#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 -1.33 0.21 1.61 0.01 -1.26 -5.07 113.70 107.86 2k6b s SER 1 Ca 0.00 0.24 -0.11 0.00 1.31 0.00 0.00 55.95 57.39 2k6b s SER 1 Cb 0.00 1.88 0.28 0.00 0.21 0.00 0.00 66.02 68.39 2k6b s SER 1 CO 0.00 -0.24 1.67 0.00 0.41 0.00 0.00 173.24 175.08 2k6b h ALA 2 N 7.85 0.60 -0.43 1.44 0.00 -2.05 0.22 119.26 126.90 2k6b h ALA 2 Ca -0.05 0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2k6b h ALA 2 Cb 1.18 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2k6b h ALA 2 CO 0.10 -0.38 -0.09 0.22 0.00 0.00 0.00 179.25 179.11 2k6b h ASP 3 N 0.14 0.83 -0.43 0.00 3.58 -1.98 0.57 116.42 119.13 2k6b h ASP 3 Ca 0.31 -0.35 -0.05 0.00 0.42 0.00 0.00 57.03 57.36 2k6b h ASP 3 Cb 0.49 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.29 2k6b h ASP 3 CO -0.48 0.99 0.09 -0.08 -2.88 0.00 0.00 179.24 176.87 2k6b h GLU 4 N 0.66 0.70 -0.24 0.28 4.57 -1.77 -0.79 114.58 117.99 2k6b h GLU 4 Ca 0.11 -0.18 -0.12 0.00 -1.18 0.00 0.00 59.36 57.99 2k6b h GLU 4 Cb 0.62 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.11 2k6b h GLU 4 CO 0.04 0.72 -0.35 0.93 -1.18 0.00 0.00 179.01 179.17 2k6b h GLU 5 N 0.57 0.52 -0.13 1.92 5.08 -0.43 0.85 114.58 122.96 2k6b h GLU 5 Ca 0.13 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2k6b h GLU 5 Cb 0.35 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2k6b h GLU 5 CO 0.00 0.80 0.06 1.25 -1.00 0.00 0.00 179.01 180.13 2k6b h LEU 6 N 0.44 0.16 -1.46 1.33 5.85 -0.58 0.12 115.31 121.17 2k6b h LEU 6 Ca 0.05 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2k6b h LEU 6 Cb 0.82 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 2k6b h LEU 6 CO 0.07 0.24 0.34 -0.33 -0.34 0.00 0.00 178.44 178.42 2k6b h GLU 7 N 0.08 0.70 -0.08 1.25 4.39 -0.88 0.42 114.58 120.46 2k6b h GLU 7 Ca 0.04 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 2k6b h GLU 7 Cb 0.12 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2k6b h GLU 7 CO -0.01 0.48 -0.03 0.00 -1.16 0.00 0.00 179.01 178.29 2k6b h ALA 8 N 1.65 0.11 -0.55 3.43 0.00 -0.44 -1.94 119.26 121.52 2k6b h ALA 8 Ca 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2k6b h ALA 8 Cb -0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2k6b h ALA 8 CO -0.04 -0.14 0.28 1.25 0.00 0.00 0.00 179.25 180.60 2k6b h LEU 9 N -0.19 0.71 -1.01 0.00 6.46 -0.62 0.40 115.31 121.06 2k6b h LEU 9 Ca 0.02 -0.11 0.07 0.00 -0.12 0.00 0.00 57.88 57.74 2k6b h LEU 9 Cb 0.46 -0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.14 2k6b h LEU 9 CO 0.01 0.62 0.65 -0.09 -0.62 0.00 0.00 178.44 179.01 2k6b h ARG 10 N 0.75 1.13 0.11 1.25 2.43 -0.91 -1.67 114.38 117.47 2k6b h ARG 10 Ca 0.19 -0.07 -0.27 0.00 -0.81 0.00 0.00 59.98 59.02 2k6b h ARG 10 Cb 0.08 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2k6b h ARG 10 CO -0.03 0.75 -1.26 0.00 -1.51 0.00 0.00 179.97 177.92 2k6b h ARG 11 N 1.17 0.24 -0.66 0.20 3.08 -0.87 -3.35 114.38 114.19 2k6b h ARG 11 Ca 0.44 -0.41 0.05 0.00 0.07 0.00 0.00 59.98 60.13 2k6b h ARG 11 Cb 0.19 0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 2k6b h ARG 11 CO -0.18 1.18 0.38 0.37 -1.07 0.00 0.00 179.97 180.64 2k6b h GLN 12 N 0.07 0.69 -0.24 0.04 4.15 0.59 0.13 115.11 120.54 2k6b h GLN 12 Ca -0.14 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.15 2k6b h GLN 12 Cb 1.96 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 29.48 2k6b h GLN 12 CO 0.19 0.46 -0.22 -0.09 -1.93 0.00 0.00 178.83 177.23 2k6b h ARG 13 N 0.71 0.44 0.00 1.69 1.12 -1.48 -1.69 114.38 115.17 2k6b h ARG 13 Ca 0.28 -0.15 -0.12 0.00 -1.11 0.00 0.00 59.98 58.88 2k6b h ARG 13 Cb 0.13 -0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.04 2k6b h ARG 13 CO -0.16 0.64 -0.59 -0.07 -3.11 0.00 0.00 179.97 176.69 2k6b h LEU 14 N 0.40 0.00 -1.58 3.80 4.07 -1.49 -3.11 115.31 117.40 2k6b h LEU 14 Ca 0.06 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.99 2k6b h LEU 14 Cb 0.61 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 2k6b h LEU 14 CO 0.04 0.59 -0.18 0.00 -1.08 0.00 0.00 178.44 177.82 2k6b h ALA 15 N 1.41 1.18 -0.54 1.53 0.00 0.16 -3.19 119.26 119.81 2k6b h ALA 15 Ca -0.01 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 54.90 2k6b h ALA 15 Cb 1.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2k6b h ALA 15 CO 0.08 0.22 0.57 0.93 0.00 0.00 0.00 179.25 181.05 2k6b h GLU 16 N 0.00 0.00 0.24 0.00 4.39 -1.39 0.51 114.58 118.33 2k6b h GLU 16 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2k6b h GLU 16 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2k6b h GLU 16 CO 0.02 0.00 -0.12 1.25 -1.16 0.00 0.00 179.01 179.01 2k6b h LEU 17 N 0.00 -0.27 -0.27 1.33 7.12 -1.79 -3.18 115.31 118.24 2k6b h LEU 17 Ca 0.25 -0.14 -0.18 0.00 0.13 0.00 0.00 57.88 57.94 2k6b h LEU 17 Cb 1.39 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.59 2k6b h LEU 17 CO -0.00 0.23 -0.55 -0.61 -0.13 0.00 0.00 178.44 177.38 2k6b h GLN 18 N -1.02 0.85 -0.07 1.25 4.15 -1.35 -3.24 115.11 115.68 2k6b h GLN 18 Ca -0.03 -0.55 0.00 0.00 0.77 0.00 0.00 58.65 58.83 2k6b h GLN 18 Cb 0.40 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.16 2k6b h GLN 18 CO 0.05 1.18 0.00 0.00 -1.93 0.00 0.00 178.83 178.14 2k6b n ALA 19 N -2.57 2.58 -2.59 3.38 0.00 0.16 -4.71 120.51 116.76 2k6b n ALA 19 Ca -0.05 -0.35 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 2k6b n ALA 19 Cb 0.63 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.92 3.53 -0.13 0.00 -2.85 -1.20 -4.76 119.74 112.41 2k6b s LYS 20 Ca 0.34 0.24 0.15 0.00 -1.00 0.00 0.00 55.97 55.70 2k6b s LYS 20 Cb 0.17 -4.00 0.33 0.00 -2.06 0.00 0.00 37.83 32.27 2k6b s LYS 20 CO 0.27 -1.60 1.16 0.72 0.10 0.00 0.00 175.35 176.00 2k6b n HIS 21 N 8.22 0.00 -2.72 1.78 8.25 -1.26 -4.68 115.22 124.80 2k6b n HIS 21 Ca 0.08 -1.01 -0.05 0.00 -0.26 0.00 0.00 57.72 56.48 2k6b n HIS 21 Cb 0.49 -0.18 0.07 0.00 1.12 0.00 0.00 29.99 31.49 2k6b n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k6b n GLY 22 N -0.83 1.62 3.09 -1.41 0.00 -1.26 -5.08 105.19 101.32 2k6b n GLY 22 Ca 0.14 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.58 2.97 0.46 1.61 -4.77 -1.26 -5.01 116.67 108.09 2k6b s ASP 23 Ca 0.23 -0.59 0.24 0.00 -3.30 0.00 0.00 52.55 49.14 2k6b s ASP 23 Cb 0.41 -1.37 1.08 0.00 -1.09 0.00 0.00 42.92 41.95 2k6b s ASP 23 CO -0.03 -0.01 1.90 -0.65 0.70 0.00 0.00 175.17 177.08 2k6b h PRO 24 N 7.90 0.00 0.00 2.11 0.11 -1.98 -3.48 132.00 136.67 2k6b h PRO 24 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2k6b h PRO 24 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2k6b h PRO 24 CO 0.59 0.21 0.00 0.41 -0.21 0.00 0.00 178.00 179.00 2k6b n GLY 25 N -0.16 2.28 0.35 -0.55 0.00 -1.26 -2.79 105.19 103.06 2k6b n GLY 25 Ca -0.01 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.07 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 0.73 0.24 1.61 3.58 -1.99 0.01 116.42 120.62 2k6b h ASP 26 Ca 0.00 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 2k6b h ASP 26 Cb 0.00 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 2k6b h ASP 26 CO 0.00 0.48 -0.16 0.00 -2.88 0.00 0.00 179.24 176.69 2k6b h ALA 27 N 1.58 1.52 0.17 -0.78 0.00 -1.93 0.33 119.26 120.15 2k6b h ALA 27 Ca 0.32 -0.14 -0.27 0.00 0.00 0.00 0.00 54.91 54.82 2k6b h ALA 27 Cb 0.19 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.97 2k6b h ALA 27 CO -0.10 0.19 -1.28 0.00 0.00 0.00 0.00 179.25 178.06 2k6b h ALA 28 N 1.84 -0.01 -0.48 0.00 0.00 -1.23 -3.16 119.26 116.22 2k6b h ALA 28 Ca -0.00 -0.90 -0.07 0.00 0.00 0.00 0.00 54.91 53.93 2k6b h ALA 28 Cb 0.32 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2k6b h ALA 28 CO 0.02 0.66 0.02 1.96 0.00 0.00 0.00 179.25 181.92 2k6b h GLN 29 N -0.15 0.84 -0.92 0.00 1.08 -0.79 -2.64 115.11 112.53 2k6b h GLN 29 Ca -0.24 -0.26 0.01 0.00 -1.45 0.00 0.00 58.65 56.71 2k6b h GLN 29 Cb 1.88 -0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 29.18 2k6b h GLN 29 CO 0.16 0.87 0.60 0.37 -0.95 0.00 0.00 178.83 179.88 2k6b h GLN 30 N 0.70 1.21 -0.53 1.46 5.75 -0.49 0.73 115.11 123.95 2k6b h GLN 30 Ca 0.14 -0.08 -0.08 0.00 -0.15 0.00 0.00 58.65 58.48 2k6b h GLN 30 Cb 0.48 -0.27 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 2k6b h GLN 30 CO 0.02 0.81 0.03 1.49 -2.65 0.00 0.00 178.83 178.53 2k6b h GLU 31 N 1.25 0.91 -0.18 1.69 4.81 -1.48 0.16 114.58 121.74 2k6b h GLU 31 Ca 0.33 -0.28 -0.14 0.00 -0.13 0.00 0.00 59.36 59.15 2k6b h GLU 31 Cb -0.13 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 2k6b h GLU 31 CO -0.07 0.92 -0.46 0.00 -0.73 0.00 0.00 179.01 178.67 2k6b h ALA 32 N 0.96 0.87 0.00 2.92 0.00 -1.07 -2.45 119.26 120.48 2k6b h ALA 32 Ca 0.15 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 2k6b h ALA 32 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2k6b h ALA 32 CO 0.02 0.65 -0.31 -0.22 0.00 0.00 0.00 179.25 179.39 2k6b h LYS 33 N 0.37 0.00 0.00 0.00 1.63 -0.42 -1.80 116.57 116.35 2k6b h LYS 33 Ca 0.02 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.74 2k6b h LYS 33 Cb 0.96 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.57 2k6b h LYS 33 CO 0.08 0.31 -0.40 1.25 -3.45 0.00 0.00 179.45 177.25 2k6b h HIS 34 N 0.00 0.00 -0.43 1.91 2.76 -0.20 0.11 115.15 119.30 2k6b h HIS 34 Ca -0.00 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.12 2k6b h HIS 34 Cb 0.73 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.68 2k6b h HIS 34 CO 0.00 0.40 0.10 0.00 -1.30 0.00 0.00 177.93 177.13 2k6b h ARG 35 N 0.00 0.68 -0.35 5.26 -0.00 -1.18 0.11 114.38 118.90 2k6b h ARG 35 Ca -0.00 -0.17 0.03 0.00 -0.50 0.00 0.00 59.98 59.33 2k6b h ARG 35 Cb 0.77 -0.09 -0.03 0.00 0.00 0.00 0.00 29.97 30.62 2k6b h ARG 35 CO 0.05 0.70 0.17 0.93 0.00 0.00 0.00 179.97 181.82 2k6b h GLU 36 N 0.55 0.34 0.53 0.04 5.08 -1.28 -2.80 114.58 117.04 2k6b h GLU 36 Ca 0.13 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2k6b h GLU 36 Cb 0.32 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2k6b h GLU 36 CO 0.00 0.23 -0.30 0.00 -1.00 0.00 0.00 179.01 177.93 2k6b h ALA 37 N 1.18 -0.78 -0.53 3.43 0.00 -0.72 -2.99 119.26 118.85 2k6b h ALA 37 Ca 0.15 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2k6b h ALA 37 Cb 0.06 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 2k6b h ALA 37 CO -0.10 -0.95 0.18 0.93 0.00 0.00 0.00 179.25 179.30 2k6b h GLU 38 N -0.78 0.34 -0.41 0.00 4.39 -0.68 0.49 114.58 117.93 2k6b h GLU 38 Ca -0.06 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 2k6b h GLU 38 Cb 0.63 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2k6b h GLU 38 CO 0.08 0.22 -0.13 0.00 -1.16 0.00 0.00 179.01 178.02 2k6b h MET 39 N 0.35 0.74 0.02 2.33 -0.00 -1.54 -2.57 114.93 114.25 2k6b h MET 39 Ca 0.26 -0.25 -0.14 0.00 -0.00 0.00 0.00 59.70 59.57 2k6b h MET 39 Cb 0.30 -0.06 0.01 0.00 -0.00 0.00 0.00 31.60 31.85 2k6b h MET 39 CO -0.28 0.83 -0.54 0.00 -0.00 0.00 0.00 176.91 176.93 2k6b h ARG 40 N 0.66 0.33 -0.19 -0.10 3.08 -1.24 -3.36 114.38 113.56 2k6b h ARG 40 Ca 0.11 -0.38 0.01 0.00 0.07 0.00 0.00 59.98 59.79 2k6b h ARG 40 Cb 0.60 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 2k6b h ARG 40 CO 0.04 1.08 0.13 -0.97 -1.07 0.00 0.00 179.97 179.18 2k6b h ASN 41 N -0.26 0.19 -0.23 7.04 -1.24 0.05 -2.39 115.58 118.76 2k6b h ASN 41 Ca -0.07 -0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.94 2k6b h ASN 41 Cb 1.29 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 40.28 2k6b h ASN 41 CO 0.11 0.14 0.11 0.77 -1.29 0.00 0.00 177.43 177.27 2k6b h SER 42 N 0.23 0.17 0.14 1.15 4.64 -1.61 0.24 113.55 118.51 2k6b h SER 42 Ca 0.07 0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.16 2k6b h SER 42 Cb 0.02 -0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2k6b h SER 42 CO -0.02 0.13 -0.96 0.16 -0.87 0.00 0.00 176.83 175.27 2k6b h ILE 43 N 0.24 1.33 -0.53 0.95 3.07 -1.70 -3.22 117.51 117.66 2k6b h ILE 43 Ca 0.09 -2.30 0.00 0.00 1.55 0.00 0.00 64.86 64.21 2k6b h ILE 43 Cb 0.02 2.34 -0.03 0.00 -0.27 0.00 0.00 36.82 38.89 2k6b h ILE 43 CO -0.06 0.70 0.35 -0.07 -1.05 0.00 0.00 178.15 178.02 2k6b h LEU 44 N 0.34 0.61 -1.87 0.16 3.38 -1.11 -1.40 115.31 115.41 2k6b h LEU 44 Ca -0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k6b h LEU 44 Cb 1.60 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.20 2k6b h LEU 44 CO 0.18 0.45 0.00 0.00 0.09 0.00 0.00 178.44 179.16 2k6b h ALA 45 N 1.19 1.00 0.00 1.53 0.00 -0.60 0.15 119.26 122.53 2k6b h ALA 45 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 2k6b h ALA 45 Cb -0.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2k6b h ALA 45 CO -0.04 0.00 -1.80 1.04 0.00 0.00 0.00 179.25 178.45 2k6b n GLN 46 N -2.84 0.65 -0.06 0.00 1.13 -0.62 -4.43 117.38 111.21 2k6b n GLN 46 Ca -0.01 0.08 -0.12 0.00 -1.94 0.00 0.00 57.00 55.01 2k6b n GLN 46 Cb 0.17 -1.67 -0.14 0.00 0.11 0.00 0.00 30.24 28.71 2k6b n GLN 46 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 2k6b n VAL 47 N -2.73 1.54 -3.28 5.09 0.24 -0.64 -4.81 118.33 113.75 2k6b n VAL 47 Ca -0.15 -0.77 -0.38 0.00 -2.04 0.00 0.00 64.34 61.00 2k6b n VAL 47 Cb 0.88 -0.98 -0.06 0.00 -1.47 0.00 0.00 33.84 32.21 2k6b n VAL 47 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2k6b s LEU 48 N -6.07 4.27 0.81 1.34 1.43 0.48 -0.08 118.68 120.84 2k6b s LEU 48 Ca -0.13 0.84 -0.13 0.00 -1.03 0.00 0.00 54.13 53.68 2k6b s LEU 48 Cb 0.07 -2.74 0.08 0.00 0.03 0.00 0.00 46.19 43.64 2k6b s LEU 48 CO 0.79 -0.03 1.18 -0.62 0.23 0.00 0.00 176.35 177.90 2k6b s ASP 49 N 0.70 3.69 0.41 2.29 -1.08 -0.05 -4.66 116.67 117.97 2k6b s ASP 49 Ca 0.27 2.27 0.13 0.00 -0.52 0.00 0.00 52.55 54.70 2k6b s ASP 49 Cb -0.15 -2.58 0.98 0.00 -1.46 0.00 0.00 42.92 39.71 2k6b s ASP 49 CO 0.11 -2.60 1.94 -0.61 0.52 0.00 0.00 175.17 174.53 2k6b h GLN 50 N -0.97 0.47 -0.22 4.34 4.15 -1.89 0.12 115.11 121.10 2k6b h GLN 50 Ca -0.46 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 58.91 2k6b h GLN 50 Cb 1.28 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 2k6b h GLN 50 CO 0.46 0.31 0.03 0.66 -1.93 0.00 0.00 178.83 178.36 2k6b h SER 51 N 0.48 0.35 -0.27 -0.69 4.64 -1.92 0.32 113.55 116.47 2k6b h SER 51 Ca 0.33 -0.27 -0.16 0.00 -0.47 0.00 0.00 61.79 61.23 2k6b h SER 51 Cb 0.65 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2k6b h SER 51 CO -0.11 0.53 -0.43 0.00 -0.87 0.00 0.00 176.83 175.96 2k6b h ALA 52 N 0.83 0.62 -0.55 5.18 0.00 -1.47 0.84 119.26 124.71 2k6b h ALA 52 Ca 0.07 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 2k6b h ALA 52 Cb 0.33 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2k6b h ALA 52 CO 0.01 0.67 0.13 -0.09 0.00 0.00 0.00 179.25 179.97 2k6b h ARG 53 N 0.67 0.89 -0.13 0.00 9.65 -0.69 0.28 114.38 125.06 2k6b h ARG 53 Ca 0.05 -0.22 -0.00 0.00 -1.10 0.00 0.00 59.98 58.70 2k6b h ARG 53 Cb 1.00 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.46 2k6b h ARG 53 CO 0.10 0.84 0.06 0.00 2.80 0.00 0.00 179.97 183.77 2k6b h ALA 54 N 1.01 0.16 -1.00 2.80 0.00 -0.76 -1.03 119.26 120.44 2k6b h ALA 54 Ca 0.17 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2k6b h ALA 54 Cb 0.35 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2k6b h ALA 54 CO 0.00 -0.28 0.66 -0.09 0.00 0.00 0.00 179.25 179.54 2k6b h ARG 55 N 0.08 1.21 0.00 0.00 9.65 -0.48 -0.97 114.38 123.88 2k6b h ARG 55 Ca 0.04 -0.07 -0.09 0.00 -1.10 0.00 0.00 59.98 58.76 2k6b h ARG 55 Cb 0.11 -0.27 -0.01 0.00 -1.39 0.00 0.00 29.97 28.40 2k6b h ARG 55 CO -0.01 0.80 -0.43 1.25 2.80 0.00 0.00 179.97 184.39 2k6b h LEU 56 N 1.25 0.00 -0.57 3.80 5.85 -0.17 -0.11 115.31 125.37 2k6b h LEU 56 Ca 0.41 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 59.00 2k6b h LEU 56 Cb 0.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2k6b h LEU 56 CO -0.13 0.43 -0.25 0.28 -0.34 0.00 0.00 178.44 178.43 2k6b h SER 57 N 0.00 0.92 -0.48 1.25 0.02 0.08 -1.74 113.55 113.60 2k6b h SER 57 Ca -0.00 -0.35 -0.05 0.00 -0.84 0.00 0.00 61.79 60.55 2k6b h SER 57 Cb 0.80 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 2k6b h SER 57 CO 0.06 1.11 0.14 0.78 -1.14 0.00 0.00 176.83 177.77 2k6b h ASN 58 N 0.76 0.77 -0.35 3.07 4.21 -0.52 -2.50 115.58 121.02 2k6b h ASN 58 Ca 0.10 -0.13 -0.03 0.00 1.21 0.00 0.00 56.30 57.44 2k6b h ASN 58 Cb 0.80 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 37.78 2k6b h ASN 58 CO 0.07 0.75 0.12 -0.07 -1.29 0.00 0.00 177.43 177.00 2k6b h LEU 59 N 0.79 0.57 -2.18 1.61 -0.00 -0.56 -2.24 115.31 113.31 2k6b h LEU 59 Ca 0.18 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 57.96 2k6b h LEU 59 Cb 0.28 -0.15 -0.00 0.00 -0.00 0.00 0.00 40.66 40.80 2k6b h LEU 59 CO -0.00 0.56 -0.06 0.00 -0.00 0.00 0.00 178.44 178.94 2k6b h ALA 60 N 1.52 1.22 0.00 1.53 0.00 -0.86 0.38 119.26 123.05 2k6b h ALA 60 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2k6b h ALA 60 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2k6b h ALA 60 CO -0.01 0.07 -0.39 1.28 0.00 0.00 0.00 179.25 180.21 2k6b n LEU 61 N -3.47 0.70 -0.04 0.00 4.77 -0.85 -4.12 117.00 113.98 2k6b n LEU 61 Ca -0.02 0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 56.21 2k6b n LEU 61 Cb 0.19 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 2k6b n LEU 61 CO 0.27 -0.08 -0.80 1.33 -1.33 0.00 0.00 177.39 176.77 2k6b n VAL 62 N -2.10 0.49 -3.46 4.08 0.24 -0.19 -4.96 118.33 112.43 2k6b n VAL 62 Ca 0.04 -0.13 -0.29 0.00 -2.04 0.00 0.00 64.34 61.93 2k6b n VAL 62 Cb 0.43 -1.57 -0.12 0.00 -1.47 0.00 0.00 33.84 31.11 2k6b n VAL 62 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2k6b s LYS 63 N -2.16 0.61 0.32 7.34 1.02 0.12 -4.99 119.74 121.99 2k6b s LYS 63 Ca -0.12 -1.45 0.02 0.00 0.02 0.00 0.00 55.97 54.43 2k6b s LYS 63 Cb 0.05 -1.33 0.53 0.00 -0.52 0.00 0.00 37.83 36.56 2k6b s LYS 63 CO 0.16 -1.24 1.89 -1.35 -0.92 0.00 0.00 175.35 173.89 2k6b h PRO 64 N 6.81 0.72 -0.37 -1.68 0.11 -1.72 -2.07 132.00 133.81 2k6b h PRO 64 Ca 0.09 -0.12 0.07 0.00 0.11 0.00 0.00 66.00 66.15 2k6b h PRO 64 Cb 0.96 -0.12 -0.06 0.00 0.11 0.00 0.00 31.00 31.89 2k6b h PRO 64 CO 0.28 0.63 -0.01 0.93 -0.21 0.00 0.00 178.00 179.61 2k6b h GLU 65 N 0.71 0.08 0.00 1.05 3.07 -1.94 0.12 114.58 117.68 2k6b h GLU 65 Ca 0.17 -0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.86 2k6b h GLU 65 Cb 0.20 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 2k6b h GLU 65 CO -0.01 0.05 -0.76 0.87 -1.40 0.00 0.00 179.01 177.76 2k6b h LYS 66 N 0.08 0.00 0.12 2.33 1.79 -1.88 -1.12 116.57 117.90 2k6b h LYS 66 Ca 0.18 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.64 2k6b h LYS 66 Cb 0.25 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 2k6b h LYS 66 CO -0.31 0.76 -0.06 1.15 -1.08 0.00 0.00 179.45 179.91 2k6b h THR 67 N 0.00 0.91 -0.60 -0.16 2.02 -0.65 -0.32 112.91 114.10 2k6b h THR 67 Ca -0.01 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 2k6b h THR 67 Cb 1.39 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.74 2k6b h THR 67 CO 0.10 0.02 0.34 0.11 0.37 0.00 0.00 175.52 176.47 2k6b h LYS 68 N -0.20 0.82 -0.09 6.66 1.57 -0.65 0.07 116.57 124.75 2k6b h LYS 68 Ca -0.02 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2k6b h LYS 68 Cb 0.16 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 2k6b h LYS 68 CO 0.03 0.59 0.01 0.00 -0.57 0.00 0.00 179.45 179.51 2k6b h ALA 69 N 1.54 0.12 -0.35 3.86 0.00 -0.80 0.85 119.26 124.48 2k6b h ALA 69 Ca 0.22 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2k6b h ALA 69 Cb -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2k6b h ALA 69 CO -0.04 -0.23 -0.32 -0.39 0.00 0.00 0.00 179.25 178.27 2k6b h VAL 70 N -0.10 1.28 -0.37 0.00 -1.51 -0.73 -0.62 116.25 114.20 2k6b h VAL 70 Ca 0.03 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 64.03 2k6b h VAL 70 Cb 0.30 1.35 -0.02 0.00 -2.13 0.00 0.00 31.29 30.79 2k6b h VAL 70 CO 0.00 0.48 0.23 -0.33 -1.23 0.00 0.00 177.57 176.73 2k6b h GLU 71 N 0.64 0.50 -0.97 5.19 5.08 -0.91 0.54 114.58 124.66 2k6b h GLU 71 Ca 0.07 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2k6b h GLU 71 Cb 0.85 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.93 2k6b h GLU 71 CO 0.07 0.35 0.63 -0.97 -1.00 0.00 0.00 179.01 178.09 2k6b h ASN 72 N 0.49 1.03 -0.13 1.42 -0.73 -0.60 -0.23 115.58 116.83 2k6b h ASN 72 Ca 0.13 -0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.28 2k6b h ASN 72 Cb -0.02 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.33 2k6b h ASN 72 CO -0.03 0.69 0.02 0.22 -0.37 0.00 0.00 177.43 177.97 2k6b h TYR 73 N 1.19 0.24 -0.69 0.67 3.20 -0.44 -2.58 116.97 118.57 2k6b h TYR 73 Ca 0.39 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.20 2k6b h TYR 73 Cb 0.05 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2k6b h TYR 73 CO -0.01 0.41 0.30 -0.07 -1.64 0.00 0.00 178.16 177.15 2k6b h LEU 74 N -0.00 0.91 -0.91 2.82 -0.00 -0.35 0.23 115.31 118.01 2k6b h LEU 74 Ca 0.04 -0.12 0.07 0.00 -0.00 0.00 0.00 57.88 57.87 2k6b h LEU 74 Cb 0.30 -0.23 -0.06 0.00 -0.00 0.00 0.00 40.66 40.66 2k6b h LEU 74 CO 0.00 0.80 0.57 0.40 -0.00 0.00 0.00 178.44 180.21 2k6b h ILE 75 N 0.99 1.05 0.04 1.22 2.04 -0.96 0.16 117.51 122.04 2k6b h ILE 75 Ca 0.23 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2k6b h ILE 75 Cb 0.16 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 2k6b h ILE 75 CO -0.02 0.19 -0.02 -0.61 0.00 0.00 0.00 178.15 177.68 2k6b h GLN 76 N 1.04 -0.06 -0.17 2.37 5.75 -1.00 -3.35 115.11 119.69 2k6b h GLN 76 Ca 0.40 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.86 2k6b h GLN 76 Cb 0.18 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 2k6b h GLN 76 CO -0.18 0.59 -0.07 1.98 -2.65 0.00 0.00 178.83 178.50 2k6b h MET 77 N -0.83 0.25 -0.88 1.69 4.05 -0.36 -1.90 114.93 116.96 2k6b h MET 77 Ca -0.01 -0.05 0.11 0.00 -0.28 0.00 0.00 59.70 59.48 2k6b h MET 77 Cb 0.67 -0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 31.37 2k6b h MET 77 CO 0.01 0.34 0.57 0.00 0.23 0.00 0.00 176.91 178.06 2k6b h ALA 78 N 1.69 1.71 0.00 0.39 0.00 -0.82 -1.07 119.26 121.16 2k6b h ALA 78 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2k6b h ALA 78 Cb 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2k6b h ALA 78 CO 0.01 0.10 0.00 0.54 0.00 0.00 0.00 179.25 179.90 2k6b n ARG 79 N -4.54 0.05 0.00 0.00 3.00 -0.71 -2.35 116.66 112.10 2k6b n ARG 79 Ca 0.16 0.21 0.15 0.00 -0.01 0.00 0.00 57.85 58.36 2k6b n ARG 79 Cb 0.36 -1.58 0.72 0.00 0.00 0.00 0.00 32.46 31.96 2k6b n ARG 79 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2k6b n TYR 80 N -1.66 0.00 -1.03 -1.55 4.02 -0.40 -4.87 117.16 111.67 2k6b n TYR 80 Ca 0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.92 2k6b n TYR 80 Cb 0.24 -0.28 -0.00 0.00 -0.02 0.00 0.00 39.34 39.27 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 1.30 0.48 0.12 2.72 0.00 -0.99 -4.85 105.19 103.96 2k6b n GLY 81 Ca 0.14 -0.23 0.03 0.00 0.00 0.00 0.00 46.02 45.95 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 0.61 0.00 -5.35 1.61 1.08 -1.75 -3.42 115.11 107.88 2k6b h GLN 82 Ca -0.02 0.00 -0.64 0.00 -1.45 0.00 0.00 58.65 56.54 2k6b h GLN 82 Cb 0.20 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 27.48 2k6b h GLN 82 CO 0.03 0.34 0.41 -0.51 -0.95 0.00 0.00 178.83 178.14 2k6b s LEU 83 N -6.04 4.56 0.00 1.46 2.01 -1.26 -4.53 118.68 114.88 2k6b s LEU 83 Ca 0.01 -0.90 0.10 0.00 0.01 0.00 0.00 54.13 53.34 2k6b s LEU 83 Cb 0.08 -2.50 0.16 0.00 0.01 0.00 0.00 46.19 43.94 2k6b s LEU 83 CO 0.78 -1.26 1.01 -0.24 1.01 0.00 0.00 176.35 177.64 2k6b n SER 84 N 7.21 -0.05 -3.73 2.29 2.88 -1.26 -5.02 113.62 115.95 2k6b n SER 84 Ca -0.04 -1.89 -0.10 0.00 -1.33 0.00 0.00 58.87 55.51 2k6b n SER 84 Cb 0.45 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.86 2k6b n SER 84 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2k6b s GLU 85 N 0.00 1.18 -0.02 -1.46 2.56 -1.26 -5.15 118.70 114.55 2k6b s GLU 85 Ca 0.13 -0.84 -0.15 0.00 0.00 0.00 0.00 54.97 54.10 2k6b s GLU 85 Cb 0.15 0.47 -0.05 0.00 2.00 0.00 0.00 34.13 36.69 2k6b s GLU 85 CO -0.06 -0.47 0.42 0.15 -0.56 0.00 0.00 175.26 174.73 2k6b s LYS 86 N -3.85 3.99 -0.31 4.30 -0.14 -1.26 -4.78 119.74 117.69 2k6b s LYS 86 Ca 0.07 0.41 -0.17 0.00 -1.36 0.00 0.00 55.97 54.92 2k6b s LYS 86 Cb 0.01 -3.26 -0.02 0.00 -1.68 0.00 0.00 37.83 32.89 2k6b s LYS 86 CO -0.07 0.61 0.48 0.08 -0.76 0.00 0.00 175.35 175.68 2k6b s VAL 87 N -0.81 5.07 0.31 3.17 1.01 0.88 -4.82 120.40 125.21 2k6b s VAL 87 Ca 0.24 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 62.71 2k6b s VAL 87 Cb -0.16 -3.87 0.06 0.00 0.00 0.00 0.00 36.38 32.41 2k6b s VAL 87 CO 0.13 -0.06 0.42 -1.20 0.00 0.00 0.00 175.10 174.39 2k6b n SER 88 N 5.59 0.43 -0.22 3.32 7.64 -1.26 -0.88 113.62 128.26 2k6b n SER 88 Ca -0.06 -1.40 -0.05 0.00 1.01 0.00 0.00 58.87 58.38 2k6b n SER 88 Cb 0.49 -0.28 0.05 0.00 -1.01 0.00 0.00 64.21 63.46 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 0.76 -0.45 1.43 5.08 -1.91 -0.50 114.58 118.99 2k6b h GLU 89 Ca -0.14 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2k6b h GLU 89 Cb 0.48 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2k6b h GLU 89 CO 0.14 0.50 0.25 0.37 -1.00 0.00 0.00 179.01 179.27 2k6b h GLN 90 N 0.79 0.62 -0.67 2.33 4.15 -1.99 0.14 115.11 120.48 2k6b h GLN 90 Ca 0.24 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 2k6b h GLN 90 Cb -0.03 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 2k6b h GLN 90 CO -0.08 0.48 0.21 0.78 -1.93 0.00 0.00 178.83 178.29 2k6b h GLY 91 N 0.59 1.10 0.97 2.39 0.00 -1.83 -0.19 103.07 106.10 2k6b h GLY 91 Ca 0.16 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2k6b h GLY 91 CO -0.03 0.59 0.25 -2.00 0.00 0.00 0.00 176.54 175.35 2k6b h LEU 92 N 0.99 0.63 -1.18 3.11 5.85 -0.39 -0.64 115.31 123.68 2k6b h LEU 92 Ca 0.22 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 2k6b h LEU 92 Cb 0.28 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2k6b h LEU 92 CO -0.01 0.57 -0.00 0.40 -0.34 0.00 0.00 178.44 179.06 2k6b h ILE 93 N 0.65 1.20 -0.01 4.05 2.04 -0.26 0.38 117.51 125.56 2k6b h ILE 93 Ca 0.17 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.21 2k6b h ILE 93 Cb 0.10 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2k6b h ILE 93 CO -0.02 0.28 0.00 -0.33 0.00 0.00 0.00 178.15 178.08 2k6b h GLU 94 N 0.53 0.01 -0.64 2.37 4.39 -0.54 -1.06 114.58 119.64 2k6b h GLU 94 Ca 0.11 -0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 2k6b h GLU 94 Cb 0.35 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 2k6b h GLU 94 CO 0.01 0.12 0.19 0.82 -1.16 0.00 0.00 179.01 178.99 2k6b h ILE 95 N -0.11 1.24 -0.84 3.13 2.04 -0.61 -1.02 117.51 121.34 2k6b h ILE 95 Ca 0.00 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.05 2k6b h ILE 95 Cb 0.12 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.69 2k6b h ILE 95 CO -0.00 0.33 0.54 0.25 0.00 0.00 0.00 178.15 179.26 2k6b h LEU 96 N 0.95 0.89 -0.40 1.44 5.85 -0.04 0.16 115.31 124.16 2k6b h LEU 96 Ca 0.21 -0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.81 2k6b h LEU 96 Cb 0.29 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2k6b h LEU 96 CO -0.01 0.61 -0.21 0.11 -0.34 0.00 0.00 178.44 178.60 2k6b h LYS 97 N 1.04 0.85 -0.89 1.25 1.57 -0.66 -2.44 116.57 117.28 2k6b h LYS 97 Ca 0.34 -0.38 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2k6b h LYS 97 Cb 0.03 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 2k6b h LYS 97 CO -0.12 1.02 0.55 0.87 -0.57 0.00 0.00 179.45 181.19 2k6b h LYS 98 N 0.66 1.20 0.00 3.15 1.57 -0.29 -1.68 116.57 121.18 2k6b h LYS 98 Ca 0.09 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2k6b h LYS 98 Cb 0.78 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2k6b h LYS 98 CO 0.06 0.83 0.00 -0.39 -0.57 0.00 0.00 179.45 179.38 2k6b h VAL 99 N 1.22 0.00 0.00 0.50 -1.51 -0.68 -2.56 116.25 113.22 2k6b h VAL 99 Ca 0.32 -0.70 -0.09 0.00 -1.23 0.00 0.00 66.70 65.00 2k6b h VAL 99 Cb -0.07 1.68 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 2k6b h VAL 99 CO -0.06 0.00 -0.42 0.28 -1.23 0.00 0.00 177.57 176.14 2k6b h SER 100 N 0.00 0.00 0.08 4.19 0.02 -0.84 -3.35 113.55 113.66 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 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2k6b h SER 100 CO 0.00 0.42 -0.04 1.56 -1.14 0.00 0.00 176.83 177.63 2k6b h GLN 101 N 0.00 -0.11 0.00 3.45 4.20 -0.92 -3.48 115.11 118.25 2k6b h GLN 101 Ca -0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2k6b h GLN 101 Cb 1.28 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.08 2k6b h GLN 101 CO 0.05 -0.07 0.00 1.04 -0.67 0.00 0.00 178.83 179.18 2k6b n GLN 102 N -2.42 0.00 0.00 1.46 6.02 -1.16 -5.00 117.38 116.29 2k6b n GLN 102 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2k6b n GLN 102 Cb 0.04 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.30 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 -1.00 0.00 -3.59 5.09 -1.04 -1.25 -4.81 114.28 107.68 2k6b n THR 103 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 2k6b n THR 103 Cb 0.00 -0.76 -0.06 0.00 -1.82 0.00 0.00 70.33 67.69 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 -1.83 0.61 0.19 -2.82 -1.05 -1.14 -3.16 118.70 109.49 2k6b s GLU 104 Ca 0.00 0.25 0.00 0.00 -0.15 0.00 0.00 54.97 55.07 2k6b s GLU 104 Cb 0.00 0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.93 2k6b s GLU 104 CO 0.00 -0.17 0.07 0.21 0.95 0.00 0.00 175.26 176.32 2k6b s LYS 105 N -0.83 1.16 0.00 -4.83 2.20 -1.26 -5.00 119.74 111.19 2k6b s LYS 105 Ca -0.01 -1.59 0.00 0.00 -0.36 0.00 0.00 55.97 54.00 2k6b s LYS 105 Cb -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 37.83 36.31 2k6b s LYS 105 CO 0.01 -0.27 0.00 -2.37 -0.36 0.00 0.00 175.35 172.35 2k6b n THR 106 N -0.27 -0.38 -0.76 3.43 5.66 -1.26 -4.89 114.28 115.81 2k6b n THR 106 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2k6b n THR 106 Cb 0.65 -0.11 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 2k6b n THR 106 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 2k6b n THR 107 N 1.09 0.00 0.04 1.09 5.66 -1.26 -4.82 114.28 116.08 2k6b n THR 107 Ca 0.00 -0.11 -0.13 0.00 -3.05 0.00 0.00 64.05 60.76 2k6b n THR 107 Cb 0.00 1.76 -0.14 0.00 -1.55 0.00 0.00 70.33 70.40 2k6b n THR 107 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k6b h THR 108 N 0.76 1.20 -3.62 1.09 1.03 -2.08 -3.40 112.91 107.89 2k6b h THR 108 Ca 0.00 -2.91 -0.73 0.00 -0.01 0.00 0.00 66.41 62.76 2k6b h THR 108 Cb 0.38 2.69 -0.32 0.00 -1.07 0.00 0.00 68.15 69.83 2k6b h THR 108 CO 0.00 0.78 -0.15 0.54 -0.01 0.00 0.00 175.52 176.67 2k6b s VAL 109 N -2.63 4.49 -0.19 0.00 0.11 -1.26 -4.68 120.40 116.24 2k6b s VAL 109 Ca -0.06 -2.93 0.14 0.00 -2.93 0.00 0.00 61.98 56.21 2k6b s VAL 109 Cb 0.08 -3.84 -0.22 0.00 -1.53 0.00 0.00 36.38 30.87 2k6b s VAL 109 CO 0.84 -0.96 0.02 0.29 -3.33 0.00 0.00 175.10 171.96 2k6b n LYS 110 N 3.48 0.95 -0.94 1.54 5.02 -1.26 -5.00 118.16 121.94 2k6b n LYS 110 Ca 0.12 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 2k6b n LYS 110 Cb 0.41 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2k6b n LYS 110 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2k6b n PHE 111 N -2.75 0.00 -0.79 2.13 7.35 -1.26 -5.23 117.46 116.91 2k6b n PHE 111 Ca -0.32 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.37 2k6b n PHE 111 Cb 1.07 -1.07 0.00 0.00 0.35 0.00 0.00 39.48 39.84 2k6b n PHE 111 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27