#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 6.35 0.29 1.61 0.01 -1.26 -4.88 113.70 115.82 2k6b s SER 1 Ca 0.00 -0.04 0.03 0.00 1.31 0.00 0.00 55.95 57.25 2k6b s SER 1 Cb 0.00 -2.56 0.64 0.00 0.21 0.00 0.00 66.02 64.31 2k6b s SER 1 CO 0.00 -1.59 1.81 0.00 0.41 0.00 0.00 173.24 173.86 2k6b h ALA 2 N 9.74 1.58 -0.47 1.44 0.00 -2.05 0.13 119.26 129.63 2k6b h ALA 2 Ca -0.26 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2k6b h ALA 2 Cb 1.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2k6b h ALA 2 CO 1.21 0.10 0.22 -0.44 0.00 0.00 0.00 179.25 180.34 2k6b h ASP 3 N 0.89 0.63 0.03 0.00 3.32 -2.00 0.20 116.42 119.48 2k6b h ASP 3 Ca 0.53 -0.14 -0.18 0.00 0.02 0.00 0.00 57.03 57.26 2k6b h ASP 3 Cb 0.67 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 2k6b h ASP 3 CO -0.32 0.59 -0.66 -0.33 -1.72 0.00 0.00 179.24 176.80 2k6b h GLU 4 N 0.62 0.60 -0.63 3.56 3.07 -1.62 -2.64 114.58 117.54 2k6b h GLU 4 Ca 0.16 -0.43 -0.03 0.00 -0.50 0.00 0.00 59.36 58.56 2k6b h GLU 4 Cb 0.13 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.09 2k6b h GLU 4 CO -0.02 1.05 0.29 0.93 -1.40 0.00 0.00 179.01 179.86 2k6b h GLU 5 N 0.43 0.90 -0.04 2.33 5.08 -0.46 0.15 114.58 122.97 2k6b h GLU 5 Ca -0.02 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2k6b h GLU 5 Cb 1.24 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 2k6b h GLU 5 CO 0.13 0.71 0.02 1.25 -1.00 0.00 0.00 179.01 180.11 2k6b h LEU 6 N 0.89 0.06 0.26 1.33 5.85 -0.83 -1.07 115.31 121.79 2k6b h LEU 6 Ca 0.22 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2k6b h LEU 6 Cb 0.12 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2k6b h LEU 6 CO -0.03 0.17 -0.15 -0.33 -0.34 0.00 0.00 178.44 177.76 2k6b h GLU 7 N -0.06 -0.38 -0.47 1.25 4.39 -1.12 -2.53 114.58 115.66 2k6b h GLU 7 Ca 0.01 0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.83 2k6b h GLU 7 Cb 0.13 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 28.79 2k6b h GLU 7 CO -0.00 -0.25 0.02 0.00 -1.16 0.00 0.00 179.01 177.61 2k6b h ALA 8 N 0.34 0.45 -0.63 3.43 0.00 -0.64 0.25 119.26 122.46 2k6b h ALA 8 Ca -0.03 0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2k6b h ALA 8 Cb 0.33 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2k6b h ALA 8 CO 0.03 -0.38 0.40 1.25 0.00 0.00 0.00 179.25 180.56 2k6b h LEU 9 N 0.13 0.68 -0.12 0.00 6.46 -1.13 -0.09 115.31 121.23 2k6b h LEU 9 Ca 0.23 -0.01 -0.16 0.00 -0.12 0.00 0.00 57.88 57.82 2k6b h LEU 9 Cb 0.34 -0.16 0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2k6b h LEU 9 CO -0.37 0.48 -0.56 0.03 -0.62 0.00 0.00 178.44 177.40 2k6b h ARG 10 N 0.80 0.58 -0.75 1.25 3.08 -0.89 -2.70 114.38 115.76 2k6b h ARG 10 Ca 0.24 -0.47 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 2k6b h ARG 10 Cb -0.03 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 2k6b h ARG 10 CO -0.08 1.09 0.40 0.00 -1.07 0.00 0.00 179.97 180.32 2k6b h ARG 11 N 0.22 1.04 0.24 0.04 3.08 -0.30 -1.01 114.38 117.69 2k6b h ARG 11 Ca -0.04 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 2k6b h ARG 11 Cb 1.20 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 2k6b h ARG 11 CO 0.12 0.77 -0.16 0.37 -1.07 0.00 0.00 179.97 180.00 2k6b h GLN 12 N 1.05 -0.38 -0.83 0.04 4.15 -1.00 -1.67 115.11 116.47 2k6b h GLN 12 Ca 0.26 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.68 2k6b h GLN 12 Cb 0.04 0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.78 2k6b h GLN 12 CO -0.04 -0.26 0.41 0.00 -1.93 0.00 0.00 178.83 177.01 2k6b h ARG 13 N -0.40 1.18 -0.46 1.69 3.08 -1.09 -1.09 114.38 117.29 2k6b h ARG 13 Ca -0.02 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 2k6b h ARG 13 Cb 0.34 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2k6b h ARG 13 CO 0.01 0.90 0.24 -0.07 -1.07 0.00 0.00 179.97 179.99 2k6b h LEU 14 N 1.18 0.56 -0.59 3.04 4.07 -1.05 0.48 115.31 123.00 2k6b h LEU 14 Ca 0.29 -0.04 -0.15 0.00 0.08 0.00 0.00 57.88 58.06 2k6b h LEU 14 Cb 0.10 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 2k6b h LEU 14 CO -0.04 0.46 -0.67 0.00 -1.08 0.00 0.00 178.44 177.12 2k6b h ALA 15 N 1.63 0.81 0.14 1.53 0.00 -0.27 -3.00 119.26 120.10 2k6b h ALA 15 Ca 0.17 -0.59 -0.30 0.00 0.00 0.00 0.00 54.91 54.18 2k6b h ALA 15 Cb 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2k6b h ALA 15 CO -0.03 0.79 -1.43 0.93 0.00 0.00 0.00 179.25 179.51 2k6b h GLU 16 N 0.11 0.30 -0.25 0.00 4.39 -0.29 -3.34 114.58 115.50 2k6b h GLU 16 Ca -0.01 -0.51 -0.09 0.00 0.34 0.00 0.00 59.36 59.08 2k6b h GLU 16 Cb 1.20 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 30.02 2k6b h GLU 16 CO 0.10 1.20 -0.23 1.25 -1.16 0.00 0.00 179.01 180.17 2k6b h LEU 17 N 0.08 0.47 0.00 1.33 6.46 -0.08 -3.46 115.31 120.11 2k6b h LEU 17 Ca -0.21 -0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.40 2k6b h LEU 17 Cb 2.02 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.83 2k6b h LEU 17 CO 0.19 0.70 0.00 1.67 -0.62 0.00 0.00 178.44 180.38 2k6b n GLN 18 N -4.14 0.00 -1.92 1.25 7.27 -1.14 -4.88 117.38 113.82 2k6b n GLN 18 Ca -0.00 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.64 2k6b n GLN 18 Cb 0.39 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 33.01 2k6b n GLN 18 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k6b s ALA 19 N 0.00 3.22 -1.37 1.69 0.00 -1.26 -4.86 121.76 119.18 2k6b s ALA 19 Ca 0.00 0.70 -0.13 0.00 0.00 0.00 0.00 51.96 52.53 2k6b s ALA 19 Cb 0.00 -3.90 0.09 0.00 0.00 0.00 0.00 23.12 19.31 2k6b s ALA 19 CO 0.00 -2.05 2.00 1.17 0.00 0.00 0.00 175.76 176.87 2k6b n LYS 20 N 7.87 3.17 -0.45 0.00 4.81 -1.26 -2.78 118.16 129.51 2k6b n LYS 20 Ca 0.21 -3.06 -0.01 0.00 -0.87 0.00 0.00 58.31 54.58 2k6b n LYS 20 Cb 0.44 -3.19 -0.01 0.00 0.02 0.00 0.00 35.03 32.29 2k6b n LYS 20 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 2k6b n HIS 21 N 5.73 0.00 1.50 5.64 -0.00 -1.26 -5.00 115.22 121.84 2k6b n HIS 21 Ca 0.47 -0.09 0.14 0.00 0.46 0.00 0.00 57.72 58.69 2k6b n HIS 21 Cb 0.39 0.27 0.76 0.00 -0.12 0.00 0.00 29.99 31.29 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 0.00 -1.06 3.65 1.57 0.00 -1.12 -4.70 105.19 103.54 2k6b n GLY 22 Ca -0.05 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 2k6b n GLY 22 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k6b s ASP 23 N -2.32 6.99 -0.27 1.61 -1.08 -1.26 -4.91 116.67 115.43 2k6b s ASP 23 Ca 0.33 1.36 0.12 0.00 -0.52 0.00 0.00 52.55 53.84 2k6b s ASP 23 Cb 0.19 -2.54 0.64 0.00 -1.46 0.00 0.00 42.92 39.75 2k6b s ASP 23 CO 0.38 -0.77 1.62 -0.81 0.52 0.00 0.00 175.17 176.11 2k6b n PRO 24 N 6.59 3.16 -0.27 4.34 -0.04 -1.26 -4.77 135.00 142.76 2k6b n PRO 24 Ca 0.13 -3.04 -0.05 0.00 -0.04 0.00 0.00 63.50 60.50 2k6b n PRO 24 Cb 0.46 -2.03 0.06 0.00 -0.04 0.00 0.00 33.50 31.95 2k6b n PRO 24 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2k6b h GLY 25 N 2.13 1.07 1.14 0.55 0.00 -1.98 0.17 103.07 106.14 2k6b h GLY 25 Ca 0.17 -0.45 -0.28 0.00 0.00 0.00 0.00 47.33 46.77 2k6b h GLY 25 CO 0.51 0.43 -1.20 -0.55 0.00 0.00 0.00 176.54 175.73 2k6b h ASP 26 N 1.01 0.81 0.11 0.19 3.32 -2.01 -3.12 116.42 116.73 2k6b h ASP 26 Ca 0.27 -0.85 -0.00 0.00 0.02 0.00 0.00 57.03 56.46 2k6b h ASP 26 Cb -0.04 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 2k6b h ASP 26 CO -0.05 1.58 -0.08 0.00 -1.72 0.00 0.00 179.24 178.97 2k6b h ALA 27 N 0.23 -0.18 -0.99 3.45 0.00 -1.84 -2.49 119.26 117.45 2k6b h ALA 27 Ca -0.19 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.73 2k6b h ALA 27 Cb 1.89 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.73 2k6b h ALA 27 CO 0.23 -0.61 0.65 0.00 0.00 0.00 0.00 179.25 179.52 2k6b h ALA 28 N 0.69 1.36 -0.28 0.00 0.00 -0.76 -0.45 119.26 119.82 2k6b h ALA 28 Ca -0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2k6b h ALA 28 Cb 0.18 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2k6b h ALA 28 CO -0.01 0.55 -0.04 1.96 0.00 0.00 0.00 179.25 181.71 2k6b h GLN 29 N 1.25 0.53 -0.36 0.00 1.08 -1.45 0.10 115.11 116.26 2k6b h GLN 29 Ca 0.40 -0.19 -0.09 0.00 -1.45 0.00 0.00 58.65 57.31 2k6b h GLN 29 Cb 0.01 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 2k6b h GLN 29 CO -0.12 0.72 -0.13 1.96 -0.95 0.00 0.00 178.83 180.30 2k6b h GLN 30 N 0.30 0.73 -0.22 1.46 1.08 -0.99 -0.29 115.11 117.18 2k6b h GLN 30 Ca 0.07 -0.30 -0.01 0.00 -1.45 0.00 0.00 58.65 56.97 2k6b h GLN 30 Cb 0.51 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 2k6b h GLN 30 CO 0.02 0.90 0.10 0.93 -0.95 0.00 0.00 178.83 179.83 2k6b h GLU 31 N 0.52 0.31 -0.38 1.46 4.39 -1.03 0.24 114.58 120.09 2k6b h GLU 31 Ca 0.09 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2k6b h GLU 31 Cb 0.66 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2k6b h GLU 31 CO 0.04 0.34 0.19 0.00 -1.16 0.00 0.00 179.01 178.42 2k6b h ALA 32 N 0.96 0.48 -0.30 3.43 0.00 -0.90 0.16 119.26 123.10 2k6b h ALA 32 Ca 0.07 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2k6b h ALA 32 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2k6b h ALA 32 CO -0.01 0.04 -0.25 -0.22 0.00 0.00 0.00 179.25 178.81 2k6b h LYS 33 N 0.47 0.58 -0.46 0.00 1.63 -0.86 0.85 116.57 118.78 2k6b h LYS 33 Ca 0.13 -0.23 -0.12 0.00 -0.85 0.00 0.00 60.65 59.59 2k6b h LYS 33 Cb 0.10 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 2k6b h LYS 33 CO -0.02 0.78 -0.17 1.25 -3.45 0.00 0.00 179.45 177.84 2k6b h HIS 34 N 0.51 1.02 -0.44 1.91 2.76 -0.26 -1.63 115.15 119.02 2k6b h HIS 34 Ca 0.07 -0.22 -0.07 0.00 -2.20 0.00 0.00 60.37 57.95 2k6b h HIS 34 Cb 0.70 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.39 2k6b h HIS 34 CO 0.03 1.00 -0.02 -0.09 -1.30 0.00 0.00 177.93 177.54 2k6b h ARG 35 N 0.79 0.72 0.32 5.26 2.43 -0.40 0.27 114.38 123.78 2k6b h ARG 35 Ca 0.12 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 2k6b h ARG 35 Cb 0.71 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 2k6b h ARG 35 CO 0.05 0.75 -0.22 0.93 -1.51 0.00 0.00 179.97 179.97 2k6b h GLU 36 N 0.67 -0.52 -0.50 0.20 4.39 -0.45 -1.84 114.58 116.53 2k6b h GLU 36 Ca 0.13 0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 2k6b h GLU 36 Cb 0.44 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 2k6b h GLU 36 CO 0.02 -0.35 0.19 0.00 -1.16 0.00 0.00 179.01 177.71 2k6b h ALA 37 N 0.09 0.66 -0.30 3.43 0.00 -1.01 -3.04 119.26 119.08 2k6b h ALA 37 Ca -0.03 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2k6b h ALA 37 Cb 0.46 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2k6b h ALA 37 CO 0.01 0.28 -0.05 0.93 0.00 0.00 0.00 179.25 180.42 2k6b h GLU 38 N 0.68 0.02 -0.01 0.00 4.39 -0.31 0.32 114.58 119.67 2k6b h GLU 38 Ca 0.17 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 2k6b h GLU 38 Cb 0.21 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2k6b h GLU 38 CO -0.01 0.02 -0.01 1.98 -1.16 0.00 0.00 179.01 179.83 2k6b h MET 39 N 0.03 -0.01 -0.26 2.33 4.05 -1.29 0.88 114.93 120.66 2k6b h MET 39 Ca 0.15 0.00 -0.15 0.00 -0.28 0.00 0.00 59.70 59.42 2k6b h MET 39 Cb 0.21 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.02 2k6b h MET 39 CO -0.29 -0.01 -0.42 0.00 0.23 0.00 0.00 176.91 176.43 2k6b h ARG 40 N -0.01 0.74 -0.19 0.39 3.08 -1.38 -2.46 114.38 114.56 2k6b h ARG 40 Ca 0.01 -0.45 -0.04 0.00 0.07 0.00 0.00 59.98 59.57 2k6b h ARG 40 Cb 0.02 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2k6b h ARG 40 CO -0.02 1.07 -0.03 -0.97 -1.07 0.00 0.00 179.97 178.95 2k6b h ASN 41 N 0.48 0.35 -0.34 7.04 -0.00 -0.27 -1.02 115.58 121.82 2k6b h ASN 41 Ca 0.02 -0.35 -0.04 0.00 -0.00 0.00 0.00 56.30 55.93 2k6b h ASN 41 Cb 1.01 -0.10 -0.02 0.00 -0.00 0.00 0.00 38.32 39.22 2k6b h ASN 41 CO 0.10 0.62 0.08 0.28 -0.00 0.00 0.00 177.43 178.51 2k6b h SER 42 N 0.08 0.58 -0.00 1.15 0.02 -0.80 0.01 113.55 114.58 2k6b h SER 42 Ca 0.05 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2k6b h SER 42 Cb 0.46 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2k6b h SER 42 CO 0.02 0.60 -0.06 0.16 -1.14 0.00 0.00 176.83 176.40 2k6b h ILE 43 N 0.61 1.61 -0.76 3.27 3.07 -1.39 -3.21 117.51 120.71 2k6b h ILE 43 Ca 0.14 -1.88 0.01 0.00 1.55 0.00 0.00 64.86 64.67 2k6b h ILE 43 Cb 0.26 2.87 -0.04 0.00 -0.27 0.00 0.00 36.82 39.64 2k6b h ILE 43 CO -0.00 0.50 0.50 -0.07 -1.05 0.00 0.00 178.15 178.03 2k6b h LEU 44 N -0.72 0.87 -0.72 0.16 3.38 -0.88 0.20 115.31 117.60 2k6b h LEU 44 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2k6b h LEU 44 Cb 0.85 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2k6b h LEU 44 CO 0.01 0.63 0.00 0.00 0.09 0.00 0.00 178.44 179.17 2k6b h ALA 45 N 1.53 1.00 0.00 1.53 0.00 -1.13 -0.05 119.26 122.14 2k6b h ALA 45 Ca 0.28 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.98 2k6b h ALA 45 Cb -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2k6b h ALA 45 CO -0.06 0.00 -2.02 1.04 0.00 0.00 0.00 179.25 178.20 2k6b n GLN 46 N -3.02 0.66 0.03 0.00 1.13 -0.52 -4.40 117.38 111.27 2k6b n GLN 46 Ca 0.02 -0.00 -0.19 0.00 -1.94 0.00 0.00 57.00 54.89 2k6b n GLN 46 Cb 0.41 -1.60 -0.14 0.00 0.11 0.00 0.00 30.24 29.02 2k6b n GLN 46 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2k6b h VAL 47 N 0.00 1.52 -3.45 5.09 2.07 -0.57 -3.42 116.25 117.50 2k6b h VAL 47 Ca -0.29 -2.45 -0.60 0.00 0.82 0.00 0.00 66.70 64.19 2k6b h VAL 47 Cb 1.72 3.12 -0.10 0.00 -1.52 0.00 0.00 31.29 34.51 2k6b h VAL 47 CO 0.03 0.69 -0.01 -0.76 0.02 0.00 0.00 177.57 177.54 2k6b s LEU 48 N -7.98 4.15 0.66 2.57 1.43 -0.04 0.37 118.68 119.84 2k6b s LEU 48 Ca -0.14 0.73 -0.16 0.00 -1.03 0.00 0.00 54.13 53.52 2k6b s LEU 48 Cb 0.01 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.48 2k6b s LEU 48 CO 0.82 -0.19 1.18 -0.62 0.23 0.00 0.00 176.35 177.77 2k6b s ASP 49 N 1.13 4.77 0.40 2.29 -1.08 -0.53 -4.63 116.67 119.01 2k6b s ASP 49 Ca 0.25 2.28 0.19 0.00 -0.52 0.00 0.00 52.55 54.75 2k6b s ASP 49 Cb -0.16 -2.58 1.12 0.00 -1.46 0.00 0.00 42.92 39.84 2k6b s ASP 49 CO 0.10 -1.87 1.75 -0.61 0.52 0.00 0.00 175.17 175.06 2k6b h GLN 50 N 0.20 0.36 -0.14 4.34 -0.00 -1.88 0.31 115.11 118.31 2k6b h GLN 50 Ca -0.48 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.14 2k6b h GLN 50 Cb 1.28 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 28.68 2k6b h GLN 50 CO 0.53 0.24 0.05 0.66 0.00 0.00 0.00 178.83 180.31 2k6b h SER 51 N 0.38 0.19 0.09 -0.69 4.64 -1.91 0.12 113.55 116.37 2k6b h SER 51 Ca 0.62 -0.17 -0.18 0.00 -0.47 0.00 0.00 61.79 61.58 2k6b h SER 51 Cb 1.59 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.62 2k6b h SER 51 CO -0.32 0.31 -0.66 0.00 -0.87 0.00 0.00 176.83 175.29 2k6b h ALA 52 N 0.89 0.58 -0.27 5.18 0.00 -1.15 0.11 119.26 124.59 2k6b h ALA 52 Ca 0.05 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2k6b h ALA 52 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2k6b h ALA 52 CO -0.00 0.72 0.14 -0.09 0.00 0.00 0.00 179.25 180.01 2k6b h ARG 53 N 0.39 0.39 -0.47 0.00 9.65 -0.32 0.17 114.38 124.19 2k6b h ARG 53 Ca -0.02 -0.06 -0.11 0.00 -1.10 0.00 0.00 59.98 58.70 2k6b h ARG 53 Cb 1.24 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.73 2k6b h ARG 53 CO 0.12 0.37 -0.14 0.00 2.80 0.00 0.00 179.97 183.13 2k6b h ALA 54 N 1.00 0.87 -0.31 2.80 0.00 -0.68 -0.56 119.26 122.38 2k6b h ALA 54 Ca 0.09 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.67 2k6b h ALA 54 Cb 0.11 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2k6b h ALA 54 CO -0.01 0.64 0.19 -0.09 0.00 0.00 0.00 179.25 179.98 2k6b h ARG 55 N 0.79 0.38 0.00 0.00 9.65 -0.55 -1.96 114.38 122.69 2k6b h ARG 55 Ca 0.12 -0.02 -0.08 0.00 -1.10 0.00 0.00 59.98 58.90 2k6b h ARG 55 Cb 0.66 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.15 2k6b h ARG 55 CO 0.05 0.25 -0.38 1.25 2.80 0.00 0.00 179.97 183.94 2k6b h LEU 56 N 0.39 0.00 -0.54 3.80 5.85 -0.45 -0.76 115.31 123.61 2k6b h LEU 56 Ca 0.12 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 2k6b h LEU 56 Cb -0.02 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2k6b h LEU 56 CO -0.05 0.38 0.17 0.28 -0.34 0.00 0.00 178.44 178.88 2k6b h SER 57 N 0.00 0.78 -0.16 1.25 0.02 -0.35 0.15 113.55 115.24 2k6b h SER 57 Ca -0.00 -0.21 -0.20 0.00 -0.84 0.00 0.00 61.79 60.55 2k6b h SER 57 Cb 0.74 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2k6b h SER 57 CO 0.05 0.78 -0.64 -1.13 -1.14 0.00 0.00 176.83 174.75 2k6b h ASN 58 N 0.74 0.88 -0.98 3.07 -0.73 -1.15 -3.13 115.58 114.28 2k6b h ASN 58 Ca 0.17 -0.51 0.08 0.00 1.87 0.00 0.00 56.30 57.90 2k6b h ASN 58 Cb 0.28 -0.26 -0.07 0.00 0.27 0.00 0.00 38.32 38.54 2k6b h ASN 58 CO -0.01 1.30 0.63 0.25 -0.37 0.00 0.00 177.43 179.24 2k6b h LEU 59 N 0.57 0.99 -2.71 0.34 7.12 -0.80 0.04 115.31 120.85 2k6b h LEU 59 Ca -0.01 0.02 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 2k6b h LEU 59 Cb 1.24 -0.19 -0.00 0.00 -0.53 0.00 0.00 40.66 41.18 2k6b h LEU 59 CO 0.13 0.61 -0.00 0.00 -0.13 0.00 0.00 178.44 179.05 2k6b h ALA 60 N 1.49 1.23 0.04 1.25 0.00 -0.65 0.72 119.26 123.33 2k6b h ALA 60 Ca 0.44 -0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.97 2k6b h ALA 60 Cb 0.24 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2k6b h ALA 60 CO -0.18 0.01 -2.11 1.28 0.00 0.00 0.00 179.25 178.25 2k6b n LEU 61 N -3.42 2.45 -0.02 0.00 4.77 -0.09 -3.86 117.00 116.84 2k6b n LEU 61 Ca -0.03 0.18 -0.17 0.00 -0.03 0.00 0.00 56.01 55.96 2k6b n LEU 61 Cb 0.09 -0.97 -0.09 0.00 -2.33 0.00 0.00 43.42 40.12 2k6b n LEU 61 CO 0.24 0.71 0.30 -0.37 -1.33 0.00 0.00 177.39 176.94 2k6b h VAL 62 N -0.38 1.35 -2.13 4.08 -1.51 -1.03 -3.41 116.25 113.22 2k6b h VAL 62 Ca -0.51 -1.93 -0.50 0.00 -1.23 0.00 0.00 66.70 62.53 2k6b h VAL 62 Cb 1.77 2.24 -0.34 0.00 -2.13 0.00 0.00 31.29 32.82 2k6b h VAL 62 CO -0.13 0.59 -0.85 -1.59 -1.23 0.00 0.00 177.57 174.35 2k6b s LYS 63 N -3.58 0.85 0.62 5.19 -2.85 0.22 -4.99 119.74 115.19 2k6b s LYS 63 Ca -0.12 -1.70 0.40 0.00 -1.00 0.00 0.00 55.97 53.55 2k6b s LYS 63 Cb 0.06 -1.11 1.99 0.00 -2.06 0.00 0.00 37.83 36.71 2k6b s LYS 63 CO 0.85 -1.33 2.21 -1.35 0.10 0.00 0.00 175.35 175.83 2k6b h PRO 64 N 5.89 0.00 -0.41 1.78 0.11 -1.67 -2.72 132.00 134.98 2k6b h PRO 64 Ca 0.19 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.14 2k6b h PRO 64 Cb 0.97 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 2k6b h PRO 64 CO 0.28 0.00 -0.34 1.49 -0.21 0.00 0.00 178.00 179.22 2k6b h GLU 65 N 0.00 0.96 0.00 1.05 4.22 -1.91 -2.34 114.58 116.56 2k6b h GLU 65 Ca -0.00 -0.48 -0.20 0.00 0.08 0.00 0.00 59.36 58.76 2k6b h GLU 65 Cb 0.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2k6b h GLU 65 CO 0.00 1.14 -0.95 0.87 -2.18 0.00 0.00 179.01 177.89 2k6b h LYS 66 N 0.79 0.00 -0.30 1.92 1.79 -1.86 -3.27 116.57 115.64 2k6b h LYS 66 Ca 0.07 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 2k6b h LYS 66 Cb 0.93 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.57 2k6b h LYS 66 CO 0.09 0.95 0.18 1.15 -1.08 0.00 0.00 179.45 180.74 2k6b h THR 67 N 0.00 1.11 -0.78 -0.16 2.02 -1.42 -1.54 112.91 112.13 2k6b h THR 67 Ca -0.01 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 66.94 2k6b h THR 67 Cb 1.68 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 68.77 2k6b h THR 67 CO 0.12 0.10 0.52 0.07 0.37 0.00 0.00 175.52 176.71 2k6b h LYS 68 N 0.39 1.00 -0.03 6.66 2.10 -1.48 0.17 116.57 125.37 2k6b h LYS 68 Ca 0.11 -0.06 -0.01 0.00 -2.00 0.00 0.00 60.65 58.69 2k6b h LYS 68 Cb 0.01 -0.22 -0.00 0.00 -0.90 0.00 0.00 32.23 31.11 2k6b h LYS 68 CO -0.02 0.66 -0.03 0.00 -2.00 0.00 0.00 179.45 178.05 2k6b h ALA 69 N 1.52 0.04 -0.54 0.07 0.00 -1.57 -2.55 119.26 116.23 2k6b h ALA 69 Ca 0.30 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2k6b h ALA 69 Cb -0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2k6b h ALA 69 CO -0.07 -0.17 0.04 -0.39 0.00 0.00 0.00 179.25 178.65 2k6b h VAL 70 N -0.41 1.26 -0.77 0.00 -1.51 -0.89 -1.10 116.25 112.83 2k6b h VAL 70 Ca 0.00 -1.04 -0.03 0.00 -1.23 0.00 0.00 66.70 64.40 2k6b h VAL 70 Cb 0.55 0.88 -0.04 0.00 -2.13 0.00 0.00 31.29 30.55 2k6b h VAL 70 CO 0.01 0.37 0.35 -0.33 -1.23 0.00 0.00 177.57 176.75 2k6b h GLU 71 N 0.81 1.11 -0.64 5.19 5.08 -1.04 -0.33 114.58 124.76 2k6b h GLU 71 Ca 0.16 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2k6b h GLU 71 Cb 0.48 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2k6b h GLU 71 CO 0.02 0.87 0.32 -0.97 -1.00 0.00 0.00 179.01 178.25 2k6b h ASN 72 N 1.10 0.83 -0.18 1.42 -0.73 -1.23 -1.78 115.58 115.01 2k6b h ASN 72 Ca 0.26 -0.12 -0.00 0.00 1.87 0.00 0.00 56.30 58.31 2k6b h ASN 72 Cb 0.14 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.50 2k6b h ASN 72 CO -0.03 0.72 0.11 0.22 -0.37 0.00 0.00 177.43 178.08 2k6b h TYR 73 N 0.88 0.24 -0.60 0.67 3.20 -0.12 -0.04 116.97 121.21 2k6b h TYR 73 Ca 0.22 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 2k6b h TYR 73 Cb 0.10 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2k6b h TYR 73 CO 0.00 0.20 0.22 -0.07 -1.64 0.00 0.00 178.16 176.86 2k6b h LEU 74 N 0.22 0.81 -0.31 2.82 -0.00 -0.94 0.16 115.31 118.06 2k6b h LEU 74 Ca 0.07 -0.11 0.02 0.00 -0.00 0.00 0.00 57.88 57.85 2k6b h LEU 74 Cb 0.02 -0.21 -0.02 0.00 -0.00 0.00 0.00 40.66 40.45 2k6b h LEU 74 CO -0.01 0.74 0.17 0.40 -0.00 0.00 0.00 178.44 179.74 2k6b h ILE 75 N 0.86 1.01 -0.36 1.22 2.04 -0.79 0.18 117.51 121.68 2k6b h ILE 75 Ca 0.20 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2k6b h ILE 75 Cb 0.20 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 2k6b h ILE 75 CO -0.01 0.06 0.16 1.56 0.00 0.00 0.00 178.15 179.92 2k6b h GLN 76 N 0.35 0.53 -0.51 2.37 1.08 -0.38 0.14 115.11 118.68 2k6b h GLN 76 Ca 0.13 -0.09 -0.10 0.00 -1.45 0.00 0.00 58.65 57.14 2k6b h GLN 76 Cb 0.02 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 2k6b h GLN 76 CO -0.07 0.49 -0.07 1.98 -0.95 0.00 0.00 178.83 180.21 2k6b h MET 77 N 0.44 0.93 -0.45 1.46 4.05 -0.53 -1.51 114.93 119.32 2k6b h MET 77 Ca 0.12 -0.31 -0.11 0.00 -0.28 0.00 0.00 59.70 59.12 2k6b h MET 77 Cb 0.15 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.86 2k6b h MET 77 CO -0.01 0.96 -0.16 0.00 0.23 0.00 0.00 176.91 177.93 2k6b h ALA 78 N 1.07 0.87 -0.73 0.39 0.00 -0.42 -0.63 119.26 119.82 2k6b h ALA 78 Ca 0.14 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2k6b h ALA 78 Cb 0.59 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 2k6b h ALA 78 CO 0.04 0.64 0.44 -0.09 0.00 0.00 0.00 179.25 180.27 2k6b h ARG 79 N 0.76 0.78 0.00 0.00 2.43 -0.21 -1.86 114.38 116.28 2k6b h ARG 79 Ca 0.11 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2k6b h ARG 79 Cb 0.68 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2k6b h ARG 79 CO 0.05 0.52 -0.24 1.88 -1.51 0.00 0.00 179.97 180.67 2k6b h TYR 80 N 0.81 0.00 -2.05 2.20 0.05 -1.07 -3.48 116.97 113.43 2k6b h TYR 80 Ca 0.32 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.10 2k6b h TYR 80 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 2k6b h TYR 80 CO -0.06 0.15 -0.00 0.41 -1.05 0.00 0.00 178.16 177.62 2k6b n GLY 81 N 1.15 0.46 1.57 3.88 0.00 -0.29 -4.95 105.19 107.02 2k6b n GLY 81 Ca 0.03 -0.47 0.06 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.03 3.95 -2.36 1.61 1.13 -0.92 -4.93 117.38 114.84 2k6b n GLN 82 Ca -0.00 -2.55 -0.43 0.00 -1.94 0.00 0.00 57.00 52.09 2k6b n GLN 82 Cb 0.50 -2.03 -0.02 0.00 0.11 0.00 0.00 30.24 28.79 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 -2.08 4.23 -0.12 1.08 2.01 -1.26 -4.86 118.68 117.68 2k6b s LEU 83 Ca 0.45 1.83 -0.12 0.00 0.01 0.00 0.00 54.13 56.30 2k6b s LEU 83 Cb 0.32 -3.54 -0.05 0.00 0.01 0.00 0.00 46.19 42.93 2k6b s LEU 83 CO 0.16 -0.75 -0.24 -1.20 1.01 0.00 0.00 176.35 175.33 2k6b n SER 84 N 6.29 1.58 -3.48 2.29 7.64 -1.26 -5.09 113.62 121.58 2k6b n SER 84 Ca 0.14 0.26 -0.22 0.00 1.01 0.00 0.00 58.87 60.06 2k6b n SER 84 Cb 0.45 -0.60 -0.07 0.00 -1.01 0.00 0.00 64.21 62.97 2k6b n SER 84 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k6b n GLU 85 N -4.07 0.48 -2.41 1.43 -0.58 -1.26 -5.13 120.64 109.09 2k6b n GLU 85 Ca -0.18 -3.36 -0.40 0.00 -0.42 0.00 0.00 57.16 52.80 2k6b n GLU 85 Cb 0.48 2.36 -0.04 0.00 -0.57 0.00 0.00 31.44 33.67 2k6b n GLU 85 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2k6b s LYS 86 N -3.43 4.59 -0.05 3.49 1.02 -1.26 -4.95 119.74 119.16 2k6b s LYS 86 Ca 0.32 1.87 -0.30 0.00 0.02 0.00 0.00 55.97 57.88 2k6b s LYS 86 Cb 0.02 -3.17 -0.03 0.00 -0.52 0.00 0.00 37.83 34.12 2k6b s LYS 86 CO 0.22 0.14 1.17 0.08 -0.92 0.00 0.00 175.35 176.05 2k6b s VAL 87 N -1.15 4.30 0.83 3.17 1.01 0.16 -4.73 120.40 123.99 2k6b s VAL 87 Ca 0.45 1.63 -0.07 0.00 0.00 0.00 0.00 61.98 63.99 2k6b s VAL 87 Cb -0.33 -4.05 0.17 0.00 0.00 0.00 0.00 36.38 32.17 2k6b s VAL 87 CO 0.43 0.02 1.14 -0.44 0.00 0.00 0.00 175.10 176.25 2k6b s SER 88 N 1.38 3.75 0.06 3.32 0.01 -1.26 -1.45 113.70 119.51 2k6b s SER 88 Ca 0.55 -0.16 -0.23 0.00 1.31 0.00 0.00 55.95 57.42 2k6b s SER 88 Cb -0.24 -0.03 -0.15 0.00 0.21 0.00 0.00 66.02 65.80 2k6b s SER 88 CO 0.23 -2.28 1.59 -0.33 0.41 0.00 0.00 173.24 172.86 2k6b h GLU 89 N -1.02 0.07 -0.66 12.44 5.08 -1.93 -0.63 114.58 127.92 2k6b h GLU 89 Ca -0.39 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 2k6b h GLU 89 Cb 1.25 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 2k6b h GLU 89 CO 0.37 0.21 0.39 1.96 -1.00 0.00 0.00 179.01 180.94 2k6b h GLN 90 N -0.09 0.89 -0.49 2.33 4.20 -1.99 0.14 115.11 120.11 2k6b h GLN 90 Ca 0.01 -0.08 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 2k6b h GLN 90 Cb 0.17 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 2k6b h GLN 90 CO -0.00 0.63 -0.15 0.78 -0.67 0.00 0.00 178.83 179.42 2k6b h GLY 91 N 0.94 1.03 1.36 3.46 0.00 -1.87 -2.00 103.07 105.99 2k6b h GLY 91 Ca 0.24 -0.85 -0.11 0.00 0.00 0.00 0.00 47.33 46.61 2k6b h GLY 91 CO -0.04 0.77 -0.20 -2.00 0.00 0.00 0.00 176.54 175.07 2k6b h LEU 92 N 0.83 0.75 -0.80 3.11 5.85 0.40 -2.74 115.31 122.72 2k6b h LEU 92 Ca 0.12 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.60 2k6b h LEU 92 Cb 0.71 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2k6b h LEU 92 CO 0.05 0.95 0.53 0.40 -0.34 0.00 0.00 178.44 180.03 2k6b h ILE 93 N 0.66 1.19 -0.48 4.05 1.08 -0.44 0.28 117.51 123.83 2k6b h ILE 93 Ca 0.10 -0.37 -0.03 0.00 -0.39 0.00 0.00 64.86 64.17 2k6b h ILE 93 Cb 0.70 0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 2k6b h ILE 93 CO 0.05 0.20 0.18 -0.33 -0.69 0.00 0.00 178.15 177.56 2k6b h GLU 94 N 1.07 0.70 -0.20 2.37 4.39 -1.18 0.52 114.58 122.25 2k6b h GLU 94 Ca 0.30 -0.10 -0.21 0.00 0.34 0.00 0.00 59.36 59.69 2k6b h GLU 94 Cb -0.10 -0.13 0.01 0.00 -0.10 0.00 0.00 28.75 28.43 2k6b h GLU 94 CO -0.07 0.58 -0.69 0.82 -1.16 0.00 0.00 179.01 178.49 2k6b h ILE 95 N 0.69 1.28 -0.75 3.13 2.04 -0.95 -2.77 117.51 120.18 2k6b h ILE 95 Ca 0.17 -1.89 0.02 0.00 1.00 0.00 0.00 64.86 64.16 2k6b h ILE 95 Cb 0.15 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 2k6b h ILE 95 CO -0.01 0.60 0.48 0.25 0.00 0.00 0.00 178.15 179.47 2k6b h LEU 96 N 0.58 0.82 -0.98 1.44 5.85 0.20 -0.89 115.31 122.32 2k6b h LEU 96 Ca -0.03 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 2k6b h LEU 96 Cb 1.31 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 2k6b h LEU 96 CO 0.15 0.58 0.28 0.11 -0.34 0.00 0.00 178.44 179.21 2k6b h LYS 97 N 0.97 1.02 -0.35 1.25 1.57 -0.90 -1.75 116.57 118.38 2k6b h LYS 97 Ca 0.29 -0.17 -0.14 0.00 -1.87 0.00 0.00 60.65 58.76 2k6b h LYS 97 Cb -0.04 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2k6b h LYS 97 CO -0.09 0.82 -0.35 -0.22 -0.57 0.00 0.00 179.45 179.04 2k6b h LYS 98 N 1.00 0.79 0.00 3.15 3.64 -0.98 -1.68 116.57 122.48 2k6b h LYS 98 Ca 0.23 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2k6b h LYS 98 Cb 0.18 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2k6b h LYS 98 CO -0.02 1.02 0.00 1.33 -2.27 0.00 0.00 179.45 179.50 2k6b n VAL 99 N -4.06 0.52 0.35 2.00 0.24 -0.44 -1.18 118.33 115.76 2k6b n VAL 99 Ca -0.01 -0.22 0.13 0.00 -2.04 0.00 0.00 64.34 62.19 2k6b n VAL 99 Cb 0.51 -0.59 0.32 0.00 -1.47 0.00 0.00 33.84 32.61 2k6b n VAL 99 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2k6b h SER 100 N 0.00 0.00 0.00 -1.34 0.02 -0.41 -3.32 113.55 108.50 2k6b h SER 100 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k6b h SER 100 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 2k6b h SER 100 CO 0.00 0.00 -0.26 1.56 -1.14 0.00 0.00 176.83 176.99 2k6b h GLN 101 N 0.00 0.00 0.00 3.45 1.08 -0.85 -3.50 115.11 115.28 2k6b h GLN 101 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k6b h GLN 101 Cb 0.83 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.26 2k6b h GLN 101 CO 0.00 0.00 0.00 1.04 -0.95 0.00 0.00 178.83 178.92 2k6b n GLN 102 N -3.54 0.00 0.08 1.46 6.02 -0.32 -5.11 117.38 115.96 2k6b n GLN 102 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2k6b n GLN 102 Cb 0.13 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.39 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 -0.41 0.00 -3.98 5.09 -1.04 -1.21 -4.50 114.28 108.23 2k6b n THR 103 Ca 0.00 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.92 2k6b n THR 103 Cb 0.00 -0.07 -0.05 0.00 -1.82 0.00 0.00 70.33 68.40 2k6b n THR 103 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2k6b s GLU 104 N -1.37 1.59 -1.41 -2.82 0.41 -1.26 -4.24 118.70 109.59 2k6b s GLU 104 Ca 0.00 -1.24 -0.01 0.00 -0.41 0.00 0.00 54.97 53.31 2k6b s GLU 104 Cb 0.00 0.49 0.01 0.00 -1.78 0.00 0.00 34.13 32.85 2k6b s GLU 104 CO 0.00 -0.67 0.48 1.63 -0.49 0.00 0.00 175.26 176.20 2k6b n LYS 105 N -0.40 -3.51 0.00 1.61 5.02 -1.26 -4.82 118.16 114.80 2k6b n LYS 105 Ca -0.02 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 2k6b n LYS 105 Cb 0.62 -4.65 0.00 0.00 -0.02 0.00 0.00 35.03 30.98 2k6b n LYS 105 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2k6b n THR 106 N -4.39 0.00 -1.34 -0.18 -2.24 -1.26 -3.16 114.28 101.71 2k6b n THR 106 Ca -0.28 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.19 2k6b n THR 106 Cb 0.67 -0.27 0.11 0.00 -2.10 0.00 0.00 70.33 68.74 2k6b n THR 106 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2k6b n THR 107 N -0.09 3.45 -1.57 4.28 -1.04 -1.26 -5.01 114.28 113.04 2k6b n THR 107 Ca 0.00 -2.72 -0.55 0.00 -2.04 0.00 0.00 64.05 58.74 2k6b n THR 107 Cb 0.10 -0.95 -0.07 0.00 -1.82 0.00 0.00 70.33 67.59 2k6b n THR 107 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2k6b n THR 108 N -0.98 0.01 -3.12 12.58 -1.04 -1.19 -4.93 114.28 115.62 2k6b n THR 108 Ca 0.60 -0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 62.18 2k6b n THR 108 Cb 0.95 -0.57 -0.07 0.00 -1.82 0.00 0.00 70.33 68.83 2k6b n THR 108 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2k6b s VAL 109 N 0.49 4.83 -0.21 12.58 -7.23 -1.26 -4.99 120.40 124.60 2k6b s VAL 109 Ca 0.87 -0.07 -0.05 0.00 -1.81 0.00 0.00 61.98 60.92 2k6b s VAL 109 Cb -1.07 -4.24 0.08 0.00 0.56 0.00 0.00 36.38 31.70 2k6b s VAL 109 CO 0.51 -0.68 0.11 -0.54 -0.31 0.00 0.00 175.10 174.19 2k6b s LYS 110 N 2.80 0.11 -0.15 4.82 1.02 -1.26 -5.12 119.74 121.96 2k6b s LYS 110 Ca 0.20 -0.23 -0.30 0.00 0.02 0.00 0.00 55.97 55.66 2k6b s LYS 110 Cb -0.16 -1.58 0.13 0.00 -0.52 0.00 0.00 37.83 35.71 2k6b s LYS 110 CO 0.17 -0.80 1.04 0.12 -0.92 0.00 0.00 175.35 174.96 2k6b s PHE 111 N 2.13 -0.31 -1.51 3.18 5.36 -1.26 -5.30 117.98 120.26 2k6b s PHE 111 Ca 0.05 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.48 2k6b s PHE 111 Cb -0.16 0.47 0.00 0.00 -0.34 0.00 0.00 43.02 42.99 2k6b s PHE 111 CO -0.19 -0.33 0.38 0.27 -1.46 0.00 0.00 175.22 173.89