#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6b s SER 1 N 0.00 0.42 0.29 1.61 0.01 -1.26 -5.05 113.70 109.72 2k6b s SER 1 Ca 0.00 0.26 0.04 0.00 1.31 0.00 0.00 55.95 57.56 2k6b s SER 1 Cb 0.00 0.96 0.66 0.00 0.21 0.00 0.00 66.02 67.85 2k6b s SER 1 CO 0.00 -0.29 1.78 0.00 0.41 0.00 0.00 173.24 175.14 2k6b h ALA 2 N 8.22 1.56 -0.46 1.44 0.00 -2.05 0.43 119.26 128.41 2k6b h ALA 2 Ca -0.18 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2k6b h ALA 2 Cb 1.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2k6b h ALA 2 CO 0.24 -0.01 -0.01 0.22 0.00 0.00 0.00 179.25 179.69 2k6b h ASP 3 N 0.77 0.73 0.01 0.00 3.58 -2.00 -1.41 116.42 118.11 2k6b h ASP 3 Ca 0.54 -0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.81 2k6b h ASP 3 Cb 0.78 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2k6b h ASP 3 CO -0.36 0.81 -0.01 -0.08 -2.88 0.00 0.00 179.24 176.72 2k6b h GLU 4 N 0.71 -0.02 0.00 0.28 4.22 -1.62 -3.33 114.58 114.83 2k6b h GLU 4 Ca 0.14 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.55 2k6b h GLU 4 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 2k6b h GLU 4 CO 0.02 0.70 -0.13 1.05 -2.18 0.00 0.00 179.01 178.47 2k6b h GLU 5 N -0.96 0.00 -0.18 1.92 4.11 -0.97 0.46 114.58 118.95 2k6b h GLU 5 Ca -0.00 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.45 2k6b h GLU 5 Cb 0.73 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 2k6b h GLU 5 CO 0.00 0.13 0.03 1.25 0.07 0.00 0.00 179.01 180.50 2k6b h LEU 6 N 0.00 0.00 0.15 3.06 6.46 -1.36 0.26 115.31 123.89 2k6b h LEU 6 Ca -0.00 0.03 -0.30 0.00 -0.12 0.00 0.00 57.88 57.49 2k6b h LEU 6 Cb 0.25 0.04 0.03 0.00 -0.73 0.00 0.00 40.66 40.26 2k6b h LEU 6 CO 0.02 0.03 -1.27 -0.33 -0.62 0.00 0.00 178.44 176.26 2k6b h GLU 7 N 0.11 0.59 0.23 1.25 4.39 -1.50 -2.82 114.58 116.81 2k6b h GLU 7 Ca 0.08 -0.84 -0.01 0.00 0.34 0.00 0.00 59.36 58.93 2k6b h GLU 7 Cb 0.08 0.29 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2k6b h GLU 7 CO -0.11 1.39 -0.11 0.00 -1.16 0.00 0.00 179.01 179.01 2k6b h ALA 8 N 0.24 -0.31 0.02 3.43 0.00 -0.75 0.16 119.26 122.06 2k6b h ALA 8 Ca -0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2k6b h ALA 8 Cb 1.96 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.87 2k6b h ALA 8 CO 0.24 -0.66 -0.01 1.25 0.00 0.00 0.00 179.25 180.07 2k6b h LEU 9 N -0.33 -0.03 -0.57 0.00 6.46 -0.61 -1.40 115.31 118.84 2k6b h LEU 9 Ca -0.03 -0.11 -0.04 0.00 -0.12 0.00 0.00 57.88 57.58 2k6b h LEU 9 Cb 0.25 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.16 2k6b h LEU 9 CO 0.05 0.10 0.20 -0.09 -0.62 0.00 0.00 178.44 178.08 2k6b h ARG 10 N -0.15 0.87 -0.19 1.25 2.43 -1.39 0.30 114.38 117.49 2k6b h ARG 10 Ca -0.00 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 2k6b h ARG 10 Cb 0.14 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2k6b h ARG 10 CO 0.01 0.77 0.09 -0.09 -1.51 0.00 0.00 179.97 179.24 2k6b h ARG 11 N 0.79 0.27 -0.21 0.20 9.65 -0.59 0.12 114.38 124.61 2k6b h ARG 11 Ca 0.19 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.02 2k6b h ARG 11 Cb 0.24 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 2k6b h ARG 11 CO -0.01 0.30 0.11 0.37 2.80 0.00 0.00 179.97 183.54 2k6b h GLN 12 N 0.18 0.30 -0.79 0.20 4.15 -1.01 -0.78 115.11 117.35 2k6b h GLN 12 Ca 0.06 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.52 2k6b h GLN 12 Cb 0.12 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 2k6b h GLN 12 CO -0.01 0.30 0.46 -0.09 -1.93 0.00 0.00 178.83 177.56 2k6b h ARG 13 N 0.23 0.79 -0.61 1.69 2.43 -0.10 0.26 114.38 119.07 2k6b h ARG 13 Ca 0.07 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 2k6b h ARG 13 Cb 0.09 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2k6b h ARG 13 CO -0.01 0.53 0.13 -0.07 -1.51 0.00 0.00 179.97 179.03 2k6b h LEU 14 N 0.82 0.95 -0.54 3.80 -0.00 -0.38 -2.11 115.31 117.85 2k6b h LEU 14 Ca 0.36 -0.25 -0.07 0.00 -0.00 0.00 0.00 57.88 57.92 2k6b h LEU 14 Cb 0.26 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 40.65 2k6b h LEU 14 CO -0.21 0.95 0.05 0.00 -0.00 0.00 0.00 178.44 179.23 2k6b h ALA 15 N 1.03 0.72 -0.50 1.53 0.00 0.02 0.42 119.26 122.48 2k6b h ALA 15 Ca 0.19 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.90 2k6b h ALA 15 Cb 0.39 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 2k6b h ALA 15 CO 0.01 0.50 0.16 0.93 0.00 0.00 0.00 179.25 180.84 2k6b h GLU 16 N 0.80 0.31 0.59 0.00 4.39 -0.31 -3.02 114.58 117.34 2k6b h GLU 16 Ca 0.16 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 2k6b h GLU 16 Cb 0.47 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.05 2k6b h GLU 16 CO 0.02 0.21 -0.28 1.25 -1.16 0.00 0.00 179.01 179.04 2k6b h LEU 17 N 0.32 -0.67 0.00 1.33 7.12 -1.14 -3.46 115.31 118.82 2k6b h LEU 17 Ca 0.24 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.23 2k6b h LEU 17 Cb 0.28 0.17 0.00 0.00 -0.53 0.00 0.00 40.66 40.58 2k6b h LEU 17 CO -0.27 -0.29 0.00 0.00 -0.13 0.00 0.00 178.44 177.76 2k6b n GLN 18 N -5.32 0.26 -0.98 1.25 1.13 -0.55 -5.12 117.38 108.05 2k6b n GLN 18 Ca -0.11 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.95 2k6b n GLN 18 Cb 0.33 -0.06 0.00 0.00 0.11 0.00 0.00 30.24 30.62 2k6b n GLN 18 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k6b n ALA 19 N -0.33 -2.71 -3.53 -1.58 0.00 0.14 -4.89 120.51 107.61 2k6b n ALA 19 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2k6b n ALA 19 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2k6b n ALA 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2k6b s LYS 20 N -1.73 0.98 -0.00 0.00 -2.85 -1.26 -4.94 119.74 109.94 2k6b s LYS 20 Ca 0.00 0.22 0.01 0.00 -1.00 0.00 0.00 55.97 55.19 2k6b s LYS 20 Cb 0.00 0.46 0.01 0.00 -2.06 0.00 0.00 37.83 36.24 2k6b s LYS 20 CO 0.00 -0.31 0.97 1.58 0.10 0.00 0.00 175.35 177.69 2k6b n HIS 21 N 0.83 0.00 -1.51 1.78 -0.00 -1.26 -4.84 115.22 110.22 2k6b n HIS 21 Ca -0.17 -0.03 -0.36 0.00 0.46 0.00 0.00 57.72 57.61 2k6b n HIS 21 Cb 0.57 -0.05 -0.04 0.00 -0.12 0.00 0.00 29.99 30.36 2k6b n HIS 21 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2k6b n GLY 22 N -0.05 4.45 3.13 1.57 0.00 -1.26 -4.75 105.19 108.29 2k6b n GLY 22 Ca 0.01 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 2k6b n GLY 22 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k6b s ASP 23 N 1.49 -0.07 -0.18 1.61 -4.77 -1.26 -4.91 116.67 108.58 2k6b s ASP 23 Ca 0.64 0.75 0.09 0.00 -3.30 0.00 0.00 52.55 50.73 2k6b s ASP 23 Cb 0.21 0.85 0.57 0.00 -1.09 0.00 0.00 42.92 43.46 2k6b s ASP 23 CO -0.07 -0.22 1.40 -0.81 0.70 0.00 0.00 175.17 176.17 2k6b n PRO 24 N 5.00 3.58 0.00 2.11 -0.05 -1.26 -4.93 135.00 139.45 2k6b n PRO 24 Ca -0.13 -2.20 0.00 0.00 -0.05 0.00 0.00 63.50 61.12 2k6b n PRO 24 Cb 0.51 -2.02 0.00 0.00 -0.05 0.00 0.00 33.50 31.94 2k6b n PRO 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 2k6b n GLY 25 N 0.34 2.88 0.26 0.55 0.00 -1.26 -4.83 105.19 103.12 2k6b n GLY 25 Ca 0.21 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.53 2k6b n GLY 25 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2k6b h ASP 26 N 0.00 0.19 -0.32 1.61 2.03 -2.00 -2.11 116.42 115.82 2k6b h ASP 26 Ca 0.00 -0.02 -0.08 0.00 -0.73 0.00 0.00 57.03 56.20 2k6b h ASP 26 Cb 0.00 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 38.44 2k6b h ASP 26 CO 0.00 0.23 -0.10 0.00 -1.03 0.00 0.00 179.24 178.34 2k6b h ALA 27 N 1.80 0.44 -0.47 4.15 0.00 -1.91 -2.97 119.26 120.30 2k6b h ALA 27 Ca 0.05 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2k6b h ALA 27 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2k6b h ALA 27 CO 0.00 0.30 0.10 0.00 0.00 0.00 0.00 179.25 179.65 2k6b h ALA 28 N 0.79 0.62 -0.56 0.00 0.00 -1.74 -1.05 119.26 117.31 2k6b h ALA 28 Ca 0.08 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2k6b h ALA 28 Cb 0.61 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2k6b h ALA 28 CO 0.04 0.32 0.05 -0.56 0.00 0.00 0.00 179.25 179.10 2k6b h GLN 29 N 0.64 0.93 -0.27 0.00 3.07 -1.54 0.47 115.11 118.40 2k6b h GLN 29 Ca 0.14 -0.25 -0.11 0.00 0.09 0.00 0.00 58.65 58.53 2k6b h GLN 29 Cb 0.35 -0.11 -0.01 0.00 0.08 0.00 0.00 27.48 27.79 2k6b h GLN 29 CO 0.00 0.89 -0.31 1.96 0.09 0.00 0.00 178.83 181.47 2k6b h GLN 30 N 0.87 0.56 -0.11 0.06 1.08 -1.33 0.46 115.11 116.71 2k6b h GLN 30 Ca 0.17 -0.24 -0.12 0.00 -1.45 0.00 0.00 58.65 57.01 2k6b h GLN 30 Cb 0.44 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.84 2k6b h GLN 30 CO 0.02 0.81 -0.46 1.49 -0.95 0.00 0.00 178.83 179.73 2k6b h GLU 31 N 0.49 0.26 -0.40 1.46 4.81 -0.74 0.67 114.58 121.13 2k6b h GLU 31 Ca 0.06 -0.14 -0.15 0.00 -0.13 0.00 0.00 59.36 59.00 2k6b h GLU 31 Cb 0.77 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 2k6b h GLU 31 CO 0.06 0.67 -0.36 0.00 -0.73 0.00 0.00 179.01 178.65 2k6b h ALA 32 N 1.31 0.61 0.00 2.92 0.00 -0.43 -2.58 119.26 121.09 2k6b h ALA 32 Ca 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 2k6b h ALA 32 Cb 0.89 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2k6b h ALA 32 CO 0.07 0.68 -0.28 -0.22 0.00 0.00 0.00 179.25 179.50 2k6b h LYS 33 N 0.77 0.00 0.12 0.00 1.63 -0.40 0.42 116.57 119.11 2k6b h LYS 33 Ca 0.07 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 2k6b h LYS 33 Cb 0.95 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.58 2k6b h LYS 33 CO 0.09 0.28 -0.06 1.25 -3.45 0.00 0.00 179.45 177.56 2k6b h HIS 34 N 0.00 -0.15 0.00 1.91 2.76 -0.67 -3.04 115.15 115.96 2k6b h HIS 34 Ca -0.00 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 2k6b h HIS 34 Cb 0.67 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.67 2k6b h HIS 34 CO 0.00 0.15 -0.17 0.00 -1.30 0.00 0.00 177.93 176.61 2k6b h ARG 35 N -0.44 0.00 -0.45 5.26 3.08 -1.19 -2.82 114.38 117.82 2k6b h ARG 35 Ca -0.02 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.11 2k6b h ARG 35 Cb 0.36 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 2k6b h ARG 35 CO 0.03 0.17 0.08 1.49 -1.07 0.00 0.00 179.97 180.66 2k6b h GLU 36 N 0.00 0.20 -0.14 0.04 4.22 -0.80 0.93 114.58 119.03 2k6b h GLU 36 Ca -0.00 -0.01 -0.14 0.00 0.08 0.00 0.00 59.36 59.29 2k6b h GLU 36 Cb 0.56 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2k6b h GLU 36 CO 0.02 0.13 -0.45 0.00 -2.18 0.00 0.00 179.01 176.53 2k6b h ALA 37 N 1.35 0.25 -0.19 2.92 0.00 -1.53 -3.32 119.26 118.74 2k6b h ALA 37 Ca 0.22 -0.48 0.03 0.00 0.00 0.00 0.00 54.91 54.68 2k6b h ALA 37 Cb 0.29 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2k6b h ALA 37 CO -0.30 0.39 -0.01 0.93 0.00 0.00 0.00 179.25 180.26 2k6b h GLU 38 N 0.19 0.05 -0.84 0.00 5.08 -1.12 -0.69 114.58 117.25 2k6b h GLU 38 Ca -0.02 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2k6b h GLU 38 Cb 1.08 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.27 2k6b h GLU 38 CO 0.10 0.03 0.42 0.52 -1.00 0.00 0.00 179.01 179.09 2k6b h MET 39 N 0.05 1.19 -0.30 2.33 2.86 -0.96 0.57 114.93 120.67 2k6b h MET 39 Ca 0.09 -0.16 -0.12 0.00 -2.06 0.00 0.00 59.70 57.45 2k6b h MET 39 Cb 0.11 -0.22 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 2k6b h MET 39 CO -0.16 0.90 -0.30 -0.09 1.06 0.00 0.00 176.91 178.32 2k6b h ARG 40 N 1.18 0.73 -0.66 1.72 2.43 -1.61 -2.61 114.38 115.56 2k6b h ARG 40 Ca 0.29 -0.38 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 2k6b h ARG 40 Cb 0.08 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 2k6b h ARG 40 CO -0.04 1.00 0.17 -0.97 -1.51 0.00 0.00 179.97 178.62 2k6b h ASN 41 N 0.48 0.98 -0.44 -3.80 -1.24 -0.43 -2.81 115.58 108.31 2k6b h ASN 41 Ca 0.05 -0.19 0.01 0.00 0.71 0.00 0.00 56.30 56.88 2k6b h ASN 41 Cb 0.87 -0.26 -0.03 0.00 0.73 0.00 0.00 38.32 39.64 2k6b h ASN 41 CO 0.07 0.94 0.28 0.28 -1.29 0.00 0.00 177.43 177.71 2k6b h SER 42 N 0.99 0.47 -0.45 1.15 0.02 0.27 0.13 113.55 116.14 2k6b h SER 42 Ca 0.21 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.06 2k6b h SER 42 Cb 0.34 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2k6b h SER 42 CO -0.00 0.34 -0.08 0.16 -1.14 0.00 0.00 176.83 176.11 2k6b h ILE 43 N 0.57 1.26 -0.54 3.27 3.07 -1.29 -1.86 117.51 121.99 2k6b h ILE 43 Ca 0.17 -1.18 -0.06 0.00 1.55 0.00 0.00 64.86 65.33 2k6b h ILE 43 Cb -0.03 0.96 -0.02 0.00 -0.27 0.00 0.00 36.82 37.46 2k6b h ILE 43 CO -0.06 0.41 0.10 -0.07 -1.05 0.00 0.00 178.15 177.49 2k6b h LEU 44 N 0.82 0.84 -1.55 0.16 3.38 -1.21 0.48 115.31 118.23 2k6b h LEU 44 Ca 0.14 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k6b h LEU 44 Cb 0.60 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2k6b h LEU 44 CO 0.04 0.88 0.00 0.00 0.09 0.00 0.00 178.44 179.45 2k6b h ALA 45 N 0.99 1.00 0.03 1.53 0.00 -0.43 -1.02 119.26 121.36 2k6b h ALA 45 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.70 2k6b h ALA 45 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2k6b h ALA 45 CO 0.01 0.00 -2.32 1.04 0.00 0.00 0.00 179.25 177.98 2k6b n GLN 46 N -2.92 0.68 0.13 0.00 1.13 -0.73 -4.48 117.38 111.19 2k6b n GLN 46 Ca 0.00 0.16 0.02 0.00 -1.94 0.00 0.00 57.00 55.24 2k6b n GLN 46 Cb 0.25 -1.58 0.01 0.00 0.11 0.00 0.00 30.24 29.03 2k6b n GLN 46 CO 0.00 0.00 0.00 -0.39 -1.44 0.00 0.00 177.06 175.23 2k6b h VAL 47 N 0.02 0.91 -3.29 5.09 -1.51 -0.88 -3.40 116.25 113.18 2k6b h VAL 47 Ca -0.53 -2.30 -0.63 0.00 -1.23 0.00 0.00 66.70 62.01 2k6b h VAL 47 Cb 1.99 2.44 -0.18 0.00 -2.13 0.00 0.00 31.29 33.40 2k6b h VAL 47 CO -0.02 0.52 -0.61 -0.76 -1.23 0.00 0.00 177.57 175.46 2k6b s LEU 48 N -6.44 3.55 0.75 4.19 1.43 -0.39 0.15 118.68 121.92 2k6b s LEU 48 Ca 0.03 -0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 52.99 2k6b s LEU 48 Cb 0.08 -1.87 0.05 0.00 0.03 0.00 0.00 46.19 44.47 2k6b s LEU 48 CO 0.76 0.18 1.14 -0.62 0.23 0.00 0.00 176.35 178.04 2k6b s ASP 49 N 0.30 4.30 0.38 2.29 -1.08 0.16 -4.57 116.67 118.44 2k6b s ASP 49 Ca 0.00 2.10 0.13 0.00 -0.52 0.00 0.00 52.55 54.26 2k6b s ASP 49 Cb -0.13 -2.56 0.94 0.00 -1.46 0.00 0.00 42.92 39.71 2k6b s ASP 49 CO 0.02 -2.18 1.85 1.56 0.52 0.00 0.00 175.17 176.94 2k6b h GLN 50 N -0.66 0.55 0.00 4.34 4.20 -1.89 0.23 115.11 121.87 2k6b h GLN 50 Ca -0.46 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.08 2k6b h GLN 50 Cb 1.26 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 2k6b h GLN 50 CO 0.50 0.36 -0.66 0.77 -0.67 0.00 0.00 178.83 179.13 2k6b h SER 51 N 0.56 0.00 0.31 1.46 0.02 -1.93 -2.05 113.55 111.92 2k6b h SER 51 Ca 0.47 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.22 2k6b h SER 51 Cb 0.96 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 2k6b h SER 51 CO -0.21 0.66 -0.85 0.00 -1.14 0.00 0.00 176.83 175.28 2k6b h ALA 52 N 1.34 0.46 -0.98 3.77 0.00 -0.95 -0.72 119.26 122.19 2k6b h ALA 52 Ca -0.01 -0.67 0.01 0.00 0.00 0.00 0.00 54.91 54.24 2k6b h ALA 52 Cb 1.19 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 2k6b h ALA 52 CO 0.09 0.80 0.64 0.00 0.00 0.00 0.00 179.25 180.78 2k6b h ARG 53 N 0.25 1.29 -0.22 0.00 2.47 -0.55 0.21 114.38 117.82 2k6b h ARG 53 Ca -0.06 -0.08 -0.09 0.00 -1.26 0.00 0.00 59.98 58.49 2k6b h ARG 53 Cb 1.47 -0.29 -0.00 0.00 -1.65 0.00 0.00 29.97 29.49 2k6b h ARG 53 CO 0.15 0.85 -0.22 0.00 0.56 0.00 0.00 179.97 181.31 2k6b h ALA 54 N 1.39 0.32 -0.38 0.04 0.00 -1.18 -2.29 119.26 117.16 2k6b h ALA 54 Ca 0.36 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2k6b h ALA 54 Cb -0.15 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2k6b h ALA 54 CO -0.08 0.28 0.12 -0.09 0.00 0.00 0.00 179.25 179.48 2k6b h ARG 55 N 0.22 0.27 -0.40 0.00 9.65 -0.75 -1.60 114.38 121.77 2k6b h ARG 55 Ca 0.03 -0.02 0.04 0.00 -1.10 0.00 0.00 59.98 58.94 2k6b h ARG 55 Cb 0.78 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.26 2k6b h ARG 55 CO 0.06 0.18 0.16 1.25 2.80 0.00 0.00 179.97 184.41 2k6b h LEU 56 N 0.28 0.20 -0.63 3.80 5.85 -0.56 -1.04 115.31 123.22 2k6b h LEU 56 Ca 0.18 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2k6b h LEU 56 Cb 0.16 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2k6b h LEU 56 CO -0.19 0.15 0.32 0.28 -0.34 0.00 0.00 178.44 178.66 2k6b h SER 57 N 0.34 0.81 -0.66 1.25 0.02 -0.97 -0.21 113.55 114.12 2k6b h SER 57 Ca 0.18 -0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 2k6b h SER 57 Cb 0.14 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2k6b h SER 57 CO -0.17 0.70 0.27 -1.13 -1.14 0.00 0.00 176.83 175.36 2k6b h ASN 58 N 0.86 0.93 -0.59 3.07 -1.24 -0.89 -2.20 115.58 115.52 2k6b h ASN 58 Ca 0.22 -0.13 -0.09 0.00 0.71 0.00 0.00 56.30 57.01 2k6b h ASN 58 Cb 0.09 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 38.88 2k6b h ASN 58 CO -0.03 0.83 0.04 0.25 -1.29 0.00 0.00 177.43 177.24 2k6b h LEU 59 N 0.99 1.00 -1.84 0.34 7.12 -0.63 -2.21 115.31 120.09 2k6b h LEU 59 Ca 0.23 -0.26 -0.02 0.00 0.13 0.00 0.00 57.88 57.96 2k6b h LEU 59 Cb 0.19 -0.27 -0.00 0.00 -0.53 0.00 0.00 40.66 40.05 2k6b h LEU 59 CO -0.02 1.03 -0.10 0.00 -0.13 0.00 0.00 178.44 179.21 2k6b h ALA 60 N 1.08 1.76 0.00 1.25 0.00 -0.49 0.13 119.26 122.99 2k6b h ALA 60 Ca 0.18 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2k6b h ALA 60 Cb 0.49 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2k6b h ALA 60 CO 0.02 0.13 -0.55 -0.07 0.00 0.00 0.00 179.25 178.78 2k6b h LEU 61 N 0.00 0.00 0.04 0.00 3.38 -0.82 -3.26 115.31 114.65 2k6b h LEU 61 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 2k6b h LEU 61 Cb 0.19 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2k6b h LEU 61 CO 0.01 0.55 -1.95 1.33 0.09 0.00 0.00 178.44 178.48 2k6b n VAL 62 N -3.36 1.60 -3.15 1.22 0.24 -0.66 -4.92 118.33 109.31 2k6b n VAL 62 Ca 0.01 -0.37 0.04 0.00 -2.04 0.00 0.00 64.34 61.98 2k6b n VAL 62 Cb 0.70 -1.82 -0.00 0.00 -1.47 0.00 0.00 33.84 31.25 2k6b n VAL 62 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2k6b s LYS 63 N -2.48 0.53 0.00 7.34 -2.85 0.38 -5.03 119.74 117.63 2k6b s LYS 63 Ca -0.30 0.61 0.10 0.00 -1.00 0.00 0.00 55.97 55.39 2k6b s LYS 63 Cb 0.08 0.30 0.47 0.00 -2.06 0.00 0.00 37.83 36.63 2k6b s LYS 63 CO 0.62 -0.89 1.30 -0.35 0.10 0.00 0.00 175.35 176.13 2k6b n PRO 64 N 5.40 0.05 -0.15 1.78 -0.04 -1.23 -2.65 135.00 138.16 2k6b n PRO 64 Ca 0.04 0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 63.69 2k6b n PRO 64 Cb 0.54 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 2k6b n PRO 64 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2k6b h GLU 65 N 0.00 0.68 0.00 0.54 4.22 -1.92 0.18 114.58 118.27 2k6b h GLU 65 Ca 0.00 -0.13 -0.17 0.00 0.08 0.00 0.00 59.36 59.15 2k6b h GLU 65 Cb 0.15 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2k6b h GLU 65 CO 0.00 0.62 -0.79 0.87 -2.18 0.00 0.00 179.01 177.53 2k6b h LYS 66 N 0.58 0.00 0.11 1.92 1.79 -1.88 -2.94 116.57 116.15 2k6b h LYS 66 Ca 0.15 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.61 2k6b h LYS 66 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2k6b h LYS 66 CO -0.01 0.79 -0.05 1.15 -1.08 0.00 0.00 179.45 180.25 2k6b h THR 67 N 0.00 0.93 -0.10 -0.16 2.02 -1.50 -1.36 112.91 112.74 2k6b h THR 67 Ca -0.01 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 2k6b h THR 67 Cb 1.48 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 2k6b h THR 67 CO 0.10 0.03 -0.08 0.07 0.37 0.00 0.00 175.52 176.02 2k6b h LYS 68 N -0.21 0.14 0.07 6.66 2.10 -0.95 0.69 116.57 125.08 2k6b h LYS 68 Ca -0.01 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2k6b h LYS 68 Cb 0.17 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 2k6b h LYS 68 CO 0.02 0.23 -0.04 0.00 -2.00 0.00 0.00 179.45 177.67 2k6b h ALA 69 N 1.78 -0.10 -0.59 0.07 0.00 -1.31 -0.13 119.26 118.98 2k6b h ALA 69 Ca 0.03 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 2k6b h ALA 69 Cb 0.24 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2k6b h ALA 69 CO 0.01 -0.37 0.02 -0.39 0.00 0.00 0.00 179.25 178.53 2k6b h VAL 70 N -0.48 1.26 0.16 0.00 -1.51 -0.81 -1.06 116.25 113.81 2k6b h VAL 70 Ca -0.01 -1.10 -0.01 0.00 -1.23 0.00 0.00 66.70 64.35 2k6b h VAL 70 Cb 0.41 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.35 2k6b h VAL 70 CO 0.02 0.40 -0.08 -0.33 -1.23 0.00 0.00 177.57 176.35 2k6b h GLU 71 N 0.93 -0.20 -0.72 5.19 5.08 -0.87 -1.00 114.58 122.99 2k6b h GLU 71 Ca 0.17 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.63 2k6b h GLU 71 Cb 0.51 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 2k6b h GLU 71 CO 0.02 0.00 0.39 -0.97 -1.00 0.00 0.00 179.01 177.45 2k6b h ASN 72 N -0.38 0.55 0.17 1.42 -0.73 -0.95 0.31 115.58 115.97 2k6b h ASN 72 Ca -0.02 0.04 -0.01 0.00 1.87 0.00 0.00 56.30 58.18 2k6b h ASN 72 Cb 0.30 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.83 2k6b h ASN 72 CO 0.04 0.33 -0.08 0.22 -0.37 0.00 0.00 177.43 177.56 2k6b h TYR 73 N 0.68 -0.21 -0.66 0.67 3.20 -1.02 -1.70 116.97 117.93 2k6b h TYR 73 Ca 0.34 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.19 2k6b h TYR 73 Cb 0.29 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2k6b h TYR 73 CO -0.09 -0.12 0.34 -0.07 -1.64 0.00 0.00 178.16 176.58 2k6b h LEU 74 N -0.24 0.84 -0.41 2.82 -0.00 -0.63 0.27 115.31 117.96 2k6b h LEU 74 Ca -0.02 -0.11 0.08 0.00 -0.00 0.00 0.00 57.88 57.82 2k6b h LEU 74 Cb 0.19 -0.21 -0.07 0.00 -0.00 0.00 0.00 40.66 40.56 2k6b h LEU 74 CO 0.04 0.71 -0.02 0.40 -0.00 0.00 0.00 178.44 179.56 2k6b h ILE 75 N 0.90 0.66 0.04 1.22 2.04 -0.73 0.35 117.51 121.99 2k6b h ILE 75 Ca 0.23 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 66.06 2k6b h ILE 75 Cb 0.07 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2k6b h ILE 75 CO -0.03 0.01 -0.02 1.56 0.00 0.00 0.00 178.15 179.67 2k6b h GLN 76 N 0.08 -0.05 -1.00 2.37 4.20 -1.03 -3.10 115.11 116.58 2k6b h GLN 76 Ca 0.20 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.94 2k6b h GLN 76 Cb 0.30 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.03 2k6b h GLN 76 CO -0.36 0.58 0.66 1.98 -0.67 0.00 0.00 178.83 181.02 2k6b h MET 77 N -0.75 1.28 -0.62 1.46 4.05 -0.33 -0.88 114.93 119.13 2k6b h MET 77 Ca -0.01 -0.08 -0.08 0.00 -0.28 0.00 0.00 59.70 59.25 2k6b h MET 77 Cb 0.65 -0.29 -0.02 0.00 -0.80 0.00 0.00 31.60 31.14 2k6b h MET 77 CO 0.01 0.84 0.06 0.00 0.23 0.00 0.00 176.91 178.05 2k6b h ALA 78 N 1.40 0.92 0.00 0.39 0.00 -1.03 -2.58 119.26 118.35 2k6b h ALA 78 Ca 0.38 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2k6b h ALA 78 Cb -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.48 2k6b h ALA 78 CO -0.10 0.66 0.00 0.54 0.00 0.00 0.00 179.25 180.34 2k6b n ARG 79 N -4.20 0.12 -0.25 0.00 1.74 -0.36 -0.69 116.66 113.02 2k6b n ARG 79 Ca 0.04 0.39 0.10 0.00 -0.77 0.00 0.00 57.85 57.61 2k6b n ARG 79 Cb 0.31 -1.75 0.26 0.00 -1.02 0.00 0.00 32.46 30.27 2k6b n ARG 79 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2k6b n TYR 80 N -1.98 0.66 -0.82 -1.55 4.02 -1.03 -4.91 117.16 111.55 2k6b n TYR 80 Ca 0.02 -0.33 0.00 0.00 -0.01 0.00 0.00 57.90 57.58 2k6b n TYR 80 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 2k6b n TYR 80 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2k6b n GLY 81 N 1.41 0.78 0.21 2.72 0.00 0.14 -4.90 105.19 105.55 2k6b n GLY 81 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 2k6b n GLY 81 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2k6b h GLN 82 N 2.62 0.00 -4.82 1.61 4.20 -1.58 -3.39 115.11 113.75 2k6b h GLN 82 Ca 0.00 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.03 2k6b h GLN 82 Cb 0.00 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 27.48 2k6b h GLN 82 CO 0.00 0.24 -0.68 -0.51 -0.67 0.00 0.00 178.83 177.21 2k6b s LEU 83 N -6.73 3.67 0.00 1.46 2.01 -1.25 -4.82 118.68 113.02 2k6b s LEU 83 Ca 0.01 -0.93 0.00 0.00 0.01 0.00 0.00 54.13 53.22 2k6b s LEU 83 Cb 0.10 -1.77 0.00 0.00 0.01 0.00 0.00 46.19 44.53 2k6b s LEU 83 CO 0.65 -0.20 0.61 -0.24 1.01 0.00 0.00 176.35 178.18 2k6b n SER 84 N 4.74 1.03 -4.46 2.29 2.88 -1.26 -4.86 113.62 113.98 2k6b n SER 84 Ca -0.15 -1.37 -0.22 0.00 -1.33 0.00 0.00 58.87 55.80 2k6b n SER 84 Cb 0.46 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.82 2k6b n SER 84 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2k6b s GLU 85 N -0.37 1.64 -0.07 -1.46 0.41 -1.26 -5.13 118.70 112.48 2k6b s GLU 85 Ca 0.00 -1.87 -0.16 0.00 -0.41 0.00 0.00 54.97 52.52 2k6b s GLU 85 Cb 0.00 -1.14 -0.05 0.00 -1.78 0.00 0.00 34.13 31.16 2k6b s GLU 85 CO 0.00 -0.04 0.44 0.15 -0.49 0.00 0.00 175.26 175.31 2k6b s LYS 86 N -3.78 4.16 -0.30 1.61 1.02 -1.26 -4.70 119.74 116.50 2k6b s LYS 86 Ca 0.33 0.41 -0.23 0.00 0.02 0.00 0.00 55.97 56.50 2k6b s LYS 86 Cb 0.06 -3.34 -0.00 0.00 -0.52 0.00 0.00 37.83 34.03 2k6b s LYS 86 CO 0.14 0.40 0.76 0.08 -0.92 0.00 0.00 175.35 175.81 2k6b s VAL 87 N -0.15 4.83 0.86 3.17 1.01 0.12 -4.79 120.40 125.45 2k6b s VAL 87 Ca 0.24 1.18 -0.09 0.00 0.00 0.00 0.00 61.98 63.32 2k6b s VAL 87 Cb -0.16 -4.11 0.19 0.00 0.00 0.00 0.00 36.38 32.30 2k6b s VAL 87 CO 0.11 -0.20 1.18 -1.20 0.00 0.00 0.00 175.10 174.99 2k6b n SER 88 N 6.12 0.72 -0.09 3.32 7.64 -1.26 -0.67 113.62 129.40 2k6b n SER 88 Ca 0.03 -1.81 -0.06 0.00 1.01 0.00 0.00 58.87 58.04 2k6b n SER 88 Cb 0.48 -0.84 0.01 0.00 -1.01 0.00 0.00 64.21 62.85 2k6b n SER 88 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2k6b h GLU 89 N 0.00 0.16 -0.52 1.43 5.08 -1.92 0.99 114.58 119.80 2k6b h GLU 89 Ca -0.38 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 57.99 2k6b h GLU 89 Cb 1.21 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 2k6b h GLU 89 CO 0.33 0.10 0.34 0.37 -1.00 0.00 0.00 179.01 179.16 2k6b h GLN 90 N 0.16 0.63 -0.04 2.33 4.15 -1.99 0.14 115.11 120.50 2k6b h GLN 90 Ca 0.15 -0.04 -0.20 0.00 0.77 0.00 0.00 58.65 59.33 2k6b h GLN 90 Cb 0.17 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 2k6b h GLN 90 CO -0.21 0.42 -0.82 0.78 -1.93 0.00 0.00 178.83 177.07 2k6b h GLY 91 N 0.65 0.41 2.00 2.39 0.00 -1.62 -2.99 103.07 103.90 2k6b h GLY 91 Ca 0.20 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 2k6b h GLY 91 CO -0.05 0.57 -0.54 -2.00 0.00 0.00 0.00 176.54 174.52 2k6b h LEU 92 N 0.23 0.00 -1.39 3.11 5.85 0.48 -2.48 115.31 121.11 2k6b h LEU 92 Ca -0.05 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.62 2k6b h LEU 92 Cb 1.42 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 2k6b h LEU 92 CO 0.14 0.54 -0.19 0.40 -0.34 0.00 0.00 178.44 178.99 2k6b h ILE 93 N 0.00 1.19 -0.61 4.05 2.04 -0.68 0.37 117.51 123.88 2k6b h ILE 93 Ca -0.01 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 2k6b h ILE 93 Cb 1.12 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 2k6b h ILE 93 CO 0.07 0.26 0.24 -0.33 0.00 0.00 0.00 178.15 178.39 2k6b h GLU 94 N 0.16 0.91 -0.41 2.37 4.39 -1.31 0.01 114.58 120.70 2k6b h GLU 94 Ca 0.03 -0.17 -0.15 0.00 0.34 0.00 0.00 59.36 59.41 2k6b h GLU 94 Cb 0.43 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2k6b h GLU 94 CO 0.03 0.78 -0.32 0.82 -1.16 0.00 0.00 179.01 179.16 2k6b h ILE 95 N 0.85 1.27 -0.55 3.13 1.08 -1.11 -2.09 117.51 120.09 2k6b h ILE 95 Ca 0.20 -1.49 -0.06 0.00 -0.39 0.00 0.00 64.86 63.12 2k6b h ILE 95 Cb 0.21 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 35.23 2k6b h ILE 95 CO -0.02 0.50 0.12 0.25 -0.69 0.00 0.00 178.15 178.32 2k6b h LEU 96 N 0.78 0.85 -1.09 1.44 5.85 0.01 -1.46 115.31 121.70 2k6b h LEU 96 Ca 0.08 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 2k6b h LEU 96 Cb 0.91 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 2k6b h LEU 96 CO 0.08 0.88 0.22 0.11 -0.34 0.00 0.00 178.44 179.39 2k6b h LYS 97 N 0.79 0.87 0.54 1.25 1.57 -0.86 -1.27 116.57 119.46 2k6b h LYS 97 Ca 0.17 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 2k6b h LYS 97 Cb 0.37 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2k6b h LYS 97 CO 0.01 0.72 -0.42 0.87 -0.57 0.00 0.00 179.45 180.06 2k6b h LYS 98 N 0.85 -0.91 0.00 3.15 1.57 -0.78 -3.00 116.57 117.45 2k6b h LYS 98 Ca 0.20 0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 2k6b h LYS 98 Cb 0.20 0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2k6b h LYS 98 CO -0.02 -0.60 -0.07 -0.39 -0.57 0.00 0.00 179.45 177.81 2k6b h VAL 99 N -0.94 0.15 0.00 0.50 -1.51 -1.12 -1.24 116.25 112.09 2k6b h VAL 99 Ca -0.06 -0.78 0.00 0.00 -1.23 0.00 0.00 66.70 64.63 2k6b h VAL 99 Cb 0.80 1.67 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 2k6b h VAL 99 CO 0.00 0.06 -0.35 0.77 -1.23 0.00 0.00 177.57 176.82 2k6b h SER 100 N 0.00 0.00 0.00 4.19 4.64 -1.18 -3.37 113.55 117.83 2k6b h SER 100 Ca -0.00 -0.01 -0.29 0.00 -0.47 0.00 0.00 61.79 61.02 2k6b h SER 100 Cb 0.67 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.71 2k6b h SER 100 CO 0.01 0.00 -2.09 0.00 -0.87 0.00 0.00 176.83 173.88 2k6b n GLN 101 N -2.88 0.60 0.00 4.77 10.64 -1.13 -5.02 117.38 124.36 2k6b n GLN 101 Ca 0.03 0.10 0.00 0.00 -1.83 0.00 0.00 57.00 55.30 2k6b n GLN 101 Cb 0.53 -1.39 0.00 0.00 -0.86 0.00 0.00 30.24 28.52 2k6b n GLN 101 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2k6b n GLN 102 N -3.01 0.00 0.14 2.61 6.02 -0.50 -5.09 117.38 117.55 2k6b n GLN 102 Ca -0.33 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.66 2k6b n GLN 102 Cb 0.88 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.14 2k6b n GLN 102 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2k6b n THR 103 N 0.00 0.00 -3.84 5.09 -1.04 -0.99 -4.76 114.28 108.73 2k6b n THR 103 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 2k6b n THR 103 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 2k6b n THR 103 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2k6b s GLU 104 N -2.00 1.22 -0.03 -2.82 -1.05 -1.26 -2.82 118.70 109.95 2k6b s GLU 104 Ca 0.00 -1.00 -0.04 0.00 -0.15 0.00 0.00 54.97 53.77 2k6b s GLU 104 Cb 0.00 0.44 0.01 0.00 -0.44 0.00 0.00 34.13 34.14 2k6b s GLU 104 CO 0.00 -0.48 0.11 0.15 0.95 0.00 0.00 175.26 175.99 2k6b s LYS 105 N -3.91 0.24 -0.65 -4.83 1.02 -1.26 -4.99 119.74 105.36 2k6b s LYS 105 Ca 0.12 -0.06 -0.22 0.00 0.02 0.00 0.00 55.97 55.83 2k6b s LYS 105 Cb 0.02 0.11 0.07 0.00 -0.52 0.00 0.00 37.83 37.51 2k6b s LYS 105 CO -0.03 -0.04 0.94 -0.08 -0.92 0.00 0.00 175.35 175.21 2k6b s THR 106 N -0.46 4.38 -0.14 2.17 -1.32 -1.26 -4.98 115.64 114.03 2k6b s THR 106 Ca -0.05 -0.44 -0.35 0.00 -1.21 0.00 0.00 61.69 59.64 2k6b s THR 106 Cb -0.03 -4.66 -0.12 0.00 -1.51 0.00 0.00 72.50 66.17 2k6b s THR 106 CO 0.00 -1.42 1.91 0.41 -2.21 0.00 0.00 174.62 173.31 2k6b n THR 107 N 5.88 0.51 -3.80 5.08 -1.04 -1.26 -4.92 114.28 114.73 2k6b n THR 107 Ca -0.04 -0.13 -0.28 0.00 -2.04 0.00 0.00 64.05 61.56 2k6b n THR 107 Cb 0.45 -1.82 -0.12 0.00 -1.82 0.00 0.00 70.33 67.02 2k6b n THR 107 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2k6b s THR 108 N 4.49 2.26 -0.01 12.58 2.01 -1.26 -4.80 115.64 130.92 2k6b s THR 108 Ca 0.95 -3.72 0.05 0.00 0.31 0.00 0.00 61.69 59.28 2k6b s THR 108 Cb -0.73 -2.51 -0.07 0.00 0.01 0.00 0.00 72.50 69.19 2k6b s THR 108 CO 0.53 -1.01 0.10 0.55 -0.69 0.00 0.00 174.62 174.10 2k6b n VAL 109 N 2.40 0.01 -2.94 3.82 3.14 -1.26 -5.05 118.33 118.45 2k6b n VAL 109 Ca 0.19 -0.11 -0.01 0.00 -2.96 0.00 0.00 64.34 61.45 2k6b n VAL 109 Cb 0.37 0.34 0.00 0.00 -1.06 0.00 0.00 33.84 33.49 2k6b n VAL 109 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 2k6b n LYS 110 N -1.69 -1.30 -3.77 1.45 4.81 -1.26 -5.06 118.16 111.34 2k6b n LYS 110 Ca -0.01 1.47 -0.13 0.00 -0.87 0.00 0.00 58.31 58.77 2k6b n LYS 110 Cb 0.15 -5.48 -0.10 0.00 0.02 0.00 0.00 35.03 29.62 2k6b n LYS 110 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 2k6b s PHE 111 N -2.97 -0.24 -1.47 5.64 5.36 -1.26 -5.33 117.98 117.72 2k6b s PHE 111 Ca 0.02 0.50 0.12 0.00 -0.96 0.00 0.00 56.93 56.61 2k6b s PHE 111 Cb -0.00 0.10 0.09 0.00 -0.34 0.00 0.00 43.02 42.87 2k6b s PHE 111 CO 0.70 -0.29 0.87 0.09 -1.46 0.00 0.00 175.22 175.14