#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fjv s LEU 3 N 0.00 2.22 0.36 -4.42 1.43 -1.26 -5.07 118.68 111.94 3fjv s LEU 3 Ca 0.00 -0.59 0.04 0.00 -1.03 0.00 0.00 54.13 52.54 3fjv s LEU 3 Cb 0.00 -0.97 -0.05 0.00 0.03 0.00 0.00 46.19 45.20 3fjv s LEU 3 CO 0.00 0.13 0.08 0.42 0.23 0.00 0.00 176.35 177.21 3fjv s THR 4 N -0.94 1.01 0.47 5.49 -4.23 -1.26 -5.00 115.64 111.19 3fjv s THR 4 Ca 0.08 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.76 3fjv s THR 4 Cb -0.09 -2.63 0.34 0.00 1.34 0.00 0.00 72.50 71.46 3fjv s THR 4 CO 0.03 0.00 2.00 0.03 -0.54 0.00 0.00 174.62 176.14 3fjv h ARG 5 N 1.98 0.25 0.00 3.99 3.08 -1.96 0.50 114.38 122.21 3fjv h ARG 5 Ca -0.39 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.64 3fjv h ARG 5 Cb 1.26 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.25 3fjv h ARG 5 CO 0.66 0.16 0.00 -0.25 -1.07 0.00 0.00 179.97 179.47 3fjv n ASP 6 N -4.45 0.20 0.02 7.04 8.00 -1.26 -2.58 116.55 123.52 3fjv n ASP 6 Ca 0.09 0.54 0.14 0.00 0.71 0.00 0.00 54.79 56.26 3fjv n ASP 6 Cb 0.42 -0.58 0.55 0.00 -0.02 0.00 0.00 41.12 41.49 3fjv n ASP 6 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3fjv n SER 7 N -1.71 0.20 -4.80 -2.24 7.64 0.17 -4.89 113.62 107.99 3fjv n SER 7 Ca 0.05 0.48 -0.32 0.00 1.01 0.00 0.00 58.87 60.08 3fjv n SER 7 Cb 0.26 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 62.88 3fjv n SER 7 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3fjv s LEU 8 N -3.32 3.95 0.60 -3.43 1.43 -1.07 -4.97 118.68 111.87 3fjv s LEU 8 Ca 0.13 0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 53.22 3fjv s LEU 8 Cb 0.18 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 3fjv s LEU 8 CO 0.55 0.24 1.07 -0.76 0.23 0.00 0.00 176.35 177.68 3fjv s LEU 9 N -1.94 3.49 0.96 1.79 1.43 -1.26 -5.05 118.68 118.09 3fjv s LEU 9 Ca 0.25 1.85 -0.12 0.00 -1.03 0.00 0.00 54.13 55.08 3fjv s LEU 9 Cb -0.12 -4.54 0.17 0.00 0.03 0.00 0.00 46.19 41.73 3fjv s LEU 9 CO 0.17 -1.23 1.10 0.42 0.23 0.00 0.00 176.35 177.04 3fjv s THR 10 N -2.43 2.25 0.21 5.49 -4.23 -1.26 -4.77 115.64 110.90 3fjv s THR 10 Ca 0.64 0.08 -0.09 0.00 -1.18 0.00 0.00 61.69 61.14 3fjv s THR 10 Cb -0.17 -2.60 0.15 0.00 1.34 0.00 0.00 72.50 71.22 3fjv s THR 10 CO 0.37 -0.11 1.83 -0.07 -0.54 0.00 0.00 174.62 176.11 3fjv h LEU 11 N -1.75 0.65 -0.28 4.79 3.38 -1.97 0.43 115.31 120.55 3fjv h LEU 11 Ca -0.53 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.45 3fjv h LEU 11 Cb 1.32 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3fjv h LEU 11 CO 0.57 0.43 0.13 -0.08 0.09 0.00 0.00 178.44 179.58 3fjv h GLU 12 N 0.78 0.41 -0.40 1.13 4.81 -1.99 -1.47 114.58 117.83 3fjv h GLU 12 Ca 0.29 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.33 3fjv h GLU 12 Cb 0.11 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3fjv h GLU 12 CO -0.14 0.40 -0.27 0.00 -0.73 0.00 0.00 179.01 178.26 3fjv h ALA 13 N 0.99 0.58 -0.59 2.92 0.00 -1.83 -2.89 119.26 118.43 3fjv h ALA 13 Ca 0.10 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 3fjv h ALA 13 Cb 0.13 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3fjv h ALA 13 CO -0.01 0.60 0.20 -0.92 0.00 0.00 0.00 179.25 179.12 3fjv h TYR 14 N 0.72 0.94 -0.57 0.00 3.20 -0.85 -2.88 116.97 117.53 3fjv h TYR 14 Ca 0.08 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 3fjv h TYR 14 Cb 0.85 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.82 3fjv h TYR 14 CO 0.06 0.77 0.35 0.00 -1.64 0.00 0.00 178.16 177.70 3fjv h ALA 15 N 1.06 1.55 0.00 1.82 0.00 -1.23 0.16 119.26 122.62 3fjv h ALA 15 Ca 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3fjv h ALA 15 Cb 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3fjv h ALA 15 CO -0.01 0.40 -0.17 0.87 0.00 0.00 0.00 179.25 180.34 3fjv h LYS 16 N 0.78 0.00 -0.24 0.00 1.57 -1.29 -3.12 116.57 114.26 3fjv h LYS 16 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3fjv h LYS 16 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3fjv h LYS 16 CO -0.04 0.17 0.00 1.33 -0.57 0.00 0.00 179.45 180.34 3fjv n VAL 17 N -4.30 0.66 -0.11 0.50 0.24 -0.03 -4.81 118.33 110.49 3fjv n VAL 17 Ca -0.02 -0.83 -0.08 0.00 -2.04 0.00 0.00 64.34 61.37 3fjv n VAL 17 Cb 0.24 0.75 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 3fjv n VAL 17 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3fjv h ARG 18 N 2.13 0.43 -0.71 7.34 2.43 -0.73 0.27 114.38 125.53 3fjv h ARG 18 Ca 0.00 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3fjv h ARG 18 Cb 0.65 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 3fjv h ARG 18 CO 0.00 0.29 0.26 0.00 -1.51 0.00 0.00 179.97 179.01 3fjv h ARG 19 N 0.45 1.09 -0.68 0.20 3.08 -1.87 -0.32 114.38 116.32 3fjv h ARG 19 Ca 0.14 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 3fjv h ARG 19 Cb -0.01 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 3fjv h ARG 19 CO -0.06 0.91 0.25 0.37 -1.07 0.00 0.00 179.97 180.37 3fjv h GLN 20 N 1.03 1.02 -0.52 0.04 4.15 -1.77 -3.00 115.11 116.07 3fjv h GLN 20 Ca 0.23 -0.18 -0.08 0.00 0.77 0.00 0.00 58.65 59.39 3fjv h GLN 20 Cb 0.25 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 3fjv h GLN 20 CO -0.01 0.85 -0.01 0.93 -1.93 0.00 0.00 178.83 178.66 3fjv h GLU 21 N 0.99 0.92 -0.30 1.69 4.39 -0.33 -0.50 114.58 121.45 3fjv h GLU 21 Ca 0.23 -0.30 0.06 0.00 0.34 0.00 0.00 59.36 59.69 3fjv h GLU 21 Cb 0.23 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 28.73 3fjv h GLU 21 CO -0.02 0.94 -0.11 0.45 -1.16 0.00 0.00 179.01 179.11 3fjv h HIS 22 N 0.79 -0.26 -0.46 4.33 3.86 -0.94 0.08 115.15 122.55 3fjv h HIS 22 Ca 0.15 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 3fjv h HIS 22 Cb 0.53 0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.15 3fjv h HIS 22 CO 0.04 -0.18 0.19 0.00 0.86 0.00 0.00 177.93 178.84 3fjv h ALA 23 N 1.21 0.59 -0.73 2.45 0.00 -1.41 -1.61 119.26 119.76 3fjv h ALA 23 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3fjv h ALA 23 Cb 0.29 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3fjv h ALA 23 CO -0.34 0.19 0.47 -0.09 0.00 0.00 0.00 179.25 179.47 3fjv h ARG 24 N 0.59 0.97 0.02 0.00 2.43 -0.71 -2.02 114.38 115.66 3fjv h ARG 24 Ca 0.15 -0.07 -0.26 0.00 -0.81 0.00 0.00 59.98 58.99 3fjv h ARG 24 Cb 0.17 -0.21 0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3fjv h ARG 24 CO -0.01 0.66 -1.03 0.28 -1.51 0.00 0.00 179.97 178.36 3fjv h VAL 25 N 0.99 1.30 -0.64 0.20 2.07 -0.92 -1.42 116.25 117.84 3fjv h VAL 25 Ca 0.26 -2.26 0.13 0.00 0.82 0.00 0.00 66.70 65.65 3fjv h VAL 25 Cb -0.08 2.46 -0.10 0.00 -1.52 0.00 0.00 31.29 32.05 3fjv h VAL 25 CO -0.05 0.69 0.06 0.40 0.02 0.00 0.00 177.57 178.69 3fjv h ILE 26 N 0.32 0.52 -0.37 4.57 2.04 -1.20 0.33 117.51 123.72 3fjv h ILE 26 Ca -0.13 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 3fjv h ILE 26 Cb 1.69 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 3fjv h ILE 26 CO 0.20 0.03 0.19 0.00 0.00 0.00 0.00 178.15 178.58 3fjv h ALA 27 N 1.56 0.47 -0.91 1.87 0.00 -1.21 -2.66 119.26 118.38 3fjv h ALA 27 Ca 0.34 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.20 3fjv h ALA 27 Cb 0.55 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3fjv h ALA 27 CO -0.50 0.01 0.59 1.25 0.00 0.00 0.00 179.25 180.60 3fjv h HIS 28 N 0.46 1.10 0.00 0.00 -0.00 -0.65 -2.69 115.15 113.38 3fjv h HIS 28 Ca 0.13 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 3fjv h HIS 28 Cb 0.08 -0.37 0.00 0.00 -0.00 0.00 0.00 27.41 27.12 3fjv h HIS 28 CO -0.02 0.63 0.00 0.87 -0.00 0.00 0.00 177.93 179.41 3fjv h LYS 29 N 1.14 0.00 0.00 5.26 1.57 -0.58 -0.86 116.57 123.09 3fjv h LYS 29 Ca 0.37 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.14 3fjv h LYS 29 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3fjv h LYS 29 CO -0.13 0.00 -0.01 0.87 -0.57 0.00 0.00 179.45 179.62 3fjv h LYS 30 N 0.00 0.00 -0.10 3.15 1.57 -1.43 -1.20 116.57 118.57 3fjv h LYS 30 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fjv h LYS 30 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3fjv h LYS 30 CO 0.00 0.01 0.00 0.54 -0.57 0.00 0.00 179.45 179.43 3fjv n ARG 31 N -3.67 1.88 0.00 3.15 1.74 -0.33 -4.46 116.66 114.97 3fjv n ARG 31 Ca -0.03 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.75 3fjv n ARG 31 Cb 0.09 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 3fjv n ARG 31 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3fjv n ARG 32 N 0.55 3.35 -3.94 5.56 5.12 -0.53 -4.38 116.66 122.38 3fjv n ARG 32 Ca 0.17 0.00 -0.37 0.00 -1.93 0.00 0.00 57.85 55.73 3fjv n ARG 32 Cb 0.42 -0.66 -0.07 0.00 -1.16 0.00 0.00 32.46 30.99 3fjv n ARG 32 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3fjv s ALA 33 N -1.22 3.79 0.02 7.54 0.00 -0.71 -1.23 121.76 129.94 3fjv s ALA 33 Ca 0.00 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.32 3fjv s ALA 33 Cb 0.00 -1.91 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 3fjv s ALA 33 CO 0.00 0.60 -0.07 0.14 0.00 0.00 0.00 175.76 176.43 3fjv s VAL 34 N -0.95 0.54 0.07 0.00 -7.23 -0.26 -5.00 120.40 107.57 3fjv s VAL 34 Ca 0.14 -0.60 -0.03 0.00 -1.81 0.00 0.00 61.98 59.68 3fjv s VAL 34 Cb -0.12 -0.51 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 3fjv s VAL 34 CO 0.04 -0.06 0.28 -0.44 -0.31 0.00 0.00 175.10 174.61 3fjv s SER 35 N -0.72 6.44 -0.31 4.85 0.01 -1.26 -0.46 113.70 122.25 3fjv s SER 35 Ca -0.02 0.46 -0.00 0.00 1.31 0.00 0.00 55.95 57.70 3fjv s SER 35 Cb -0.05 -2.04 0.10 0.00 0.21 0.00 0.00 66.02 64.23 3fjv s SER 35 CO 0.00 0.15 0.08 -0.63 0.41 0.00 0.00 173.24 173.25 3fjv s ILE 36 N -1.50 1.13 0.00 1.44 1.01 0.21 -4.95 121.20 118.54 3fjv s ILE 36 Ca 0.35 -1.50 0.00 0.00 0.00 0.00 0.00 60.65 59.49 3fjv s ILE 36 Cb -0.13 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.53 3fjv s ILE 36 CO 0.23 -0.61 0.00 0.61 0.00 0.00 0.00 174.94 175.18 3fjv n GLY 37 N 4.75 0.24 0.05 6.18 0.00 -1.26 -3.05 105.19 112.09 3fjv n GLY 37 Ca -0.02 -0.92 0.12 0.00 0.00 0.00 0.00 46.02 45.19 3fjv n GLY 37 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fjv n ASN 38 N -1.82 0.64 0.00 1.61 3.02 -1.26 -4.53 115.26 112.92 3fjv n ASN 38 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 3fjv n ASN 38 Cb 0.00 0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 3fjv n ASN 38 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3fjv n HIS 39 N -2.00 0.00 -4.66 3.10 8.25 -1.26 -4.96 115.22 113.70 3fjv n HIS 39 Ca 0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.15 3fjv n HIS 39 Cb 0.43 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.42 3fjv n HIS 39 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3fjv s LEU 40 N -0.78 3.02 -0.05 2.41 1.02 -1.17 -0.88 118.68 122.25 3fjv s LEU 40 Ca 0.00 -0.14 0.02 0.00 0.02 0.00 0.00 54.13 54.04 3fjv s LEU 40 Cb 0.00 -1.67 0.01 0.00 0.02 0.00 0.00 46.19 44.55 3fjv s LEU 40 CO 0.00 0.28 -0.10 -0.13 0.02 0.00 0.00 176.35 176.42 3fjv s ARG 41 N -0.32 1.35 -0.08 1.70 1.81 -0.30 -0.61 118.95 122.51 3fjv s ARG 41 Ca 0.04 -0.34 0.03 0.00 -1.72 0.00 0.00 55.73 53.74 3fjv s ARG 41 Cb -0.13 -1.18 -0.02 0.00 -0.45 0.00 0.00 34.95 33.18 3fjv s ARG 41 CO 0.02 0.04 -0.16 -0.51 -0.68 0.00 0.00 175.30 174.02 3fjv s LEU 42 N 0.56 2.59 -0.25 2.53 1.43 0.39 -0.78 118.68 125.15 3fjv s LEU 42 Ca -0.11 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.67 3fjv s LEU 42 Cb -0.14 -1.54 0.03 0.00 0.03 0.00 0.00 46.19 44.57 3fjv s LEU 42 CO 0.02 0.25 -0.06 -0.22 0.23 0.00 0.00 176.35 176.57 3fjv s LEU 43 N -0.19 3.18 -0.11 1.79 2.96 -0.15 -1.10 118.68 125.05 3fjv s LEU 43 Ca -0.00 -0.88 -0.30 0.00 -0.22 0.00 0.00 54.13 52.73 3fjv s LEU 43 Cb -0.13 -1.66 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 3fjv s LEU 43 CO 0.03 -0.13 1.25 -0.36 -1.32 0.00 0.00 176.35 175.83 3fjv s PHE 44 N 1.32 2.97 0.05 5.38 0.08 -0.37 -1.17 117.98 126.24 3fjv s PHE 44 Ca 0.00 1.06 -0.18 0.00 0.12 0.00 0.00 56.93 57.93 3fjv s PHE 44 Cb -0.17 -3.49 -0.06 0.00 -0.57 0.00 0.00 43.02 38.73 3fjv s PHE 44 CO -0.05 -1.63 0.53 -1.21 -0.10 0.00 0.00 175.22 172.77 3fjv s GLU 45 N 2.92 4.14 0.08 0.44 0.41 0.34 -4.84 118.70 122.18 3fjv s GLU 45 Ca 0.56 0.66 0.01 0.00 -0.41 0.00 0.00 54.97 55.79 3fjv s GLU 45 Cb -0.24 -3.24 -0.00 0.00 -1.78 0.00 0.00 34.13 28.87 3fjv s GLU 45 CO 0.19 0.65 0.08 -0.40 -0.49 0.00 0.00 175.26 175.28 3fjv n ASP 46 N 1.77 -0.21 -0.23 -0.19 5.68 -1.26 -4.60 116.55 117.50 3fjv n ASP 46 Ca -0.11 -1.49 0.01 0.00 -0.50 0.00 0.00 54.79 52.70 3fjv n ASP 46 Cb 0.51 0.45 0.13 0.00 -1.14 0.00 0.00 41.12 41.07 3fjv n ASP 46 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3fjv h GLU 47 N 0.00 0.51 0.03 0.11 4.81 -1.98 -0.83 114.58 117.23 3fjv h GLU 47 Ca -0.06 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3fjv h GLU 47 Cb 0.28 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3fjv h GLU 47 CO 0.08 0.34 -0.01 1.15 -0.73 0.00 0.00 179.01 179.84 3fjv h THR 48 N 0.53 1.06 -0.35 0.32 2.02 -1.99 -0.85 112.91 113.65 3fjv h THR 48 Ca 0.34 -0.27 -0.11 0.00 0.77 0.00 0.00 66.41 67.14 3fjv h THR 48 Cb 0.38 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 3fjv h THR 48 CO -0.29 0.07 -0.22 0.71 0.37 0.00 0.00 175.52 176.17 3fjv h THR 49 N -0.15 1.27 0.00 3.16 1.35 -1.89 -2.75 112.91 113.89 3fjv h THR 49 Ca -0.00 -1.29 -0.03 0.00 -0.55 0.00 0.00 66.41 64.53 3fjv h THR 49 Cb 0.14 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 3fjv h THR 49 CO 0.01 0.43 -0.14 0.40 -0.25 0.00 0.00 175.52 175.97 3fjv h ILE 50 N 0.60 1.60 -0.80 6.82 2.04 -1.09 -2.58 117.51 124.09 3fjv h ILE 50 Ca 0.09 -1.94 0.12 0.00 1.00 0.00 0.00 64.86 64.13 3fjv h ILE 50 Cb 0.69 2.86 -0.08 0.00 -0.74 0.00 0.00 36.82 39.55 3fjv h ILE 50 CO 0.05 0.52 0.41 -0.09 0.00 0.00 0.00 178.15 179.04 3fjv h ARG 51 N -0.65 0.62 -0.15 2.37 2.43 -1.22 -1.01 114.38 116.78 3fjv h ARG 51 Ca -0.02 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3fjv h ARG 51 Cb 0.92 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.32 3fjv h ARG 51 CO 0.03 0.41 0.09 -0.92 -1.51 0.00 0.00 179.97 178.07 3fjv h TYR 52 N 0.64 0.20 -0.79 2.20 3.20 -1.55 0.46 116.97 121.33 3fjv h TYR 52 Ca 0.41 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.29 3fjv h TYR 52 Cb 0.51 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 3fjv h TYR 52 CO -0.09 0.18 0.51 1.96 -1.64 0.00 0.00 178.16 179.07 3fjv h GLN 53 N 0.17 1.05 -0.23 1.82 4.20 -0.90 0.93 115.11 122.15 3fjv h GLN 53 Ca 0.05 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3fjv h GLN 53 Cb 0.04 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 3fjv h GLN 53 CO -0.01 0.71 0.09 0.82 -0.67 0.00 0.00 178.83 179.77 3fjv h ILE 54 N 1.08 1.18 -0.70 2.54 2.04 -1.00 -2.86 117.51 119.79 3fjv h ILE 54 Ca 0.29 -0.54 0.08 0.00 1.00 0.00 0.00 64.86 65.68 3fjv h ILE 54 Cb -0.10 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 3fjv h ILE 54 CO -0.06 0.18 0.37 0.45 0.00 0.00 0.00 178.15 179.09 3fjv h HIS 55 N 0.22 0.68 0.00 1.37 3.86 -0.46 -1.01 115.15 119.81 3fjv h HIS 55 Ca 0.08 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 3fjv h HIS 55 Cb 0.19 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3fjv h HIS 55 CO -0.01 0.29 0.00 0.39 0.86 0.00 0.00 177.93 179.46 3fjv n GLU 56 N -4.81 0.17 0.00 2.45 -0.58 0.28 -0.66 120.64 117.48 3fjv n GLU 56 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 3fjv n GLU 56 Cb 0.22 -1.15 0.00 0.00 -0.57 0.00 0.00 31.44 29.95 3fjv n GLU 56 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3fjv n LEU 58 N 0.51 0.00 0.00 -4.62 4.77 -0.38 -1.41 117.00 115.87 3fjv n LEU 58 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 3fjv n LEU 58 Cb 0.05 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 3fjv n LEU 58 CO 0.00 0.00 0.81 -0.74 -1.33 0.00 0.00 177.39 176.13 3fjv h HIS 59 N 0.00 0.08 -0.31 -1.77 2.76 -1.13 0.18 115.15 114.95 3fjv h HIS 59 Ca 0.00 -0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.04 3fjv h HIS 59 Cb 0.00 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 3fjv h HIS 59 CO 0.00 0.21 -0.29 0.82 -1.30 0.00 0.00 177.93 177.37 3fjv h ILE 60 N -0.08 1.29 -0.00 6.26 2.04 -1.49 -2.76 117.51 122.78 3fjv h ILE 60 Ca 0.02 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.42 3fjv h ILE 60 Cb 0.17 1.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 3fjv h ILE 60 CO -0.00 0.47 -0.10 -0.62 0.00 0.00 0.00 178.15 177.90 3fjv n GLU 61 N -4.23 0.66 -3.82 2.37 -0.58 -1.22 -4.97 120.64 108.85 3fjv n GLU 61 Ca -0.03 -0.21 -0.34 0.00 -0.42 0.00 0.00 57.16 56.16 3fjv n GLU 61 Cb 0.48 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.88 3fjv n GLU 61 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3fjv n LYS 62 N -0.99 -1.39 -3.65 3.49 5.02 0.49 -4.98 118.16 116.15 3fjv n LYS 62 Ca 0.14 0.36 -0.38 0.00 -2.02 0.00 0.00 58.31 56.42 3fjv n LYS 62 Cb 0.27 -3.87 -0.12 0.00 -0.02 0.00 0.00 35.03 31.30 3fjv n LYS 62 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3fjv s ILE 63 N -3.58 4.92 0.00 -0.18 1.01 -0.42 -4.94 121.20 118.01 3fjv s ILE 63 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 60.65 61.04 3fjv s ILE 63 Cb -0.16 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 38.96 3fjv s ILE 63 CO 0.89 0.26 0.35 2.22 0.00 0.00 0.00 174.94 178.66 3fjv n PHE 64 N 5.01 0.00 -3.21 3.97 -1.74 -1.26 -4.83 117.46 115.40 3fjv n PHE 64 Ca -0.15 -0.03 -0.29 0.00 -0.56 0.00 0.00 57.45 56.43 3fjv n PHE 64 Cb 0.52 -0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.48 3fjv n PHE 64 CO 0.00 0.00 0.00 0.16 -0.56 0.00 0.00 176.76 176.36 3fjv s ASP 65 N -0.06 6.45 0.13 5.98 -4.77 -1.26 -4.94 116.67 118.19 3fjv s ASP 65 Ca 0.00 0.80 -0.14 0.00 -3.30 0.00 0.00 52.55 49.91 3fjv s ASP 65 Cb 0.00 -2.18 -0.02 0.00 -1.09 0.00 0.00 42.92 39.64 3fjv s ASP 65 CO 0.00 -0.26 1.56 -0.08 0.70 0.00 0.00 175.17 177.09 3fjv h GLU 66 N 1.49 0.77 -0.49 2.11 4.81 -1.99 0.08 114.58 121.37 3fjv h GLU 66 Ca -0.48 -0.27 -0.10 0.00 -0.13 0.00 0.00 59.36 58.39 3fjv h GLU 66 Cb 1.19 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 3fjv h GLU 66 CO 0.65 0.87 -0.08 -0.44 -0.73 0.00 0.00 179.01 179.28 3fjv h ASP 67 N 0.60 0.86 -0.33 1.04 3.32 -1.99 -1.30 116.42 118.62 3fjv h ASP 67 Ca 0.11 -0.26 -0.12 0.00 0.02 0.00 0.00 57.03 56.79 3fjv h ASP 67 Cb 0.55 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3fjv h ASP 67 CO 0.03 0.97 -0.25 1.23 -1.72 0.00 0.00 179.24 179.50 3fjv h GLY 68 N 0.98 0.82 0.86 2.75 0.00 -1.86 -0.79 103.07 105.82 3fjv h GLY 68 Ca 0.14 -0.80 0.02 0.00 0.00 0.00 0.00 47.33 46.69 3fjv h GLY 68 CO 0.04 0.72 0.06 -2.22 0.00 0.00 0.00 176.54 175.14 3fjv h ILE 69 N 0.53 0.96 -0.70 2.60 2.04 -0.94 -2.75 117.51 119.24 3fjv h ILE 69 Ca 0.06 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3fjv h ILE 69 Cb 0.81 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 3fjv h ILE 69 CO 0.07 0.03 0.44 -0.61 0.00 0.00 0.00 178.15 178.08 3fjv h GLN 70 N 0.14 0.93 -0.35 2.37 5.75 -1.04 -1.70 115.11 121.21 3fjv h GLN 70 Ca 0.07 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.45 3fjv h GLN 70 Cb 0.05 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 3fjv h GLN 70 CO -0.08 0.63 -0.04 0.00 -2.65 0.00 0.00 178.83 176.70 3fjv h ALA 71 N 1.53 1.29 -0.15 3.38 0.00 -1.01 -0.38 119.26 123.92 3fjv h ALA 71 Ca 0.25 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 3fjv h ALA 71 Cb -0.08 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.57 3fjv h ALA 71 CO -0.05 0.48 -0.67 0.93 0.00 0.00 0.00 179.25 179.94 3fjv h GLU 72 N 0.53 0.71 -0.72 0.00 4.39 -1.04 -1.07 114.58 117.38 3fjv h GLU 72 Ca 0.11 -0.57 0.12 0.00 0.34 0.00 0.00 59.36 59.36 3fjv h GLU 72 Cb 0.40 0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.08 3fjv h GLU 72 CO 0.02 1.18 0.31 -0.07 -1.16 0.00 0.00 179.01 179.29 3fjv h LEU 73 N 0.40 0.34 -0.48 1.33 3.38 -1.00 -1.98 115.31 117.31 3fjv h LEU 73 Ca -0.04 0.09 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 3fjv h LEU 73 Cb 1.30 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 3fjv h LEU 73 CO 0.14 0.17 -0.74 0.44 0.09 0.00 0.00 178.44 178.54 3fjv h ASP 74 N 0.50 0.25 -0.15 -0.43 3.32 -1.03 -1.80 116.42 117.08 3fjv h ASP 74 Ca 0.38 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3fjv h ASP 74 Cb 0.49 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3fjv h ASP 74 CO -0.34 0.89 -0.14 0.00 -1.72 0.00 0.00 179.24 177.94 3fjv h ALA 75 N 1.10 1.20 -0.01 3.45 0.00 -0.66 -3.00 119.26 121.33 3fjv h ALA 75 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3fjv h ALA 75 Cb 1.30 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3fjv h ALA 75 CO 0.11 0.52 -0.29 0.66 0.00 0.00 0.00 179.25 180.25 3fjv n TYR 76 N -4.19 0.00 -0.31 0.00 4.01 -0.79 -4.40 117.16 111.48 3fjv n TYR 76 Ca 0.01 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.90 3fjv n TYR 76 Cb 0.34 -0.13 0.40 0.00 -0.31 0.00 0.00 39.34 39.63 3fjv n TYR 76 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3fjv h LEU 77 N 1.10 0.63 -1.92 7.72 5.85 -1.18 -0.84 115.31 126.67 3fjv h LEU 77 Ca 0.00 0.07 0.21 0.00 0.84 0.00 0.00 57.88 59.00 3fjv h LEU 77 Cb 0.51 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 3fjv h LEU 77 CO 0.00 0.25 0.61 -0.65 -0.34 0.00 0.00 178.44 178.31 3fjv h PRO 78 N 0.63 0.00 -0.00 5.25 0.11 -1.79 -1.46 132.00 134.73 3fjv h PRO 78 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 3fjv h PRO 78 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3fjv h PRO 78 CO -0.28 0.00 -0.03 1.28 -0.21 0.00 0.00 178.00 178.75 3fjv n LEU 79 N -3.96 0.05 -4.64 2.35 4.77 -0.32 -4.85 117.00 110.40 3fjv n LEU 79 Ca 0.15 0.40 -0.43 0.00 -0.03 0.00 0.00 56.01 56.10 3fjv n LEU 79 Cb 0.87 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 3fjv n LEU 79 CO 0.33 0.01 1.01 -0.69 -1.33 0.00 0.00 177.39 176.73 3fjv s VAL 80 N -2.89 4.40 0.51 4.08 1.01 -0.55 -4.64 120.40 122.32 3fjv s VAL 80 Ca 0.18 1.62 -0.22 0.00 0.00 0.00 0.00 61.98 63.56 3fjv s VAL 80 Cb 0.19 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.21 3fjv s VAL 80 CO 0.52 -0.43 1.24 -2.16 0.00 0.00 0.00 175.10 174.28 3fjv s PRO 81 N 3.75 3.40 0.00 2.72 0.04 -1.26 -4.94 135.00 138.71 3fjv s PRO 81 Ca 0.49 1.95 0.03 0.00 0.04 0.00 0.00 61.00 63.52 3fjv s PRO 81 Cb -0.14 -2.27 0.04 0.00 0.04 0.00 0.00 34.50 32.17 3fjv s PRO 81 CO 0.17 -0.89 0.74 -0.40 0.04 0.00 0.00 177.00 176.65 3fjv n ASP 82 N -0.87 1.56 0.00 6.66 5.68 -1.26 -4.99 116.55 123.34 3fjv n ASP 82 Ca 0.09 -1.38 0.00 0.00 -0.50 0.00 0.00 54.79 53.01 3fjv n ASP 82 Cb 0.47 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 3fjv n ASP 82 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3fjv n GLY 83 N 0.08 3.13 0.00 6.12 0.00 -1.26 -4.89 105.19 108.38 3fjv n GLY 83 Ca 0.02 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3fjv n GLY 83 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3fjv n SER 84 N 0.00 1.35 -3.91 1.61 7.64 -1.26 -1.03 113.62 118.01 3fjv n SER 84 Ca 0.00 -1.62 -0.18 0.00 1.01 0.00 0.00 58.87 58.08 3fjv n SER 84 Cb 0.00 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.04 3fjv n SER 84 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3fjv s ASN 85 N -0.62 0.76 0.06 6.43 0.01 -1.26 -0.37 114.94 119.95 3fjv s ASN 85 Ca 0.00 -0.10 -0.15 0.00 -0.71 0.00 0.00 52.86 51.90 3fjv s ASN 85 Cb 0.00 -0.28 -0.06 0.00 0.41 0.00 0.00 41.25 41.31 3fjv s ASN 85 CO 0.00 -0.02 0.46 -0.76 -1.51 0.00 0.00 177.10 175.28 3fjv s LEU 86 N 0.56 4.43 -0.04 0.60 1.43 -0.37 -3.98 118.68 121.31 3fjv s LEU 86 Ca -0.07 1.01 0.06 0.00 -1.03 0.00 0.00 54.13 54.10 3fjv s LEU 86 Cb -0.10 -2.85 -0.02 0.00 0.03 0.00 0.00 46.19 43.25 3fjv s LEU 86 CO -0.00 0.24 -0.21 -0.54 0.23 0.00 0.00 176.35 176.07 3fjv s LYS 87 N -1.42 2.33 -0.04 1.70 -0.14 -1.26 -0.12 119.74 120.79 3fjv s LYS 87 Ca 0.29 -0.83 -0.07 0.00 -1.36 0.00 0.00 55.97 54.01 3fjv s LYS 87 Cb -0.16 -2.20 0.01 0.00 -1.68 0.00 0.00 37.83 33.80 3fjv s LYS 87 CO 0.16 0.57 0.17 0.00 -0.76 0.00 0.00 175.35 175.49 3fjv s ALA 88 N -0.61 -0.42 -0.22 5.17 0.00 -0.52 -0.51 121.76 124.65 3fjv s ALA 88 Ca 0.09 0.26 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 3fjv s ALA 88 Cb -0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 3fjv s ALA 88 CO 0.00 -0.14 0.42 0.99 0.00 0.00 0.00 175.76 177.03 3fjv s THR 89 N -0.53 5.17 -0.19 0.00 2.01 -0.32 0.05 115.64 121.83 3fjv s THR 89 Ca -0.06 0.73 -0.10 0.00 0.31 0.00 0.00 61.69 62.57 3fjv s THR 89 Cb -0.04 -3.75 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 3fjv s THR 89 CO 0.01 0.21 0.13 -0.22 -0.69 0.00 0.00 174.62 174.05 3fjv s LEU 90 N 1.60 4.19 -0.05 4.42 2.96 -0.15 -0.98 118.68 130.68 3fjv s LEU 90 Ca 0.19 0.24 0.05 0.00 -0.22 0.00 0.00 54.13 54.39 3fjv s LEU 90 Cb -0.15 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 3fjv s LEU 90 CO 0.09 0.20 -0.21 -1.10 -1.32 0.00 0.00 176.35 174.01 3fjv s GLN 91 N 0.26 2.06 -0.23 1.98 -0.21 0.04 -1.10 119.66 122.46 3fjv s GLN 91 Ca 0.08 -0.74 -0.06 0.00 0.02 0.00 0.00 55.36 54.66 3fjv s GLN 91 Cb -0.11 -1.79 -0.02 0.00 1.00 0.00 0.00 33.01 32.08 3fjv s GLN 91 CO -0.01 0.32 0.03 0.42 -2.12 0.00 0.00 175.29 173.92 3fjv s ILE 92 N -0.10 4.06 -0.13 1.08 1.01 0.19 -1.14 121.20 126.16 3fjv s ILE 92 Ca -0.02 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.38 3fjv s ILE 92 Cb -0.12 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.50 3fjv s ILE 92 CO 0.02 0.38 -0.16 -1.61 0.00 0.00 0.00 174.94 173.58 3fjv s GLU 93 N 1.37 2.40 0.13 2.79 2.02 -0.05 -4.79 118.70 122.57 3fjv s GLU 93 Ca 0.05 -0.62 0.07 0.00 0.02 0.00 0.00 54.97 54.49 3fjv s GLU 93 Cb -0.15 -2.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 3fjv s GLU 93 CO 0.02 -0.13 -0.16 0.71 0.02 0.00 0.00 175.26 175.71 3fjv s TYR 94 N 1.17 1.58 0.40 1.61 1.51 -1.26 -4.66 117.35 117.70 3fjv s TYR 94 Ca -0.01 -0.51 0.19 0.00 -1.01 0.00 0.00 57.07 55.73 3fjv s TYR 94 Cb -0.14 -0.82 1.09 0.00 -0.11 0.00 0.00 41.96 41.99 3fjv s TYR 94 CO -0.06 0.21 1.97 0.93 -1.11 0.00 0.00 175.55 177.49 3fjv h GLU 95 N 3.52 0.00 -3.72 -0.62 5.08 -2.00 -3.45 114.58 113.39 3fjv h GLU 95 Ca -0.41 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.87 3fjv h GLU 95 Cb 1.20 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.34 3fjv h GLU 95 CO 0.49 0.21 -0.19 0.54 -1.00 0.00 0.00 179.01 179.06 3fjv s ASN 96 N -6.63 -0.06 0.15 1.42 2.20 -1.26 -5.03 114.94 105.71 3fjv s ASN 96 Ca -0.03 -0.85 -0.18 0.00 -0.94 0.00 0.00 52.86 50.86 3fjv s ASN 96 Cb 0.14 0.52 0.04 0.00 -2.00 0.00 0.00 41.25 39.95 3fjv s ASN 96 CO 0.66 -1.02 1.71 1.05 -2.94 0.00 0.00 177.10 176.55 3fjv h GLU 97 N 2.36 0.07 -0.48 3.55 -0.00 -1.98 0.40 114.58 118.50 3fjv h GLU 97 Ca -0.29 -0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 58.94 3fjv h GLU 97 Cb 1.24 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.97 3fjv h GLU 97 CO 0.41 0.04 -0.21 1.15 -0.00 0.00 0.00 179.01 180.40 3fjv h THR 98 N 0.07 1.27 0.04 -1.06 2.02 -1.98 0.33 112.91 113.60 3fjv h THR 98 Ca 0.14 -1.38 -0.00 0.00 0.77 0.00 0.00 66.41 65.94 3fjv h THR 98 Cb 0.20 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 3fjv h THR 98 CO -0.25 0.48 -0.02 -0.61 0.37 0.00 0.00 175.52 175.48 3fjv h GLN 99 N 0.85 -0.05 0.53 6.66 5.75 -1.85 0.63 115.11 127.63 3fjv h GLN 99 Ca 0.11 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.59 3fjv h GLN 99 Cb 0.79 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.35 3fjv h GLN 99 CO 0.07 0.11 -0.30 0.00 -2.65 0.00 0.00 178.83 176.06 3fjv h ARG 100 N -0.21 -0.75 -0.50 1.69 -0.00 -0.11 0.33 114.38 114.83 3fjv h ARG 100 Ca -0.01 0.05 0.10 0.00 -0.50 0.00 0.00 59.98 59.63 3fjv h ARG 100 Cb 0.19 0.17 -0.10 0.00 0.00 0.00 0.00 29.97 30.23 3fjv h ARG 100 CO 0.01 -0.50 -0.14 -0.09 0.00 0.00 0.00 179.97 179.25 3fjv h ARG 101 N -0.78 -0.02 -0.60 0.04 2.43 -0.33 0.14 114.38 115.27 3fjv h ARG 101 Ca -0.06 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 3fjv h ARG 101 Cb 0.62 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 3fjv h ARG 101 CO 0.08 -0.01 0.27 0.00 -1.51 0.00 0.00 179.97 178.80 3fjv h ALA 102 N 1.47 0.77 -0.29 2.80 0.00 -0.63 -3.06 119.26 120.31 3fjv h ALA 102 Ca 0.24 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3fjv h ALA 102 Cb 0.38 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3fjv h ALA 102 CO -0.53 0.35 0.19 0.00 0.00 0.00 0.00 179.25 179.26 3fjv h ALA 103 N 1.11 0.37 -0.61 0.00 0.00 0.15 -1.85 119.26 118.42 3fjv h ALA 103 Ca 0.20 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3fjv h ALA 103 Cb 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3fjv h ALA 103 CO -0.02 -0.18 0.41 -0.07 0.00 0.00 0.00 179.25 179.39 3fjv h LEU 104 N 0.38 0.62 -0.03 0.00 3.38 -0.77 0.22 115.31 119.12 3fjv h LEU 104 Ca 0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3fjv h LEU 104 Cb -0.03 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3fjv h LEU 104 CO -0.03 0.43 -0.01 0.00 0.09 0.00 0.00 178.44 178.92 3fjv h ALA 105 N 1.64 0.04 -0.13 1.53 0.00 -1.40 -2.84 119.26 118.10 3fjv h ALA 105 Ca 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3fjv h ALA 105 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3fjv h ALA 105 CO -0.07 -0.25 -0.06 -0.09 0.00 0.00 0.00 179.25 178.78 3fjv h ARG 106 N -0.31 0.20 -0.64 0.00 2.43 -0.71 -2.88 114.38 112.46 3fjv h ARG 106 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3fjv h ARG 106 Cb 0.41 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3fjv h ARG 106 CO 0.00 0.27 0.00 1.28 -1.51 0.00 0.00 179.97 180.02 3fjv n LEU 107 N -4.36 3.91 -4.58 3.80 4.77 0.73 -4.79 117.00 116.49 3fjv n LEU 107 Ca -0.01 -1.97 -0.50 0.00 -0.03 0.00 0.00 56.01 53.50 3fjv n LEU 107 Cb 0.20 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 3fjv n LEU 107 CO 0.37 0.77 0.78 0.55 -1.33 0.00 0.00 177.39 178.53 3fjv n VAL 108 N 1.13 0.53 -0.93 4.08 3.14 -1.08 -0.80 118.33 124.41 3fjv n VAL 108 Ca 0.22 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.47 3fjv n VAL 108 Cb 0.69 -0.80 0.00 0.00 -1.06 0.00 0.00 33.84 32.68 3fjv n VAL 108 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3fjv n GLY 109 N 2.20 0.83 0.31 7.55 0.00 -1.26 -4.91 105.19 109.90 3fjv n GLY 109 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 3fjv n GLY 109 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fjv h ILE 110 N 0.00 1.06 0.00 -0.61 2.10 -1.37 -2.07 117.51 116.62 3fjv h ILE 110 Ca 0.00 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 65.78 3fjv h ILE 110 Cb 0.00 0.55 0.00 0.00 -1.09 0.00 0.00 36.82 36.28 3fjv h ILE 110 CO 0.00 0.08 0.03 1.05 -1.08 0.00 0.00 178.15 178.24 3fjv h GLU 111 N 0.46 0.00 -0.00 2.19 9.09 -1.91 -0.46 114.58 123.95 3fjv h GLU 111 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.56 3fjv h GLU 111 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 3fjv h GLU 111 CO -0.04 0.00 -0.44 -0.25 0.05 0.00 0.00 179.01 178.33 3fjv n ASP 112 N -3.06 0.63 -0.44 3.06 8.00 -0.78 -4.36 116.55 119.61 3fjv n ASP 112 Ca -0.03 -0.41 0.05 0.00 0.71 0.00 0.00 54.79 55.10 3fjv n ASP 112 Cb 0.10 0.23 0.08 0.00 -0.02 0.00 0.00 41.12 41.51 3fjv n ASP 112 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3fjv n ARG 113 N -1.29 1.54 -3.00 -1.24 5.12 -0.19 -4.60 116.66 113.01 3fjv n ARG 113 Ca 0.07 -1.48 -0.40 0.00 -1.93 0.00 0.00 57.85 54.11 3fjv n ARG 113 Cb 0.34 -1.19 -0.04 0.00 -1.16 0.00 0.00 32.46 30.40 3fjv n ARG 113 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3fjv s VAL 114 N -0.87 5.01 0.06 1.55 1.01 -1.21 -2.32 120.40 123.64 3fjv s VAL 114 Ca 0.15 1.51 0.03 0.00 0.00 0.00 0.00 61.98 63.67 3fjv s VAL 114 Cb 0.09 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 3fjv s VAL 114 CO 0.12 0.22 -0.10 0.72 0.00 0.00 0.00 175.10 176.06 3fjv s PHE 115 N 0.97 0.92 0.14 5.22 -0.71 -0.70 -1.53 117.98 122.28 3fjv s PHE 115 Ca 0.39 -0.53 0.05 0.00 -1.04 0.00 0.00 56.93 55.80 3fjv s PHE 115 Cb -0.18 -0.53 -0.04 0.00 -1.21 0.00 0.00 43.02 41.07 3fjv s PHE 115 CO 0.18 -0.03 0.05 -0.51 -1.34 0.00 0.00 175.22 173.58 3fjv s LEU 116 N -1.83 3.57 -0.09 -1.99 1.43 0.11 -1.00 118.68 118.88 3fjv s LEU 116 Ca -0.04 -0.20 -0.02 0.00 -1.03 0.00 0.00 54.13 52.83 3fjv s LEU 116 Cb -0.08 -2.24 0.04 0.00 0.03 0.00 0.00 46.19 43.94 3fjv s LEU 116 CO 0.01 0.12 0.04 -0.60 0.23 0.00 0.00 176.35 176.14 3fjv s ARG 117 N -2.76 0.29 -0.32 1.70 3.52 0.58 0.11 118.95 122.08 3fjv s ARG 117 Ca 0.28 0.12 -0.24 0.00 -0.13 0.00 0.00 55.73 55.76 3fjv s ARG 117 Cb -0.11 -1.07 0.00 0.00 -1.56 0.00 0.00 34.95 32.22 3fjv s ARG 117 CO 0.20 -0.40 0.81 0.08 -0.81 0.00 0.00 175.30 175.18 3fjv s VAL 118 N 2.05 4.76 0.00 7.11 1.01 -1.26 -1.44 120.40 132.63 3fjv s VAL 118 Ca 0.04 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.18 3fjv s VAL 118 Cb -0.13 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.07 3fjv s VAL 118 CO -0.05 -0.30 0.00 -0.67 0.00 0.00 0.00 175.10 174.08 3fjv n ASP 119 N 6.29 0.00 -2.02 3.32 2.03 0.31 -1.36 116.55 125.12 3fjv n ASP 119 Ca 0.04 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.25 3fjv n ASP 119 Cb 0.48 0.00 0.26 0.00 -0.72 0.00 0.00 41.12 41.14 3fjv n ASP 119 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 3fjv n ASP 120 N 1.92 4.48 -4.77 1.67 5.75 -1.26 -4.98 116.55 119.37 3fjv n ASP 120 Ca 0.00 -3.25 -0.28 0.00 -0.01 0.00 0.00 54.79 51.25 3fjv n ASP 120 Cb 0.00 -0.76 0.10 0.00 -1.03 0.00 0.00 41.12 39.43 3fjv n ASP 120 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3fjv s GLU 121 N -2.93 1.80 0.44 0.11 0.41 -0.46 -4.99 118.70 113.08 3fjv s GLU 121 Ca 0.53 -0.12 -0.25 0.00 -0.41 0.00 0.00 54.97 54.71 3fjv s GLU 121 Cb 0.43 -2.01 -0.09 0.00 -1.78 0.00 0.00 34.13 30.68 3fjv s GLU 121 CO 0.12 -1.63 1.36 0.00 -0.49 0.00 0.00 175.26 174.62 3fjv n ALA 122 N -3.27 1.69 -1.63 5.21 0.00 -1.26 -4.68 120.51 116.57 3fjv n ALA 122 Ca 0.09 0.25 -0.35 0.00 0.00 0.00 0.00 53.44 53.43 3fjv n ALA 122 Cb 0.61 -2.33 0.05 0.00 0.00 0.00 0.00 19.45 17.77 3fjv n ALA 122 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3fjv s PRO 123 N -2.35 2.74 -0.24 0.00 0.05 -1.26 -4.68 135.00 129.26 3fjv s PRO 123 Ca 0.61 1.76 -0.00 0.00 0.05 0.00 0.00 61.00 63.42 3fjv s PRO 123 Cb -0.47 -1.91 0.03 0.00 0.05 0.00 0.00 34.50 32.20 3fjv s PRO 123 CO 0.57 -1.37 -0.09 0.08 0.05 0.00 0.00 177.00 176.24 3fjv s VAL 124 N -1.77 2.62 0.19 -0.36 1.01 0.12 -4.96 120.40 117.25 3fjv s VAL 124 Ca 0.76 -1.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.36 3fjv s VAL 124 Cb -0.29 -2.33 -0.08 0.00 0.00 0.00 0.00 36.38 33.68 3fjv s VAL 124 CO 0.37 0.22 0.83 -0.31 0.00 0.00 0.00 175.10 176.21 3fjv s TYR 125 N 1.28 3.93 0.39 5.22 1.51 -1.26 -0.71 117.35 127.71 3fjv s TYR 125 Ca -0.01 1.73 -0.27 0.00 -1.01 0.00 0.00 57.07 57.51 3fjv s TYR 125 Cb -0.17 -2.84 -0.10 0.00 -0.11 0.00 0.00 41.96 38.75 3fjv s TYR 125 CO -0.06 0.49 1.41 0.00 -1.11 0.00 0.00 175.55 176.28 3fjv s ALA 126 N -1.17 3.44 -0.27 3.71 0.00 -0.58 -4.73 121.76 122.16 3fjv s ALA 126 Ca 0.38 1.43 -0.09 0.00 0.00 0.00 0.00 51.96 53.68 3fjv s ALA 126 Cb -0.24 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.29 3fjv s ALA 126 CO 0.28 -0.96 0.12 0.42 0.00 0.00 0.00 175.76 175.62 3fjv s ILE 127 N -1.16 4.64 -0.07 0.00 1.01 -0.07 -4.69 121.20 120.85 3fjv s ILE 127 Ca 0.54 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 61.05 3fjv s ILE 127 Cb -0.43 -3.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 3fjv s ILE 127 CO 0.57 0.28 0.07 0.00 0.00 0.00 0.00 174.94 175.86 3fjv s ALA 128 N 1.66 3.56 -1.38 9.38 0.00 -1.26 -1.04 121.76 132.68 3fjv s ALA 128 Ca 0.06 -0.77 -0.08 0.00 0.00 0.00 0.00 51.96 51.17 3fjv s ALA 128 Cb -0.16 -1.66 0.01 0.00 0.00 0.00 0.00 23.12 21.31 3fjv s ALA 128 CO 0.06 0.63 1.05 -0.25 0.00 0.00 0.00 175.76 177.26 3fjv n ASP 129 N 1.80 -6.28 0.28 0.00 8.00 0.30 -4.86 116.55 115.79 3fjv n ASP 129 Ca -0.17 -0.48 0.18 0.00 0.71 0.00 0.00 54.79 55.02 3fjv n ASP 129 Cb 0.54 -4.95 0.73 0.00 -0.02 0.00 0.00 41.12 37.42 3fjv n ASP 129 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3fjv h GLU 130 N -2.41 0.00 0.00 -1.24 5.08 -1.86 -1.42 114.58 112.72 3fjv h GLU 130 Ca -0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 3fjv h GLU 130 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3fjv h GLU 130 CO 0.55 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.16 3fjv n ASP 131 N -3.05 0.00 -4.57 1.42 5.75 -1.26 -4.75 116.55 110.09 3fjv n ASP 131 Ca 0.00 -0.05 -0.34 0.00 -0.01 0.00 0.00 54.79 54.39 3fjv n ASP 131 Cb 0.28 -0.29 -0.11 0.00 -1.03 0.00 0.00 41.12 39.96 3fjv n ASP 131 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3fjv s LEU 132 N -2.58 3.37 0.82 -2.12 1.43 -0.54 -5.08 118.68 113.98 3fjv s LEU 132 Ca 0.23 -0.02 -0.13 0.00 -1.03 0.00 0.00 54.13 53.18 3fjv s LEU 132 Cb 0.17 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.66 3fjv s LEU 132 CO 0.38 0.26 0.98 -0.62 0.23 0.00 0.00 176.35 177.58 3fjv n GLU 133 N 2.94 0.09 -0.31 1.70 1.02 -1.26 -4.44 120.64 120.38 3fjv n GLU 133 Ca -0.18 0.10 0.13 0.00 -0.02 0.00 0.00 57.16 57.19 3fjv n GLU 133 Cb 0.53 -2.26 0.31 0.00 -0.02 0.00 0.00 31.44 30.00 3fjv n GLU 133 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 3fjv h ARG 134 N -0.98 0.43 -0.18 3.49 0.11 -1.97 0.21 114.38 115.50 3fjv h ARG 134 Ca -0.46 -0.03 -0.20 0.00 0.10 0.00 0.00 59.98 59.40 3fjv h ARG 134 Cb 1.30 -0.10 0.01 0.00 1.11 0.00 0.00 29.97 32.29 3fjv h ARG 134 CO 0.43 0.29 -0.66 -0.44 0.10 0.00 0.00 179.97 179.69 3fjv h ASP 135 N 0.45 0.88 -0.32 0.08 3.32 -2.00 -1.77 116.42 117.07 3fjv h ASP 135 Ca 0.56 -0.61 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 3fjv h ASP 135 Cb 1.03 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 3fjv h ASP 135 CO -0.50 1.34 0.04 0.74 -1.72 0.00 0.00 179.24 179.14 3fjv h THR 136 N 0.48 1.24 -0.14 0.35 2.02 -1.70 -3.01 112.91 112.16 3fjv h THR 136 Ca -0.03 -0.85 0.01 0.00 0.77 0.00 0.00 66.41 66.30 3fjv h THR 136 Cb 1.28 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 3fjv h THR 136 CO 0.14 0.28 0.09 0.00 0.37 0.00 0.00 175.52 176.40 3fjv h ALA 137 N 0.87 1.95 0.00 6.16 0.00 -0.55 -2.29 119.26 125.41 3fjv h ALA 137 Ca 0.10 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3fjv h ALA 137 Cb 0.37 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3fjv h ALA 137 CO 0.01 0.03 -0.33 1.49 0.00 0.00 0.00 179.25 180.45 3fjv h GLU 138 N 0.14 0.00 -6.63 0.00 4.81 -1.18 -3.43 114.58 108.29 3fjv h GLU 138 Ca 0.05 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.76 3fjv h GLU 138 Cb 0.04 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.45 3fjv h GLU 138 CO -0.01 0.33 0.69 0.15 -0.73 0.00 0.00 179.01 179.44 3fjv s LYS 139 N -3.37 4.35 0.96 1.92 1.02 -0.86 -5.02 119.74 118.74 3fjv s LYS 139 Ca 0.02 2.08 -0.12 0.00 0.02 0.00 0.00 55.97 57.97 3fjv s LYS 139 Cb 0.09 -3.21 0.17 0.00 -0.52 0.00 0.00 37.83 34.36 3fjv s LYS 139 CO 0.68 -0.34 1.09 0.95 -0.92 0.00 0.00 175.35 176.81 3fjv s THR 140 N 0.50 2.40 -0.23 2.17 -4.23 -1.26 -5.01 115.64 109.98 3fjv s THR 140 Ca 0.60 0.13 -0.26 0.00 -1.18 0.00 0.00 61.69 60.97 3fjv s THR 140 Cb -0.37 -2.47 0.09 0.00 1.34 0.00 0.00 72.50 71.09 3fjv s THR 140 CO 0.35 -0.17 0.83 -0.55 -0.54 0.00 0.00 174.62 174.54 3fjv s SER 141 N -3.15 -0.61 0.00 3.99 0.15 -1.26 -4.99 113.70 107.82 3fjv s SER 141 Ca 0.65 1.06 0.22 0.00 0.70 0.00 0.00 55.95 58.58 3fjv s SER 141 Cb -0.20 1.04 1.10 0.00 -1.71 0.00 0.00 66.02 66.24 3fjv s SER 141 CO 0.59 -0.29 1.70 0.00 1.20 0.00 0.00 173.24 176.44 3fjv n ALA 142 N 2.07 2.13 -3.57 5.45 0.00 -1.26 -4.77 120.51 120.55 3fjv n ALA 142 Ca -0.14 -0.10 -0.23 0.00 0.00 0.00 0.00 53.44 52.96 3fjv n ALA 142 Cb 0.56 -1.35 -0.17 0.00 0.00 0.00 0.00 19.45 18.49 3fjv n ALA 142 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3fjv s VAL 143 N -2.58 0.93 0.07 0.00 1.01 -1.26 -0.64 120.40 117.92 3fjv s VAL 143 Ca 0.20 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.89 3fjv s VAL 143 Cb 0.15 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3fjv s VAL 143 CO 0.33 0.32 -0.12 -1.00 0.00 0.00 0.00 175.10 174.63 3fjv s HIS 144 N 0.89 1.07 -0.28 5.22 0.09 -0.26 -4.98 115.29 117.04 3fjv s HIS 144 Ca -0.11 -0.48 -0.09 0.00 -0.00 0.00 0.00 55.06 54.38 3fjv s HIS 144 Cb -0.15 -0.61 -0.02 0.00 -0.00 0.00 0.00 32.58 31.80 3fjv s HIS 144 CO 0.01 0.02 0.12 -0.06 -0.00 0.00 0.00 174.74 174.83 3fjv s PHE 145 N -1.37 3.14 0.10 1.40 0.08 -1.26 -0.98 117.98 119.10 3fjv s PHE 145 Ca -0.04 -0.38 0.06 0.00 0.12 0.00 0.00 56.93 56.69 3fjv s PHE 145 Cb -0.10 -2.31 -0.04 0.00 -0.57 0.00 0.00 43.02 40.01 3fjv s PHE 145 CO 0.02 -0.36 -0.04 -0.51 -0.10 0.00 0.00 175.22 174.23 3fjv s LEU 146 N 1.64 3.28 -0.07 -0.37 1.43 0.11 -0.54 118.68 124.15 3fjv s LEU 146 Ca 0.06 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 3fjv s LEU 146 Cb -0.16 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3fjv s LEU 146 CO 0.06 0.17 -0.15 -0.60 0.23 0.00 0.00 176.35 176.05 3fjv s ARG 147 N -2.31 2.06 -0.22 1.70 3.52 -0.21 -1.43 118.95 122.07 3fjv s ARG 147 Ca 0.24 -0.54 -0.01 0.00 -0.13 0.00 0.00 55.73 55.29 3fjv s ARG 147 Cb -0.11 -1.65 0.02 0.00 -1.56 0.00 0.00 34.95 31.65 3fjv s ARG 147 CO 0.16 0.07 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.55 3fjv s PHE 148 N 0.57 2.95 -0.24 5.12 0.08 0.82 -0.90 117.98 126.38 3fjv s PHE 148 Ca -0.16 -1.51 -0.18 0.00 0.12 0.00 0.00 56.93 55.21 3fjv s PHE 148 Cb -0.16 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.25 3fjv s PHE 148 CO 0.05 -0.73 0.49 -2.00 -0.10 0.00 0.00 175.22 172.94 3fjv s GLU 149 N 1.33 4.10 -0.11 0.44 2.12 -1.26 -1.24 118.70 124.08 3fjv s GLU 149 Ca 0.03 0.31 -0.00 0.00 0.36 0.00 0.00 54.97 55.66 3fjv s GLU 149 Cb -0.15 -3.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.59 3fjv s GLU 149 CO -0.07 -0.28 -0.10 -0.51 -0.54 0.00 0.00 175.26 173.76 3fjv s LEU 150 N 2.07 2.91 0.00 2.70 1.02 0.50 -4.97 118.68 122.92 3fjv s LEU 150 Ca 0.21 -0.21 -0.09 0.00 0.02 0.00 0.00 54.13 54.06 3fjv s LEU 150 Cb -0.16 -1.65 0.17 0.00 0.02 0.00 0.00 46.19 44.57 3fjv s LEU 150 CO 0.09 0.23 1.02 0.61 0.02 0.00 0.00 176.35 178.32 3fjv n GLY 151 N 3.11 -0.69 0.12 -3.19 0.00 -1.26 -4.79 105.19 98.50 3fjv n GLY 151 Ca -0.18 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 43.92 3fjv n GLY 151 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3fjv h ASP 152 N -1.13 0.30 0.00 1.61 3.58 -2.00 -0.77 116.42 118.01 3fjv h ASP 152 Ca -0.33 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 56.89 3fjv h ASP 152 Cb 1.01 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.98 3fjv h ASP 152 CO 0.27 0.44 0.00 0.00 -2.88 0.00 0.00 179.24 177.08 3fjv n ALA 153 N -2.27 1.14 0.00 -0.78 0.00 -1.26 -0.95 120.51 116.38 3fjv n ALA 153 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3fjv n ALA 153 Cb 0.16 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3fjv n ALA 153 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fjv n LYS 155 N 0.67 0.00 0.05 0.00 5.02 -0.30 -2.20 118.16 121.41 3fjv n LYS 155 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 3fjv n LYS 155 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 34.95 3fjv n LYS 155 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fjv h ALA 156 N 0.00 -0.07 -0.39 7.82 0.00 -1.31 -1.77 119.26 123.54 3fjv h ALA 156 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3fjv h ALA 156 Cb 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3fjv h ALA 156 CO 0.00 -0.56 0.00 0.87 0.00 0.00 0.00 179.25 179.57 3fjv h LYS 157 N -0.11 0.69 -0.16 0.00 1.57 -1.70 -0.41 116.57 116.45 3fjv h LYS 157 Ca 0.02 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 3fjv h LYS 157 Cb 0.13 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3fjv h LYS 157 CO -0.05 0.78 0.10 1.25 -0.57 0.00 0.00 179.45 180.96 3fjv h LEU 158 N 0.52 0.18 -1.74 2.94 5.85 -1.81 -1.06 115.31 120.20 3fjv h LEU 158 Ca 0.11 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3fjv h LEU 158 Cb 0.46 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.44 3fjv h LEU 158 CO 0.02 0.16 -0.15 0.11 -0.34 0.00 0.00 178.44 178.24 3fjv h LYS 159 N 0.19 0.00 0.00 1.25 1.57 -1.21 0.39 116.57 118.76 3fjv h LYS 159 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3fjv h LYS 159 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3fjv h LYS 159 CO -0.01 0.15 0.00 0.00 -0.57 0.00 0.00 179.45 179.02 3fjv n ALA 160 N -2.48 2.57 -0.51 3.86 0.00 -0.17 -4.90 120.51 118.89 3fjv n ALA 160 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3fjv n ALA 160 Cb 0.22 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.24 3fjv n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fjv n GLY 161 N 0.79 0.70 3.69 0.00 0.00 0.13 -5.04 105.19 105.45 3fjv n GLY 161 Ca 0.20 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 3fjv n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fjv s ALA 162 N -2.00 1.49 0.36 4.61 0.00 -0.47 -4.95 121.76 120.79 3fjv s ALA 162 Ca 0.00 0.20 -0.28 0.00 0.00 0.00 0.00 51.96 51.88 3fjv s ALA 162 Cb 0.00 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 3fjv s ALA 162 CO 0.00 -2.47 1.30 -2.14 0.00 0.00 0.00 175.76 172.45 3fjv s PRO 163 N -4.79 4.23 -0.13 0.00 0.02 -1.26 -4.78 135.00 128.29 3fjv s PRO 163 Ca 0.64 2.19 0.03 0.00 0.02 0.00 0.00 61.00 63.88 3fjv s PRO 163 Cb -0.20 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3fjv s PRO 163 CO 0.58 -0.28 -0.21 -1.17 -0.33 0.00 0.00 177.00 175.58 3fjv s LEU 164 N -2.00 2.19 0.13 -5.54 2.96 -1.26 -0.53 118.68 114.62 3fjv s LEU 164 Ca 0.51 -0.55 0.10 0.00 -0.22 0.00 0.00 54.13 53.97 3fjv s LEU 164 Cb -0.39 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 3fjv s LEU 164 CO 0.51 0.11 -0.22 -0.44 -1.32 0.00 0.00 176.35 175.00 3fjv s SER 165 N 0.62 3.62 -0.02 3.68 0.01 -0.52 0.38 113.70 121.46 3fjv s SER 165 Ca -0.11 -0.67 0.04 0.00 1.31 0.00 0.00 55.95 56.51 3fjv s SER 165 Cb -0.16 -0.38 -0.01 0.00 0.21 0.00 0.00 66.02 65.68 3fjv s SER 165 CO 0.03 0.17 -0.14 -0.63 0.41 0.00 0.00 173.24 173.08 3fjv s ILE 166 N -1.19 1.10 0.31 1.44 1.01 -0.36 -0.31 121.20 123.20 3fjv s ILE 166 Ca 0.17 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.30 3fjv s ILE 166 Cb -0.10 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 3fjv s ILE 166 CO 0.09 0.32 0.28 -0.83 0.00 0.00 0.00 174.94 174.80 3fjv s GLY 167 N -0.14 2.11 -0.08 6.18 0.00 -0.17 -1.77 107.32 113.45 3fjv s GLY 167 Ca 0.02 -1.96 -0.06 0.00 0.00 0.00 0.00 44.72 42.72 3fjv s GLY 167 CO 0.00 -1.41 0.21 0.00 0.00 0.00 0.00 173.10 171.90 3fjv n ASP 169 N 3.67 2.78 -4.68 0.00 5.68 -0.98 -0.29 116.55 122.72 3fjv n ASP 169 Ca -0.20 -2.68 -0.45 0.00 -0.50 0.00 0.00 54.79 50.96 3fjv n ASP 169 Cb 0.55 -0.34 -0.03 0.00 -1.14 0.00 0.00 41.12 40.16 3fjv n ASP 169 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 3fjv n HIS 170 N -0.70 2.30 0.21 2.11 -0.00 -1.26 -4.89 115.22 112.99 3fjv n HIS 170 Ca 0.13 0.35 0.06 0.00 0.46 0.00 0.00 57.72 58.73 3fjv n HIS 170 Cb 0.60 -2.51 0.55 0.00 -0.12 0.00 0.00 29.99 28.51 3fjv n HIS 170 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3fjv h PRO 171 N 4.81 0.08 -0.42 1.57 0.11 -1.96 -0.86 132.00 135.32 3fjv h PRO 171 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3fjv h PRO 171 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3fjv h PRO 171 CO 0.80 0.12 0.00 0.72 -0.21 0.00 0.00 178.00 179.44 3fjv n HIS 172 N -4.45 0.56 -2.90 0.65 8.25 -1.26 -4.49 115.22 111.57 3fjv n HIS 172 Ca -0.02 -0.28 -0.12 0.00 -0.26 0.00 0.00 57.72 57.04 3fjv n HIS 172 Cb 0.15 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.30 3fjv n HIS 172 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 3fjv n TYR 173 N 0.97 -1.54 -2.14 4.41 9.36 -0.37 -5.00 117.16 122.84 3fjv n TYR 173 Ca 0.18 -2.80 -0.43 0.00 3.32 0.00 0.00 57.90 58.17 3fjv n TYR 173 Cb 0.45 0.77 -0.02 0.00 -0.63 0.00 0.00 39.34 39.90 3fjv n TYR 173 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 3fjv s PRO 174 N -0.90 3.91 -0.18 2.98 0.04 -0.94 -4.27 135.00 135.64 3fjv s PRO 174 Ca 0.29 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.06 3fjv s PRO 174 Cb 0.32 -3.99 0.04 0.00 0.04 0.00 0.00 34.50 30.91 3fjv s PRO 174 CO -0.06 -1.15 -0.09 0.42 0.04 0.00 0.00 177.00 176.16 3fjv s ILE 175 N 4.80 1.45 0.30 0.56 -1.09 0.60 -4.97 121.20 122.84 3fjv s ILE 175 Ca 0.69 -0.85 -0.30 0.00 -2.23 0.00 0.00 60.65 57.97 3fjv s ILE 175 Cb -0.26 -1.55 -0.11 0.00 -1.58 0.00 0.00 42.46 38.97 3fjv s ILE 175 CO 0.27 0.17 1.56 -1.10 -1.23 0.00 0.00 174.94 174.61 3fjv s GLN 176 N 1.49 4.14 -0.00 2.79 -1.52 -1.26 -1.60 119.66 123.70 3fjv s GLN 176 Ca -0.00 2.54 -0.36 0.00 -1.95 0.00 0.00 55.36 55.59 3fjv s GLN 176 Cb -0.16 -3.03 -0.14 0.00 -0.22 0.00 0.00 33.01 29.46 3fjv s GLN 176 CO -0.08 -0.59 1.63 0.00 -0.25 0.00 0.00 175.29 176.00 3fjv n ALA 177 N 1.98 0.39 -2.77 6.09 0.00 -1.26 -4.73 120.51 120.21 3fjv n ALA 177 Ca 0.07 0.41 -0.16 0.00 0.00 0.00 0.00 53.44 53.76 3fjv n ALA 177 Cb 0.38 -2.30 -0.13 0.00 0.00 0.00 0.00 19.45 17.40 3fjv n ALA 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fjv s ALA 178 N 2.10 0.72 0.23 0.00 0.00 -0.73 -4.87 121.76 119.20 3fjv s ALA 178 Ca 0.87 -0.63 -0.30 0.00 0.00 0.00 0.00 51.96 51.90 3fjv s ALA 178 Cb -0.82 -0.07 -0.09 0.00 0.00 0.00 0.00 23.12 22.14 3fjv s ALA 178 CO 0.49 0.09 1.35 0.50 0.00 0.00 0.00 175.76 178.19 3fjv s ARG 179 N -1.03 4.35 0.39 0.00 6.06 -1.26 -1.23 118.95 126.22 3fjv s ARG 179 Ca -0.03 2.15 -0.08 0.00 -2.50 0.00 0.00 55.73 55.27 3fjv s ARG 179 Cb -0.07 -3.15 -0.06 0.00 0.06 0.00 0.00 34.95 31.73 3fjv s ARG 179 CO 0.00 -0.30 0.72 0.96 -2.50 0.00 0.00 175.30 174.18 3fjv s ILE 180 N -0.04 4.86 -0.10 4.11 -4.36 0.16 -4.92 121.20 120.91 3fjv s ILE 180 Ca 0.57 0.41 -0.39 0.00 -0.26 0.00 0.00 60.65 60.98 3fjv s ILE 180 Cb -0.39 -3.75 -0.17 0.00 1.25 0.00 0.00 42.46 39.40 3fjv s ILE 180 CO 0.41 -0.52 1.46 -0.67 0.24 0.00 0.00 174.94 175.86 3fjv n ASP 181 N -1.37 1.62 0.20 4.36 -0.08 -1.26 -4.72 116.55 115.30 3fjv n ASP 181 Ca 0.01 1.12 0.06 0.00 -1.51 0.00 0.00 54.79 54.47 3fjv n ASP 181 Cb 0.54 -1.11 0.54 0.00 2.34 0.00 0.00 41.12 43.44 3fjv n ASP 181 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3fjv h PRO 182 N 5.25 0.09 -0.60 -0.67 0.11 -1.96 0.33 132.00 134.55 3fjv h PRO 182 Ca -0.47 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3fjv h PRO 182 Cb 1.35 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 3fjv h PRO 182 CO 0.84 0.14 0.29 0.22 -0.21 0.00 0.00 178.00 179.27 3fjv h ASP 183 N 0.09 0.76 -0.09 -2.05 3.58 -1.97 0.28 116.42 117.01 3fjv h ASP 183 Ca 0.02 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.35 3fjv h ASP 183 Cb 0.14 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 40.99 3fjv h ASP 183 CO 0.01 0.65 -0.14 0.58 -2.88 0.00 0.00 179.24 177.46 3fjv h VAL 184 N 0.84 1.39 -0.61 2.25 2.07 -1.22 -2.67 116.25 118.30 3fjv h VAL 184 Ca 0.21 -1.38 0.06 0.00 0.82 0.00 0.00 66.70 66.42 3fjv h VAL 184 Cb 0.09 2.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3fjv h VAL 184 CO -0.03 0.39 0.41 0.00 0.02 0.00 0.00 177.57 178.36 3fjv h ALA 185 N 0.53 1.82 -0.65 1.67 0.00 -0.93 -1.59 119.26 120.11 3fjv h ALA 185 Ca 0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3fjv h ALA 185 Cb 0.69 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3fjv h ALA 185 CO 0.03 0.08 0.13 0.00 0.00 0.00 0.00 179.25 179.48 3fjv h ALA 186 N 1.67 0.87 -0.65 0.00 0.00 -0.89 -1.36 119.26 118.90 3fjv h ALA 186 Ca 0.27 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3fjv h ALA 186 Cb 0.30 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3fjv h ALA 186 CO -0.08 0.61 0.19 1.03 0.00 0.00 0.00 179.25 181.01 3fjv h SER 187 N 0.99 0.96 -0.61 0.00 0.87 -1.02 -2.94 113.55 111.80 3fjv h SER 187 Ca 0.20 -0.21 -0.07 0.00 -1.23 0.00 0.00 61.79 60.47 3fjv h SER 187 Cb 0.41 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 3fjv h SER 187 CO 0.01 0.92 0.10 -0.07 -0.53 0.00 0.00 176.83 177.26 3fjv h LEU 188 N 0.95 0.97 -1.39 2.23 4.07 -1.05 -2.44 115.31 118.66 3fjv h LEU 188 Ca 0.21 -0.26 0.18 0.00 0.08 0.00 0.00 57.88 58.08 3fjv h LEU 188 Cb 0.31 -0.26 -0.07 0.00 1.08 0.00 0.00 40.66 41.72 3fjv h LEU 188 CO -0.00 0.99 0.58 0.00 -1.08 0.00 0.00 178.44 178.92 3fjv h ALA 189 N 1.02 2.01 0.00 1.53 0.00 -1.08 -0.99 119.26 121.75 3fjv h ALA 189 Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3fjv h ALA 189 Cb 0.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3fjv h ALA 189 CO 0.01 -0.29 0.00 0.78 0.00 0.00 0.00 179.25 179.76 3fjv h GLY 190 N 0.54 0.00 2.00 0.00 0.00 -1.38 -2.63 103.07 101.61 3fjv h GLY 190 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 3fjv h GLY 190 CO -0.20 0.00 0.00 -0.55 0.00 0.00 0.00 176.54 175.79 3fjv h ASP 191 N 0.00 0.00 -2.97 0.19 3.32 -1.24 -3.46 116.42 112.27 3fjv h ASP 191 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 3fjv h ASP 191 Cb 0.39 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.87 3fjv h ASP 191 CO 0.00 0.00 -0.53 -0.76 -1.72 0.00 0.00 179.24 176.23 3fjv s LEU 192 N -5.55 4.14 0.00 1.55 1.43 -0.99 -4.15 118.68 115.11 3fjv s LEU 192 Ca 0.04 0.22 0.11 0.00 -1.03 0.00 0.00 54.13 53.47 3fjv s LEU 192 Cb 0.09 -2.56 0.09 0.00 0.03 0.00 0.00 46.19 43.84 3fjv s LEU 192 CO 0.52 0.24 0.86 -0.90 0.23 0.00 0.00 176.35 177.30