#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6b n SER 1 N 0.00 -2.33 0.09 1.61 7.64 -1.26 -4.82 113.62 114.55 2k6b n SER 1 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 2k6b n SER 1 Cb 0.00 -2.12 -0.09 0.00 -1.01 0.00 0.00 64.21 60.99 2k6b n SER 1 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k6b h ALA 2 N 0.00 0.24 -0.01 -0.43 0.00 -2.06 -0.13 119.26 116.87 2k6b h ALA 2 Ca 0.00 -0.81 -0.20 0.00 0.00 0.00 0.00 54.91 53.89 2k6b h ALA 2 Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2k6b h ALA 2 CO 0.00 0.93 -0.87 0.22 0.00 0.00 0.00 179.25 179.53 2k6b h ASP 3 N 0.12 0.39 -0.44 0.00 1.82 -2.00 -2.85 116.42 113.46 2k6b h ASP 3 Ca -0.10 -0.30 -0.01 0.00 -0.39 0.00 0.00 57.03 56.23 2k6b h ASP 3 Cb 1.79 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 41.65 2k6b h ASP 3 CO 0.18 1.09 0.24 -0.33 -1.61 0.00 0.00 179.24 178.81 2k6b h GLU 4 N 0.18 0.64 -0.54 0.28 5.08 -1.90 0.11 114.58 118.43 2k6b h GLU 4 Ca -0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2k6b h GLU 4 Cb 1.49 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 2k6b h GLU 4 CO 0.14 0.48 0.30 0.93 -1.00 0.00 0.00 179.01 179.86 2k6b h GLU 5 N 0.65 0.76 -0.44 2.33 4.39 -0.79 0.15 114.58 121.61 2k6b h GLU 5 Ca 0.17 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.70 2k6b h GLU 5 Cb 0.04 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 2k6b h GLU 5 CO -0.03 0.58 -0.02 1.25 -1.16 0.00 0.00 179.01 179.64 2k6b h LEU 6 N 0.73 0.79 0.37 1.33 5.85 -1.13 -0.66 115.31 122.58 2k6b h LEU 6 Ca 0.19 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2k6b h LEU 6 Cb 0.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2k6b h LEU 6 CO -0.03 0.92 -0.29 -0.08 -0.34 0.00 0.00 178.44 178.61 2k6b h GLU 7 N 0.64 -0.64 -0.66 1.25 4.57 -0.57 -0.01 114.58 119.15 2k6b h GLU 7 Ca 0.12 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.34 2k6b h GLU 7 Cb 0.53 0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.23 2k6b h GLU 7 CO 0.03 -0.43 0.39 0.00 -1.18 0.00 0.00 179.01 177.82 2k6b h ALA 8 N -0.14 0.84 0.25 2.92 0.00 -0.66 0.40 119.26 122.88 2k6b h ALA 8 Ca -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2k6b h ALA 8 Cb 0.58 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2k6b h ALA 8 CO -0.01 0.32 -0.12 1.25 0.00 0.00 0.00 179.25 180.69 2k6b h LEU 9 N 0.90 -0.28 -0.50 0.00 6.46 -0.95 0.05 115.31 120.99 2k6b h LEU 9 Ca 0.24 -0.03 -0.04 0.00 -0.12 0.00 0.00 57.88 57.93 2k6b h LEU 9 Cb -0.02 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.97 2k6b h LEU 9 CO -0.04 -0.16 0.16 -0.09 -0.62 0.00 0.00 178.44 177.69 2k6b h ARG 10 N -0.39 0.77 -0.36 1.25 2.43 -0.71 -0.25 114.38 117.12 2k6b h ARG 10 Ca -0.03 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 58.94 2k6b h ARG 10 Cb 0.30 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 2k6b h ARG 10 CO 0.06 0.71 0.09 0.00 -1.51 0.00 0.00 179.97 179.32 2k6b h ARG 11 N 0.67 0.58 0.17 0.20 3.08 -0.81 0.78 114.38 119.06 2k6b h ARG 11 Ca 0.16 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2k6b h ARG 11 Cb 0.26 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2k6b h ARG 11 CO -0.01 0.62 -0.08 0.37 -1.07 0.00 0.00 179.97 179.80 2k6b h GLN 12 N 0.44 -0.22 -0.88 0.04 4.15 -0.83 -0.37 115.11 117.44 2k6b h GLN 12 Ca 0.11 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.62 2k6b h GLN 12 Cb 0.30 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 27.98 2k6b h GLN 12 CO 0.00 -0.01 0.57 0.00 -1.93 0.00 0.00 178.83 177.46 2k6b h ARG 13 N -0.39 0.94 -0.33 1.69 -0.00 -0.96 -0.77 114.38 114.55 2k6b h ARG 13 Ca -0.02 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.98 59.34 2k6b h ARG 13 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 29.97 30.05 2k6b h ARG 13 CO 0.04 0.62 -0.01 1.25 0.00 0.00 0.00 179.97 181.87 2k6b h LEU 14 N 0.96 0.58 -0.34 3.04 6.46 -0.59 -2.54 115.31 122.89 2k6b h LEU 14 Ca 0.38 -0.32 -0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2k6b h LEU 14 Cb 0.24 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 2k6b h LEU 14 CO -0.14 0.76 0.01 0.00 -0.62 0.00 0.00 178.44 178.45 2k6b h ALA 15 N 0.84 0.46 -0.32 1.25 0.00 -0.22 0.23 119.26 121.50 2k6b h ALA 15 Ca 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2k6b h ALA 15 Cb 0.47 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2k6b h ALA 15 CO 0.02 0.20 0.17 0.93 0.00 0.00 0.00 179.25 180.57 2k6b h GLU 16 N 0.40 0.46 0.00 0.00 5.08 -1.18 -2.59 114.58 116.75 2k6b h GLU 16 Ca 0.10 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 2k6b h GLU 16 Cb 0.43 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2k6b h GLU 16 CO 0.02 0.40 -0.55 1.25 -1.00 0.00 0.00 179.01 179.13 2k6b h LEU 17 N 0.39 0.00 -1.44 1.33 7.12 -1.43 -3.47 115.31 117.82 2k6b h LEU 17 Ca 0.11 0.00 -0.29 0.00 0.13 0.00 0.00 57.88 57.83 2k6b h LEU 17 Cb 0.09 0.00 0.13 0.00 -0.53 0.00 0.00 40.66 40.35 2k6b h LEU 17 CO -0.02 0.55 -0.62 0.00 -0.13 0.00 0.00 178.44 178.22 2k6b n GLN 18 N -3.37 -5.91 -2.01 1.25 6.02 0.72 -4.91 117.38 109.16 2k6b n GLN 18 Ca 0.01 0.70 -0.43 0.00 -0.01 0.00 0.00 57.00 57.27 2k6b n GLN 18 Cb 0.69 -5.32 -0.03 0.00 1.02 0.00 0.00 30.24 26.60 2k6b n GLN 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k6b s ALA 19 N -3.29 3.20 -0.09 -1.58 0.00 -0.67 -4.99 121.76 114.35 2k6b s ALA 19 Ca 0.16 0.55 -0.01 0.00 0.00 0.00 0.00 51.96 52.66 2k6b s ALA 19 Cb -0.07 -3.89 -0.03 0.00 0.00 0.00 0.00 23.12 19.13 2k6b s ALA 19 CO 0.61 -2.07 -0.03 -1.59 0.00 0.00 0.00 175.76 172.68 2k6b s LYS 20 N 4.93 2.96 -0.01 0.00 -2.85 -1.26 -4.97 119.74 118.53 2k6b s LYS 20 Ca 0.77 -0.46 0.18 0.00 -1.00 0.00 0.00 55.97 55.45 2k6b s LYS 20 Cb -0.27 -2.73 0.31 0.00 -2.06 0.00 0.00 37.83 33.08 2k6b s LYS 20 CO 0.31 0.65 1.12 1.58 0.10 0.00 0.00 175.35 179.12 2k6b n HIS 21 N 2.28 0.00 -1.35 1.78 -0.00 -1.26 -4.89 115.22 111.77 2k6b n HIS 21 Ca -0.18 -0.41 -0.34 0.00 0.46 0.00 0.00 57.72 57.25 2k6b n HIS 21 Cb 0.53 -0.13 -0.05 0.00 -0.12 0.00 0.00 29.99 30.23 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 0.27 4.17 3.11 1.57 0.00 -1.26 -4.78 105.19 108.27 2k6b n GLY 22 Ca 0.05 -1.54 -0.12 0.00 0.00 0.00 0.00 46.02 44.41 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 1.84 -0.13 -0.12 1.61 -4.77 -1.26 -5.04 116.67 108.80 2k6b s ASP 23 Ca 0.67 0.17 0.04 0.00 -3.30 0.00 0.00 52.55 50.13 2k6b s ASP 23 Cb 0.21 0.34 0.29 0.00 -1.09 0.00 0.00 42.92 42.67 2k6b s ASP 23 CO -0.06 -0.21 1.11 -2.65 0.70 0.00 0.00 175.17 174.05 2k6b n PRO 24 N 2.28 2.11 0.00 2.11 -0.02 -1.26 -4.98 135.00 135.23 2k6b n PRO 24 Ca -0.17 -1.16 0.00 0.00 -2.02 0.00 0.00 63.50 60.15 2k6b n PRO 24 Cb 0.57 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 2k6b n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k6b n GLY 25 N 0.11 1.49 0.25 -1.23 0.00 -1.26 -3.94 105.19 100.61 2k6b n GLY 25 Ca 0.15 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.40 2k6b n GLY 25 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2k6b h ASP 26 N 0.00 -0.05 -0.50 1.61 3.58 -2.01 -0.54 116.42 118.52 2k6b h ASP 26 Ca 0.00 0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.62 2k6b h ASP 26 Cb 0.00 0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.23 2k6b h ASP 26 CO 0.00 -0.04 0.33 0.00 -2.88 0.00 0.00 179.24 176.65 2k6b h ALA 27 N 1.57 1.75 -0.16 -0.78 0.00 -1.98 -1.87 119.26 117.79 2k6b h ALA 27 Ca 0.37 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.13 2k6b h ALA 27 Cb 0.62 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2k6b h ALA 27 CO -0.49 0.20 -0.45 0.00 0.00 0.00 0.00 179.25 178.50 2k6b h ALA 28 N 1.71 0.91 -0.38 0.00 0.00 -1.39 0.23 119.26 120.33 2k6b h ALA 28 Ca 0.20 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 2k6b h ALA 28 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2k6b h ALA 28 CO -0.05 0.65 -0.28 1.96 0.00 0.00 0.00 179.25 181.52 2k6b h GLN 29 N 0.33 0.81 -0.03 0.00 4.20 -1.26 -2.07 115.11 117.09 2k6b h GLN 29 Ca 0.02 -0.36 -0.15 0.00 0.06 0.00 0.00 58.65 58.22 2k6b h GLN 29 Cb 0.93 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.68 2k6b h GLN 29 CO 0.08 0.99 -0.67 1.96 -0.67 0.00 0.00 178.83 180.52 2k6b h GLN 30 N 0.69 0.13 -0.80 1.46 1.08 -0.80 -2.12 115.11 114.74 2k6b h GLN 30 Ca 0.08 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2k6b h GLN 30 Cb 0.82 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.24 2k6b h GLN 30 CO 0.07 0.75 0.38 0.93 -0.95 0.00 0.00 178.83 180.01 2k6b h GLU 31 N 0.09 1.16 -0.05 1.46 5.08 -0.32 0.29 114.58 122.30 2k6b h GLU 31 Ca -0.01 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2k6b h GLU 31 Cb 1.19 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 2k6b h GLU 31 CO 0.10 0.90 0.03 0.00 -1.00 0.00 0.00 179.01 179.03 2k6b h ALA 32 N 1.20 0.06 -0.73 3.43 0.00 -1.10 0.12 119.26 122.24 2k6b h ALA 32 Ca 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2k6b h ALA 32 Cb 0.12 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2k6b h ALA 32 CO -0.03 -0.40 0.47 -0.22 0.00 0.00 0.00 179.25 179.06 2k6b h LYS 33 N -0.01 0.97 -0.80 0.00 1.63 -1.15 -0.85 116.57 116.36 2k6b h LYS 33 Ca 0.02 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 2k6b h LYS 33 Cb 0.08 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.46 2k6b h LYS 33 CO -0.00 0.66 0.43 1.25 -3.45 0.00 0.00 179.45 178.33 2k6b h HIS 34 N 0.99 1.10 -0.28 1.91 2.76 -0.09 -1.28 115.15 120.25 2k6b h HIS 34 Ca 0.26 -0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.29 2k6b h HIS 34 Cb -0.09 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 28.51 2k6b h HIS 34 CO -0.02 0.78 -0.29 -0.09 -1.30 0.00 0.00 177.93 177.01 2k6b h ARG 35 N 1.11 0.58 -0.32 5.26 2.43 -0.31 0.51 114.38 123.63 2k6b h ARG 35 Ca 0.28 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 2k6b h ARG 35 Cb 0.05 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2k6b h ARG 35 CO -0.04 0.81 -0.11 0.93 -1.51 0.00 0.00 179.97 180.05 2k6b h GLU 36 N 0.50 0.55 0.37 0.20 4.39 -0.48 0.11 114.58 120.21 2k6b h GLU 36 Ca 0.06 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 2k6b h GLU 36 Cb 0.76 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.35 2k6b h GLU 36 CO 0.06 0.65 -0.18 0.00 -1.16 0.00 0.00 179.01 178.39 2k6b h ALA 37 N 1.38 -0.50 0.07 3.43 0.00 -0.81 -3.16 119.26 119.67 2k6b h ALA 37 Ca 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2k6b h ALA 37 Cb 0.49 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2k6b h ALA 37 CO 0.03 -0.50 -0.03 0.93 0.00 0.00 0.00 179.25 179.67 2k6b h GLU 38 N -1.05 -0.09 -0.26 0.00 5.08 -0.81 -1.89 114.58 115.55 2k6b h GLU 38 Ca -0.05 0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 2k6b h GLU 38 Cb 0.49 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2k6b h GLU 38 CO 0.08 -0.03 -0.53 1.98 -1.00 0.00 0.00 179.01 179.51 2k6b h MET 39 N -0.13 0.82 -0.16 2.33 4.05 -0.95 0.12 114.93 121.01 2k6b h MET 39 Ca -0.01 -0.53 -0.20 0.00 -0.28 0.00 0.00 59.70 58.68 2k6b h MET 39 Cb 0.10 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 2k6b h MET 39 CO 0.02 1.16 -0.71 0.00 0.23 0.00 0.00 176.91 177.60 2k6b h ARG 40 N 0.58 0.69 -0.08 0.39 3.08 -1.58 -2.97 114.38 114.49 2k6b h ARG 40 Ca 0.01 -0.53 -0.06 0.00 0.07 0.00 0.00 59.98 59.47 2k6b h ARG 40 Cb 1.14 0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2k6b h ARG 40 CO 0.12 1.15 -0.17 -0.97 -1.07 0.00 0.00 179.97 179.03 2k6b h ASN 41 N 0.49 0.29 -0.14 7.04 -0.73 -1.25 -3.24 115.58 118.04 2k6b h ASN 41 Ca -0.03 -0.57 0.03 0.00 1.87 0.00 0.00 56.30 57.60 2k6b h ASN 41 Cb 1.32 -0.08 -0.03 0.00 0.27 0.00 0.00 38.32 39.79 2k6b h ASN 41 CO 0.14 0.80 -0.06 0.77 -0.37 0.00 0.00 177.43 178.71 2k6b h SER 42 N -0.21 -0.21 -0.83 1.15 4.64 -0.81 0.22 113.55 117.50 2k6b h SER 42 Ca 0.00 0.05 0.03 0.00 -0.47 0.00 0.00 61.79 61.41 2k6b h SER 42 Cb 0.76 0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 62.92 2k6b h SER 42 CO 0.04 -0.09 0.54 0.16 -0.87 0.00 0.00 176.83 176.62 2k6b h ILE 43 N -0.05 1.15 -0.01 0.95 3.07 -1.64 0.39 117.51 121.37 2k6b h ILE 43 Ca 0.08 -0.36 -0.20 0.00 1.55 0.00 0.00 64.86 65.92 2k6b h ILE 43 Cb 0.16 0.02 -0.00 0.00 -0.27 0.00 0.00 36.82 36.72 2k6b h ILE 43 CO -0.17 0.19 -0.87 -0.07 -1.05 0.00 0.00 178.15 176.18 2k6b h LEU 44 N 1.04 0.40 -0.01 0.16 3.38 -1.45 -2.49 115.31 116.33 2k6b h LEU 44 Ca 0.32 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 2k6b h LEU 44 Cb 0.01 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2k6b h LEU 44 CO -0.09 1.09 -0.67 0.00 0.09 0.00 0.00 178.44 178.86 2k6b h ALA 45 N 0.89 0.57 0.00 1.53 0.00 0.60 0.23 119.26 123.08 2k6b h ALA 45 Ca -0.05 -0.61 -0.16 0.00 0.00 0.00 0.00 54.91 54.08 2k6b h ALA 45 Cb 1.49 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 2k6b h ALA 45 CO 0.14 0.84 -0.93 1.96 0.00 0.00 0.00 179.25 181.26 2k6b h GLN 46 N 0.00 0.00 0.04 0.00 4.20 -0.32 -3.37 115.11 115.66 2k6b h GLN 46 Ca -0.01 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.38 2k6b h GLN 46 Cb 1.51 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.26 2k6b h GLN 46 CO 0.09 0.59 -1.78 0.28 -0.67 0.00 0.00 178.83 177.33 2k6b n VAL 47 N -3.17 1.62 -3.21 -0.54 0.31 -0.94 -4.75 118.33 107.65 2k6b n VAL 47 Ca -0.03 -0.34 -0.39 0.00 -0.01 0.00 0.00 64.34 63.58 2k6b n VAL 47 Cb 0.84 -1.86 -0.05 0.00 -0.91 0.00 0.00 33.84 31.85 2k6b n VAL 47 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2k6b s LEU 48 N -7.43 4.28 0.97 7.52 1.43 0.82 0.19 118.68 126.46 2k6b s LEU 48 Ca -0.28 0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 53.65 2k6b s LEU 48 Cb 0.08 -2.84 0.17 0.00 0.03 0.00 0.00 46.19 43.62 2k6b s LEU 48 CO 0.64 -0.06 1.11 -0.62 0.23 0.00 0.00 176.35 177.65 2k6b s ASP 49 N 0.73 2.57 0.38 2.29 2.15 -0.53 -4.53 116.67 119.72 2k6b s ASP 49 Ca 0.30 1.95 0.11 0.00 0.43 0.00 0.00 52.55 55.34 2k6b s ASP 49 Cb -0.16 -2.47 0.90 0.00 -0.30 0.00 0.00 42.92 40.89 2k6b s ASP 49 CO 0.13 -3.28 1.87 -0.61 -0.17 0.00 0.00 175.17 173.11 2k6b h GLN 50 N -1.99 0.58 -0.46 4.34 4.15 -1.89 0.16 115.11 119.99 2k6b h GLN 50 Ca -0.48 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 58.78 2k6b h GLN 50 Cb 1.28 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.83 2k6b h GLN 50 CO 0.45 0.38 -0.18 0.77 -1.93 0.00 0.00 178.83 178.33 2k6b h SER 51 N 0.60 0.96 0.13 -0.69 0.02 -1.92 -1.73 113.55 110.91 2k6b h SER 51 Ca 0.45 -0.39 -0.17 0.00 -0.84 0.00 0.00 61.79 60.84 2k6b h SER 51 Cb 0.84 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 2k6b h SER 51 CO -0.20 1.13 -0.64 0.00 -1.14 0.00 0.00 176.83 175.99 2k6b h ALA 52 N 0.86 0.65 -0.86 3.77 0.00 -1.24 -0.44 119.26 121.99 2k6b h ALA 52 Ca 0.11 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2k6b h ALA 52 Cb 0.75 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2k6b h ALA 52 CO 0.06 0.72 0.46 0.00 0.00 0.00 0.00 179.25 180.49 2k6b h ARG 53 N 0.36 1.21 -0.14 0.00 2.47 -0.58 0.19 114.38 117.89 2k6b h ARG 53 Ca -0.01 -0.15 -0.04 0.00 -1.26 0.00 0.00 59.98 58.52 2k6b h ARG 53 Cb 1.20 -0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 29.28 2k6b h ARG 53 CO 0.11 0.90 -0.05 0.00 0.56 0.00 0.00 179.97 181.49 2k6b h ALA 54 N 1.25 0.19 -0.63 0.04 0.00 -1.03 -1.46 119.26 117.63 2k6b h ALA 54 Ca 0.30 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2k6b h ALA 54 Cb 0.05 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2k6b h ALA 54 CO -0.05 -0.03 0.35 -0.09 0.00 0.00 0.00 179.25 179.43 2k6b h ARG 55 N -0.04 0.64 -0.66 0.00 9.65 -0.83 -1.14 114.38 121.99 2k6b h ARG 55 Ca 0.03 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 2k6b h ARG 55 Cb 0.50 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 2k6b h ARG 55 CO 0.02 0.42 0.32 1.25 2.80 0.00 0.00 179.97 184.78 2k6b h LEU 56 N 0.66 0.86 -0.93 3.80 5.85 -0.55 0.94 115.31 125.94 2k6b h LEU 56 Ca 0.28 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 2k6b h LEU 56 Cb 0.15 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2k6b h LEU 56 CO -0.17 0.75 0.28 0.28 -0.34 0.00 0.00 178.44 179.24 2k6b h SER 57 N 0.91 0.98 0.45 1.25 0.02 -0.68 0.22 113.55 116.69 2k6b h SER 57 Ca 0.23 -0.14 -0.15 0.00 -0.84 0.00 0.00 61.79 60.89 2k6b h SER 57 Cb 0.11 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 2k6b h SER 57 CO -0.03 0.87 -0.63 0.78 -1.14 0.00 0.00 176.83 176.68 2k6b h ASN 58 N 1.04 0.20 -0.14 3.07 2.35 -0.79 -3.06 115.58 118.25 2k6b h ASN 58 Ca 0.24 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.75 2k6b h ASN 58 Cb 0.20 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2k6b h ASN 58 CO -0.02 0.77 -0.34 0.25 -1.65 0.00 0.00 177.43 176.45 2k6b h LEU 59 N 0.13 0.67 -2.35 1.61 7.12 -0.08 -2.62 115.31 119.79 2k6b h LEU 59 Ca -0.01 -0.27 0.02 0.00 0.13 0.00 0.00 57.88 57.75 2k6b h LEU 59 Cb 1.13 -0.19 -0.00 0.00 -0.53 0.00 0.00 40.66 41.07 2k6b h LEU 59 CO 0.09 0.95 0.09 0.00 -0.13 0.00 0.00 178.44 179.45 2k6b h ALA 60 N 1.09 1.66 0.21 1.25 0.00 -0.87 -1.88 119.26 120.72 2k6b h ALA 60 Ca 0.06 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.64 2k6b h ALA 60 Cb 0.84 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.66 2k6b h ALA 60 CO 0.07 -0.13 -1.52 -0.07 0.00 0.00 0.00 179.25 177.60 2k6b h LEU 61 N 0.00 0.68 -0.10 0.00 3.38 -1.49 -3.21 115.31 114.57 2k6b h LEU 61 Ca 0.04 -0.81 -0.24 0.00 0.09 0.00 0.00 57.88 56.96 2k6b h LEU 61 Cb 0.22 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2k6b h LEU 61 CO -0.00 1.65 -0.94 -0.37 0.09 0.00 0.00 178.44 178.87 2k6b h VAL 62 N 0.12 1.31 -0.52 1.22 -1.51 -1.31 -3.44 116.25 112.12 2k6b h VAL 62 Ca -0.26 -2.21 0.17 0.00 -1.23 0.00 0.00 66.70 63.17 2k6b h VAL 62 Cb 2.11 2.27 -0.20 0.00 -2.13 0.00 0.00 31.29 33.34 2k6b h VAL 62 CO 0.23 0.68 -0.07 -1.59 -1.23 0.00 0.00 177.57 175.60 2k6b s LYS 63 N -3.43 0.29 0.01 5.19 -2.85 -0.86 -5.04 119.74 113.05 2k6b s LYS 63 Ca -0.09 0.40 0.13 0.00 -1.00 0.00 0.00 55.97 55.41 2k6b s LYS 63 Cb 0.08 0.20 0.56 0.00 -2.06 0.00 0.00 37.83 36.62 2k6b s LYS 63 CO 0.90 -0.44 1.42 -0.35 0.10 0.00 0.00 175.35 176.98 2k6b n PRO 64 N 5.33 0.01 -0.17 1.78 -0.04 -1.21 -2.67 135.00 138.03 2k6b n PRO 64 Ca 0.02 0.28 -0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2k6b n PRO 64 Cb 0.55 -1.51 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 0.93 -0.04 0.00 0.00 175.50 176.39 2k6b h GLU 65 N 0.00 0.94 0.00 0.54 5.08 -1.93 -0.41 114.58 118.81 2k6b h GLU 65 Ca 0.00 -0.34 -0.18 0.00 -1.00 0.00 0.00 59.36 57.84 2k6b h GLU 65 Cb 0.22 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2k6b h GLU 65 CO 0.00 1.00 -0.87 0.87 -1.00 0.00 0.00 179.01 179.01 2k6b h LYS 66 N 0.80 0.00 0.08 2.33 6.56 -1.89 -3.04 116.57 121.40 2k6b h LYS 66 Ca 0.13 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.72 2k6b h LYS 66 Cb 0.63 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.29 2k6b h LYS 66 CO 0.04 0.87 -0.05 1.15 -2.06 0.00 0.00 179.45 179.40 2k6b h THR 67 N 0.00 0.90 -0.05 -0.16 2.02 -1.43 -1.35 112.91 112.84 2k6b h THR 67 Ca -0.01 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 2k6b h THR 67 Cb 1.61 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 2k6b h THR 67 CO 0.11 0.00 -0.20 0.07 0.37 0.00 0.00 175.52 175.87 2k6b h LYS 68 N -0.12 0.08 -0.17 6.66 2.10 -1.15 0.14 116.57 124.12 2k6b h LYS 68 Ca -0.01 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.61 2k6b h LYS 68 Cb 0.10 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.41 2k6b h LYS 68 CO 0.01 0.29 0.06 0.00 -2.00 0.00 0.00 179.45 177.80 2k6b h ALA 69 N 1.72 0.22 -0.19 0.07 0.00 -1.33 -0.59 119.26 119.15 2k6b h ALA 69 Ca 0.01 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2k6b h ALA 69 Cb 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2k6b h ALA 69 CO 0.03 -0.17 -0.46 -0.39 0.00 0.00 0.00 179.25 178.25 2k6b h VAL 70 N 0.10 1.32 0.00 0.00 -1.51 -0.74 -2.38 116.25 113.04 2k6b h VAL 70 Ca 0.05 -1.70 0.02 0.00 -1.23 0.00 0.00 66.70 63.85 2k6b h VAL 70 Cb 0.20 1.89 -0.03 0.00 -2.13 0.00 0.00 31.29 31.22 2k6b h VAL 70 CO -0.00 0.53 -0.15 -0.33 -1.23 0.00 0.00 177.57 176.39 2k6b h GLU 71 N 0.34 -0.24 -0.57 5.19 5.08 -0.69 0.54 114.58 124.23 2k6b h GLU 71 Ca -0.00 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2k6b h GLU 71 Cb 1.08 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 2k6b h GLU 71 CO 0.10 -0.16 0.29 -0.97 -1.00 0.00 0.00 179.01 177.27 2k6b h ASN 72 N -0.25 0.70 -0.14 1.42 -1.24 -1.18 0.09 115.58 114.97 2k6b h ASN 72 Ca 0.05 -0.06 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 2k6b h ASN 72 Cb 0.32 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.18 2k6b h ASN 72 CO -0.15 0.59 0.04 0.22 -1.29 0.00 0.00 177.43 176.84 2k6b h TYR 73 N 0.79 0.23 -0.62 0.67 3.20 -0.79 -1.61 116.97 118.84 2k6b h TYR 73 Ca 0.20 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 2k6b h TYR 73 Cb 0.06 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2k6b h TYR 73 CO 0.01 0.34 0.21 -0.07 -1.64 0.00 0.00 178.16 177.00 2k6b h LEU 74 N 0.05 0.86 -0.26 2.82 -0.00 -0.37 0.73 115.31 119.15 2k6b h LEU 74 Ca 0.05 -0.14 0.05 0.00 -0.00 0.00 0.00 57.88 57.83 2k6b h LEU 74 Cb 0.22 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 40.61 2k6b h LEU 74 CO -0.00 0.80 -0.01 0.40 -0.00 0.00 0.00 178.44 179.63 2k6b h ILE 75 N 0.91 0.80 0.00 1.22 2.04 -0.79 0.27 117.51 121.97 2k6b h ILE 75 Ca 0.21 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 66.04 2k6b h ILE 75 Cb 0.24 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2k6b h ILE 75 CO -0.01 0.01 -0.00 1.56 0.00 0.00 0.00 178.15 179.71 2k6b h GLN 76 N 0.07 -0.01 -0.16 2.37 7.50 -0.83 -2.22 115.11 121.83 2k6b h GLN 76 Ca 0.12 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.23 2k6b h GLN 76 Cb 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.69 2k6b h GLN 76 CO -0.22 0.16 -0.08 0.52 -1.50 0.00 0.00 178.83 177.71 2k6b h MET 77 N -0.17 0.24 -0.47 1.46 2.86 -0.63 -0.02 114.93 118.21 2k6b h MET 77 Ca -0.00 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.49 2k6b h MET 77 Cb 0.17 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 2k6b h MET 77 CO 0.00 0.34 -0.13 0.00 1.06 0.00 0.00 176.91 178.18 2k6b h ALA 78 N 1.69 0.89 -0.48 6.32 0.00 -0.38 -1.12 119.26 126.17 2k6b h ALA 78 Ca 0.05 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 2k6b h ALA 78 Cb 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2k6b h ALA 78 CO 0.01 0.64 -0.05 0.00 0.00 0.00 0.00 179.25 179.85 2k6b h ARG 79 N 0.78 0.84 0.00 0.00 2.47 -0.56 -2.78 114.38 115.13 2k6b h ARG 79 Ca 0.12 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 2k6b h ARG 79 Cb 0.65 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.89 2k6b h ARG 79 CO 0.05 0.87 0.00 1.88 0.56 0.00 0.00 179.97 183.33 2k6b h TYR 80 N 0.77 0.00 -2.87 3.04 0.05 -0.83 -3.47 116.97 113.66 2k6b h TYR 80 Ca 0.14 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.77 2k6b h TYR 80 Cb 0.54 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.33 2k6b h TYR 80 CO 0.03 0.00 -0.26 0.41 -1.05 0.00 0.00 178.16 177.29 2k6b n GLY 81 N 1.14 0.37 0.82 3.88 0.00 -0.54 -4.93 105.19 105.93 2k6b n GLY 81 Ca 0.05 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.87 2k6b n GLY 81 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k6b n GLN 82 N -2.17 2.10 -3.75 1.61 1.13 -0.54 -4.74 117.38 111.03 2k6b n GLN 82 Ca -0.01 -1.63 -0.37 0.00 -1.94 0.00 0.00 57.00 53.05 2k6b n GLN 82 Cb 0.53 -1.46 -0.11 0.00 0.11 0.00 0.00 30.24 29.30 2k6b n GLN 82 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2k6b s LEU 83 N -1.77 5.13 -0.03 1.08 2.01 -1.26 -4.89 118.68 118.96 2k6b s LEU 83 Ca 0.34 -1.87 -0.09 0.00 0.01 0.00 0.00 54.13 52.52 2k6b s LEU 83 Cb 0.20 -1.85 -0.30 0.00 0.01 0.00 0.00 46.19 44.25 2k6b s LEU 83 CO 0.30 -0.52 0.74 0.28 1.01 0.00 0.00 176.35 178.16 2k6b h SER 84 N 8.12 0.57 -1.16 2.29 0.02 -1.98 -3.48 113.55 117.94 2k6b h SER 84 Ca -0.16 -0.82 -0.59 0.00 -0.84 0.00 0.00 61.79 59.37 2k6b h SER 84 Cb 1.06 -0.19 -0.09 0.00 0.14 0.00 0.00 62.40 63.32 2k6b h SER 84 CO 0.70 1.69 -0.46 -1.61 -1.14 0.00 0.00 176.83 176.01 2k6b s GLU 85 N -2.59 2.21 0.65 3.45 0.41 -1.26 -5.12 118.70 116.45 2k6b s GLU 85 Ca -0.14 -2.00 -0.15 0.00 -0.41 0.00 0.00 54.97 52.28 2k6b s GLU 85 Cb 0.06 -1.91 -0.01 0.00 -1.78 0.00 0.00 34.13 30.50 2k6b s GLU 85 CO 0.86 -0.26 1.10 0.15 -0.49 0.00 0.00 175.26 176.62 2k6b s LYS 86 N -3.97 2.89 -0.36 1.61 1.02 -1.26 -4.94 119.74 114.74 2k6b s LYS 86 Ca 0.33 1.33 -0.15 0.00 0.02 0.00 0.00 55.97 57.50 2k6b s LYS 86 Cb 0.03 -1.97 -0.01 0.00 -0.52 0.00 0.00 37.83 35.36 2k6b s LYS 86 CO 0.18 -1.17 0.34 0.08 -0.92 0.00 0.00 175.35 173.86 2k6b s VAL 87 N -2.40 5.19 0.82 3.17 1.01 0.13 -4.90 120.40 123.42 2k6b s VAL 87 Ca 0.66 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.40 2k6b s VAL 87 Cb -0.19 -3.84 0.18 0.00 0.00 0.00 0.00 36.38 32.53 2k6b s VAL 87 CO 0.41 -0.14 1.12 -1.20 0.00 0.00 0.00 175.10 175.29 2k6b n SER 88 N 5.33 0.34 -0.23 3.32 7.64 -1.26 -1.45 113.62 127.31 2k6b n SER 88 Ca -0.10 -1.56 -0.06 0.00 1.01 0.00 0.00 58.87 58.16 2k6b n SER 88 Cb 0.49 -0.83 0.04 0.00 -1.01 0.00 0.00 64.21 62.90 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 0.89 0.00 1.43 5.08 -1.94 -0.35 114.58 119.69 2k6b h GLU 89 Ca -0.36 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 57.89 2k6b h GLU 89 Cb 1.06 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 2k6b h GLU 89 CO 0.28 0.68 -0.02 -0.56 -1.00 0.00 0.00 179.01 178.38 2k6b h GLN 90 N 0.87 0.00 0.06 2.33 -0.00 -1.99 0.12 115.11 116.51 2k6b h GLN 90 Ca 0.23 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 58.60 2k6b h GLN 90 Cb 0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.50 2k6b h GLN 90 CO -0.04 0.02 -1.41 0.78 -0.00 0.00 0.00 178.83 178.19 2k6b h GLY 91 N 0.21 0.14 1.02 0.06 0.00 -1.57 -2.70 103.07 100.23 2k6b h GLY 91 Ca -0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 47.33 46.80 2k6b h GLY 91 CO 0.00 0.32 -0.46 -2.00 0.00 0.00 0.00 176.54 174.40 2k6b h LEU 92 N 0.03 0.80 -1.49 3.11 5.85 0.05 -2.21 115.31 121.46 2k6b h LEU 92 Ca -0.18 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 2k6b h LEU 92 Cb 1.94 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.73 2k6b h LEU 92 CO 0.14 1.20 0.06 0.40 -0.34 0.00 0.00 178.44 179.90 2k6b h ILE 93 N 0.44 1.14 -0.19 4.05 2.04 -0.92 0.31 117.51 124.38 2k6b h ILE 93 Ca 0.01 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 2k6b h ILE 93 Cb 1.07 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 2k6b h ILE 93 CO 0.10 0.17 0.09 -0.08 0.00 0.00 0.00 178.15 178.43 2k6b h GLU 94 N 0.39 0.28 -0.17 2.37 4.57 -1.24 -0.09 114.58 120.69 2k6b h GLU 94 Ca 0.10 -0.04 -0.16 0.00 -1.18 0.00 0.00 59.36 58.08 2k6b h GLU 94 Cb 0.16 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 2k6b h GLU 94 CO -0.00 0.31 -0.54 0.82 -1.18 0.00 0.00 179.01 178.42 2k6b h ILE 95 N 0.17 1.33 0.21 2.32 2.04 -0.76 -2.60 117.51 120.21 2k6b h ILE 95 Ca 0.07 -1.80 -0.00 0.00 1.00 0.00 0.00 64.86 64.12 2k6b h ILE 95 Cb 0.13 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 2k6b h ILE 95 CO -0.01 0.56 -0.14 0.25 0.00 0.00 0.00 178.15 178.81 2k6b h LEU 96 N 0.39 -0.34 -1.46 1.44 5.85 -0.06 0.19 115.31 121.31 2k6b h LEU 96 Ca 0.01 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2k6b h LEU 96 Cb 1.08 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 2k6b h LEU 96 CO 0.10 -0.22 -0.07 0.07 -0.34 0.00 0.00 178.44 177.98 2k6b h LYS 97 N -0.34 0.27 0.05 1.25 2.10 -1.02 0.23 116.57 119.12 2k6b h LYS 97 Ca -0.02 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.58 2k6b h LYS 97 Cb 0.29 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 2k6b h LYS 97 CO 0.01 0.36 -0.03 -0.22 -2.00 0.00 0.00 179.45 177.57 2k6b h LYS 98 N 0.27 -0.07 0.00 0.07 3.64 -1.03 -1.98 116.57 117.47 2k6b h LYS 98 Ca 0.06 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 2k6b h LYS 98 Cb 0.29 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2k6b h LYS 98 CO 0.01 0.11 -0.32 -0.39 -2.27 0.00 0.00 179.45 176.60 2k6b h VAL 99 N -0.24 0.55 -0.58 2.00 -1.51 -0.61 0.11 116.25 115.99 2k6b h VAL 99 Ca -0.01 -1.74 -0.08 0.00 -1.23 0.00 0.00 66.70 63.65 2k6b h VAL 99 Cb 0.21 2.24 -0.02 0.00 -2.13 0.00 0.00 31.29 31.59 2k6b h VAL 99 CO 0.01 0.31 0.05 -1.28 -1.23 0.00 0.00 177.57 175.44 2k6b h SER 100 N 0.00 0.95 0.07 4.19 0.87 -0.43 -3.31 113.55 115.89 2k6b h SER 100 Ca -0.00 -0.28 -0.29 0.00 -1.23 0.00 0.00 61.79 59.98 2k6b h SER 100 Cb 1.21 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.89 2k6b h SER 100 CO 0.04 1.00 -1.59 -0.61 -0.53 0.00 0.00 176.83 175.14 2k6b h GLN 101 N 0.88 0.14 0.00 2.24 4.15 -1.33 -3.48 115.11 117.70 2k6b h GLN 101 Ca 0.17 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2k6b h GLN 101 Cb 0.47 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.25 2k6b h GLN 101 CO 0.02 1.12 0.00 1.04 -1.93 0.00 0.00 178.83 179.07 2k6b n GLN 102 N -3.98 0.00 0.00 1.69 6.02 0.33 -5.08 117.38 116.36 2k6b n GLN 102 Ca -0.31 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.68 2k6b n GLN 102 Cb 0.86 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.12 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 0.00 5.09 -1.04 -0.83 -4.72 114.28 112.78 2k6b n THR 103 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2k6b n THR 103 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2k6b n THR 103 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2k6b n GLU 104 N 0.00 0.00 -2.23 -2.82 2.13 -1.26 -3.77 120.64 112.69 2k6b n GLU 104 Ca 0.00 0.00 -0.00 0.00 0.66 0.00 0.00 57.16 57.82 2k6b n GLU 104 Cb 0.00 0.00 0.05 0.00 0.27 0.00 0.00 31.44 31.76 2k6b n GLU 104 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2k6b n LYS 105 N 0.00 1.30 -2.18 5.31 4.76 -1.26 -5.03 118.16 121.05 2k6b n LYS 105 Ca 0.00 -3.05 -0.31 0.00 -2.87 0.00 0.00 58.31 52.08 2k6b n LYS 105 Cb 0.00 -1.13 -0.05 0.00 -1.84 0.00 0.00 35.03 32.01 2k6b n LYS 105 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2k6b s THR 106 N -2.58 3.62 0.11 -0.18 -4.23 -1.26 -4.71 115.64 106.41 2k6b s THR 106 Ca 0.32 -0.83 -0.14 0.00 -1.18 0.00 0.00 61.69 59.85 2k6b s THR 106 Cb 0.35 -4.50 -0.07 0.00 1.34 0.00 0.00 72.50 69.62 2k6b s THR 106 CO -0.08 -1.21 1.45 0.74 -0.54 0.00 0.00 174.62 174.98 2k6b h THR 107 N 6.56 1.29 -3.63 3.99 2.02 -2.04 -3.46 112.91 117.65 2k6b h THR 107 Ca 0.20 -1.41 -0.10 0.00 0.77 0.00 0.00 66.41 65.87 2k6b h THR 107 Cb 0.96 1.49 -0.16 0.00 -1.74 0.00 0.00 68.15 68.70 2k6b h THR 107 CO 1.27 0.46 -0.38 -0.89 0.37 0.00 0.00 175.52 176.35 2k6b s THR 108 N -4.45 0.12 -0.06 3.16 2.01 -1.26 -5.04 115.64 110.12 2k6b s THR 108 Ca -0.12 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 60.89 2k6b s THR 108 Cb 0.09 -1.04 0.00 0.00 0.01 0.00 0.00 72.50 71.56 2k6b s THR 108 CO 0.83 -0.54 0.03 0.52 -0.69 0.00 0.00 174.62 174.77 2k6b n VAL 109 N 0.45 -4.80 0.00 3.82 0.31 -1.26 -5.08 118.33 111.77 2k6b n VAL 109 Ca -0.18 0.54 0.00 0.00 -0.01 0.00 0.00 64.34 64.69 2k6b n VAL 109 Cb 0.60 -4.50 0.00 0.00 -0.91 0.00 0.00 33.84 29.02 2k6b n VAL 109 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2k6b n LYS 110 N 0.27 0.00 0.00 5.55 4.81 -1.26 -4.76 118.16 122.77 2k6b n LYS 110 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 2k6b n LYS 110 Cb 0.07 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.12 2k6b n LYS 110 CO 0.00 0.00 0.00 1.97 1.17 0.00 0.00 177.40 180.54 2k6b n PHE 111 N -2.04 0.00 -0.54 5.64 1.16 -1.26 -5.08 117.46 115.33 2k6b n PHE 111 Ca 0.00 -0.17 0.00 0.00 -1.87 0.00 0.00 57.45 55.41 2k6b n PHE 111 Cb 0.00 -0.02 0.00 0.00 -1.61 0.00 0.00 39.48 37.85 2k6b n PHE 111 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18