0.00 0.00 55.06 54.35 1vjf s HIS 18 Cb -0.10 -0.14 0.02 0.00 -1.43 0.00 0.00 32.58 30.93 1vjf s HIS 18 CO 0.17 -0.32 -0.03 0.21 -2.00 0.00 0.00 174.74 172.77 1vjf s LYS 19 N -2.26 0.73 -0.03 -0.38 2.47 -0.73 -4.98 119.74 114.57 1vjf s LYS 19 Ca -0.08 -0.02 0.06 0.00 -1.56 0.00 0.00 55.97 54.37 1vjf s LYS 19 Cb -0.03 -0.87 -0.02 0.00 -1.46 0.00 0.00 37.83 35.44 1vjf s LYS 19 CO -0.03 -0.16 -0.21 0.99 0.16 0.00 0.00 175.35 176.09 1vjf s THR 20 N 1.29 2.47 -0.18 3.43 2.01 -1.26 -0.18 115.64 123.22 1vjf s THR 20 Ca -0.05 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 1vjf s THR 20 Cb -0.14 -1.91 -0.00 0.00 0.01 0.00 0.00 72.50 70.46 1vjf s THR 20 CO -0.02 0.57 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.14 1vjf s LEU 21 N -0.70 2.58 0.21 4.42 2.96 0.14 -4.98 118.68 123.32 1vjf s LEU 21 Ca 0.11 -0.45 -0.14 0.00 -0.22 0.00 0.00 54.13 53.42 1vjf s LEU 21 Cb -0.10 -1.61 -0.08 0.00 0.50 0.00 0.00 46.19 44.90 1vjf s LEU 21 CO -0.00 0.05 0.61 -1.81 -1.32 0.00 0.00 176.35 173.88 1vjf s ASP 22 N 1.02 6.81 -0.07 3.68 1.01 -1.26 -1.05 116.67 126.80 1vjf s ASP 22 Ca -0.01 1.13 -0.29 0.00 0.71 0.00 0.00 52.55 54.09 1vjf s ASP 22 Cb -0.15 -2.31 0.10 0.00 1.01 0.00 0.00 42.92 41.58 1vjf s ASP 22 CO -0.02 -0.01 0.86 -1.38 0.21 0.00 0.00 175.17 174.83 1vjf s HIS 23 N -1.66 -0.45 0.72 4.23 -3.43 -0.54 -4.95 115.29 109.22 1vjf s HIS 23 Ca 0.44 0.63 -0.16 0.00 -0.80 0.00 0.00 55.06 55.17 1vjf s HIS 23 Cb -0.13 0.47 0.03 0.00 -1.43 0.00 0.00 32.58 31.52 1vjf s HIS 23 CO 0.20 -0.50 1.26 -2.14 -2.00 0.00 0.00 174.74 171.56 1vjf s PRO 24 N -1.83 2.14 0.28 -0.38 0.02 -1.26 -4.01 135.00 129.96 1vjf s PRO 24 Ca -0.02 1.94 -0.29 0.00 0.02 0.00 0.00 61.00 62.64 1vjf s PRO 24 Cb -0.01 -1.81 -0.13 0.00 0.02 0.00 0.00 34.50 32.57 1vjf s PRO 24 CO -0.00 -1.88 1.29 -2.30 -0.33 0.00 0.00 177.00 173.77 1vjf n PRO 25 N -2.52 1.92 -2.99 5.54 -0.02 -1.26 -4.84 135.00 130.83 1vjf n PRO 25 Ca 0.15 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 61.90 1vjf n PRO 25 Cb 0.49 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.67 1vjf n PRO 25 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vjf s VAL 26 N -0.64 4.91 -0.03 -1.45 1.01 -1.26 -4.87 120.40 118.07 1vjf s VAL 26 Ca 0.62 1.37 0.04 0.00 0.00 0.00 0.00 61.98 64.00 1vjf s VAL 26 Cb -0.63 -4.03 0.06 0.00 0.00 0.00 0.00 36.38 31.77 1vjf s VAL 26 CO 0.56 -0.02 0.92 0.49 0.00 0.00 0.00 175.10 177.06 1vjf n PHE 27 N 5.81 0.00 -3.79 5.22 3.72 -1.26 -5.04 117.46 122.12 1vjf n PHE 27 Ca 0.03 -0.45 -0.14 0.00 -0.05 0.00 0.00 57.45 56.83 1vjf n PHE 27 Cb 0.48 -0.06 -0.16 0.00 -0.94 0.00 0.00 39.48 38.81 1vjf n PHE 27 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1vjf s ARG 28 N -1.08 -0.03 0.40 -1.08 0.52 -1.26 -5.04 118.95 111.38 1vjf s ARG 28 Ca 0.06 0.16 0.07 0.00 -0.52 0.00 0.00 55.73 55.50 1vjf s ARG 28 Cb 0.06 -0.20 0.82 0.00 0.52 0.00 0.00 34.95 36.15 1vjf s ARG 28 CO 0.01 -0.14 2.01 -0.24 0.02 0.00 0.00 175.30 176.96 1vjf h VAL 29 N 6.08 1.13 -0.82 3.52 3.04 -2.00 -2.33 116.25 124.87 1vjf h VAL 29 Ca -0.42 -0.37 -0.03 0.00 -1.01 0.00 0.00 66.70 64.87 1vjf h VAL 29 Cb 1.14 0.71 -0.04 0.00 -2.01 0.00 0.00 31.29 31.09 1vjf h VAL 29 CO 0.48 0.15 0.40 -0.33 -1.01 0.00 0.00 177.57 177.26 1vjf h GLU 30 N 0.47 1.17 -0.62 4.17 3.07 -2.00 -1.54 114.58 119.30 1vjf h GLU 30 Ca 0.12 -0.17 -0.08 0.00 -0.50 0.00 0.00 59.36 58.73 1vjf h GLU 30 Cb 0.08 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.75 1vjf h GLU 30 CO -0.01 0.90 0.07 0.93 -1.40 0.00 0.00 179.01 179.49 1vjf h GLU 31 N 1.15 1.04 -0.62 2.33 5.08 -1.86 -1.56 114.58 120.14 1vjf h GLU 31 Ca 0.28 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1vjf h GLU 31 Cb 0.11 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1vjf h GLU 31 CO -0.04 0.97 0.31 0.78 -1.00 0.00 0.00 179.01 180.04 1vjf h GLY 32 N 1.03 0.95 1.13 -3.84 0.00 -1.11 -1.54 103.07 99.69 1vjf h GLY 32 Ca 0.19 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 1vjf h GLY 32 CO 0.02 0.44 0.26 1.41 0.00 0.00 0.00 176.54 178.67 1vjf h LEU 33 N 0.85 1.02 -0.75 3.11 3.38 -1.05 -1.63 115.31 120.24 1vjf h LEU 33 Ca 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1vjf h LEU 33 Cb 0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1vjf h LEU 33 CO -0.03 0.92 0.39 -0.33 0.09 0.00 0.00 178.44 179.48 1vjf h GLU 34 N 1.07 1.06 -0.48 1.13 5.08 -0.87 -0.05 114.58 121.51 1vjf h GLU 34 Ca 0.24 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1vjf h GLU 34 Cb 0.24 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1vjf h GLU 34 CO -0.02 0.80 0.16 0.82 -1.00 0.00 0.00 179.01 179.78 1vjf h ILE 35 N 1.04 1.22 -0.16 3.13 2.04 -1.00 -2.24 117.51 121.55 1vjf h ILE 35 Ca 0.26 -0.73 -0.07 0.00 1.00 0.00 0.00 64.86 65.32 1vjf h ILE 35 Cb 0.07 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1vjf h ILE 35 CO -0.04 0.27 -0.22 0.11 0.00 0.00 0.00 178.15 178.27 1vjf h LYS 36 N 0.64 0.29 -0.26 2.37 1.57 -1.10 -2.35 116.57 117.73 1vjf h LYS 36 Ca 0.16 -0.09 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 1vjf h LYS 36 Cb 0.25 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1vjf h LYS 36 CO -0.01 0.50 -0.35 0.00 -0.57 0.00 0.00 179.45 179.02 1vjf h ALA 37 N 1.51 0.90 -0.01 3.86 0.00 -0.70 -3.36 119.26 121.47 1vjf h ALA 37 Ca 0.04 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1vjf h ALA 37 Cb 0.54 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1vjf h ALA 37 CO 0.04 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1vjf n ALA 38 N -2.50 2.72 -2.77 0.00 0.00 -0.87 -5.10 120.51 111.99 1vjf n ALA 38 Ca -0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 1vjf n ALA 38 Cb 0.49 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.86 1vjf n ALA 38 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1vjf s PRO 40 N -0.02 1.37 0.55 0.00 0.02 -1.26 -5.10 135.00 130.56 1vjf s PRO 40 Ca 0.00 -1.38 0.00 0.00 0.02 0.00 0.00 61.00 59.65 1vjf s PRO 40 Cb 0.00 0.39 0.00 0.00 0.02 0.00 0.00 34.50 34.91 1vjf s PRO 40 CO 0.00 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 1vjf n GLY 41 N -0.32 -1.79 3.69 0.52 0.00 -1.26 -4.50 105.19 101.53 1vjf n GLY 41 Ca -0.01 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 1vjf n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1vjf s GLY 42 N -0.14 2.38 -0.12 -0.02 0.00 0.16 -4.94 107.32 104.64 1vjf s GLY 42 Ca 0.00 0.41 -0.05 0.00 0.00 0.00 0.00 44.72 45.07 1vjf s GLY 42 CO 0.00 1.92 0.08 0.30 0.00 0.00 0.00 173.10 175.40 1vjf s HIS 43 N 1.94 3.38 0.26 1.90 3.76 -1.26 -1.27 115.29 124.00 1vjf s HIS 43 Ca 0.49 0.32 0.11 0.00 -0.15 0.00 0.00 55.06 55.84 1vjf s HIS 43 Cb -0.19 -1.92 -0.05 0.00 1.11 0.00 0.00 32.58 31.54 1vjf s HIS 43 CO 0.19 0.53 -0.13 0.95 -0.85 0.00 0.00 174.74 175.43 1vjf s THR 44 N -0.69 2.86 0.15 1.30 -4.23 -1.24 -1.74 115.64 112.04 1vjf s THR 44 Ca 0.12 -2.13 0.08 0.00 -1.18 0.00 0.00 61.69 58.58 1vjf s THR 44 Cb -0.12 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.19 1vjf s THR 44 CO 0.03 -0.33 -0.18 -1.59 -0.54 0.00 0.00 174.62 172.01 1vjf s LYS 45 N -3.41 1.21 -0.23 3.99 -2.85 0.07 -4.64 119.74 113.89 1vjf s LYS 45 Ca 0.29 -1.35 -0.04 0.00 -1.00 0.00 0.00 55.97 53.87 1vjf s LYS 45 Cb -0.06 -1.25 0.09 0.00 -2.06 0.00 0.00 37.83 34.55 1vjf s LYS 45 CO 0.16 0.25 0.15 -0.80 0.10 0.00 0.00 175.35 175.22 1vjf s ASN 46 N -2.57 2.45 -0.21 0.03 0.01 -1.26 -1.29 114.94 112.11 1vjf s ASN 46 Ca 0.14 -0.76 -0.14 0.00 -0.71 0.00 0.00 52.86 51.38 1vjf s ASN 46 Cb -0.06 -0.07 -0.04 0.00 0.41 0.00 0.00 41.25 41.49 1vjf s ASN 46 CO 0.06 -0.38 0.32 -0.76 -1.51 0.00 0.00 177.10 174.83 1vjf s LEU 47 N 2.19 4.16 -0.36 0.60 1.02 0.69 -4.74 118.68 122.23 1vjf s LEU 47 Ca 0.06 0.41 -0.12 0.00 0.02 0.00 0.00 54.13 54.50 1vjf s LEU 47 Cb -0.16 -2.39 0.01 0.00 0.02 0.00 0.00 46.19 43.68 1vjf s LEU 47 CO -0.21 -0.01 0.22 0.12 0.02 0.00 0.00 176.35 176.48 1vjf s PHE 48 N 1.11 3.22 0.20 0.29 5.36 -1.26 -0.85 117.98 126.06 1vjf s PHE 48 Ca 0.16 -0.68 0.11 0.00 -0.96 0.00 0.00 56.93 55.56 1vjf s PHE 48 Cb -0.14 -2.45 -0.04 0.00 -0.34 0.00 0.00 43.02 40.04 1vjf s PHE 48 CO 0.06 -0.54 -0.23 -0.51 -1.46 0.00 0.00 175.22 172.54 1vjf s LEU 49 N 1.62 2.45 -0.05 6.12 1.43 0.25 -0.81 118.68 129.69 1vjf s LEU 49 Ca 0.04 -0.89 0.02 0.00 -1.03 0.00 0.00 54.13 52.27 1vjf s LEU 49 Cb -0.18 -1.13 0.02 0.00 0.03 0.00 0.00 46.19 44.92 1vjf s LEU 49 CO 0.08 0.10 -0.08 -0.75 0.23 0.00 0.00 176.35 175.93 1vjf s LYS 50 N -2.79 1.20 0.60 1.70 2.20 -0.19 -0.57 119.74 121.89 1vjf s LYS 50 Ca 0.22 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 1vjf s LYS 50 Cb -0.07 -1.08 0.05 0.00 -1.51 0.00 0.00 37.83 35.22 1vjf s LYS 50 CO 0.10 -0.04 0.84 0.16 -0.36 0.00 0.00 175.35 176.05 1vjf s ASP 51 N 0.81 5.05 0.24 1.43 1.47 -0.07 -1.38 116.67 124.21 1vjf s ASP 51 Ca -0.13 -0.06 0.18 0.00 1.18 0.00 0.00 52.55 53.72 1vjf s ASP 51 Cb -0.15 -0.70 0.91 0.00 -0.34 0.00 0.00 42.92 42.64 1vjf s ASP 51 CO 0.02 -1.32 1.56 0.00 0.68 0.00 0.00 175.17 176.10 1vjf n ALA 52 N -2.48 1.23 0.74 2.11 0.00 0.75 -0.60 120.51 122.26 1vjf n ALA 52 Ca 0.09 0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.78 1vjf n ALA 52 Cb 0.60 -1.28 0.19 0.00 0.00 0.00 0.00 19.45 18.96 1vjf n ALA 52 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vjf n LYS 53 N -2.09 2.35 -0.51 0.00 4.76 -1.26 -4.98 118.16 116.43 1vjf n LYS 53 Ca -0.00 -2.00 0.00 0.00 -2.87 0.00 0.00 58.31 53.44 1vjf n LYS 53 Cb 0.08 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 1vjf n LYS 53 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vjf n GLY 54 N 1.40 0.75 3.71 0.72 0.00 0.23 -5.06 105.19 106.96 1vjf n GLY 54 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1vjf n GLY 54 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1vjf s GLN 55 N -0.49 4.54 0.23 1.61 2.00 -1.26 -4.79 119.66 121.49 1vjf s GLN 55 Ca 0.00 1.51 -0.19 0.00 -2.00 0.00 0.00 55.36 54.69 1vjf s GLN 55 Cb 0.00 -3.42 -0.08 0.00 0.80 0.00 0.00 33.01 30.31 1vjf s GLN 55 CO 0.00 -0.07 0.71 -0.51 -0.50 0.00 0.00 175.29 174.92 1vjf s LEU 56 N 0.90 4.31 0.01 3.68 1.43 -1.25 -0.89 118.68 126.86 1vjf s LEU 56 Ca 0.53 1.37 0.01 0.00 -1.03 0.00 0.00 54.13 55.01 1vjf s LEU 56 Cb -0.23 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.36 1vjf s LEU 56 CO 0.29 0.01 -0.04 0.26 0.23 0.00 0.00 176.35 177.10 1vjf s TRP 57 N -1.58 0.32 -0.14 0.29 0.52 0.27 -1.95 118.94 116.68 1vjf s TRP 57 Ca 0.44 -0.16 0.01 0.00 0.02 0.00 0.00 56.10 56.42 1vjf s TRP 57 Cb -0.16 -0.20 0.02 0.00 -1.15 0.00 0.00 33.47 31.97 1vjf s TRP 57 CO 0.20 -0.03 -0.17 -1.17 0.02 0.00 0.00 176.95 175.80 1vjf s LEU 58 N -0.40 1.87 -0.22 2.99 2.96 0.13 -0.58 118.68 125.43 1vjf s LEU 58 Ca -0.02 -0.52 -0.06 0.00 -0.22 0.00 0.00 54.13 53.30 1vjf s LEU 58 Cb -0.03 -1.27 -0.03 0.00 0.50 0.00 0.00 46.19 45.36 1vjf s LEU 58 CO -0.00 0.01 0.04 -0.63 -1.32 0.00 0.00 176.35 174.45 1vjf s ILE 59 N 1.12 4.21 -0.17 6.68 1.01 -0.03 -1.00 121.20 133.03 1vjf s ILE 59 Ca -0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 60.65 60.37 1vjf s ILE 59 Cb -0.14 -2.93 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 1vjf s ILE 59 CO -0.06 0.39 -0.02 -0.44 0.00 0.00 0.00 174.94 174.81 1vjf s SER 60 N 1.24 4.91 0.13 3.58 0.01 -0.39 -0.22 113.70 122.96 1vjf s SER 60 Ca 0.04 -0.11 -0.06 0.00 1.31 0.00 0.00 55.95 57.13 1vjf s SER 60 Cb -0.15 -1.81 -0.02 0.00 0.21 0.00 0.00 66.02 64.26 1vjf s SER 60 CO 0.02 0.15 0.18 0.00 0.41 0.00 0.00 173.24 174.01 1vjf s ALA 61 N 0.46 0.19 0.54 1.44 0.00 -0.41 -1.17 121.76 122.80 1vjf s ALA 61 Ca -0.02 -0.98 -0.22 0.00 0.00 0.00 0.00 51.96 50.74 1vjf s ALA 61 Cb -0.14 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.66 1vjf s ALA 61 CO 0.02 -0.56 1.33 -0.51 0.00 0.00 0.00 175.76 176.04 1vjf s LEU 62 N -2.96 3.86 0.41 0.00 1.43 -1.26 -0.75 118.68 119.41 1vjf s LEU 62 Ca 0.15 2.69 0.13 0.00 -1.03 0.00 0.00 54.13 56.07 1vjf s LEU 62 Cb 0.05 -4.29 0.98 0.00 0.03 0.00 0.00 46.19 42.96 1vjf s LEU 62 CO -0.03 -1.50 1.93 1.23 0.23 0.00 0.00 176.35 178.20 1vjf h GLY 63 N 1.48 0.78 1.48 -3.19 0.00 -1.60 -1.67 103.07 100.34 1vjf h GLY 63 Ca -0.51 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.62 1vjf h GLY 63 CO 0.57 0.09 -0.32 -1.84 0.00 0.00 0.00 176.54 175.04 1vjf n GLU 64 N -4.49 0.13 -2.03 4.80 0.00 -1.26 -4.86 120.64 112.93 1vjf n GLU 64 Ca 0.13 0.07 -0.42 0.00 0.00 0.00 0.00 57.16 56.94 1vjf n GLU 64 Cb 0.46 -1.61 -0.03 0.00 0.00 0.00 0.00 31.44 30.26 1vjf n GLU 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1vjf s THR 65 N -3.07 3.44 -0.07 3.84 2.01 -0.63 -4.96 115.64 116.20 1vjf s THR 65 Ca 0.10 0.73 -0.30 0.00 0.31 0.00 0.00 61.69 62.54 1vjf s THR 65 Cb 0.16 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 1vjf s THR 65 CO 0.64 -0.03 1.07 -0.89 -0.69 0.00 0.00 174.62 174.73 1vjf s THR 66 N 3.20 4.59 -0.30 -0.82 2.01 -1.26 -4.95 115.64 118.10 1vjf s THR 66 Ca 0.71 1.87 -0.02 0.00 0.31 0.00 0.00 61.69 64.57 1vjf s THR 66 Cb -0.35 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.01 1vjf s THR 66 CO 0.30 0.02 0.01 -0.63 -0.69 0.00 0.00 174.62 173.63 1vjf s ILE 67 N 1.92 2.99 -0.93 1.82 1.01 -1.26 -4.74 121.20 122.02 1vjf s ILE 67 Ca 0.52 -1.42 -0.24 0.00 0.00 0.00 0.00 60.65 59.51 1vjf s ILE 67 Cb -0.21 -2.74 0.05 0.00 0.01 0.00 0.00 42.46 39.57 1vjf s ILE 67 CO 0.21 -0.13 1.38 -0.62 0.00 0.00 0.00 174.94 175.78 1vjf s ASP 68 N 1.27 6.40 0.52 3.58 2.15 -1.26 -4.84 116.67 124.50 1vjf s ASP 68 Ca -0.05 -1.19 0.28 0.00 0.43 0.00 0.00 52.55 52.03 1vjf s ASP 68 Cb -0.20 -2.56 1.44 0.00 -0.30 0.00 0.00 42.92 41.31 1vjf s ASP 68 CO -0.01 -1.58 2.06 -0.07 -0.17 0.00 0.00 175.17 175.40 1vjf h LEU 69 N 12.74 0.00 -1.28 -1.34 3.38 -1.97 -1.22 115.31 125.62 1vjf h LEU 69 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1vjf h LEU 69 Cb 1.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1vjf h LEU 69 CO 1.37 0.12 -0.24 0.50 0.09 0.00 0.00 178.44 180.27 1vjf h LYS 70 N 0.00 0.18 -0.00 1.13 3.64 -1.91 -3.27 116.57 116.33 1vjf h LYS 70 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1vjf h LYS 70 Cb 0.36 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1vjf h LYS 70 CO 0.02 0.42 -0.25 1.63 -2.27 0.00 0.00 179.45 179.00 1vjf n LYS 71 N -4.19 2.97 0.23 1.90 5.02 -0.97 -4.73 118.16 118.39 1vjf n LYS 71 Ca -0.01 -0.35 0.08 0.00 -2.02 0.00 0.00 58.31 56.00 1vjf n LYS 71 Cb 0.34 -0.98 0.55 0.00 -0.02 0.00 0.00 35.03 34.92 1vjf n LYS 71 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1vjf h LEU 72 N 0.60 0.00 -1.81 -0.35 5.85 -1.29 -2.65 115.31 115.66 1vjf h LEU 72 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1vjf h LEU 72 Cb 0.25 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1vjf h LEU 72 CO 0.00 0.22 0.01 1.12 -0.34 0.00 0.00 178.44 179.45 1vjf h HIS 73 N 0.00 0.12 -0.13 1.25 2.07 -1.84 0.28 115.15 116.90 1vjf h HIS 73 Ca -0.00 -0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 1vjf h HIS 73 Cb 0.48 -0.04 -0.01 0.00 2.57 0.00 0.00 27.41 30.41 1vjf h HIS 73 CO 0.00 0.12 -0.27 0.45 -3.07 0.00 0.00 177.93 175.16 1vjf h HIS 74 N 0.13 0.26 0.01 6.12 3.86 -1.74 -0.77 115.15 123.01 1vjf h HIS 74 Ca 0.03 -0.05 -0.10 0.00 -1.16 0.00 0.00 60.37 59.09 1vjf h HIS 74 Cb 0.07 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 28.48 1vjf h HIS 74 CO 0.00 0.49 -0.40 0.28 0.86 0.00 0.00 177.93 179.16 1vjf h VAL 75 N 0.21 1.51 -0.01 2.45 2.07 -1.09 -3.35 116.25 118.04 1vjf h VAL 75 Ca 0.03 -2.04 0.00 0.00 0.82 0.00 0.00 66.70 65.51 1vjf h VAL 75 Cb 0.60 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 1vjf h VAL 75 CO 0.04 0.57 -0.34 2.30 0.02 0.00 0.00 177.57 180.17 1vjf n ILE 76 N -4.38 0.00 -2.07 4.57 -5.35 -0.87 -4.68 119.36 106.59 1vjf n ILE 76 Ca -0.10 -0.22 -0.05 0.00 -0.27 0.00 0.00 62.75 62.10 1vjf n ILE 76 Cb 0.58 0.88 -0.00 0.00 -1.74 0.00 0.00 39.64 39.36 1vjf n ILE 76 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vjf n GLY 77 N 1.37 0.17 4.02 3.28 0.00 -0.34 -5.05 105.19 108.63 1vjf n GLY 77 Ca 0.11 -0.66 -0.19 0.00 0.00 0.00 0.00 46.02 45.28 1vjf n GLY 77 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vjf s SER 78 N -2.76 5.30 1.03 1.61 1.04 -0.90 -5.05 113.70 113.97 1vjf s SER 78 Ca 0.00 -0.59 -0.15 0.00 0.48 0.00 0.00 55.95 55.69 1vjf s SER 78 Cb 0.00 -0.19 0.20 0.00 0.10 0.00 0.00 66.02 66.14 1vjf s SER 78 CO 0.00 -1.12 1.15 -0.83 0.98 0.00 0.00 173.24 173.42 1vjf s GLY 79 N -4.52 1.61 0.41 7.32 0.00 -1.26 -4.68 107.32 106.19 1vjf s GLY 79 Ca 0.59 -0.74 -0.26 0.00 0.00 0.00 0.00 44.72 44.31 1vjf s GLY 79 CO 0.37 -0.03 1.30 0.54 0.00 0.00 0.00 173.10 175.28 1vjf n ARG 80 N -4.16 2.04 -3.87 2.90 1.74 -1.26 -4.36 116.66 109.69 1vjf n ARG 80 Ca 0.10 0.72 -0.37 0.00 -0.77 0.00 0.00 57.85 57.53 1vjf n ARG 80 Cb 0.59 -2.42 -0.06 0.00 -1.02 0.00 0.00 32.46 29.55 1vjf n ARG 80 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1vjf s LEU 81 N -1.72 4.38 0.32 0.55 1.43 -1.26 -0.18 118.68 122.20 1vjf s LEU 81 Ca 0.60 0.46 0.04 0.00 -1.03 0.00 0.00 54.13 54.20 1vjf s LEU 81 Cb -0.51 -2.08 -0.06 0.00 0.03 0.00 0.00 46.19 43.57 1vjf s LEU 81 CO 0.59 0.39 0.05 -0.44 0.23 0.00 0.00 176.35 177.17 1vjf s SER 82 N -0.94 2.39 0.36 2.29 0.01 -0.48 -4.93 113.70 112.39 1vjf s SER 82 Ca 0.15 -1.36 -0.27 0.00 1.31 0.00 0.00 55.95 55.78 1vjf s SER 82 Cb -0.12 -0.09 -0.09 0.00 0.21 0.00 0.00 66.02 65.93 1vjf s SER 82 CO 0.04 -0.58 1.23 -0.36 0.41 0.00 0.00 173.24 173.98 1vjf s PHE 83 N -3.28 3.09 0.70 2.43 0.08 -1.26 -1.02 117.98 118.72 1vjf s PHE 83 Ca 0.36 1.50 -0.11 0.00 0.12 0.00 0.00 56.93 58.80 1vjf s PHE 83 Cb 0.08 -3.53 0.01 0.00 -0.57 0.00 0.00 43.02 39.01 1vjf s PHE 83 CO 0.15 -1.53 1.08 0.20 -0.10 0.00 0.00 175.22 175.01 1vjf s GLY 84 N -0.79 1.64 0.42 4.36 0.00 0.01 -4.39 107.32 108.57 1vjf s GLY 84 Ca 0.52 -0.22 -0.23 0.00 0.00 0.00 0.00 44.72 44.79 1vjf s GLY 84 CO 0.46 0.13 1.05 2.56 0.00 0.00 0.00 173.10 177.29 1vjf s PRO 85 N -5.26 4.08 0.35 2.90 0.04 -1.26 -4.92 135.00 130.93 1vjf s PRO 85 Ca 0.58 1.47 0.05 0.00 0.04 0.00 0.00 61.00 63.14 1vjf s PRO 85 Cb -0.12 -2.43 0.70 0.00 0.04 0.00 0.00 34.50 32.69 1vjf s PRO 85 CO 0.53 -0.21 1.95 0.37 0.04 0.00 0.00 177.00 179.68 1vjf h GLN 86 N 2.26 0.78 -5.01 4.56 4.15 -1.99 -3.43 115.11 116.43 1vjf h GLN 86 Ca -0.49 -0.05 -0.38 0.00 0.77 0.00 0.00 58.65 58.51 1vjf h GLN 86 Cb 1.22 -0.18 0.06 0.00 0.21 0.00 0.00 27.48 28.79 1vjf h GLN 86 CO 0.61 0.52 1.05 0.39 -1.93 0.00 0.00 178.83 179.48 1vjf n GLU 87 N -4.48 0.53 0.00 1.69 4.71 -1.26 -4.68 120.64 117.15 1vjf n GLU 87 Ca 0.11 -1.59 0.00 0.00 -0.01 0.00 0.00 57.16 55.67 1vjf n GLU 87 Cb 0.21 -3.22 0.00 0.00 -1.01 0.00 0.00 31.44 27.43 1vjf n GLU 87 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1vjf n LEU 90 N 13.05 0.00 -0.20 -4.62 7.94 -1.24 -4.65 117.00 127.27 1vjf n LEU 90 Ca 0.45 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 55.28 1vjf n LEU 90 Cb 0.44 0.00 0.03 0.00 0.53 0.00 0.00 43.42 44.42 1vjf n LEU 90 CO 0.90 0.00 1.01 -0.08 -1.11 0.00 0.00 177.39 178.11 1vjf h GLU 91 N 0.00 0.83 0.00 1.96 4.81 -1.90 -0.43 114.58 119.85 1vjf h GLU 91 Ca 0.00 -0.13 -0.22 0.00 -0.13 0.00 0.00 59.36 58.88 1vjf h GLU 91 Cb 0.00 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.19 1vjf h GLU 91 CO 0.00 0.69 -1.93 0.25 -0.73 0.00 0.00 179.01 177.29 1vjf n THR 92 N -4.53 1.05 0.27 0.32 -2.24 -1.26 -4.50 114.28 103.39 1vjf n THR 92 Ca 0.03 -0.72 0.03 0.00 -2.27 0.00 0.00 64.05 61.12 1vjf n THR 92 Cb 0.13 -0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 1vjf n THR 92 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1vjf n LEU 93 N -2.72 0.27 -2.48 3.22 4.77 -1.25 -2.09 117.00 116.71 1vjf n LEU 93 Ca -0.18 -0.48 -0.20 0.00 -0.03 0.00 0.00 56.01 55.12 1vjf n LEU 93 Cb 0.92 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.02 1vjf n LEU 93 CO 0.44 0.07 -0.13 0.61 -1.33 0.00 0.00 177.39 177.04 1vjf n GLY 94 N 1.19 -0.43 3.27 -0.72 0.00 -0.17 -4.50 105.19 103.83 1vjf n GLY 94 Ca 0.01 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 1vjf n GLY 94 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vjf s VAL 95 N -3.04 1.46 0.38 1.61 -7.23 -1.26 -4.85 120.40 107.46 1vjf s VAL 95 Ca 0.13 -1.86 0.07 0.00 -1.81 0.00 0.00 61.98 58.52 1vjf s VAL 95 Cb -0.06 -1.69 -0.01 0.00 0.56 0.00 0.00 36.38 35.18 1vjf s VAL 95 CO 0.17 -0.45 0.43 0.42 -0.31 0.00 0.00 175.10 175.36 1vjf s THR 96 N -2.35 3.35 0.20 5.32 -4.23 -1.26 -3.72 115.64 112.95 1vjf s THR 96 Ca 0.13 -1.16 -0.32 0.00 -1.18 0.00 0.00 61.69 59.16 1vjf s THR 96 Cb -0.04 -3.16 -0.15 0.00 1.34 0.00 0.00 72.50 70.50 1vjf s THR 96 CO 0.04 -0.09 1.19 -2.65 -0.54 0.00 0.00 174.62 172.58 1vjf n PRO 97 N -1.61 1.36 -1.00 3.99 -0.02 -1.26 -1.60 135.00 134.86 1vjf n PRO 97 Ca 0.02 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1vjf n PRO 97 Cb 0.60 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1vjf n PRO 97 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vjf n GLY 98 N 1.95 0.73 1.63 -1.23 0.00 -1.26 -4.91 105.19 102.09 1vjf n GLY 98 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 1vjf n GLY 98 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1vjf n SER 99 N 0.00 2.99 -4.77 1.61 2.88 -0.63 -4.64 113.62 111.07 1vjf n SER 99 Ca 0.00 -3.37 -0.39 0.00 -1.33 0.00 0.00 58.87 53.79 1vjf n SER 99 Cb 0.00 -0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 63.02 1vjf n SER 99 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1vjf s VAL 100 N -3.56 3.25 -0.21 2.46 1.01 -1.26 -4.55 120.40 117.54 1vjf s VAL 100 Ca 0.42 1.09 -0.27 0.00 0.00 0.00 0.00 61.98 63.22 1vjf s VAL 100 Cb 0.38 -3.63 0.10 0.00 0.00 0.00 0.00 36.38 33.23 1vjf s VAL 100 CO -0.03 0.13 0.86 0.28 0.00 0.00 0.00 175.10 176.35 1vjf s THR 101 N -1.38 0.00 0.54 3.92 -1.32 -1.26 -4.67 115.64 111.47 1vjf s THR 101 Ca 0.54 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 61.26 1vjf s THR 101 Cb -0.30 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.04 1vjf s THR 101 CO 0.39 0.00 2.06 0.00 -2.21 0.00 0.00 174.62 174.86 1vjf h ALA 102 N 3.88 2.20 0.00 11.08 0.00 -1.95 -1.46 119.26 133.01 1vjf h ALA 102 Ca -0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1vjf h ALA 102 Cb 1.16 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1vjf h ALA 102 CO 0.19 -0.40 -0.04 0.74 0.00 0.00 0.00 179.25 179.74 1vjf h PHE 103 N 0.00 0.00 0.00 0.00 0.04 -1.96 -1.79 116.94 113.23 1vjf h PHE 103 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 1vjf h PHE 103 Cb 0.63 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.78 1vjf h PHE 103 CO 0.00 0.04 0.00 0.78 -0.60 0.00 0.00 178.31 178.53 1vjf h GLY 104 N 1.08 0.00 1.71 -1.45 0.00 -1.49 -2.83 103.07 100.09 1vjf h GLY 104 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1vjf h GLY 104 CO 0.00 0.00 0.14 1.41 0.00 0.00 0.00 176.54 178.09 1vjf h LEU 105 N 0.00 0.00 -2.54 3.11 3.38 -1.51 -1.02 115.31 116.73 1vjf h LEU 105 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1vjf h LEU 105 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1vjf h LEU 105 CO 0.00 0.00 0.05 0.16 0.09 0.00 0.00 178.44 178.74 1vjf h ILE 106 N 0.00 0.36 -0.01 1.22 3.07 -1.75 -2.22 117.51 118.19 1vjf h ILE 106 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1vjf h ILE 106 Cb 0.28 0.95 0.00 0.00 -0.27 0.00 0.00 36.82 37.79 1vjf h ILE 106 CO -0.00 0.00 -0.24 0.59 -1.05 0.00 0.00 178.15 177.45 1vjf n ASN 107 N -3.60 0.76 -3.84 2.16 3.02 -0.39 -4.67 115.26 108.71 1vjf n ASN 107 Ca -0.02 -0.67 -0.42 0.00 -0.03 0.00 0.00 54.58 53.44 1vjf n ASN 107 Cb 0.14 0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1vjf n ASN 107 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1vjf n ASP 108 N -0.88 5.57 0.22 6.41 2.03 -0.84 -4.66 116.55 124.42 1vjf n ASP 108 Ca 0.12 -3.16 0.06 0.00 0.52 0.00 0.00 54.79 52.33 1vjf n ASP 108 Cb 0.33 -1.44 0.51 0.00 -0.72 0.00 0.00 41.12 39.80 1vjf n ASP 108 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1vjf h THR 109 N 3.56 1.05 -0.01 5.18 1.35 -1.84 -2.00 112.91 120.21 1vjf h THR 109 Ca 0.40 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 1vjf h THR 109 Cb 0.59 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1vjf h THR 109 CO 1.57 0.21 -0.01 -0.62 -0.25 0.00 0.00 175.52 176.42 1vjf n GLU 110 N -4.13 1.16 -3.85 4.72 -0.58 -1.26 -4.93 120.64 111.76 1vjf n GLU 110 Ca -0.02 -0.33 -0.24 0.00 -0.42 0.00 0.00 57.16 56.15 1vjf n GLU 110 Cb 0.28 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 1vjf n GLU 110 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1vjf n LYS 111 N -0.63 -4.02 0.16 3.49 4.76 -0.75 -4.88 118.16 116.28 1vjf n LYS 111 Ca 0.21 0.50 0.12 0.00 -2.87 0.00 0.00 58.31 56.27 1vjf n LYS 111 Cb 0.21 -4.83 0.16 0.00 -1.84 0.00 0.00 35.03 28.73 1vjf n LYS 111 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1vjf h ARG 112 N -1.85 0.00 -4.81 1.97 3.08 -1.92 -3.45 114.38 107.40 1vjf h ARG 112 Ca -0.62 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 58.75 1vjf h ARG 112 Cb 1.37 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 31.14 1vjf h ARG 112 CO 0.60 0.00 -0.64 0.08 -1.07 0.00 0.00 179.97 178.94 1vjf s VAL 113 N -3.23 3.74 0.24 2.04 1.01 -1.26 -3.82 120.40 119.12 1vjf s VAL 113 Ca 0.06 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.94 1vjf s VAL 113 Cb 0.08 -2.95 -0.09 0.00 0.00 0.00 0.00 36.38 33.42 1vjf s VAL 113 CO 0.69 0.07 0.90 -0.13 0.00 0.00 0.00 175.10 176.63 1vjf s ARG 114 N 1.45 4.73 -0.15 2.72 0.52 -0.82 -4.87 118.95 122.54 1vjf s ARG 114 Ca 0.01 1.37 -0.01 0.00 -0.52 0.00 0.00 55.73 56.59 1vjf s ARG 114 Cb -0.17 -3.18 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 1vjf s ARG 114 CO 0.01 0.48 -0.12 0.12 0.02 0.00 0.00 175.30 175.81 1vjf s PHE 115 N -1.26 2.83 -0.11 -0.53 5.36 -1.26 -0.69 117.98 122.32 1vjf s PHE 115 Ca 0.42 -0.78 0.02 0.00 -0.96 0.00 0.00 56.93 55.62 1vjf s PHE 115 Cb -0.24 -1.89 -0.01 0.00 -0.34 0.00 0.00 43.02 40.54 1vjf s PHE 115 CO 0.29 -0.32 -0.17 0.08 -1.46 0.00 0.00 175.22 173.64 1vjf s VAL 116 N 0.62 2.72 -0.15 3.12 1.01 -0.17 -4.46 120.40 123.09 1vjf s VAL 116 Ca -0.07 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1vjf s VAL 116 Cb -0.15 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1vjf s VAL 116 CO 0.03 0.54 -0.18 -0.22 0.00 0.00 0.00 175.10 175.27 1vjf s LEU 117 N 0.22 2.31 0.20 3.92 2.96 -1.26 -1.26 118.68 125.77 1vjf s LEU 117 Ca -0.11 -0.54 -0.32 0.00 -0.22 0.00 0.00 54.13 52.94 1vjf s LEU 117 Cb -0.16 -1.51 -0.12 0.00 0.50 0.00 0.00 46.19 44.89 1vjf s LEU 117 CO 0.06 0.07 1.70 -0.67 -1.32 0.00 0.00 176.35 176.19 1vjf n ASP 118 N 4.15 3.83 -0.33 3.68 2.03 -0.32 -1.26 116.55 128.33 1vjf n ASP 118 Ca -0.20 1.06 0.13 0.00 0.52 0.00 0.00 54.79 56.31 1vjf n ASP 118 Cb 0.51 -1.55 0.35 0.00 -0.72 0.00 0.00 41.12 39.71 1vjf n ASP 118 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1vjf h LYS 119 N 6.62 0.71 0.00 -0.67 3.64 -1.32 -0.06 116.57 125.49 1vjf h LYS 119 Ca -0.43 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 58.85 1vjf h LYS 119 Cb 1.21 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1vjf h LYS 119 CO 0.94 0.47 -0.24 0.00 -2.27 0.00 0.00 179.45 178.36 1vjf h ALA 120 N 1.62 1.46 0.17 5.00 0.00 -1.90 -0.31 119.26 125.29 1vjf h ALA 120 Ca 0.54 -0.22 -0.32 0.00 0.00 0.00 0.00 54.91 54.91 1vjf h ALA 120 Cb 0.87 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1vjf h ALA 120 CO -0.31 0.30 -1.51 1.25 0.00 0.00 0.00 179.25 178.97 1vjf h LEU 121 N 0.00 0.56 -2.03 0.00 5.85 -1.48 -3.01 115.31 115.20 1vjf h LEU 121 Ca -0.00 -0.70 0.05 0.00 0.84 0.00 0.00 57.88 58.07 1vjf h LEU 121 Cb 0.46 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1vjf h LEU 121 CO 0.03 1.57 0.14 0.00 -0.34 0.00 0.00 178.44 179.84 1vjf h ALA 122 N 0.35 2.14 -0.93 1.25 0.00 -0.69 -2.22 119.26 119.16 1vjf h ALA 122 Ca -0.25 -0.01 -0.47 0.00 0.00 0.00 0.00 54.91 54.19 1vjf h ALA 122 Cb 2.07 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 19.59 1vjf h ALA 122 CO 0.20 -0.23 0.57 -0.25 0.00 0.00 0.00 179.25 179.53 1vjf n ASP 123 N -4.43 3.74 -4.48 0.00 8.00 -0.16 -4.92 116.55 114.30 1vjf n ASP 123 Ca 0.02 -3.59 -0.30 0.00 0.71 0.00 0.00 54.79 51.62 1vjf n ASP 123 Cb 0.28 -0.82 -0.12 0.00 -0.02 0.00 0.00 41.12 40.44 1vjf n ASP 123 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1vjf s SER 124 N -1.38 3.88 -0.22 -2.24 0.01 -0.84 -4.98 113.70 107.94 1vjf s SER 124 Ca 0.56 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 57.21 1vjf s SER 124 Cb 0.47 -0.59 0.08 0.00 0.21 0.00 0.00 66.02 66.19 1vjf s SER 124 CO 0.10 0.21 0.53 -0.62 0.41 0.00 0.00 173.24 173.87 1vjf s ASP 125 N -1.87 -0.69 1.04 2.44 -1.08 -1.26 -4.50 116.67 110.75 1vjf s ASP 125 Ca 0.17 1.19 -0.05 0.00 -0.52 0.00 0.00 52.55 53.34 1vjf s ASP 125 Cb -0.11 1.20 0.07 0.00 -1.46 0.00 0.00 42.92 42.62 1vjf s ASP 125 CO 0.08 -0.22 0.28 -0.81 0.52 0.00 0.00 175.17 175.03 1vjf n PRO 126 N 4.54 -1.17 -4.24 4.34 -0.04 -1.26 -4.53 135.00 132.64 1vjf n PRO 126 Ca -0.19 -0.45 -0.19 0.00 -0.04 0.00 0.00 63.50 62.63 1vjf n PRO 126 Cb 0.55 -0.38 -0.11 0.00 -0.04 0.00 0.00 33.50 33.52 1vjf n PRO 126 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1vjf s VAL 127 N -1.55 1.35 -0.04 0.52 -7.23 -0.31 -0.66 120.40 112.49 1vjf s VAL 127 Ca 0.18 -1.61 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 1vjf s VAL 127 Cb -0.01 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.49 1vjf s VAL 127 CO 0.13 -0.32 -0.08 0.20 -0.31 0.00 0.00 175.10 174.72 1vjf s ASN 128 N -2.23 1.16 0.11 4.85 0.01 -0.40 -1.39 114.94 117.05 1vjf s ASN 128 Ca 0.06 -0.18 -0.05 0.00 -0.71 0.00 0.00 52.86 51.98 1vjf s ASN 128 Cb -0.07 -0.44 -0.02 0.00 0.41 0.00 0.00 41.25 41.13 1vjf s ASN 128 CO 0.03 0.01 0.13 -0.36 -1.51 0.00 0.00 177.10 175.41 1vjf s PHE 129 N 0.53 0.45 0.25 2.20 0.40 -0.09 -3.68 117.98 118.04 1vjf s PHE 129 Ca -0.08 -0.88 -0.30 0.00 -0.60 0.00 0.00 56.93 55.07 1vjf s PHE 129 Cb -0.12 -0.23 -0.09 0.00 0.51 0.00 0.00 43.02 43.09 1vjf s PHE 129 CO 0.01 -0.54 1.11 -1.01 0.70 0.00 0.00 175.22 175.49 1vjf s HIS 130 N -3.94 3.56 -1.47 0.36 3.76 -1.26 -0.32 115.29 115.99 1vjf s HIS 130 Ca 0.12 1.65 -0.09 0.00 -0.15 0.00 0.00 55.06 56.59 1vjf s HIS 130 Cb 0.06 -3.30 0.03 0.00 1.11 0.00 0.00 32.58 30.47 1vjf s HIS 130 CO -0.05 -0.64 2.53 -0.35 -0.85 0.00 0.00 174.74 175.37 1vjf n PRO 131 N 1.59 3.80 -0.83 8.40 -0.04 -1.26 -4.54 135.00 142.11 1vjf n PRO 131 Ca 0.00 -2.81 0.00 0.00 -0.04 0.00 0.00 63.50 60.66 1vjf n PRO 131 Cb 0.45 -2.86 0.00 0.00 -0.04 0.00 0.00 33.50 31.05 1vjf n PRO 131 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1vjf n LEU 132 N 3.54 0.23 -3.70 1.53 4.77 -1.26 -4.54 117.00 117.56 1vjf n LEU 132 Ca 0.64 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.48 1vjf n LEU 132 Cb 0.28 -0.35 -0.08 0.00 -2.33 0.00 0.00 43.42 40.94 1vjf n LEU 132 CO 0.81 -0.11 0.13 -0.75 -1.33 0.00 0.00 177.39 176.14 1vjf s LYS 133 N -0.23 0.72 -0.02 3.23 2.20 -1.26 -4.64 119.74 119.73 1vjf s LYS 133 Ca 0.00 0.09 0.04 0.00 -0.36 0.00 0.00 55.97 55.73 1vjf s LYS 133 Cb 0.00 0.33 0.14 0.00 -1.51 0.00 0.00 37.83 36.79 1vjf s LYS 133 CO 0.00 -0.19 0.92 0.27 -0.36 0.00 0.00 175.35 176.00 1vjf n ASN 134 N 1.55 1.33 -1.79 1.43 0.23 -1.26 -3.52 115.26 113.23 1vjf n ASN 134 Ca -0.19 -2.09 -0.02 0.00 -0.53 0.00 0.00 54.58 51.75 1vjf n ASN 134 Cb 0.56 -0.31 0.28 0.00 -2.08 0.00 0.00 39.78 38.23 1vjf n ASN 134 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1vjf n ASP 135 N 0.02 4.55 -3.49 0.53 5.75 -1.26 -4.02 116.55 118.63 1vjf n ASP 135 Ca 0.05 -2.96 -0.09 0.00 -0.01 0.00 0.00 54.79 51.78 1vjf n ASP 135 Cb 0.27 -0.70 -0.02 0.00 -1.03 0.00 0.00 41.12 39.65 1vjf n ASP 135 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1vjf s ALA 136 N -2.57 -1.79 -0.04 2.12 0.00 -1.23 -1.46 121.76 116.78 1vjf s ALA 136 Ca 0.46 0.94 0.01 0.00 0.00 0.00 0.00 51.96 53.38 1vjf s ALA 136 Cb 0.37 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.98 1vjf s ALA 136 CO 0.12 -0.70 -0.06 0.99 0.00 0.00 0.00 175.76 176.11 1vjf s THR 137 N -3.19 0.66 -0.13 0.00 2.01 -0.22 -4.32 115.64 110.45 1vjf s THR 137 Ca 0.04 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.85 1vjf s THR 137 Cb -0.01 -0.65 0.00 0.00 0.01 0.00 0.00 72.50 71.85 1vjf s THR 137 CO -0.09 0.25 -0.20 -0.89 -0.69 0.00 0.00 174.62 172.99 1vjf s THR 138 N 0.76 2.35 -0.10 -0.82 2.01 0.57 -0.68 115.64 119.72 1vjf s THR 138 Ca -0.11 -0.90 -0.11 0.00 0.31 0.00 0.00 61.69 60.88 1vjf s THR 138 Cb -0.14 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.38 1vjf s THR 138 CO 0.01 0.54 0.25 0.00 -0.69 0.00 0.00 174.62 174.73 1vjf s ALA 139 N 0.61 3.75 0.12 7.40 0.00 0.74 -0.91 121.76 133.47 1vjf s ALA 139 Ca -0.11 -0.47 0.03 0.00 0.00 0.00 0.00 51.96 51.41 1vjf s ALA 139 Cb -0.16 -2.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 1vjf s ALA 139 CO 0.03 0.44 -0.08 0.14 0.00 0.00 0.00 175.76 176.29 1vjf s VAL 140 N -0.64 0.89 0.82 0.00 -7.23 -0.48 -1.77 120.40 111.98 1vjf s VAL 140 Ca 0.18 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.24 1vjf s VAL 140 Cb -0.14 -1.76 0.08 0.00 0.56 0.00 0.00 36.38 35.12 1vjf s VAL 140 CO 0.06 -0.81 1.10 -0.94 -0.31 0.00 0.00 175.10 174.20 1vjf s SER 141 N -3.10 4.31 0.17 4.85 1.04 -1.26 -1.16 113.70 118.55 1vjf s SER 141 Ca 0.14 1.32 -0.14 0.00 0.48 0.00 0.00 55.95 57.75 1vjf s SER 141 Cb 0.04 -2.04 0.10 0.00 0.10 0.00 0.00 66.02 64.22 1vjf s SER 141 CO -0.02 -2.09 1.78 -0.61 0.98 0.00 0.00 173.24 173.28 1vjf h GLN 142 N -1.17 0.45 -0.73 4.02 5.75 -1.89 0.23 115.11 121.76 1vjf h GLN 142 Ca -0.47 -0.03 0.03 0.00 -0.15 0.00 0.00 58.65 58.03 1vjf h GLN 142 Cb 1.27 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 29.68 1vjf h GLN 142 CO 0.59 0.29 0.48 0.00 -2.65 0.00 0.00 178.83 177.55 1vjf h ALA 143 N 1.24 1.56 -0.39 3.38 0.00 -1.93 -1.75 119.26 121.37 1vjf h ALA 143 Ca 0.20 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1vjf h ALA 143 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1vjf h ALA 143 CO -0.14 0.36 0.16 0.78 0.00 0.00 0.00 179.25 180.42 1vjf h GLY 144 N 0.90 0.62 0.65 0.00 0.00 -1.67 0.46 103.07 104.03 1vjf h GLY 144 Ca 0.29 -0.33 0.05 0.00 0.00 0.00 0.00 47.33 47.34 1vjf h GLY 144 CO -0.08 0.31 0.16 -2.00 0.00 0.00 0.00 176.54 174.93 1vjf h LEU 145 N 0.48 0.19 -0.81 3.11 5.85 -0.50 -0.06 115.31 123.58 1vjf h LEU 145 Ca 0.13 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1vjf h LEU 145 Cb 0.17 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1vjf h LEU 145 CO -0.01 0.14 0.05 0.03 -0.34 0.00 0.00 178.44 178.31 1vjf h ARG 146 N 0.34 0.94 -0.63 1.25 3.08 -0.95 -1.13 114.38 117.28 1vjf h ARG 146 Ca 0.20 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1vjf h ARG 146 Cb 0.17 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 1vjf h ARG 146 CO -0.19 0.90 0.34 -0.09 -1.07 0.00 0.00 179.97 179.86 1vjf h ARG 147 N 0.88 0.89 0.23 0.04 2.43 -0.53 0.17 114.38 118.49 1vjf h ARG 147 Ca 0.17 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1vjf h ARG 147 Cb 0.45 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1vjf h ARG 147 CO 0.02 0.68 -0.22 0.35 -1.51 0.00 0.00 179.97 179.29 1vjf h PHE 148 N 0.86 -0.57 -0.67 2.20 3.57 -0.65 -1.20 116.94 120.48 1vjf h PHE 148 Ca 0.22 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1vjf h PHE 148 Cb 0.06 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1vjf h PHE 148 CO -0.01 -0.32 0.44 -0.07 -2.23 0.00 0.00 178.31 176.12 1vjf h LEU 149 N -0.47 0.75 -0.85 0.59 3.38 -1.06 -2.49 115.31 115.16 1vjf h LEU 149 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vjf h LEU 149 Cb 0.44 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1vjf h LEU 149 CO -0.04 0.54 0.53 0.00 0.09 0.00 0.00 178.44 179.56 1vjf h ALA 150 N 1.26 1.08 0.00 1.53 0.00 -0.86 -0.17 119.26 122.10 1vjf h ALA 150 Ca 0.25 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1vjf h ALA 150 Cb -0.07 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.38 1vjf h ALA 150 CO -0.07 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.61 1vjf h ALA 151 N 1.29 1.20 -0.01 0.00 0.00 -0.78 -1.55 119.26 119.41 1vjf h ALA 151 Ca 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1vjf h ALA 151 Cb -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1vjf h ALA 151 CO -0.06 0.11 -0.42 1.28 0.00 0.00 0.00 179.25 180.16 1vjf n LEU 152 N -3.49 1.10 -1.01 0.00 4.77 -0.82 -4.95 117.00 112.61 1vjf n LEU 152 Ca -0.02 -0.32 -0.10 0.00 -0.03 0.00 0.00 56.01 55.54 1vjf n LEU 152 Cb 0.23 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 1vjf n LEU 152 CO 0.28 0.22 -0.12 0.61 -1.33 0.00 0.00 177.39 177.06 1vjf n GLY 153 N 1.40 0.24 3.51 -0.72 0.00 -0.58 -5.00 105.19 104.04 1vjf n GLY 153 Ca 0.09 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 1vjf n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vjf s VAL 154 N -2.45 5.23 -0.33 1.61 1.01 -0.14 -5.01 120.40 120.32 1vjf s VAL 154 Ca 0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 1vjf s VAL 154 Cb 0.00 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 1vjf s VAL 154 CO 0.00 -0.15 0.59 -0.70 0.00 0.00 0.00 175.10 174.84 1vjf s GLU 155 N 1.83 3.78 0.00 2.72 2.12 -1.26 -4.35 118.70 123.55 1vjf s GLU 155 Ca 0.08 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.52 1vjf s GLU 155 Cb -0.18 -3.76 0.00 0.00 0.26 0.00 0.00 34.13 30.45 1vjf s GLU 155 CO 0.11 -0.62 0.00 -0.35 -0.54 0.00 0.00 175.26 173.86 1vjf n PRO 156 N 5.86 3.40 -3.65 4.30 -0.04 -1.26 -4.67 135.00 138.94 1vjf n PRO 156 Ca -0.02 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.39 1vjf n PRO 156 Cb 0.49 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.89 1vjf n PRO 156 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1vjf s ILE 158 N 0.00 -0.46 -0.08 0.52 1.01 -1.26 -4.92 121.20 116.01 1vjf s ILE 158 Ca 0.00 0.02 0.04 0.00 0.00 0.00 0.00 60.65 60.70 1vjf s ILE 158 Cb 0.00 -0.96 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1vjf s ILE 158 CO 0.00 0.01 -0.21 -0.69 0.00 0.00 0.00 174.94 174.05 1vjf s VAL 159 N 2.22 1.78 -0.58 2.92 1.01 -0.39 -0.59 120.40 126.77 1vjf s VAL 159 Ca -0.08 -0.87 -0.23 0.00 0.00 0.00 0.00 61.98 60.80 1vjf s VAL 159 Cb -0.09 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.80 1vjf s VAL 159 CO -0.19 0.50 0.91 -0.62 0.00 0.00 0.00 175.10 175.70 1vjf s ASP 160 N 0.33 6.27 0.49 3.32 -1.08 0.15 -0.83 116.67 125.32 1vjf s ASP 160 Ca -0.15 -0.63 0.28 0.00 -0.52 0.00 0.00 52.55 51.53 1vjf s ASP 160 Cb -0.16 -2.41 0.87 0.00 -1.46 0.00 0.00 42.92 39.75 1vjf s ASP 160 CO 0.07 -1.26 1.80 -0.26 0.52 0.00 0.00 175.17 176.04 1vjf h PHE 161 N 9.36 0.00 -0.05 -5.34 0.04 -1.90 -2.22 116.94 116.83 1vjf h PHE 161 Ca -0.27 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.40 1vjf h PHE 161 Cb 1.07 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.23 1vjf h PHE 161 CO 0.91 0.04 -0.36 0.00 -0.60 0.00 0.00 178.31 178.30 1vjf h ALA 162 N 1.96 0.11 -3.00 2.45 0.00 -1.91 -3.46 119.26 115.40 1vjf h ALA 162 Ca -0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1vjf h ALA 162 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1vjf h ALA 162 CO 0.01 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.46 1vjf n ALA 163 N -2.52 0.00 0.00 0.00 0.00 -1.20 -5.19 120.51 111.59 1vjf n ALA 163 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1vjf n ALA 163 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1vjf n ALA 163 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1vjf n GLU 165 N -0.61 0.00 -2.93 0.00 1.02 -0.84 -5.07 120.64 112.22 1vjf n GLU 165 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 1vjf n GLU 165 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 1vjf n GLU 165 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1vjf s VAL 166 N -1.63 4.47 0.29 2.62 1.01 -1.26 -0.68 120.40 125.22 1vjf s VAL 166 Ca 0.00 1.76 0.02 0.00 0.00 0.00 0.00 61.98 63.76 1vjf s VAL 166 Cb 0.00 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 1vjf s VAL 166 CO 0.00 0.45 0.07 1.33 0.00 0.00 0.00 175.10 176.95 1vjf n VAL 167 N 2.10 0.00 0.00 2.92 0.24 0.24 -4.92 118.33 118.92 1vjf n VAL 167 Ca -0.03 -1.60 0.00 0.00 -2.04 0.00 0.00 64.34 60.67 1vjf n VAL 167 Cb 0.49 0.51 0.00 0.00 -1.47 0.00 0.00 33.84 33.37 1vjf n VAL 167 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30