#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6x s SER 26 N 0.00 7.08 0.00 1.61 1.04 -1.26 -4.92 113.70 117.25 2k6x s SER 26 Ca 0.00 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.74 2k6x s SER 26 Cb 0.00 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2k6x s SER 26 CO 0.00 -0.35 0.00 1.41 0.98 0.00 0.00 173.24 175.28 2k6x n HIS 27 N 2.01 0.00 -3.13 5.02 -0.00 -1.26 -5.03 115.22 112.83 2k6x n HIS 27 Ca 0.03 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.79 2k6x n HIS 27 Cb 0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 30.43 2k6x n HIS 27 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 2k6x s MET 28 N -1.82 0.31 0.47 -0.41 -2.45 -1.26 -5.03 119.30 109.11 2k6x s MET 28 Ca 0.00 0.26 0.22 0.00 -1.25 0.00 0.00 55.69 54.92 2k6x s MET 28 Cb 0.00 0.13 1.23 0.00 1.25 0.00 0.00 34.83 37.44 2k6x s MET 28 CO 0.00 -0.57 1.90 -1.35 1.05 0.00 0.00 175.02 176.05 2k6x h PRO 29 N 7.41 0.23 -0.94 4.11 0.11 -1.99 0.10 132.00 141.02 2k6x h PRO 29 Ca -0.06 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 66.08 2k6x h PRO 29 Cb 1.18 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 2k6x h PRO 29 CO -0.00 0.15 0.62 0.37 -0.21 0.00 0.00 178.00 178.93 2k6x h GLN 30 N 0.24 1.15 -0.24 1.05 4.15 -1.99 0.15 115.11 119.61 2k6x h GLN 30 Ca 0.40 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.70 2k6x h GLN 30 Cb 1.22 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.64 2k6x h GLN 30 CO -0.09 0.76 -0.08 0.82 -1.93 0.00 0.00 178.83 178.31 2k6x h ILE 31 N 1.18 1.29 -0.58 2.39 1.08 -1.38 -1.14 117.51 120.35 2k6x h ILE 31 Ca 0.37 -1.10 0.06 0.00 -0.39 0.00 0.00 64.86 63.80 2k6x h ILE 31 Cb 0.01 1.51 -0.05 0.00 -3.07 0.00 0.00 36.82 35.22 2k6x h ILE 31 CO -0.11 0.34 0.29 -0.33 -0.69 0.00 0.00 178.15 177.65 2k6x h GLU 32 N 0.22 0.53 -0.64 2.37 5.08 -1.04 0.71 114.58 121.81 2k6x h GLU 32 Ca 0.06 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.31 2k6x h GLU 32 Cb 0.55 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2k6x h GLU 32 CO 0.03 0.35 0.07 0.00 -1.00 0.00 0.00 179.01 178.46 2k6x h ARG 33 N 0.55 1.07 -0.36 2.33 2.47 -0.68 -2.95 114.38 116.81 2k6x h ARG 33 Ca 0.26 -0.30 -0.09 0.00 -1.26 0.00 0.00 59.98 58.60 2k6x h ARG 33 Cb 0.19 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 2k6x h ARG 33 CO -0.19 1.00 -0.13 -0.09 0.56 0.00 0.00 179.97 181.11 2k6x h ARG 34 N 0.99 0.64 -0.60 0.04 9.65 -0.05 -1.75 114.38 123.30 2k6x h ARG 34 Ca 0.19 -0.20 0.01 0.00 -1.10 0.00 0.00 59.98 58.88 2k6x h ARG 34 Cb 0.47 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.96 2k6x h ARG 34 CO 0.02 0.75 0.39 0.82 2.80 0.00 0.00 179.97 184.75 2k6x h ILE 35 N 0.58 1.13 -0.43 1.20 2.04 -0.73 0.46 117.51 121.75 2k6x h ILE 35 Ca 0.10 -0.27 -0.09 0.00 1.00 0.00 0.00 64.86 65.60 2k6x h ILE 35 Cb 0.56 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2k6x h ILE 35 CO 0.04 0.14 -0.07 0.11 0.00 0.00 0.00 178.15 178.37 2k6x h LYS 36 N 0.79 0.80 -0.80 2.37 1.79 -1.43 -1.86 116.57 118.23 2k6x h LYS 36 Ca 0.23 -0.29 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 2k6x h LYS 36 Cb -0.06 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.50 2k6x h LYS 36 CO -0.06 0.91 0.39 0.87 -1.08 0.00 0.00 179.45 180.47 2k6x h LYS 37 N 0.63 1.14 -0.22 3.15 1.57 -0.84 -1.34 116.57 120.66 2k6x h LYS 37 Ca 0.11 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2k6x h LYS 37 Cb 0.59 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2k6x h LYS 37 CO 0.04 0.87 0.14 -0.07 -0.57 0.00 0.00 179.45 179.86 2k6x h LEU 38 N 1.13 0.26 -1.28 2.94 3.38 0.20 0.37 115.31 122.31 2k6x h LEU 38 Ca 0.28 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 2k6x h LEU 38 Cb 0.10 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2k6x h LEU 38 CO -0.04 0.21 0.17 0.40 0.09 0.00 0.00 178.44 179.28 2k6x h ILE 39 N 0.29 1.18 -0.14 1.22 5.03 -1.08 -0.15 117.51 123.86 2k6x h ILE 39 Ca 0.08 -0.57 -0.03 0.00 -0.12 0.00 0.00 64.86 64.22 2k6x h ILE 39 Cb -0.01 0.64 -0.00 0.00 -3.03 0.00 0.00 36.82 34.41 2k6x h ILE 39 CO -0.02 0.22 -0.02 -1.28 -0.68 0.00 0.00 178.15 176.37 2k6x h SER 40 N 0.66 0.27 -0.51 1.72 0.87 -0.42 -1.67 113.55 114.46 2k6x h SER 40 Ca 0.16 -0.35 0.01 0.00 -1.23 0.00 0.00 61.79 60.38 2k6x h SER 40 Cb 0.15 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 2k6x h SER 40 CO -0.01 0.55 0.34 -0.07 -0.53 0.00 0.00 176.83 177.11 2k6x h LEU 41 N -0.03 0.58 -0.66 2.23 3.38 0.26 0.22 115.31 121.29 2k6x h LEU 41 Ca 0.04 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 2k6x h LEU 41 Cb 0.43 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2k6x h LEU 41 CO 0.01 0.42 -0.31 1.23 0.09 0.00 0.00 178.44 179.88 2k6x h GLY 42 N 0.69 0.76 0.94 0.83 0.00 -1.03 0.11 103.07 105.37 2k6x h GLY 42 Ca 0.19 -0.70 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 2k6x h GLY 42 CO -0.04 0.64 0.06 1.70 0.00 0.00 0.00 176.54 178.89 2k6x h LYS 43 N 0.60 0.69 -0.57 4.80 1.63 -0.79 -1.61 116.57 121.30 2k6x h LYS 43 Ca 0.07 -0.19 0.02 0.00 -0.85 0.00 0.00 60.65 59.70 2k6x h LYS 43 Cb 0.82 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.34 2k6x h LYS 43 CO 0.07 0.73 0.38 0.87 -3.45 0.00 0.00 179.45 178.05 2k6x h LYS 44 N 0.54 0.69 0.00 1.90 6.56 -0.27 -1.57 116.57 124.41 2k6x h LYS 44 Ca 0.12 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.62 2k6x h LYS 44 Cb 0.39 -0.16 -0.01 0.00 -0.57 0.00 0.00 32.23 31.89 2k6x h LYS 44 CO 0.01 0.46 -0.23 0.87 -2.06 0.00 0.00 179.45 178.50 2k6x h LYS 45 N 0.71 0.00 0.00 3.15 1.79 0.01 -3.47 116.57 118.77 2k6x h LYS 45 Ca 0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 2k6x h LYS 45 Cb 0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 2k6x h LYS 45 CO -0.06 0.23 0.00 0.41 -1.08 0.00 0.00 179.45 178.95 2k6x n GLY 46 N -0.22 0.26 3.17 3.86 0.00 -0.59 -5.08 105.19 106.59 2k6x n GLY 46 Ca -0.01 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 2k6x n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6x s TYR 47 N 0.00 0.95 -1.11 1.61 2.02 -1.16 -4.86 117.35 114.80 2k6x s TYR 47 Ca 0.00 -0.79 -0.21 0.00 -0.37 0.00 0.00 57.07 55.70 2k6x s TYR 47 Cb 0.00 -0.53 0.07 0.00 -0.40 0.00 0.00 41.96 41.10 2k6x s TYR 47 CO 0.00 -0.08 1.52 0.96 -1.57 0.00 0.00 175.55 176.38 2k6x s ILE 48 N -3.05 4.09 0.02 2.71 -5.25 -1.26 -3.67 121.20 114.79 2k6x s ILE 48 Ca 0.08 -1.27 -0.17 0.00 -0.99 0.00 0.00 60.65 58.30 2k6x s ILE 48 Cb 0.01 -5.08 0.03 0.00 2.95 0.00 0.00 42.46 40.38 2k6x s ILE 48 CO -0.02 -1.92 0.38 0.28 -1.79 0.00 0.00 174.94 171.87 2k6x s THR 49 N 4.43 0.06 0.48 8.37 -1.32 -1.24 0.57 115.64 126.99 2k6x s THR 49 Ca 0.47 -0.48 0.15 0.00 -1.21 0.00 0.00 61.69 60.62 2k6x s THR 49 Cb 0.01 -0.87 0.24 0.00 -1.51 0.00 0.00 72.50 70.36 2k6x s THR 49 CO -0.04 -0.26 2.08 0.22 -2.21 0.00 0.00 174.62 174.41 2k6x h TYR 50 N 3.25 0.04 -0.43 9.09 3.20 -0.91 -0.04 116.97 131.17 2k6x h TYR 50 Ca -0.31 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.45 2k6x h TYR 50 Cb 1.19 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.44 2k6x h TYR 50 CO 0.44 0.09 -0.19 0.93 -1.64 0.00 0.00 178.16 177.80 2k6x h GLU 51 N 0.04 0.83 -0.04 1.82 4.39 -1.85 -0.27 114.58 119.50 2k6x h GLU 51 Ca 0.01 -0.32 -0.14 0.00 0.34 0.00 0.00 59.36 59.25 2k6x h GLU 51 Cb 0.12 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2k6x h GLU 51 CO 0.01 0.95 -0.60 -0.44 -1.16 0.00 0.00 179.01 177.77 2k6x h ASP 52 N 0.73 0.15 -0.02 1.42 5.19 -1.40 -0.84 116.42 121.65 2k6x h ASP 52 Ca 0.11 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2k6x h ASP 52 Cb 0.71 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.17 2k6x h ASP 52 CO 0.05 0.72 0.01 0.40 -3.12 0.00 0.00 179.24 177.31 2k6x h ILE 53 N 0.10 1.04 -0.93 0.35 1.08 -0.71 -0.30 117.51 118.13 2k6x h ILE 53 Ca -0.01 -0.12 0.07 0.00 -0.39 0.00 0.00 64.86 64.42 2k6x h ILE 53 Cb 1.09 1.08 -0.06 0.00 -3.07 0.00 0.00 36.82 35.85 2k6x h ILE 53 CO 0.09 0.03 0.60 -0.78 -0.69 0.00 0.00 178.15 177.40 2k6x h ASP 54 N -0.01 0.92 1.25 1.72 1.82 -0.89 -0.12 116.42 121.11 2k6x h ASP 54 Ca 0.01 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 2k6x h ASP 54 Cb 0.04 -0.18 0.00 0.00 0.68 0.00 0.00 39.33 39.87 2k6x h ASP 54 CO -0.00 0.58 0.00 0.07 -1.61 0.00 0.00 179.24 178.28 2k6x h LYS 55 N 1.04 0.00 0.00 0.28 2.10 -0.82 -2.93 116.57 116.24 2k6x h LYS 55 Ca 0.41 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.06 2k6x h LYS 55 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2k6x h LYS 55 CO -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.29 2k6x h ALA 56 N 2.34 1.00 -3.01 0.07 0.00 0.79 -3.45 119.26 117.00 2k6x h ALA 56 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 2k6x h ALA 56 Cb 0.62 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.54 2k6x h ALA 56 CO 0.00 0.00 0.62 -0.06 0.00 0.00 0.00 179.25 179.81 2k6x s PHE 57 N -3.30 2.34 0.38 0.00 0.08 -1.11 -4.20 117.98 112.17 2k6x s PHE 57 Ca 0.06 1.36 -0.25 0.00 0.12 0.00 0.00 56.93 58.22 2k6x s PHE 57 Cb 0.07 -3.81 -0.09 0.00 -0.57 0.00 0.00 43.02 38.63 2k6x s PHE 57 CO 0.61 -2.86 1.09 -2.14 -0.10 0.00 0.00 175.22 171.82 2k6x s PRO 58 N -2.81 4.20 0.00 0.24 0.02 -1.26 -5.10 135.00 130.29 2k6x s PRO 58 Ca 0.69 1.64 0.00 0.00 0.02 0.00 0.00 61.00 63.35 2k6x s PRO 58 Cb -0.41 -2.67 0.00 0.00 0.02 0.00 0.00 34.50 31.44 2k6x s PRO 58 CO 0.49 -0.14 0.00 -0.35 -0.33 0.00 0.00 177.00 176.67 2k6x n PRO 59 N 0.15 3.42 -0.38 5.54 -0.05 -1.26 -5.02 135.00 137.39 2k6x n PRO 59 Ca 0.04 0.00 0.10 0.00 -0.05 0.00 0.00 63.50 63.59 2k6x n PRO 59 Cb 0.48 0.00 0.30 0.00 -0.05 0.00 0.00 33.50 34.23 2k6x n PRO 59 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 2k6x n ASP 60 N 0.00 3.68 -4.65 3.54 8.00 -1.26 -4.97 116.55 120.90 2k6x n ASP 60 Ca 0.00 -2.09 -0.42 0.00 0.71 0.00 0.00 54.79 52.98 2k6x n ASP 60 Cb 0.00 -0.46 -0.03 0.00 -0.02 0.00 0.00 41.12 40.61 2k6x n ASP 60 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2k6x s PHE 61 N -1.29 1.54 -0.31 1.24 0.08 -1.26 -4.82 117.98 113.16 2k6x s PHE 61 Ca 0.44 -0.00 0.20 0.00 0.12 0.00 0.00 56.93 57.69 2k6x s PHE 61 Cb 0.24 -4.08 0.19 0.00 -0.57 0.00 0.00 43.02 38.80 2k6x s PHE 61 CO 0.28 -4.56 1.45 0.93 -0.10 0.00 0.00 175.22 173.23 2k6x h GLU 62 N 11.11 0.00 -1.64 0.44 5.08 -1.98 -3.45 114.58 124.14 2k6x h GLU 62 Ca -0.43 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.02 2k6x h GLU 62 Cb 1.21 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.22 2k6x h GLU 62 CO 0.96 0.18 0.18 0.20 -1.00 0.00 0.00 179.01 179.53 2k6x s GLY 63 N -4.34 -0.31 -0.02 -3.84 0.00 -1.26 -5.17 107.32 92.38 2k6x s GLY 63 Ca 0.05 2.82 -0.01 0.00 0.00 0.00 0.00 44.72 47.57 2k6x s GLY 63 CO 0.71 2.72 0.10 -0.12 0.00 0.00 0.00 173.10 176.52 2k6x s PHE 64 N 1.83 3.36 0.06 1.90 5.36 -1.26 -5.03 117.98 124.20 2k6x s PHE 64 Ca -0.08 0.26 -0.15 0.00 -0.96 0.00 0.00 56.93 56.01 2k6x s PHE 64 Cb -0.06 -1.78 0.03 0.00 -0.34 0.00 0.00 43.02 40.87 2k6x s PHE 64 CO -0.17 0.58 0.34 0.34 -1.46 0.00 0.00 175.22 174.85 2k6x s ASP 65 N -1.68 -0.17 0.55 6.13 -1.08 -1.26 -5.02 116.67 114.15 2k6x s ASP 65 Ca 0.23 -0.20 0.29 0.00 -0.52 0.00 0.00 52.55 52.35 2k6x s ASP 65 Cb -0.12 0.40 1.63 0.00 -1.46 0.00 0.00 42.92 43.37 2k6x s ASP 65 CO 0.13 -0.69 2.15 0.74 0.52 0.00 0.00 175.17 178.03 2k6x h THR 66 N 2.94 0.51 -0.90 1.71 2.02 -2.02 -2.39 112.91 114.78 2k6x h THR 66 Ca -0.32 -0.32 0.07 0.00 0.77 0.00 0.00 66.41 66.60 2k6x h THR 66 Cb 1.21 1.21 -0.06 0.00 -1.74 0.00 0.00 68.15 68.78 2k6x h THR 66 CO 0.46 0.07 0.59 -1.13 0.37 0.00 0.00 175.52 175.88 2k6x h ASN 67 N 0.00 0.89 -1.00 4.18 -1.24 -2.00 -0.75 115.58 115.66 2k6x h ASN 67 Ca -0.00 0.01 0.06 0.00 0.71 0.00 0.00 56.30 57.08 2k6x h ASN 67 Cb 0.21 -0.18 -0.07 0.00 0.73 0.00 0.00 38.32 39.01 2k6x h ASN 67 CO 0.01 0.57 0.65 0.25 -1.29 0.00 0.00 177.43 177.61 2k6x h LEU 68 N 1.01 1.04 -0.73 0.34 5.85 -1.85 0.66 115.31 121.63 2k6x h LEU 68 Ca 0.39 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.09 2k6x h LEU 68 Cb 0.23 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2k6x h LEU 68 CO -0.15 0.67 0.36 0.40 -0.34 0.00 0.00 178.44 179.38 2k6x h ILE 69 N 1.18 1.24 -0.39 4.05 1.08 -1.27 0.50 117.51 123.89 2k6x h ILE 69 Ca 0.43 -0.65 -0.11 0.00 -0.39 0.00 0.00 64.86 64.14 2k6x h ILE 69 Cb 0.15 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.20 2k6x h ILE 69 CO -0.16 0.28 -0.17 -0.33 -0.69 0.00 0.00 178.15 177.07 2k6x h GLU 70 N 1.03 0.80 -0.22 2.37 5.08 -1.29 -3.11 114.58 119.24 2k6x h GLU 70 Ca 0.25 -0.34 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 2k6x h GLU 70 Cb 0.10 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2k6x h GLU 70 CO -0.03 0.97 -0.33 0.00 -1.00 0.00 0.00 179.01 178.61 2k6x h ARG 71 N 0.60 0.47 -0.09 2.33 2.47 -0.04 -1.89 114.38 118.23 2k6x h ARG 71 Ca 0.09 -0.20 -0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2k6x h ARG 71 Cb 0.71 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.02 2k6x h ARG 71 CO 0.05 0.74 0.05 0.82 0.56 0.00 0.00 179.97 182.19 2k6x h ILE 72 N 0.40 1.08 -0.71 2.04 2.04 -0.02 -0.16 117.51 122.19 2k6x h ILE 72 Ca 0.05 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 2k6x h ILE 72 Cb 0.77 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2k6x h ILE 72 CO 0.06 0.07 0.21 0.45 0.00 0.00 0.00 178.15 178.94 2k6x h HIS 73 N 0.06 1.16 -0.06 1.37 3.86 -1.45 -2.23 115.15 117.85 2k6x h HIS 73 Ca 0.03 -0.12 0.01 0.00 -1.16 0.00 0.00 60.37 59.13 2k6x h HIS 73 Cb 0.07 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.20 2k6x h HIS 73 CO -0.05 0.92 0.00 0.93 0.86 0.00 0.00 177.93 180.60 2k6x h GLU 74 N 1.07 0.02 -0.33 2.45 5.08 -1.15 -2.41 114.58 119.31 2k6x h GLU 74 Ca 0.23 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.68 2k6x h GLU 74 Cb 0.32 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2k6x h GLU 74 CO -0.00 0.02 0.24 0.93 -1.00 0.00 0.00 179.01 179.20 2k6x h GLU 75 N 0.03 0.00 -0.06 2.33 4.39 -0.65 0.71 114.58 121.33 2k6x h GLU 75 Ca 0.03 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.74 2k6x h GLU 75 Cb 0.03 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2k6x h GLU 75 CO -0.05 0.00 -0.02 -0.07 -1.16 0.00 0.00 179.01 177.71 2k6x h LEU 76 N 0.00 -0.07 0.04 1.33 3.38 -0.88 0.46 115.31 119.56 2k6x h LEU 76 Ca 0.16 0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.98 2k6x h LEU 76 Cb 0.64 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2k6x h LEU 76 CO -0.00 -0.03 -0.86 -0.08 0.09 0.00 0.00 178.44 177.56 2k6x h GLU 77 N -0.01 0.08 -0.19 1.13 4.81 -1.24 -2.52 114.58 116.64 2k6x h GLU 77 Ca 0.03 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 59.05 2k6x h GLU 77 Cb 0.06 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 2k6x h GLU 77 CO -0.07 1.06 -0.18 -0.22 -0.73 0.00 0.00 179.01 178.88 2k6x h LYS 78 N -0.78 0.46 0.00 1.92 3.64 0.30 -3.33 116.57 118.78 2k6x h LYS 78 Ca -0.21 -0.24 -0.37 0.00 -1.27 0.00 0.00 60.65 58.56 2k6x h LYS 78 Cb 1.34 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 33.10 2k6x h LYS 78 CO -0.05 0.81 -2.34 0.72 -2.27 0.00 0.00 179.45 176.32 2k6x n HIS 79 N -4.47 0.11 -0.19 1.91 8.25 0.10 -5.00 115.22 115.93 2k6x n HIS 79 Ca -0.05 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2k6x n HIS 79 Cb 0.39 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.48 2k6x n HIS 79 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k6x n GLY 80 N 1.81 1.08 3.78 -1.41 0.00 0.14 -5.00 105.19 105.59 2k6x n GLY 80 Ca -0.34 -0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 2k6x n GLY 80 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k6x s ILE 81 N -2.00 3.54 -0.11 -0.61 2.07 -0.70 -4.94 121.20 118.44 2k6x s ILE 81 Ca 0.00 1.20 0.02 0.00 -1.41 0.00 0.00 60.65 60.46 2k6x s ILE 81 Cb 0.00 -3.63 -0.01 0.00 0.13 0.00 0.00 42.46 38.95 2k6x s ILE 81 CO 0.00 0.03 -0.18 0.20 -1.91 0.00 0.00 174.94 173.08 2k6x s ASN 82 N -1.45 3.60 -0.29 4.50 0.02 -1.26 -4.25 114.94 115.81 2k6x s ASN 82 Ca 0.58 -0.43 -0.19 0.00 -1.02 0.00 0.00 52.86 51.80 2k6x s ASN 82 Cb -0.25 -1.49 0.13 0.00 0.02 0.00 0.00 41.25 39.66 2k6x s ASN 82 CO 0.31 0.17 0.99 -0.51 0.02 0.00 0.00 177.10 178.07 2k6x s ILE 83 N 0.31 0.00 0.22 0.60 1.10 -1.26 -4.94 121.20 117.23 2k6x s ILE 83 Ca -0.14 0.00 -0.08 0.00 -0.51 0.00 0.00 60.65 59.92 2k6x s ILE 83 Cb -0.17 -1.00 -0.07 0.00 0.15 0.00 0.00 42.46 41.38 2k6x s ILE 83 CO 0.07 0.00 0.51 0.54 -2.11 0.00 0.00 174.94 173.95 2k6x s VAL 84 N 0.93 4.99 -0.12 4.00 0.11 0.19 -4.91 120.40 125.60 2k6x s VAL 84 Ca -0.04 0.34 0.20 0.00 -2.93 0.00 0.00 61.98 59.55 2k6x s VAL 84 Cb -0.04 -3.63 -0.22 0.00 -1.53 0.00 0.00 36.38 30.96 2k6x s VAL 84 CO -0.12 -0.07 0.57 -0.62 -3.33 0.00 0.00 175.10 171.52 2k6x n GLU 85 N -0.17 0.65 -0.96 1.54 1.02 -1.26 -0.42 120.64 121.04 2k6x n GLU 85 Ca -0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2k6x n GLU 85 Cb 0.52 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2k6x n GLU 85 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2k6x n ASN 86 N -2.56 -1.83 -4.62 1.62 5.15 -1.26 -4.24 115.26 107.52 2k6x n ASN 86 Ca -0.10 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.53 2k6x n ASN 86 Cb 0.74 -0.76 -0.10 0.00 -0.53 0.00 0.00 39.78 39.13 2k6x n ASN 86 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2k6x s GLU 87 N -0.27 3.96 0.18 1.20 2.12 -1.26 -5.10 118.70 119.52 2k6x s GLU 87 Ca 0.00 -0.35 -0.17 0.00 0.36 0.00 0.00 54.97 54.81 2k6x s GLU 87 Cb 0.00 -3.25 -0.07 0.00 0.26 0.00 0.00 34.13 31.06 2k6x s GLU 87 CO 0.00 0.22 0.63 -1.25 -0.54 0.00 0.00 175.26 174.31 2k6x s PRO 88 N 0.54 4.11 0.00 4.30 0.04 -1.26 -4.98 135.00 137.75 2k6x s PRO 88 Ca 0.04 0.68 0.17 0.00 0.04 0.00 0.00 61.00 61.92 2k6x s PRO 88 Cb -0.13 -2.92 -0.17 0.00 0.04 0.00 0.00 34.50 31.32 2k6x s PRO 88 CO 0.01 0.45 0.73 -0.85 0.04 0.00 0.00 177.00 177.38 2k6x n GLU 89 N 0.81 1.45 -0.03 4.56 0.28 -1.26 -4.64 120.64 121.81 2k6x n GLU 89 Ca -0.04 -0.08 -0.01 0.00 -0.16 0.00 0.00 57.16 56.86 2k6x n GLU 89 Cb 0.51 -1.30 -0.00 0.00 1.43 0.00 0.00 31.44 32.08 2k6x n GLU 89 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2k6x h GLU 90 N 0.19 0.00 -4.22 3.44 4.11 -2.03 -3.41 114.58 112.65 2k6x h GLU 90 Ca 0.00 0.00 -0.72 0.00 0.07 0.00 0.00 59.36 58.71 2k6x h GLU 90 Cb 0.42 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.58 2k6x h GLU 90 CO 0.00 0.00 2.56 -1.91 0.07 0.00 0.00 179.01 179.73 2k6x n GLU 91 N -3.56 3.15 0.20 1.06 2.13 -1.26 -3.22 120.64 119.15 2k6x n GLU 91 Ca -0.02 -3.05 0.00 0.00 0.66 0.00 0.00 57.16 54.75 2k6x n GLU 91 Cb 0.07 -3.21 0.00 0.00 0.27 0.00 0.00 31.44 28.57 2k6x n GLU 91 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2k6x n GLU 92 N 5.84 0.00 -0.00 5.31 4.07 -1.26 -4.90 120.64 129.69 2k6x n GLU 92 Ca 0.47 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 57.40 2k6x n GLU 92 Cb 0.40 0.00 -0.10 0.00 -0.06 0.00 0.00 31.44 31.68 2k6x n GLU 92 CO 0.00 0.00 0.00 0.97 -0.06 0.00 0.00 177.13 178.04 2k6x h ILE 93 N 0.00 1.38 -6.22 6.31 2.10 -1.81 -3.48 117.51 115.78 2k6x h ILE 93 Ca 0.00 -2.01 -0.37 0.00 1.08 0.00 0.00 64.86 63.56 2k6x h ILE 93 Cb 0.00 2.39 0.05 0.00 -1.09 0.00 0.00 36.82 38.16 2k6x h ILE 93 CO 0.00 0.60 -0.80 -1.20 -1.08 0.00 0.00 178.15 175.67 2k6x n SER 94 N -4.15 -5.64 -4.64 2.19 7.64 -1.20 -5.00 113.62 102.82 2k6x n SER 94 Ca -0.09 -0.84 -0.24 0.00 1.01 0.00 0.00 58.87 58.71 2k6x n SER 94 Cb 0.68 -3.25 -0.08 0.00 -1.01 0.00 0.00 64.21 60.55 2k6x n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k6x s ALA 95 N -3.26 3.14 -0.74 -0.43 0.00 -1.26 -5.15 121.76 114.06 2k6x s ALA 95 Ca 0.27 -1.59 0.06 0.00 0.00 0.00 0.00 51.96 50.70 2k6x s ALA 95 Cb -0.10 -0.79 0.05 0.00 0.00 0.00 0.00 23.12 22.27 2k6x s ALA 95 CO 0.85 0.32 0.69 0.41 0.00 0.00 0.00 175.76 178.03