#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k90 h ALA 2 N 0.00 1.32 -0.33 3.17 0.00 -1.96 -0.99 119.26 120.48 3k90 h ALA 2 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k90 h ALA 2 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3k90 h ALA 2 CO 0.00 0.33 0.00 -1.13 0.00 0.00 0.00 179.25 178.45 3k90 n SER 3 N -3.87 2.01 -4.04 0.00 3.41 -1.26 -0.29 113.62 109.57 3k90 n SER 3 Ca -0.02 -1.93 -0.31 0.00 -0.26 0.00 0.00 58.87 56.35 3k90 n SER 3 Cb 0.35 -0.22 -0.16 0.00 -0.26 0.00 0.00 64.21 63.92 3k90 n SER 3 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3k90 s GLU 4 N -1.56 2.24 0.60 4.33 8.01 -0.38 -4.48 118.70 127.46 3k90 s GLU 4 Ca 0.28 -1.00 -0.18 0.00 0.01 0.00 0.00 54.97 54.07 3k90 s GLU 4 Cb 0.15 -2.60 -0.03 0.00 -4.31 0.00 0.00 34.13 27.34 3k90 s GLU 4 CO 0.20 -0.44 1.20 -0.51 0.01 0.00 0.00 175.26 175.72 3k90 s LEU 5 N 1.29 3.64 0.66 1.80 1.43 -1.26 -4.93 118.68 121.30 3k90 s LEU 5 Ca -0.03 2.37 -0.06 0.00 -1.03 0.00 0.00 54.13 55.38 3k90 s LEU 5 Cb -0.17 -4.60 0.04 0.00 0.03 0.00 0.00 46.19 41.50 3k90 s LEU 5 CO -0.08 -1.62 0.97 0.42 0.23 0.00 0.00 176.35 176.26 3k90 s THR 6 N -1.65 2.80 0.31 5.49 -4.23 -1.26 -4.95 115.64 112.15 3k90 s THR 6 Ca 0.77 -0.18 0.15 0.00 -1.18 0.00 0.00 61.69 61.25 3k90 s THR 6 Cb -0.30 -3.17 0.09 0.00 1.34 0.00 0.00 72.50 70.46 3k90 s THR 6 CO 0.34 -0.18 1.77 -0.65 -0.54 0.00 0.00 174.62 175.36 3k90 h PRO 7 N -0.42 0.00 -0.10 3.99 0.11 -1.99 -2.34 132.00 131.24 3k90 h PRO 7 Ca -0.45 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.49 3k90 h PRO 7 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 3k90 h PRO 7 CO 0.60 0.42 -0.67 0.93 -0.21 0.00 0.00 178.00 179.07 3k90 h GLU 8 N 0.00 0.43 -0.05 1.05 5.08 -2.00 -2.53 114.58 116.56 3k90 h GLU 8 Ca -0.00 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 3k90 h GLU 8 Cb 0.79 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 3k90 h GLU 8 CO 0.05 0.95 -0.04 0.93 -1.00 0.00 0.00 179.01 179.90 3k90 h GLU 9 N 0.30 0.11 0.00 2.33 5.08 -1.90 -3.10 114.58 117.40 3k90 h GLU 9 Ca -0.02 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 3k90 h GLU 9 Cb 1.23 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3k90 h GLU 9 CO 0.12 0.53 -0.25 0.00 -1.00 0.00 0.00 179.01 178.41 3k90 h ARG 10 N -0.31 0.00 -0.23 2.33 3.08 -1.48 -1.94 114.38 115.83 3k90 h ARG 10 Ca 0.01 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.88 3k90 h ARG 10 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3k90 h ARG 10 CO 0.01 0.25 -0.55 0.77 -1.07 0.00 0.00 179.97 179.38 3k90 h SER 11 N 0.00 0.88 -0.46 7.04 0.02 -1.50 -2.43 113.55 117.09 3k90 h SER 11 Ca -0.00 -0.56 -0.10 0.00 -0.84 0.00 0.00 61.79 60.28 3k90 h SER 11 Cb 0.53 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 3k90 h SER 11 CO 0.03 1.28 -0.09 -0.08 -1.14 0.00 0.00 176.83 176.83 3k90 h GLU 12 N 0.51 0.93 -0.00 3.45 4.57 -1.43 -3.19 114.58 119.42 3k90 h GLU 12 Ca -0.00 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 3k90 h GLU 12 Cb 1.17 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 3k90 h GLU 12 CO 0.12 0.98 -0.04 1.28 -1.18 0.00 0.00 179.01 180.17 3k90 n LEU 13 N -4.16 0.27 -0.32 1.64 4.32 -0.75 -4.00 117.00 114.01 3k90 n LEU 13 Ca 0.02 0.04 0.11 0.00 -0.02 0.00 0.00 56.01 56.16 3k90 n LEU 13 Cb 0.38 -0.14 0.28 0.00 -1.62 0.00 0.00 43.42 42.32 3k90 n LEU 13 CO 0.44 0.05 1.12 0.50 -1.22 0.00 0.00 177.39 178.28 3k90 h LYS 14 N 0.36 0.59 0.10 3.23 3.64 -1.42 0.11 116.57 123.18 3k90 h LYS 14 Ca 0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3k90 h LYS 14 Cb 0.23 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3k90 h LYS 14 CO 0.00 0.39 -0.05 -0.91 -2.27 0.00 0.00 179.45 176.62 3k90 h ASN 15 N 0.61 -0.11 -0.57 4.20 2.35 -1.84 -1.87 115.58 118.36 3k90 h ASN 15 Ca 0.53 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 3k90 h ASN 15 Cb 0.86 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 3k90 h ASN 15 CO -0.41 0.17 0.35 0.28 -1.65 0.00 0.00 177.43 176.17 3k90 h SER 16 N -0.40 0.67 -0.44 5.81 0.02 -1.69 -1.99 113.55 115.53 3k90 h SER 16 Ca -0.01 -0.04 0.05 0.00 -0.84 0.00 0.00 61.79 60.94 3k90 h SER 16 Cb 0.33 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.66 3k90 h SER 16 CO 0.02 0.51 0.19 0.40 -1.14 0.00 0.00 176.83 176.82 3k90 h ILE 17 N 0.76 0.92 -0.59 3.27 2.04 -0.77 -0.77 117.51 122.37 3k90 h ILE 17 Ca 0.20 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 3k90 h ILE 17 Cb -0.04 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 3k90 h ILE 17 CO -0.04 0.07 0.18 0.00 0.00 0.00 0.00 178.15 178.36 3k90 h ALA 18 N 1.26 1.20 -0.00 1.87 0.00 -1.18 -0.47 119.26 121.94 3k90 h ALA 18 Ca 0.20 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3k90 h ALA 18 Cb 0.15 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.71 3k90 h ALA 18 CO -0.17 0.56 -0.49 1.49 0.00 0.00 0.00 179.25 180.64 3k90 h GLU 19 N 0.87 0.34 0.00 0.00 4.81 -0.80 -3.40 114.58 116.40 3k90 h GLU 19 Ca 0.20 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 3k90 h GLU 19 Cb 0.26 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3k90 h GLU 19 CO -0.01 1.05 -1.34 1.19 -0.73 0.00 0.00 179.01 179.17 3k90 n PHE 20 N -4.31 0.00 -1.01 0.92 3.72 -0.35 -4.78 117.46 111.66 3k90 n PHE 20 Ca -0.10 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.39 3k90 n PHE 20 Cb 0.62 -0.19 0.14 0.00 -0.94 0.00 0.00 39.48 39.11 3k90 n PHE 20 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3k90 n HIS 21 N -1.84 0.08 -5.24 1.38 8.25 -0.22 -4.88 115.22 112.75 3k90 n HIS 21 Ca -0.03 -0.96 -0.31 0.00 -0.26 0.00 0.00 57.72 56.16 3k90 n HIS 21 Cb 0.29 -0.16 -0.16 0.00 1.12 0.00 0.00 29.99 31.08 3k90 n HIS 21 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3k90 s THR 22 N -2.77 1.99 -0.03 1.59 -4.23 -0.97 -4.92 115.64 106.30 3k90 s THR 22 Ca 0.31 -1.05 0.04 0.00 -1.18 0.00 0.00 61.69 59.81 3k90 s THR 22 Cb 0.27 -1.67 -0.00 0.00 1.34 0.00 0.00 72.50 72.43 3k90 s THR 22 CO 0.03 0.56 -0.14 -0.31 -0.54 0.00 0.00 174.62 174.22 3k90 s TYR 23 N -0.29 1.35 -0.56 3.99 2.02 -1.26 -5.00 117.35 117.59 3k90 s TYR 23 Ca 0.01 -0.33 -0.19 0.00 -0.37 0.00 0.00 57.07 56.18 3k90 s TYR 23 Cb -0.12 -0.91 0.08 0.00 -0.40 0.00 0.00 41.96 40.62 3k90 s TYR 23 CO 0.02 -0.10 0.69 1.14 -1.57 0.00 0.00 175.55 175.73 3k90 s GLN 24 N -0.04 3.08 -0.33 -0.62 -2.07 -1.26 -5.05 119.66 113.37 3k90 s GLN 24 Ca -0.01 -1.12 -0.17 0.00 -1.82 0.00 0.00 55.36 52.24 3k90 s GLN 24 Cb -0.09 -4.20 -0.01 0.00 -1.09 0.00 0.00 33.01 27.62 3k90 s GLN 24 CO 0.01 -1.44 0.48 -0.51 -1.32 0.00 0.00 175.29 172.51 3k90 s LEU 25 N 2.75 4.31 0.43 2.60 1.02 -1.26 -5.05 118.68 123.48 3k90 s LEU 25 Ca 0.14 0.02 -0.26 0.00 0.02 0.00 0.00 54.13 54.05 3k90 s LEU 25 Cb -0.22 -2.54 -0.09 0.00 0.02 0.00 0.00 46.19 43.36 3k90 s LEU 25 CO 0.09 -0.42 1.41 -1.81 0.02 0.00 0.00 176.35 175.64 3k90 s ASP 26 N 1.73 6.01 0.70 2.29 1.01 -1.26 -4.94 116.67 122.20 3k90 s ASP 26 Ca 0.18 2.89 -0.16 0.00 0.71 0.00 0.00 52.55 56.17 3k90 s ASP 26 Cb -0.16 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.13 3k90 s ASP 26 CO 0.12 -1.08 1.16 -0.81 0.21 0.00 0.00 175.17 174.77 3k90 n PRO 27 N -0.06 0.73 -0.96 8.23 -0.04 -1.26 -2.19 135.00 139.46 3k90 n PRO 27 Ca 0.04 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.81 3k90 n PRO 27 Cb 0.42 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 3k90 n PRO 27 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3k90 n GLY 28 N 0.92 0.78 3.36 0.55 0.00 -1.26 -5.04 105.19 104.50 3k90 n GLY 28 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 3k90 n GLY 28 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k90 s SER 29 N -2.57 2.99 0.05 1.61 1.04 -0.93 -1.77 113.70 114.12 3k90 s SER 29 Ca 0.00 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 55.66 3k90 s SER 29 Cb 0.00 -0.19 -0.03 0.00 0.10 0.00 0.00 66.02 65.90 3k90 s SER 29 CO 0.00 0.08 -0.06 0.00 0.98 0.00 0.00 173.24 174.24 3k90 s SER 31 N -2.08 2.05 -0.08 0.00 1.04 -1.26 -1.07 113.70 112.30 3k90 s SER 31 Ca -0.03 -1.12 -0.28 0.00 0.48 0.00 0.00 55.95 54.99 3k90 s SER 31 Cb -0.04 -0.04 0.06 0.00 0.10 0.00 0.00 66.02 66.10 3k90 s SER 31 CO -0.02 -0.38 0.64 -0.55 0.98 0.00 0.00 173.24 173.91 3k90 s SER 32 N -3.28 -0.62 -0.02 7.02 0.15 -0.76 -4.99 113.70 111.20 3k90 s SER 32 Ca 0.24 0.76 0.04 0.00 0.70 0.00 0.00 55.95 57.69 3k90 s SER 32 Cb 0.04 0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 64.99 3k90 s SER 32 CO 0.06 -0.53 -0.15 -0.22 1.20 0.00 0.00 173.24 173.60 3k90 s LEU 33 N -0.95 1.96 0.09 3.45 1.98 -1.26 -1.13 118.68 122.82 3k90 s LEU 33 Ca -0.09 -0.28 0.06 0.00 -2.89 0.00 0.00 54.13 50.92 3k90 s LEU 33 Cb -0.01 -0.80 -0.03 0.00 0.66 0.00 0.00 46.19 46.01 3k90 s LEU 33 CO 0.08 0.16 -0.15 -1.00 -1.89 0.00 0.00 176.35 173.55 3k90 s HIS 34 N -0.16 1.34 0.05 5.38 3.76 -0.09 -5.00 115.29 120.57 3k90 s HIS 34 Ca 0.02 -0.48 0.04 0.00 -0.15 0.00 0.00 55.06 54.49 3k90 s HIS 34 Cb -0.08 -0.74 -0.02 0.00 1.11 0.00 0.00 32.58 32.85 3k90 s HIS 34 CO 0.00 0.10 -0.13 0.00 -0.85 0.00 0.00 174.74 173.86 3k90 s ALA 35 N -1.48 1.04 -0.12 -1.40 0.00 -1.26 -1.50 121.76 117.04 3k90 s ALA 35 Ca 0.02 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.11 3k90 s ALA 35 Cb -0.09 -0.12 0.06 0.00 0.00 0.00 0.00 23.12 22.97 3k90 s ALA 35 CO 0.03 0.17 0.22 -1.14 0.00 0.00 0.00 175.76 175.04 3k90 s GLN 36 N -1.30 0.11 0.09 0.00 2.00 -0.44 -4.24 119.66 115.87 3k90 s GLN 36 Ca -0.01 0.64 -0.25 0.00 -2.00 0.00 0.00 55.36 53.74 3k90 s GLN 36 Cb -0.08 -0.21 -0.06 0.00 0.80 0.00 0.00 33.01 33.46 3k90 s GLN 36 CO 0.01 -0.32 0.78 0.50 -0.50 0.00 0.00 175.29 175.76 3k90 s ARG 37 N 2.37 4.53 -0.12 1.67 3.52 0.60 -0.85 118.95 130.67 3k90 s ARG 37 Ca 0.02 1.12 -0.01 0.00 -0.13 0.00 0.00 55.73 56.73 3k90 s ARG 37 Cb -0.12 -3.33 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 3k90 s ARG 37 CO -0.08 0.38 -0.07 0.42 -0.81 0.00 0.00 175.30 175.14 3k90 s ILE 38 N -0.42 0.98 -1.34 4.11 1.01 0.15 -4.92 121.20 120.77 3k90 s ILE 38 Ca 0.38 -0.29 -0.14 0.00 0.00 0.00 0.00 60.65 60.60 3k90 s ILE 38 Cb -0.21 -1.03 0.09 0.00 0.01 0.00 0.00 42.46 41.32 3k90 s ILE 38 CO 0.24 0.33 1.89 1.41 0.00 0.00 0.00 174.94 178.82 3k90 n HIS 39 N 4.95 3.99 -3.53 3.97 8.25 -1.26 -0.84 115.22 130.75 3k90 n HIS 39 Ca -0.12 -2.96 -0.10 0.00 -0.26 0.00 0.00 57.72 54.28 3k90 n HIS 39 Cb 0.50 -2.41 -0.02 0.00 1.12 0.00 0.00 29.99 29.18 3k90 n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k90 s ALA 40 N 2.73 -1.56 0.39 -1.41 0.00 -1.26 -4.73 121.76 115.92 3k90 s ALA 40 Ca 0.47 0.39 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 3k90 s ALA 40 Cb 0.08 0.80 -0.09 0.00 0.00 0.00 0.00 23.12 23.91 3k90 s ALA 40 CO -0.01 -0.82 1.16 -2.14 0.00 0.00 0.00 175.76 173.95 3k90 s PRO 41 N -3.67 4.11 0.49 0.00 0.02 -1.26 -3.52 135.00 131.17 3k90 s PRO 41 Ca 0.04 1.83 0.20 0.00 0.02 0.00 0.00 61.00 63.09 3k90 s PRO 41 Cb -0.02 -2.71 1.24 0.00 0.02 0.00 0.00 34.50 33.03 3k90 s PRO 41 CO -0.08 -0.27 2.06 -1.35 -0.33 0.00 0.00 177.00 177.03 3k90 h PRO 42 N 2.73 0.00 -0.35 5.54 0.11 -1.90 -1.96 132.00 136.17 3k90 h PRO 42 Ca -0.49 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3k90 h PRO 42 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 3k90 h PRO 42 CO 0.63 0.13 -0.12 1.05 -0.21 0.00 0.00 178.00 179.47 3k90 h GLU 43 N 0.00 0.61 -0.18 1.05 9.09 -1.99 0.15 114.58 123.32 3k90 h GLU 43 Ca -0.00 -0.19 -0.08 0.00 0.05 0.00 0.00 59.36 59.14 3k90 h GLU 43 Cb 0.25 -0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 27.29 3k90 h GLU 43 CO 0.02 0.72 -0.18 1.25 0.05 0.00 0.00 179.01 180.86 3k90 h LEU 44 N 0.56 0.48 -0.57 3.06 5.85 -1.76 -1.77 115.31 121.17 3k90 h LEU 44 Ca 0.10 -0.48 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 3k90 h LEU 44 Cb 0.54 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3k90 h LEU 44 CO 0.03 0.86 0.28 0.58 -0.34 0.00 0.00 178.44 179.85 3k90 h VAL 45 N 0.11 1.20 -0.53 1.05 2.07 -1.21 -2.59 116.25 116.35 3k90 h VAL 45 Ca 0.03 -0.56 -0.08 0.00 0.82 0.00 0.00 66.70 66.91 3k90 h VAL 45 Cb 0.73 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3k90 h VAL 45 CO 0.05 0.23 0.01 -0.25 0.02 0.00 0.00 177.57 177.62 3k90 h TRP 46 N 0.76 0.95 0.00 1.57 2.91 -0.72 -1.59 115.95 119.83 3k90 h TRP 46 Ca 0.20 -0.14 -0.01 0.00 1.13 0.00 0.00 58.89 60.06 3k90 h TRP 46 Cb 0.10 -0.26 -0.00 0.00 -0.51 0.00 0.00 29.16 28.49 3k90 h TRP 46 CO -0.00 0.86 -0.07 0.66 -1.03 0.00 0.00 178.44 178.85 3k90 h SER 47 N 0.82 0.00 0.00 2.65 4.64 -0.93 0.16 113.55 120.89 3k90 h SER 47 Ca 0.16 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.34 3k90 h SER 47 Cb 0.48 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 3k90 h SER 47 CO 0.02 0.07 -0.75 0.40 -0.87 0.00 0.00 176.83 175.69 3k90 h ILE 48 N 0.00 1.12 -0.35 0.95 2.04 -1.29 -3.39 117.51 116.59 3k90 h ILE 48 Ca -0.00 -2.12 -0.01 0.00 1.00 0.00 0.00 64.86 63.73 3k90 h ILE 48 Cb 0.17 2.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 3k90 h ILE 48 CO 0.01 0.38 0.19 0.58 0.00 0.00 0.00 178.15 179.31 3k90 h VAL 49 N -1.00 1.11 0.00 1.67 2.07 -0.92 -2.73 116.25 116.45 3k90 h VAL 49 Ca -0.20 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3k90 h VAL 49 Cb 1.11 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 3k90 h VAL 49 CO -0.12 0.12 0.00 -2.11 0.02 0.00 0.00 177.57 175.48 3k90 n ARG 50 N -4.45 0.02 -2.68 1.57 1.85 0.51 -4.58 116.66 108.91 3k90 n ARG 50 Ca 0.02 0.14 -0.43 0.00 -1.00 0.00 0.00 57.85 56.58 3k90 n ARG 50 Cb 0.09 -1.53 -0.01 0.00 -1.05 0.00 0.00 32.46 29.97 3k90 n ARG 50 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3k90 s ARG 51 N -3.02 3.92 0.40 2.89 0.52 -1.03 -4.81 118.95 117.83 3k90 s ARG 51 Ca 0.10 -1.97 0.12 0.00 -0.52 0.00 0.00 55.73 53.46 3k90 s ARG 51 Cb 0.14 -5.37 0.94 0.00 0.52 0.00 0.00 34.95 31.18 3k90 s ARG 51 CO 0.41 -2.11 1.93 0.35 0.02 0.00 0.00 175.30 175.90 3k90 h PHE 52 N 7.92 0.59 0.00 -0.53 3.57 -1.88 -1.22 116.94 125.39 3k90 h PHE 52 Ca 0.36 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.88 3k90 h PHE 52 Cb 0.90 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.45 3k90 h PHE 52 CO 1.32 0.26 0.00 -0.40 -2.23 0.00 0.00 178.31 177.25 3k90 n ASP 53 N -4.49 0.47 -3.06 0.41 3.85 -1.26 -4.22 116.55 108.25 3k90 n ASP 53 Ca 0.13 0.55 -0.24 0.00 -0.71 0.00 0.00 54.79 54.51 3k90 n ASP 53 Cb 0.42 -0.67 -0.04 0.00 -1.35 0.00 0.00 41.12 39.47 3k90 n ASP 53 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3k90 n LYS 54 N -1.95 2.49 0.24 0.11 5.02 -0.46 -4.82 118.16 118.79 3k90 n LYS 54 Ca 0.06 -4.40 0.10 0.00 -2.02 0.00 0.00 58.31 52.05 3k90 n LYS 54 Cb 0.39 -2.06 0.61 0.00 -0.02 0.00 0.00 35.03 33.94 3k90 n LYS 54 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3k90 h PRO 55 N 3.12 0.00 0.00 1.97 0.13 -1.73 -2.74 132.00 132.74 3k90 h PRO 55 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3k90 h PRO 55 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 3k90 h PRO 55 CO 0.72 0.18 0.07 1.96 -0.23 0.00 0.00 178.00 180.71 3k90 h GLN 56 N 0.00 0.00 0.00 0.86 7.50 -1.90 0.11 115.11 121.67 3k90 h GLN 56 Ca -0.00 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.12 3k90 h GLN 56 Cb 0.46 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.99 3k90 h GLN 56 CO 0.02 0.00 -0.15 1.79 -1.50 0.00 0.00 178.83 179.00 3k90 h THR 57 N 0.00 0.52 0.00 -0.54 1.35 -1.89 -3.32 112.91 109.03 3k90 h THR 57 Ca 0.00 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 3k90 h THR 57 Cb 0.14 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3k90 h THR 57 CO 0.00 0.14 0.00 0.00 -0.25 0.00 0.00 175.52 175.41 3k90 n TYR 58 N -3.52 0.00 -4.60 4.73 0.18 -0.75 -4.92 117.16 108.28 3k90 n TYR 58 Ca -0.01 -0.01 -0.33 0.00 1.88 0.00 0.00 57.90 59.44 3k90 n TYR 58 Cb 0.30 -0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.14 3k90 n TYR 58 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 3k90 s LYS 59 N -0.01 2.54 0.69 -3.48 1.02 0.30 -3.95 119.74 116.85 3k90 s LYS 59 Ca 0.00 -0.70 -0.11 0.00 0.02 0.00 0.00 55.97 55.18 3k90 s LYS 59 Cb 0.00 -2.47 0.01 0.00 -0.52 0.00 0.00 37.83 34.85 3k90 s LYS 59 CO 0.00 0.62 1.09 -1.01 -0.92 0.00 0.00 175.35 175.12 3k90 s HIS 60 N -0.89 3.36 0.00 3.18 3.76 -1.26 -4.39 115.29 119.04 3k90 s HIS 60 Ca 0.15 1.10 0.00 0.00 -0.15 0.00 0.00 55.06 56.15 3k90 s HIS 60 Cb -0.11 -3.01 0.00 0.00 1.11 0.00 0.00 32.58 30.57 3k90 s HIS 60 CO 0.04 -1.12 0.00 1.19 -0.85 0.00 0.00 174.74 174.01 3k90 n PHE 61 N -2.98 0.00 -3.68 1.40 0.99 -1.26 -4.99 117.46 106.94 3k90 n PHE 61 Ca 0.07 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 57.15 3k90 n PHE 61 Cb 0.57 -0.08 -0.11 0.00 -1.00 0.00 0.00 39.48 38.86 3k90 n PHE 61 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3k90 s ILE 62 N -2.98 5.07 -0.12 4.37 1.01 -1.26 -2.52 121.20 124.77 3k90 s ILE 62 Ca 0.00 0.08 -0.26 0.00 0.00 0.00 0.00 60.65 60.47 3k90 s ILE 62 Cb 0.00 -3.38 -0.23 0.00 0.01 0.00 0.00 42.46 38.86 3k90 s ILE 62 CO 0.00 0.31 0.78 0.50 0.00 0.00 0.00 174.94 176.53 3k90 h LYS 63 N 7.99 -0.01 -3.36 2.79 3.64 -0.56 -3.47 116.57 123.60 3k90 h LYS 63 Ca -0.37 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.98 3k90 h LYS 63 Cb 1.18 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.94 3k90 h LYS 63 CO 0.59 0.84 0.07 -1.54 -2.27 0.00 0.00 179.45 177.14 3k90 s SER 64 N -6.08 -0.01 -0.15 4.20 1.04 -1.12 -5.03 113.70 106.55 3k90 s SER 64 Ca -0.17 -0.93 -0.10 0.00 0.48 0.00 0.00 55.95 55.23 3k90 s SER 64 Cb -0.02 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.84 3k90 s SER 64 CO 0.63 -1.34 0.38 0.00 0.98 0.00 0.00 173.24 173.90 3k90 s SER 66 N 1.04 2.90 0.23 0.00 1.04 -0.93 -4.96 113.70 113.01 3k90 s SER 66 Ca -0.07 -0.72 0.09 0.00 0.48 0.00 0.00 55.95 55.74 3k90 s SER 66 Cb -0.07 -0.18 -0.05 0.00 0.10 0.00 0.00 66.02 65.83 3k90 s SER 66 CO -0.08 0.11 -0.17 0.68 0.98 0.00 0.00 173.24 174.76 3k90 s VAL 67 N -1.14 2.02 0.33 5.02 -7.23 -1.26 -1.05 120.40 117.09 3k90 s VAL 67 Ca 0.10 -2.25 -0.29 0.00 -1.81 0.00 0.00 61.98 57.73 3k90 s VAL 67 Cb -0.10 -2.12 -0.12 0.00 0.56 0.00 0.00 36.38 34.61 3k90 s VAL 67 CO 0.05 -0.49 1.48 -1.84 -0.31 0.00 0.00 175.10 173.99 3k90 n GLU 68 N -0.39 2.51 -1.48 4.82 0.28 -1.26 -4.91 120.64 120.21 3k90 n GLU 68 Ca -0.07 0.89 -0.37 0.00 -0.16 0.00 0.00 57.16 57.44 3k90 n GLU 68 Cb 0.60 -2.60 0.05 0.00 1.43 0.00 0.00 31.44 30.92 3k90 n GLU 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3k90 n GLN 69 N 1.19 0.61 -3.76 3.44 10.64 -1.26 -2.29 117.38 125.95 3k90 n GLN 69 Ca 0.05 0.25 -0.26 0.00 -1.83 0.00 0.00 57.00 55.21 3k90 n GLN 69 Cb 0.37 -1.96 0.05 0.00 -0.86 0.00 0.00 30.24 27.83 3k90 n GLN 69 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3k90 n ASN 70 N -0.40 -4.82 -4.75 2.61 3.02 -1.26 -4.92 115.26 104.74 3k90 n ASN 70 Ca 0.12 -0.69 -0.41 0.00 -0.03 0.00 0.00 54.58 53.57 3k90 n ASN 70 Cb 0.48 -4.37 -0.03 0.00 -0.61 0.00 0.00 39.78 35.26 3k90 n ASN 70 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3k90 s PHE 71 N -3.35 3.18 -0.05 3.10 2.19 -0.97 -5.04 117.98 117.05 3k90 s PHE 71 Ca 0.53 1.32 0.04 0.00 0.33 0.00 0.00 56.93 59.15 3k90 s PHE 71 Cb -0.25 -3.62 -0.00 0.00 -1.31 0.00 0.00 43.02 37.83 3k90 s PHE 71 CO 0.79 -1.83 -0.18 -1.21 1.83 0.00 0.00 175.22 174.62 3k90 s GLU 72 N -0.90 1.91 -0.56 10.12 2.02 -1.26 -5.09 118.70 124.93 3k90 s GLU 72 Ca 0.53 -0.65 -0.26 0.00 0.02 0.00 0.00 54.97 54.61 3k90 s GLU 72 Cb -0.38 -1.64 0.04 0.00 0.10 0.00 0.00 34.13 32.25 3k90 s GLU 72 CO 0.45 0.25 1.04 1.41 0.02 0.00 0.00 175.26 178.43 3k90 s MET 73 N 0.04 3.41 0.03 1.61 -2.45 -1.26 -4.93 119.30 115.74 3k90 s MET 73 Ca -0.04 -0.05 -0.05 0.00 -1.25 0.00 0.00 55.69 54.29 3k90 s MET 73 Cb -0.12 -4.03 -0.01 0.00 1.25 0.00 0.00 34.83 31.92 3k90 s MET 73 CO 0.03 -1.55 0.09 1.03 1.05 0.00 0.00 175.02 175.67 3k90 s ARG 74 N 4.32 0.53 0.17 4.11 0.52 -1.26 -5.08 118.95 122.27 3k90 s ARG 74 Ca 0.35 -0.65 -0.33 0.00 -0.52 0.00 0.00 55.73 54.58 3k90 s ARG 74 Cb -0.10 0.21 -0.15 0.00 0.52 0.00 0.00 34.95 35.42 3k90 s ARG 74 CO 0.22 -0.13 1.23 0.28 0.02 0.00 0.00 175.30 176.92 3k90 n VAL 75 N 1.03 0.78 0.00 3.52 0.31 -1.26 -1.31 118.33 121.39 3k90 n VAL 75 Ca -0.20 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3k90 n VAL 75 Cb 0.57 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.54 3k90 n VAL 75 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k90 n GLY 76 N 2.13 2.88 3.75 2.92 0.00 0.45 -5.01 105.19 112.32 3k90 n GLY 76 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 3k90 n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k90 s THR 78 N -1.50 2.86 0.04 0.00 -4.23 -1.26 -1.05 115.64 110.50 3k90 s THR 78 Ca 0.74 -2.13 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 3k90 s THR 78 Cb -0.33 -2.49 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 3k90 s THR 78 CO 0.37 -0.33 -0.10 0.00 -0.54 0.00 0.00 174.62 174.02 3k90 s ARG 79 N -3.40 0.63 -0.37 3.99 1.70 -0.15 -4.51 118.95 116.83 3k90 s ARG 79 Ca 0.29 -0.72 -0.07 0.00 -0.47 0.00 0.00 55.73 54.75 3k90 s ARG 79 Cb -0.06 -0.50 0.05 0.00 -0.57 0.00 0.00 34.95 33.87 3k90 s ARG 79 CO 0.16 0.11 0.17 -0.51 -1.08 0.00 0.00 175.30 174.15 3k90 s ASP 80 N -1.36 5.45 -0.11 -2.89 1.01 -0.21 -1.27 116.67 117.29 3k90 s ASP 80 Ca -0.05 -1.29 -0.18 0.00 0.71 0.00 0.00 52.55 51.74 3k90 s ASP 80 Cb -0.09 -1.92 -0.04 0.00 1.01 0.00 0.00 42.92 41.88 3k90 s ASP 80 CO 0.01 -0.41 0.46 -0.69 0.21 0.00 0.00 175.17 174.75 3k90 s VAL 81 N 1.41 5.17 -0.19 -1.27 1.01 0.26 -2.19 120.40 124.60 3k90 s VAL 81 Ca 0.01 0.92 -0.05 0.00 0.00 0.00 0.00 61.98 62.86 3k90 s VAL 81 Cb -0.21 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 3k90 s VAL 81 CO 0.03 0.36 -0.01 -0.63 0.00 0.00 0.00 175.10 174.84 3k90 s ILE 82 N 0.42 3.88 -0.08 2.22 -1.09 0.43 -0.87 121.20 126.11 3k90 s ILE 82 Ca 0.25 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.34 3k90 s ILE 82 Cb -0.15 -2.75 -0.03 0.00 -1.58 0.00 0.00 42.46 37.95 3k90 s ILE 82 CO 0.10 0.44 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.49 3k90 s VAL 83 N 0.93 3.66 0.91 2.92 1.01 -0.52 0.20 120.40 129.52 3k90 s VAL 83 Ca 0.01 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 3k90 s VAL 83 Cb -0.14 -2.51 0.11 0.00 0.00 0.00 0.00 36.38 33.84 3k90 s VAL 83 CO 0.02 0.58 0.97 2.30 0.00 0.00 0.00 175.10 178.98 3k90 n ILE 84 N 2.41 0.32 -1.12 2.22 -0.00 -1.05 -4.75 119.36 117.40 3k90 n ILE 84 Ca -0.18 -0.08 -0.30 0.00 -0.00 0.00 0.00 62.75 62.19 3k90 n ILE 84 Cb 0.53 -0.94 0.13 0.00 -0.00 0.00 0.00 39.64 39.36 3k90 n ILE 84 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.55 176.11 3k90 s SER 85 N -2.40 3.64 0.00 7.28 0.01 -1.26 -4.26 113.70 116.71 3k90 s SER 85 Ca 0.66 1.70 0.00 0.00 1.31 0.00 0.00 55.95 59.62 3k90 s SER 85 Cb -0.24 -2.36 0.00 0.00 0.21 0.00 0.00 66.02 63.63 3k90 s SER 85 CO 0.59 -2.57 0.00 0.61 0.41 0.00 0.00 173.24 172.28 3k90 n GLY 86 N -0.88 0.21 3.83 3.44 0.00 -1.26 -5.08 105.19 105.45 3k90 n GLY 86 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 3k90 n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k90 s LEU 87 N 0.00 3.20 0.13 0.99 1.43 -1.26 -5.02 118.68 118.15 3k90 s LEU 87 Ca 0.00 -0.93 0.18 0.00 -1.03 0.00 0.00 54.13 52.35 3k90 s LEU 87 Cb 0.00 -1.71 0.77 0.00 0.03 0.00 0.00 46.19 45.28 3k90 s LEU 87 CO 0.00 -0.68 1.56 -2.65 0.23 0.00 0.00 176.35 174.81 3k90 n PRO 88 N -1.47 0.09 -4.42 1.29 -0.02 -1.26 -4.74 135.00 124.48 3k90 n PRO 88 Ca 0.01 0.36 -0.24 0.00 -2.02 0.00 0.00 63.50 61.61 3k90 n PRO 88 Cb 0.63 -1.69 -0.11 0.00 -0.02 0.00 0.00 33.50 32.32 3k90 n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k90 s ALA 89 N -3.17 2.48 -0.22 3.55 0.00 -1.26 -4.48 121.76 118.66 3k90 s ALA 89 Ca 0.05 -1.72 0.11 0.00 0.00 0.00 0.00 51.96 50.39 3k90 s ALA 89 Cb 0.09 -0.25 -0.22 0.00 0.00 0.00 0.00 23.12 22.74 3k90 s ALA 89 CO 0.30 0.29 -0.02 0.09 0.00 0.00 0.00 175.76 176.42 3k90 n ASN 90 N -0.20 0.87 -3.71 0.00 5.03 -1.23 -4.83 115.26 111.18 3k90 n ASN 90 Ca -0.09 -0.04 -0.10 0.00 0.87 0.00 0.00 54.58 55.23 3k90 n ASN 90 Cb 0.58 0.36 -0.05 0.00 -1.02 0.00 0.00 39.78 39.65 3k90 n ASN 90 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 3k90 s THR 91 N -2.51 0.09 -0.17 3.41 -1.32 -1.26 -1.44 115.64 112.44 3k90 s THR 91 Ca -0.20 -0.78 -0.09 0.00 -1.21 0.00 0.00 61.69 59.41 3k90 s THR 91 Cb 0.07 -1.26 0.06 0.00 -1.51 0.00 0.00 72.50 69.86 3k90 s THR 91 CO 0.74 -0.40 0.40 -0.55 -2.21 0.00 0.00 174.62 172.60 3k90 s SER 92 N -2.83 -0.46 -0.18 8.08 0.15 -0.05 -3.69 113.70 114.72 3k90 s SER 92 Ca 0.04 0.88 -0.06 0.00 0.70 0.00 0.00 55.95 57.51 3k90 s SER 92 Cb 0.03 0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 65.12 3k90 s SER 92 CO -0.11 -0.20 0.03 0.28 1.20 0.00 0.00 173.24 174.45 3k90 s THR 93 N 1.56 4.48 0.01 6.45 -1.32 -0.76 0.93 115.64 126.99 3k90 s THR 93 Ca -0.08 -0.14 0.05 0.00 -1.21 0.00 0.00 61.69 60.30 3k90 s THR 93 Cb -0.09 -3.01 -0.02 0.00 -1.51 0.00 0.00 72.50 67.87 3k90 s THR 93 CO -0.13 0.46 -0.15 -1.61 -2.21 0.00 0.00 174.62 170.98 3k90 s GLU 94 N 0.50 1.10 -0.12 7.08 2.02 -0.39 -1.12 118.70 127.76 3k90 s GLU 94 Ca 0.01 -0.66 -0.00 0.00 0.02 0.00 0.00 54.97 54.34 3k90 s GLU 94 Cb -0.13 -1.10 -0.02 0.00 0.10 0.00 0.00 34.13 32.98 3k90 s GLU 94 CO 0.01 0.29 -0.12 0.50 0.02 0.00 0.00 175.26 175.96 3k90 s ARG 95 N -0.74 3.34 -0.13 1.61 3.52 0.26 -0.98 118.95 125.83 3k90 s ARG 95 Ca 0.04 -0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 54.69 3k90 s ARG 95 Cb -0.07 -2.65 -0.03 0.00 -1.56 0.00 0.00 34.95 30.65 3k90 s ARG 95 CO 0.00 0.26 1.45 -1.17 -0.81 0.00 0.00 175.30 175.04 3k90 s LEU 96 N 0.23 4.22 -0.16 -0.88 2.96 -0.22 -1.26 118.68 123.57 3k90 s LEU 96 Ca -0.08 1.90 -0.03 0.00 -0.22 0.00 0.00 54.13 55.71 3k90 s LEU 96 Cb -0.15 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.77 3k90 s LEU 96 CO 0.05 -0.87 0.19 0.47 -1.32 0.00 0.00 176.35 174.87 3k90 n ASP 97 N 6.96 1.98 -3.81 3.68 8.00 -0.20 -0.41 116.55 132.75 3k90 n ASP 97 Ca 0.16 0.11 -0.13 0.00 0.71 0.00 0.00 54.79 55.63 3k90 n ASP 97 Cb 0.44 -0.65 -0.14 0.00 -0.02 0.00 0.00 41.12 40.75 3k90 n ASP 97 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k90 s ILE 98 N -2.55 -0.02 -0.36 0.53 1.01 -1.18 -4.82 121.20 113.81 3k90 s ILE 98 Ca -0.25 0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.49 3k90 s ILE 98 Cb 0.07 -0.17 0.16 0.00 0.01 0.00 0.00 42.46 42.53 3k90 s ILE 98 CO 0.72 0.02 0.38 -0.22 0.00 0.00 0.00 174.94 175.85 3k90 s LEU 99 N 0.41 -0.17 -0.39 2.97 2.96 -1.25 -2.49 118.68 120.71 3k90 s LEU 99 Ca -0.03 -1.45 -0.03 0.00 -0.22 0.00 0.00 54.13 52.40 3k90 s LEU 99 Cb -0.04 0.65 0.10 0.00 0.50 0.00 0.00 46.19 47.39 3k90 s LEU 99 CO -0.02 -0.27 0.18 -0.62 -1.32 0.00 0.00 176.35 174.31 3k90 s ASP 100 N 1.55 5.25 0.46 3.68 -1.08 0.47 -4.96 116.67 122.03 3k90 s ASP 100 Ca 0.16 -1.87 0.25 0.00 -0.52 0.00 0.00 52.55 50.57 3k90 s ASP 100 Cb -0.15 -1.83 1.02 0.00 -1.46 0.00 0.00 42.92 40.51 3k90 s ASP 100 CO -0.06 -0.50 1.87 0.44 0.52 0.00 0.00 175.17 177.43 3k90 h ASP 101 N 8.08 0.00 0.02 -0.34 3.32 -1.97 0.14 116.42 125.67 3k90 h ASP 101 Ca -0.15 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 3k90 h ASP 101 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 3k90 h ASP 101 CO 0.68 0.19 -0.01 -0.33 -1.72 0.00 0.00 179.24 178.06 3k90 h GLU 102 N 0.00 -0.02 -0.01 3.56 4.39 -1.97 -3.33 114.58 117.20 3k90 h GLU 102 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3k90 h GLU 102 Cb 0.68 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 3k90 h GLU 102 CO 0.03 0.64 -0.27 0.54 -1.16 0.00 0.00 179.01 178.79 3k90 n ARG 103 N -4.77 1.15 -3.26 2.33 1.74 -1.20 -4.98 116.66 107.66 3k90 n ARG 103 Ca -0.09 -0.79 -0.14 0.00 -0.77 0.00 0.00 57.85 56.06 3k90 n ARG 103 Cb 0.33 -1.48 0.06 0.00 -1.02 0.00 0.00 32.46 30.35 3k90 n ARG 103 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k90 n ARG 104 N -0.24 -2.09 -4.16 5.56 1.74 0.42 -4.68 116.66 113.21 3k90 n ARG 104 Ca 0.12 0.91 -0.23 0.00 -0.77 0.00 0.00 57.85 57.89 3k90 n ARG 104 Cb 0.40 -5.72 -0.17 0.00 -1.02 0.00 0.00 32.46 25.95 3k90 n ARG 104 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3k90 s VAL 105 N -3.35 0.73 0.40 1.55 1.01 -0.73 -1.57 120.40 118.44 3k90 s VAL 105 Ca 0.41 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.24 3k90 s VAL 105 Cb -0.06 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 3k90 s VAL 105 CO 0.75 0.28 0.05 0.42 0.00 0.00 0.00 175.10 176.60 3k90 s THR 106 N 1.15 1.26 -0.06 3.92 -4.23 -0.49 -0.40 115.64 116.80 3k90 s THR 106 Ca -0.07 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.13 3k90 s THR 106 Cb -0.14 -2.64 0.11 0.00 1.34 0.00 0.00 72.50 71.18 3k90 s THR 106 CO -0.01 0.00 1.06 -0.83 -0.54 0.00 0.00 174.62 174.30 3k90 s GLY 107 N -3.64 -0.37 0.09 3.99 0.00 -1.04 0.02 107.32 106.37 3k90 s GLY 107 Ca 0.28 1.10 -0.12 0.00 0.00 0.00 0.00 44.72 45.98 3k90 s GLY 107 CO 0.14 0.35 0.26 -0.11 0.00 0.00 0.00 173.10 173.74 3k90 s PHE 108 N -2.79 0.01 -0.02 1.90 -0.12 -0.62 -1.03 117.98 115.30 3k90 s PHE 108 Ca 0.09 -0.34 0.07 0.00 -0.05 0.00 0.00 56.93 56.70 3k90 s PHE 108 Cb -0.00 0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.42 3k90 s PHE 108 CO -0.06 -0.57 -0.24 -1.12 -0.05 0.00 0.00 175.22 173.19 3k90 s SER 109 N -2.64 2.78 -0.14 1.98 0.01 -0.39 -0.94 113.70 114.37 3k90 s SER 109 Ca 0.02 -0.43 -0.29 0.00 1.31 0.00 0.00 55.95 56.56 3k90 s SER 109 Cb 0.03 -0.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.90 3k90 s SER 109 CO -0.09 0.29 0.98 -0.63 0.41 0.00 0.00 173.24 174.19 3k90 s ILE 110 N -0.52 4.79 -0.34 1.44 1.01 -0.20 -0.57 121.20 126.81 3k90 s ILE 110 Ca 0.08 1.97 0.04 0.00 0.00 0.00 0.00 60.65 62.73 3k90 s ILE 110 Cb -0.09 -4.28 -0.00 0.00 0.01 0.00 0.00 42.46 38.09 3k90 s ILE 110 CO -0.01 -0.02 0.39 2.30 0.00 0.00 0.00 174.94 177.60 3k90 n ILE 111 N 4.70 0.00 -3.88 2.92 -5.35 -0.28 -4.38 119.36 113.09 3k90 n ILE 111 Ca 0.08 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 3k90 n ILE 111 Cb 0.48 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.43 3k90 n ILE 111 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3k90 n GLY 112 N 0.66 0.55 0.00 3.28 0.00 -1.12 -4.99 105.19 103.57 3k90 n GLY 112 Ca 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.17 3k90 n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k90 n GLY 113 N -0.15 0.86 3.31 -0.02 0.00 -1.26 -1.83 105.19 106.09 3k90 n GLY 113 Ca 0.01 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.70 3k90 n GLY 113 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k90 s GLU 114 N -1.88 2.84 0.00 1.61 2.56 -1.24 -4.96 118.70 117.62 3k90 s GLU 114 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 54.97 53.94 3k90 s GLU 114 Cb 0.00 -3.43 0.00 0.00 2.00 0.00 0.00 34.13 32.70 3k90 s GLU 114 CO 0.00 -0.57 0.00 -2.39 -0.56 0.00 0.00 175.26 171.74 3k90 n HIS 115 N 4.85 -0.33 -1.06 5.30 1.44 -1.26 -3.56 115.22 120.60 3k90 n HIS 115 Ca -0.13 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.65 3k90 n HIS 115 Cb 0.46 0.00 0.23 0.00 0.12 0.00 0.00 29.99 30.81 3k90 n HIS 115 CO 0.00 0.00 0.00 2.89 -2.81 0.00 0.00 176.34 176.42 3k90 n ARG 116 N 0.00 2.53 -2.09 -1.40 0.00 -1.26 -4.81 116.66 109.63 3k90 n ARG 116 Ca 0.00 -2.84 -0.32 0.00 -0.00 0.00 0.00 57.85 54.69 3k90 n ARG 116 Cb 0.00 -1.79 0.03 0.00 -0.00 0.00 0.00 32.46 30.70 3k90 n ARG 116 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3k90 n LEU 117 N -0.74 6.12 -4.75 2.89 4.32 -1.26 -4.81 117.00 118.77 3k90 n LEU 117 Ca 0.22 -4.92 -0.41 0.00 -0.02 0.00 0.00 56.01 50.87 3k90 n LEU 117 Cb 0.87 -0.73 -0.01 0.00 -1.62 0.00 0.00 43.42 41.92 3k90 n LEU 117 CO 0.13 1.96 1.25 0.42 -1.22 0.00 0.00 177.39 179.93 3k90 s THR 118 N -5.18 2.03 -1.79 -5.08 -4.23 -1.26 -1.93 115.64 98.21 3k90 s THR 118 Ca 0.52 0.03 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 3k90 s THR 118 Cb 0.43 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 71.25 3k90 s THR 118 CO -0.23 0.00 0.00 0.59 -0.54 0.00 0.00 174.62 174.45 3k90 n ASN 119 N 2.12 -5.11 -4.70 3.99 3.02 -1.26 -3.04 115.26 110.27 3k90 n ASN 119 Ca 0.08 0.35 -0.43 0.00 -0.03 0.00 0.00 54.58 54.55 3k90 n ASN 119 Cb 0.37 -4.15 -0.03 0.00 -0.61 0.00 0.00 39.78 35.36 3k90 n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k90 n TYR 120 N -2.78 2.64 -3.86 3.10 4.19 -0.81 -4.46 117.16 115.17 3k90 n TYR 120 Ca -0.18 -0.05 -0.16 0.00 3.31 0.00 0.00 57.90 60.82 3k90 n TYR 120 Cb 0.59 -2.70 -0.16 0.00 0.49 0.00 0.00 39.34 37.56 3k90 n TYR 120 CO 0.00 0.00 0.00 0.21 0.91 0.00 0.00 176.86 177.98 3k90 s LYS 121 N 2.10 0.17 0.16 2.98 2.20 -0.70 -1.03 119.74 125.62 3k90 s LYS 121 Ca 0.80 0.12 0.07 0.00 -0.36 0.00 0.00 55.97 56.60 3k90 s LYS 121 Cb -0.51 -0.39 -0.04 0.00 -1.51 0.00 0.00 37.83 35.37 3k90 s LYS 121 CO 0.36 -0.15 -0.14 -1.54 -0.36 0.00 0.00 175.35 173.52 3k90 s SER 122 N 1.05 2.29 -0.03 1.43 1.04 -0.11 -1.54 113.70 117.83 3k90 s SER 122 Ca -0.09 -0.93 0.02 0.00 0.48 0.00 0.00 55.95 55.43 3k90 s SER 122 Cb -0.13 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 65.90 3k90 s SER 122 CO -0.02 -0.17 -0.09 -0.69 0.98 0.00 0.00 173.24 173.25 3k90 s VAL 123 N -2.63 0.79 -0.11 5.02 1.01 -0.32 -1.58 120.40 122.57 3k90 s VAL 123 Ca 0.16 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.84 3k90 s VAL 123 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.64 3k90 s VAL 123 CO 0.05 0.26 -0.21 -0.89 0.00 0.00 0.00 175.10 174.30 3k90 s THR 124 N 0.36 1.90 0.00 3.92 2.01 0.10 -1.44 115.64 122.49 3k90 s THR 124 Ca -0.06 -0.91 0.07 0.00 0.31 0.00 0.00 61.69 61.10 3k90 s THR 124 Cb -0.10 -1.67 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 3k90 s THR 124 CO 0.01 0.52 -0.21 0.42 -0.69 0.00 0.00 174.62 174.67 3k90 s THR 125 N 0.57 1.65 -0.11 -0.82 -4.23 0.40 -1.39 115.64 111.72 3k90 s THR 125 Ca -0.14 -0.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.39 3k90 s THR 125 Cb -0.17 -1.39 -0.02 0.00 1.34 0.00 0.00 72.50 72.26 3k90 s THR 125 CO 0.04 0.38 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.68 3k90 s VAL 126 N -0.58 3.07 -0.01 2.29 1.01 -0.61 -1.12 120.40 124.45 3k90 s VAL 126 Ca 0.08 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.42 3k90 s VAL 126 Cb -0.08 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 3k90 s VAL 126 CO 0.00 0.54 -0.13 -1.00 0.00 0.00 0.00 175.10 174.51 3k90 s HIS 127 N 0.02 1.20 0.01 5.22 3.76 0.31 -4.78 115.29 121.03 3k90 s HIS 127 Ca -0.04 -0.23 -0.17 0.00 -0.15 0.00 0.00 55.06 54.47 3k90 s HIS 127 Cb -0.14 -0.78 -0.06 0.00 1.11 0.00 0.00 32.58 32.71 3k90 s HIS 127 CO 0.04 -0.03 0.47 0.50 -0.85 0.00 0.00 174.74 174.88 3k90 s ARG 128 N -0.29 4.07 -0.06 1.40 3.52 -1.26 -1.34 118.95 124.99 3k90 s ARG 128 Ca 0.05 0.53 0.03 0.00 -0.13 0.00 0.00 55.73 56.20 3k90 s ARG 128 Cb -0.05 -3.26 0.01 0.00 -1.56 0.00 0.00 34.95 30.09 3k90 s ARG 128 CO -0.00 0.60 -0.15 -0.06 -0.81 0.00 0.00 175.30 174.88 3k90 s PHE 129 N -0.84 1.62 -0.08 5.12 0.08 -0.36 -4.93 117.98 118.58 3k90 s PHE 129 Ca 0.26 -0.56 -0.00 0.00 0.12 0.00 0.00 56.93 56.75 3k90 s PHE 129 Cb -0.17 -1.14 0.02 0.00 -0.57 0.00 0.00 43.02 41.16 3k90 s PHE 129 CO 0.15 -0.25 -0.05 -1.83 -0.10 0.00 0.00 175.22 173.14 3k90 s GLU 130 N 0.41 1.09 0.00 0.44 1.03 -1.26 -1.92 118.70 118.49 3k90 s GLU 130 Ca -0.11 -0.11 0.00 0.00 0.03 0.00 0.00 54.97 54.77 3k90 s GLU 130 Cb -0.14 -1.21 0.00 0.00 -0.80 0.00 0.00 34.13 31.98 3k90 s GLU 130 CO 0.04 -0.21 0.00 1.63 -1.33 0.00 0.00 175.26 175.38 3k90 n LYS 131 N 4.72 0.00 -4.69 -4.83 5.02 -1.15 -4.88 118.16 112.35 3k90 n LYS 131 Ca -0.14 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.90 3k90 n LYS 131 Cb 0.50 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 35.35 3k90 n LYS 131 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3k90 s GLU 132 N 0.00 1.69 -1.48 1.97 8.01 -1.26 -4.73 118.70 122.90 3k90 s GLU 132 Ca 0.00 -0.50 -0.12 0.00 0.01 0.00 0.00 54.97 54.36 3k90 s GLU 132 Cb 0.00 -1.43 0.06 0.00 -4.31 0.00 0.00 34.13 28.45 3k90 s GLU 132 CO 0.00 0.13 1.03 0.09 0.01 0.00 0.00 175.26 176.52 3k90 n ASN 133 N 3.45 -5.35 -3.68 -0.19 3.02 -1.26 -4.99 115.26 106.25 3k90 n ASN 133 Ca -0.20 -0.68 -0.10 0.00 -0.03 0.00 0.00 54.58 53.58 3k90 n ASN 133 Cb 0.53 -4.25 -0.10 0.00 -0.61 0.00 0.00 39.78 35.34 3k90 n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k90 s ARG 134 N -6.49 0.42 -0.09 3.52 1.70 -1.26 -5.17 118.95 111.58 3k90 s ARG 134 Ca 0.63 0.89 0.04 0.00 -0.47 0.00 0.00 55.73 56.82 3k90 s ARG 134 Cb -0.30 0.07 -0.00 0.00 -0.57 0.00 0.00 34.95 34.15 3k90 s ARG 134 CO 0.77 -0.17 -0.23 0.42 -1.08 0.00 0.00 175.30 175.01 3k90 s ILE 135 N 1.67 1.93 0.32 4.99 1.01 -1.26 -2.92 121.20 126.94 3k90 s ILE 135 Ca -0.08 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 59.68 3k90 s ILE 135 Cb -0.09 -1.66 -0.02 0.00 0.01 0.00 0.00 42.46 40.70 3k90 s ILE 135 CO -0.14 0.53 0.30 -2.67 0.00 0.00 0.00 174.94 172.96 3k90 n TRP 136 N 3.43 -0.85 -4.91 3.97 2.14 -0.81 -4.60 117.44 115.82 3k90 n TRP 136 Ca -0.19 -2.62 -0.26 0.00 2.07 0.00 0.00 57.50 56.49 3k90 n TRP 136 Cb 0.53 0.31 -0.16 0.00 -0.81 0.00 0.00 31.31 31.18 3k90 n TRP 136 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 3k90 s THR 137 N -3.23 1.51 -0.13 -1.67 2.01 -0.02 -1.23 115.64 112.88 3k90 s THR 137 Ca 0.37 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.58 3k90 s THR 137 Cb 0.01 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.24 3k90 s THR 137 CO 0.26 0.43 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.78 3k90 s VAL 138 N -0.22 2.87 -0.18 3.82 1.01 -0.45 0.31 120.40 127.56 3k90 s VAL 138 Ca 0.02 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 3k90 s VAL 138 Cb -0.10 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 3k90 s VAL 138 CO 0.01 0.52 0.04 -0.69 0.00 0.00 0.00 175.10 174.98 3k90 s VAL 139 N 0.45 4.49 -0.08 2.92 1.01 -0.03 -0.53 120.40 128.62 3k90 s VAL 139 Ca -0.11 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.74 3k90 s VAL 139 Cb -0.16 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3k90 s VAL 139 CO 0.05 0.45 -0.09 -0.76 0.00 0.00 0.00 175.10 174.75 3k90 s LEU 140 N 0.53 2.99 -0.06 3.92 1.43 -0.27 -1.33 118.68 125.89 3k90 s LEU 140 Ca 0.01 -0.13 -0.02 0.00 -1.03 0.00 0.00 54.13 52.96 3k90 s LEU 140 Cb -0.13 -1.65 0.04 0.00 0.03 0.00 0.00 46.19 44.47 3k90 s LEU 140 CO 0.01 0.31 0.10 -0.70 0.23 0.00 0.00 176.35 176.30 3k90 s GLU 141 N -0.47 -0.01 0.20 1.70 2.12 -0.56 -0.45 118.70 121.22 3k90 s GLU 141 Ca 0.07 0.41 0.09 0.00 0.36 0.00 0.00 54.97 55.89 3k90 s GLU 141 Cb -0.12 -0.34 -0.05 0.00 0.26 0.00 0.00 34.13 33.89 3k90 s GLU 141 CO 0.02 -0.27 -0.17 -1.54 -0.54 0.00 0.00 175.26 172.76 3k90 s SER 142 N 1.89 2.74 0.08 -1.70 1.04 -0.52 -0.91 113.70 116.33 3k90 s SER 142 Ca 0.00 -0.96 -0.02 0.00 0.48 0.00 0.00 55.95 55.45 3k90 s SER 142 Cb -0.12 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 3k90 s SER 142 CO -0.04 -0.09 0.03 -0.72 0.98 0.00 0.00 173.24 173.39 3k90 s TYR 143 N -2.57 0.58 -0.09 5.02 -0.85 -0.28 -1.17 117.35 117.99 3k90 s TYR 143 Ca 0.21 -1.06 0.03 0.00 -0.52 0.00 0.00 57.07 55.73 3k90 s TYR 143 Cb -0.03 -0.37 0.01 0.00 0.38 0.00 0.00 41.96 41.95 3k90 s TYR 143 CO 0.08 -0.45 -0.17 0.08 -1.52 0.00 0.00 175.55 173.56 3k90 s VAL 144 N -3.95 1.55 0.05 -3.49 1.01 -0.59 -1.82 120.40 113.15 3k90 s VAL 144 Ca 0.12 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.41 3k90 s VAL 144 Cb 0.07 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 3k90 s VAL 144 CO -0.06 0.45 -0.07 0.68 0.00 0.00 0.00 175.10 176.10 3k90 s VAL 145 N 0.59 0.50 -0.08 2.92 -7.23 -0.23 -1.71 120.40 115.14 3k90 s VAL 145 Ca -0.15 -1.20 -0.07 0.00 -1.81 0.00 0.00 61.98 58.75 3k90 s VAL 145 Cb -0.17 -0.74 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 3k90 s VAL 145 CO 0.05 -0.48 0.17 -1.81 -0.31 0.00 0.00 175.10 172.72 3k90 s ASP 146 N -1.81 6.42 0.37 4.85 1.01 -1.17 0.16 116.67 126.51 3k90 s ASP 146 Ca -0.07 0.49 -0.00 0.00 0.71 0.00 0.00 52.55 53.67 3k90 s ASP 146 Cb -0.07 -2.07 -0.03 0.00 1.01 0.00 0.00 42.92 41.76 3k90 s ASP 146 CO -0.01 0.37 0.59 0.00 0.21 0.00 0.00 175.17 176.33 3k90 s MET 147 N -1.24 3.45 0.66 8.23 0.23 -0.73 -4.38 119.30 125.52 3k90 s MET 147 Ca 0.19 -0.29 0.39 0.00 -1.03 0.00 0.00 55.69 54.95 3k90 s MET 147 Cb -0.12 -2.62 2.16 0.00 -1.53 0.00 0.00 34.83 32.72 3k90 s MET 147 CO 0.08 0.07 2.25 -1.35 -2.03 0.00 0.00 175.02 174.04 3k90 h PRO 148 N 0.65 0.00 0.00 3.16 0.11 -1.89 -3.47 132.00 130.57 3k90 h PRO 148 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3k90 h PRO 148 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3k90 h PRO 148 CO 0.61 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.49 3k90 n GLU 153 N -3.16 0.00 -0.12 1.05 4.07 -1.26 -5.10 120.64 116.12 3k90 n GLU 153 Ca -0.02 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.04 3k90 n GLU 153 Cb 0.16 0.00 0.17 0.00 -0.06 0.00 0.00 31.44 31.71 3k90 n GLU 153 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3k90 h ASP 154 N 0.00 0.77 0.52 4.31 3.32 -2.05 -3.23 116.42 120.06 3k90 h ASP 154 Ca 0.00 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 3k90 h ASP 154 Cb 0.00 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3k90 h ASP 154 CO 0.00 0.80 -0.26 0.44 -1.72 0.00 0.00 179.24 178.50 3k90 h ASP 155 N 0.77 -0.62 -0.60 6.45 3.45 -2.05 0.41 116.42 124.23 3k90 h ASP 155 Ca 0.16 0.02 0.07 0.00 0.43 0.00 0.00 57.03 57.71 3k90 h ASP 155 Cb 0.39 0.16 -0.06 0.00 -0.56 0.00 0.00 39.33 39.26 3k90 h ASP 155 CO 0.01 -0.43 0.29 0.74 -1.57 0.00 0.00 179.24 178.27 3k90 h THR 156 N -0.71 0.90 -0.41 0.35 2.02 -2.00 -0.02 112.91 113.04 3k90 h THR 156 Ca -0.07 -0.18 -0.08 0.00 0.77 0.00 0.00 66.41 66.85 3k90 h THR 156 Cb 0.55 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 3k90 h THR 156 CO 0.11 0.10 -0.06 -0.09 0.37 0.00 0.00 175.52 175.94 3k90 h ARG 157 N 0.53 0.76 -0.64 6.66 2.43 -1.52 -1.87 114.38 120.74 3k90 h ARG 157 Ca 0.28 -0.28 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 3k90 h ARG 157 Cb 0.24 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 3k90 h ARG 157 CO -0.21 0.88 0.14 0.52 -1.51 0.00 0.00 179.97 179.79 3k90 h MET 158 N 0.59 1.04 0.21 0.20 2.86 0.23 -1.27 114.93 118.79 3k90 h MET 158 Ca 0.11 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 3k90 h MET 158 Cb 0.58 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.11 3k90 h MET 158 CO 0.03 0.94 -0.10 0.35 1.06 0.00 0.00 176.91 179.19 3k90 h PHE 159 N 0.96 -0.27 -0.53 -0.22 3.57 -0.90 -1.95 116.94 117.61 3k90 h PHE 159 Ca 0.20 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.61 3k90 h PHE 159 Cb 0.38 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 3k90 h PHE 159 CO 0.03 -0.12 0.01 0.00 -2.23 0.00 0.00 178.31 176.00 3k90 h ALA 160 N 0.42 0.71 -0.87 2.41 0.00 -1.30 -1.99 119.26 118.65 3k90 h ALA 160 Ca -0.03 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.67 3k90 h ALA 160 Cb 0.27 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 3k90 h ALA 160 CO 0.05 0.52 0.53 -0.44 0.00 0.00 0.00 179.25 179.90 3k90 h ASP 161 N 0.80 0.81 0.05 0.00 3.32 -1.25 -0.04 116.42 120.11 3k90 h ASP 161 Ca 0.15 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 3k90 h ASP 161 Cb 0.52 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3k90 h ASP 161 CO 0.03 0.49 -0.03 0.74 -1.72 0.00 0.00 179.24 178.75 3k90 h THR 162 N 0.93 1.03 -0.07 0.35 2.02 -0.65 -1.62 112.91 114.91 3k90 h THR 162 Ca 0.39 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.31 3k90 h THR 162 Cb 0.25 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3k90 h THR 162 CO -0.20 0.07 0.04 0.58 0.37 0.00 0.00 175.52 176.38 3k90 h VAL 163 N -0.19 1.03 -0.25 3.16 2.07 -1.07 -2.03 116.25 118.96 3k90 h VAL 163 Ca -0.01 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.45 3k90 h VAL 163 Cb 0.17 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 3k90 h VAL 163 CO 0.01 0.03 0.15 0.58 0.02 0.00 0.00 177.57 178.36 3k90 h VAL 164 N 0.08 1.04 -0.20 2.57 2.07 -0.95 0.23 116.25 121.11 3k90 h VAL 164 Ca 0.03 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.44 3k90 h VAL 164 Cb 0.01 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3k90 h VAL 164 CO -0.01 0.06 0.12 0.11 0.02 0.00 0.00 177.57 177.87 3k90 h LYS 165 N 0.32 0.23 -0.40 1.57 1.57 -1.22 -0.26 116.57 118.38 3k90 h LYS 165 Ca 0.09 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 3k90 h LYS 165 Cb -0.02 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 3k90 h LYS 165 CO -0.03 0.16 0.18 -0.07 -0.57 0.00 0.00 179.45 179.11 3k90 h LEU 166 N 0.24 0.24 -0.72 2.94 3.38 -1.13 0.04 115.31 120.31 3k90 h LEU 166 Ca 0.07 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3k90 h LEU 166 Cb -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3k90 h LEU 166 CO -0.03 0.18 0.36 0.78 0.09 0.00 0.00 178.44 179.81 3k90 h ASN 167 N 0.37 0.93 -0.64 -0.43 2.35 -0.77 -0.83 115.58 116.56 3k90 h ASN 167 Ca 0.18 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 3k90 h ASN 167 Cb 0.11 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 3k90 h ASN 167 CO -0.14 0.79 0.26 -0.07 -1.65 0.00 0.00 177.43 176.62 3k90 h LEU 168 N 1.00 0.90 -0.40 1.61 3.38 -0.71 -0.02 115.31 121.08 3k90 h LEU 168 Ca 0.25 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3k90 h LEU 168 Cb 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3k90 h LEU 168 CO -0.03 0.80 0.24 1.56 0.09 0.00 0.00 178.44 181.10 3k90 h GLN 169 N 0.96 0.54 -0.37 1.13 4.20 -0.58 -1.07 115.11 119.91 3k90 h GLN 169 Ca 0.22 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 3k90 h GLN 169 Cb 0.19 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3k90 h GLN 169 CO -0.02 0.39 0.23 -0.22 -0.67 0.00 0.00 178.83 178.54 3k90 h LYS 170 N 0.52 0.51 -0.50 1.46 3.64 -0.88 -1.45 116.57 119.88 3k90 h LYS 170 Ca 0.14 -0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.57 3k90 h LYS 170 Cb -0.01 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.63 3k90 h LYS 170 CO -0.03 0.38 0.06 1.25 -2.27 0.00 0.00 179.45 178.84 3k90 h LEU 171 N 0.49 -0.08 -0.40 5.20 6.46 -0.75 0.20 115.31 126.43 3k90 h LEU 171 Ca 0.13 0.10 0.02 0.00 -0.12 0.00 0.00 57.88 58.01 3k90 h LEU 171 Cb 0.00 0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.06 3k90 h LEU 171 CO -0.03 -0.01 0.23 0.00 -0.62 0.00 0.00 178.44 178.02 3k90 h ALA 172 N 1.41 0.50 0.07 1.25 0.00 -0.95 -0.91 119.26 120.63 3k90 h ALA 172 Ca 0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3k90 h ALA 172 Cb 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3k90 h ALA 172 CO -0.36 -0.10 -0.03 1.15 0.00 0.00 0.00 179.25 179.91 3k90 h THR 173 N 0.48 1.04 -0.31 0.00 2.02 -0.37 -1.25 112.91 114.52 3k90 h THR 173 Ca 0.16 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.96 3k90 h THR 173 Cb 0.00 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 3k90 h THR 173 CO -0.07 0.09 0.20 0.58 0.37 0.00 0.00 175.52 176.69 3k90 h VAL 174 N -0.26 1.09 -0.69 3.16 2.07 -0.57 -0.51 116.25 120.54 3k90 h VAL 174 Ca -0.01 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.32 3k90 h VAL 174 Cb 0.23 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3k90 h VAL 174 CO 0.02 0.09 0.43 0.00 0.02 0.00 0.00 177.57 178.13 3k90 h ALA 175 N 1.10 0.88 -0.05 1.67 0.00 -1.18 -1.95 119.26 119.73 3k90 h ALA 175 Ca 0.11 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 3k90 h ALA 175 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3k90 h ALA 175 CO -0.02 0.34 -0.42 0.93 0.00 0.00 0.00 179.25 180.08 3k90 h GLU 176 N 0.94 0.11 -0.09 0.00 5.08 -0.92 -1.17 114.58 118.53 3k90 h GLU 176 Ca 0.25 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.42 3k90 h GLU 176 Cb -0.06 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3k90 h GLU 176 CO -0.05 0.51 -0.54 0.00 -1.00 0.00 0.00 179.01 177.93 3k90 h ALA 177 N 1.48 0.90 -0.05 3.43 0.00 -0.85 -2.83 119.26 121.34 3k90 h ALA 177 Ca 0.01 -0.50 -0.20 0.00 0.00 0.00 0.00 54.91 54.21 3k90 h ALA 177 Cb 0.78 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 3k90 h ALA 177 CO 0.06 0.69 -0.83 0.52 0.00 0.00 0.00 179.25 179.69 3k90 h MET 178 N 0.21 0.42 -0.43 0.00 2.86 -0.99 -3.19 114.93 113.81 3k90 h MET 178 Ca 0.00 -0.39 -0.06 0.00 -2.06 0.00 0.00 59.70 57.20 3k90 h MET 178 Cb 1.03 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 3k90 h MET 178 CO 0.09 1.04 0.02 0.00 1.06 0.00 0.00 176.91 179.12 3k90 h ALA 179 N 0.84 1.24 0.00 6.32 0.00 -1.19 -3.52 119.26 122.95 3k90 h ALA 179 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3k90 h ALA 179 Cb 1.43 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3k90 h ALA 179 CO 0.14 0.51 0.00 0.54 0.00 0.00 0.00 179.25 180.44