#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6x n SER 26 N 0.00 1.05 -3.09 1.61 3.41 -1.26 -4.98 113.62 110.36 2k6x n SER 26 Ca 0.00 -0.02 -0.02 0.00 -0.26 0.00 0.00 58.87 58.57 2k6x n SER 26 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 2k6x n SER 26 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2k6x n HIS 27 N 0.00 -2.91 -3.51 7.33 -0.00 -1.26 -5.00 115.22 109.87 2k6x n HIS 27 Ca 0.00 1.10 -0.27 0.00 -0.00 0.00 0.00 57.72 58.55 2k6x n HIS 27 Cb 0.00 -4.12 -0.10 0.00 -0.00 0.00 0.00 29.99 25.77 2k6x n HIS 27 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2k6x n MET 28 N -1.99 1.17 0.24 1.57 2.00 -1.26 -4.91 117.12 113.94 2k6x n MET 28 Ca -0.01 -3.82 0.10 0.00 0.00 0.00 0.00 57.70 53.97 2k6x n MET 28 Cb 0.52 -1.86 0.57 0.00 0.00 0.00 0.00 33.22 32.44 2k6x n MET 28 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 2k6x h PRO 29 N 5.00 0.00 0.00 0.03 0.11 -2.02 -2.64 132.00 132.48 2k6x h PRO 29 Ca 0.18 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.26 2k6x h PRO 29 Cb 0.82 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 2k6x h PRO 29 CO 0.57 0.20 -0.16 -0.56 -0.21 0.00 0.00 178.00 177.84 2k6x h GLN 30 N 0.00 0.00 -0.01 1.05 3.07 -2.00 -2.48 115.11 114.74 2k6x h GLN 30 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 2k6x h GLN 30 Cb 0.55 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.11 2k6x h GLN 30 CO 0.03 0.16 0.00 0.82 0.09 0.00 0.00 178.83 179.93 2k6x h ILE 31 N 0.00 1.21 -0.49 1.86 1.08 -1.89 -0.05 117.51 119.23 2k6x h ILE 31 Ca -0.00 -0.61 0.06 0.00 -0.39 0.00 0.00 64.86 63.92 2k6x h ILE 31 Cb 0.43 1.61 -0.05 0.00 -3.07 0.00 0.00 36.82 35.74 2k6x h ILE 31 CO 0.02 0.16 0.19 -0.33 -0.69 0.00 0.00 178.15 177.50 2k6x h GLU 32 N -0.24 0.36 -0.30 2.37 5.08 -1.57 -0.52 114.58 119.76 2k6x h GLU 32 Ca 0.00 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 2k6x h GLU 32 Cb 0.26 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2k6x h GLU 32 CO 0.00 0.24 -0.08 0.00 -1.00 0.00 0.00 179.01 178.17 2k6x h ARG 33 N 0.37 0.59 -0.71 2.33 2.47 -1.49 -3.10 114.38 114.84 2k6x h ARG 33 Ca 0.23 -0.23 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 2k6x h ARG 33 Cb 0.23 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.48 2k6x h ARG 33 CO -0.22 0.78 0.36 -0.09 0.56 0.00 0.00 179.97 181.36 2k6x h ARG 34 N 0.35 1.00 -0.38 0.04 2.43 -0.39 -0.45 114.38 116.98 2k6x h ARG 34 Ca 0.07 -0.12 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2k6x h ARG 34 Cb 0.57 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 2k6x h ARG 34 CO 0.03 0.76 0.24 0.82 -1.51 0.00 0.00 179.97 180.31 2k6x h ILE 35 N 1.00 1.09 -0.41 1.20 2.04 -1.04 0.23 117.51 121.62 2k6x h ILE 35 Ca 0.25 -0.17 -0.10 0.00 1.00 0.00 0.00 64.86 65.84 2k6x h ILE 35 Cb 0.07 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2k6x h ILE 35 CO -0.04 0.09 -0.16 0.11 0.00 0.00 0.00 178.15 178.15 2k6x h LYS 36 N 0.50 0.77 -0.77 2.37 1.79 -1.33 -2.08 116.57 117.83 2k6x h LYS 36 Ca 0.14 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 58.30 2k6x h LYS 36 Cb -0.05 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.52 2k6x h LYS 36 CO -0.04 0.88 0.36 0.87 -1.08 0.00 0.00 179.45 180.44 2k6x h LYS 37 N 0.69 1.11 -0.29 3.15 1.57 -0.56 -0.41 116.57 121.84 2k6x h LYS 37 Ca 0.11 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2k6x h LYS 37 Cb 0.65 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 2k6x h LYS 37 CO 0.05 0.88 0.06 -0.07 -0.57 0.00 0.00 179.45 179.79 2k6x h LEU 38 N 1.09 0.45 -0.96 2.94 3.38 -0.05 0.26 115.31 122.43 2k6x h LEU 38 Ca 0.26 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2k6x h LEU 38 Cb 0.14 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2k6x h LEU 38 CO -0.03 0.58 -0.16 0.40 0.09 0.00 0.00 178.44 179.33 2k6x h ILE 39 N 0.30 1.25 -0.50 1.22 5.03 -1.32 -2.56 117.51 120.93 2k6x h ILE 39 Ca 0.09 -1.14 -0.07 0.00 -0.12 0.00 0.00 64.86 63.62 2k6x h ILE 39 Cb 0.32 1.17 -0.02 0.00 -3.03 0.00 0.00 36.82 35.26 2k6x h ILE 39 CO 0.00 0.37 0.02 -1.28 -0.68 0.00 0.00 178.15 176.59 2k6x h SER 40 N 0.53 0.85 -0.69 1.72 0.87 -0.43 -0.96 113.55 115.43 2k6x h SER 40 Ca 0.09 -0.30 0.01 0.00 -1.23 0.00 0.00 61.79 60.36 2k6x h SER 40 Cb 0.58 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 2k6x h SER 40 CO 0.04 0.93 0.45 -0.07 -0.53 0.00 0.00 176.83 177.65 2k6x h LEU 41 N 0.73 0.80 -0.96 2.23 3.38 -0.28 0.28 115.31 121.48 2k6x h LEU 41 Ca 0.14 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2k6x h LEU 41 Cb 0.49 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2k6x h LEU 41 CO 0.02 0.58 -0.16 1.23 0.09 0.00 0.00 178.44 180.20 2k6x h GLY 42 N 0.93 0.61 1.38 0.83 0.00 -1.19 0.31 103.07 105.95 2k6x h GLY 42 Ca 0.25 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 2k6x h GLY 42 CO -0.05 0.42 -0.15 1.70 0.00 0.00 0.00 176.54 178.46 2k6x h LYS 43 N 0.51 0.73 -0.40 4.80 3.11 -0.17 0.23 116.57 125.39 2k6x h LYS 43 Ca 0.09 -0.25 -0.13 0.00 -2.81 0.00 0.00 60.65 57.55 2k6x h LYS 43 Cb 0.58 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.74 2k6x h LYS 43 CO 0.04 0.84 -0.25 0.87 -2.81 0.00 0.00 179.45 178.14 2k6x h LYS 44 N 0.65 0.88 -0.07 1.90 6.56 0.20 -3.19 116.57 123.50 2k6x h LYS 44 Ca 0.11 -0.41 -0.10 0.00 -1.06 0.00 0.00 60.65 59.19 2k6x h LYS 44 Cb 0.62 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.25 2k6x h LYS 44 CO 0.04 1.05 -0.42 0.87 -2.06 0.00 0.00 179.45 178.93 2k6x h LYS 45 N 0.69 0.15 0.00 3.15 1.79 0.16 -3.48 116.57 119.04 2k6x h LYS 45 Ca 0.08 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2k6x h LYS 45 Cb 0.82 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2k6x h LYS 45 CO 0.07 0.55 0.00 0.41 -1.08 0.00 0.00 179.45 179.40 2k6x n GLY 46 N -0.21 1.64 3.37 3.86 0.00 0.77 -5.07 105.19 109.55 2k6x n GLY 46 Ca -0.02 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 2.34 -1.07 1.61 2.02 -0.84 -4.79 117.35 116.61 2k6x s TYR 47 Ca 0.00 -0.39 -0.19 0.00 -0.37 0.00 0.00 57.07 56.12 2k6x s TYR 47 Cb 0.00 -1.34 0.10 0.00 -0.40 0.00 0.00 41.96 40.33 2k6x s TYR 47 CO 0.00 0.23 1.39 0.96 -1.57 0.00 0.00 175.55 176.55 2k6x s ILE 48 N -0.92 4.44 0.01 2.71 -5.25 -1.26 -3.89 121.20 117.03 2k6x s ILE 48 Ca 0.13 -1.59 -0.03 0.00 -0.99 0.00 0.00 60.65 58.18 2k6x s ILE 48 Cb -0.10 -4.96 -0.01 0.00 2.95 0.00 0.00 42.46 40.34 2k6x s ILE 48 CO 0.04 -1.75 0.04 -0.89 -1.79 0.00 0.00 174.94 170.59 2k6x s THR 49 N 3.43 0.08 0.23 8.37 2.01 -1.26 0.52 115.64 129.03 2k6x s THR 49 Ca 0.42 -0.67 -0.06 0.00 0.31 0.00 0.00 61.69 61.69 2k6x s THR 49 Cb -0.01 -0.28 0.20 0.00 0.01 0.00 0.00 72.50 72.41 2k6x s THR 49 CO -0.05 -0.37 1.84 0.22 -0.69 0.00 0.00 174.62 175.58 2k6x h TYR 50 N 4.80 0.92 -0.10 4.92 3.20 -1.08 -0.70 116.97 128.94 2k6x h TYR 50 Ca -0.30 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.47 2k6x h TYR 50 Cb 1.20 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 2k6x h TYR 50 CO 0.59 0.46 -0.48 0.93 -1.64 0.00 0.00 178.16 178.03 2k6x h GLU 51 N 0.91 0.25 0.00 1.82 5.08 -1.85 -2.84 114.58 117.95 2k6x h GLU 51 Ca 0.36 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.50 2k6x h GLU 51 Cb 0.17 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2k6x h GLU 51 CO -0.17 0.68 -0.39 -0.44 -1.00 0.00 0.00 179.01 177.69 2k6x h ASP 52 N 0.20 0.00 -0.39 1.42 5.19 -1.54 0.04 116.42 121.34 2k6x h ASP 52 Ca 0.01 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.37 2k6x h ASP 52 Cb 0.92 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.42 2k6x h ASP 52 CO 0.07 0.39 0.03 0.40 -3.12 0.00 0.00 179.24 177.02 2k6x h ILE 53 N 0.00 1.25 -0.96 0.35 2.04 -1.00 -0.86 117.51 118.33 2k6x h ILE 53 Ca -0.00 -0.93 0.07 0.00 1.00 0.00 0.00 64.86 64.99 2k6x h ILE 53 Cb 0.71 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.83 2k6x h ILE 53 CO 0.05 0.32 0.62 0.44 0.00 0.00 0.00 178.15 179.58 2k6x h ASP 54 N 0.50 0.98 1.36 1.72 3.32 -1.09 -0.47 116.42 122.74 2k6x h ASP 54 Ca 0.11 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2k6x h ASP 54 Cb 0.42 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2k6x h ASP 54 CO 0.01 0.63 0.00 0.07 -1.72 0.00 0.00 179.24 178.23 2k6x h LYS 55 N 1.11 0.00 0.00 3.56 5.09 -0.84 -2.68 116.57 122.81 2k6x h LYS 55 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.15 2k6x h LYS 55 Cb 0.18 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.51 2k6x h LYS 55 CO -0.16 0.00 0.00 0.00 -2.09 0.00 0.00 179.45 177.20 2k6x h ALA 56 N 2.40 1.00 -1.93 0.07 0.00 0.39 -3.46 119.26 117.74 2k6x h ALA 56 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2k6x h ALA 56 Cb 0.68 0.00 0.09 0.00 0.00 0.00 0.00 17.79 18.56 2k6x h ALA 56 CO 0.00 0.00 0.30 0.34 0.00 0.00 0.00 179.25 179.89 2k6x n PHE 57 N -2.85 1.46 -2.50 0.00 -0.00 -1.01 -4.04 117.46 108.51 2k6x n PHE 57 Ca 0.03 0.64 -0.41 0.00 -0.00 0.00 0.00 57.45 57.71 2k6x n PHE 57 Cb 0.40 -2.31 -0.04 0.00 -0.00 0.00 0.00 39.48 37.53 2k6x n PHE 57 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 2k6x s PRO 58 N -0.70 4.62 0.00 -7.13 0.04 -1.26 -5.10 135.00 125.47 2k6x s PRO 58 Ca 0.68 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.48 2k6x s PRO 58 Cb -0.77 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 30.53 2k6x s PRO 58 CO 0.54 0.14 0.00 -0.35 0.04 0.00 0.00 177.00 177.37 2k6x n PRO 59 N 1.84 1.87 -0.51 0.56 -0.05 -1.26 -5.00 135.00 132.44 2k6x n PRO 59 Ca 0.01 0.00 0.09 0.00 -0.05 0.00 0.00 63.50 63.55 2k6x n PRO 59 Cb 0.45 0.00 0.31 0.00 -0.05 0.00 0.00 33.50 34.22 2k6x n PRO 59 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 2k6x n ASP 60 N -1.58 4.14 -4.66 3.54 2.03 -1.26 -4.96 116.55 113.80 2k6x n ASP 60 Ca 0.00 -2.32 -0.42 0.00 0.52 0.00 0.00 54.79 52.57 2k6x n ASP 60 Cb 0.00 -0.52 -0.03 0.00 -0.72 0.00 0.00 41.12 39.85 2k6x n ASP 60 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2k6x s PHE 61 N -1.69 1.69 -0.30 -0.67 -0.71 -1.26 -4.86 117.98 110.19 2k6x s PHE 61 Ca 0.45 -0.12 0.19 0.00 -1.04 0.00 0.00 56.93 56.42 2k6x s PHE 61 Cb 0.28 -4.09 0.19 0.00 -1.21 0.00 0.00 43.02 38.19 2k6x s PHE 61 CO 0.23 -4.73 1.48 0.93 -1.34 0.00 0.00 175.22 171.80 2k6x h GLU 62 N 9.88 0.00 -2.19 1.99 3.07 -1.93 -3.46 114.58 121.93 2k6x h GLU 62 Ca -0.45 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.34 2k6x h GLU 62 Cb 1.21 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 28.92 2k6x h GLU 62 CO 0.94 0.22 0.08 0.20 -1.40 0.00 0.00 179.01 179.06 2k6x s GLY 63 N -4.34 -0.50 -0.27 -3.84 0.00 -1.26 -5.13 107.32 91.98 2k6x s GLY 63 Ca 0.05 1.34 -0.10 0.00 0.00 0.00 0.00 44.72 46.01 2k6x s GLY 63 CO 0.71 1.04 0.17 -0.12 0.00 0.00 0.00 173.10 174.90 2k6x s PHE 64 N -0.74 3.21 -0.03 1.90 5.36 -1.26 -5.07 117.98 121.35 2k6x s PHE 64 Ca -0.08 0.05 0.01 0.00 -0.96 0.00 0.00 56.93 55.95 2k6x s PHE 64 Cb -0.02 -2.34 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 2k6x s PHE 64 CO 0.06 -0.17 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.10 2k6x s ASP 65 N 1.66 0.86 0.40 6.13 1.01 -1.26 -5.00 116.67 120.47 2k6x s ASP 65 Ca 0.07 -0.12 0.10 0.00 0.71 0.00 0.00 52.55 53.31 2k6x s ASP 65 Cb -0.16 -0.34 0.83 0.00 1.01 0.00 0.00 42.92 44.26 2k6x s ASP 65 CO 0.09 -0.02 1.94 0.74 0.21 0.00 0.00 175.17 178.14 2k6x h THR 66 N 5.83 1.16 -0.75 -1.27 2.02 -2.01 -1.87 112.91 116.03 2k6x h THR 66 Ca -0.36 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.09 2k6x h THR 66 Cb 1.16 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.70 2k6x h THR 66 CO 0.48 0.22 0.35 0.78 0.37 0.00 0.00 175.52 177.72 2k6x h ASN 67 N 0.22 0.98 -0.91 4.18 4.21 -2.00 -2.57 115.58 119.69 2k6x h ASN 67 Ca 0.05 -0.12 0.02 0.00 1.21 0.00 0.00 56.30 57.46 2k6x h ASN 67 Cb 0.32 -0.25 -0.05 0.00 -1.12 0.00 0.00 38.32 37.23 2k6x h ASN 67 CO 0.02 0.83 0.60 0.25 -1.29 0.00 0.00 177.43 177.84 2k6x h LEU 68 N 1.07 1.03 -0.33 1.61 5.85 -1.75 0.21 115.31 123.01 2k6x h LEU 68 Ca 0.26 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2k6x h LEU 68 Cb 0.12 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2k6x h LEU 68 CO -0.03 0.74 0.19 0.40 -0.34 0.00 0.00 178.44 179.40 2k6x h ILE 69 N 1.21 1.12 -0.15 4.05 1.08 -1.33 0.53 117.51 124.02 2k6x h ILE 69 Ca 0.34 -0.29 -0.14 0.00 -0.39 0.00 0.00 64.86 64.38 2k6x h ILE 69 Cb -0.10 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.36 2k6x h ILE 69 CO -0.08 0.12 -0.50 1.05 -0.69 0.00 0.00 178.15 178.04 2k6x h GLU 70 N 0.42 0.42 -0.09 2.37 4.11 -1.39 -3.09 114.58 117.32 2k6x h GLU 70 Ca 0.12 -0.24 -0.13 0.00 0.07 0.00 0.00 59.36 59.18 2k6x h GLU 70 Cb 0.02 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2k6x h GLU 70 CO -0.02 0.83 -0.50 0.00 0.07 0.00 0.00 179.01 179.38 2k6x h ARG 71 N 0.33 0.24 -0.04 1.06 2.47 0.14 -1.33 114.38 117.25 2k6x h ARG 71 Ca 0.01 -0.14 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 2k6x h ARG 71 Cb 1.00 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.33 2k6x h ARG 71 CO 0.09 0.69 0.02 0.82 0.56 0.00 0.00 179.97 182.15 2k6x h ILE 72 N 0.19 1.08 -0.26 2.04 2.04 0.08 -1.55 117.51 121.13 2k6x h ILE 72 Ca 0.01 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 2k6x h ILE 72 Cb 0.96 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 2k6x h ILE 72 CO 0.08 0.06 -0.26 0.45 0.00 0.00 0.00 178.15 178.49 2k6x h HIS 73 N -0.03 0.57 -0.06 1.37 3.86 -1.42 0.23 115.15 119.67 2k6x h HIS 73 Ca 0.01 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 2k6x h HIS 73 Cb 0.09 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 2k6x h HIS 73 CO -0.05 0.72 -0.02 1.05 0.86 0.00 0.00 177.93 180.50 2k6x h GLU 74 N 0.45 0.12 -0.13 2.45 -0.00 -1.20 -2.42 114.58 113.84 2k6x h GLU 74 Ca 0.06 -0.05 0.04 0.00 -0.00 0.00 0.00 59.36 59.42 2k6x h GLU 74 Cb 0.69 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.42 2k6x h GLU 74 CO 0.05 0.46 0.10 0.93 -0.00 0.00 0.00 179.01 180.55 2k6x h GLU 75 N -0.24 0.00 -0.58 1.06 4.39 -1.13 0.27 114.58 118.35 2k6x h GLU 75 Ca 0.01 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.76 2k6x h GLU 75 Cb 0.42 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.03 2k6x h GLU 75 CO 0.01 0.00 0.32 1.25 -1.16 0.00 0.00 179.01 179.43 2k6x h LEU 76 N 0.00 0.49 0.00 1.33 5.85 -0.17 0.15 115.31 122.97 2k6x h LEU 76 Ca 0.06 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 2k6x h LEU 76 Cb 0.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 2k6x h LEU 76 CO -0.00 0.34 -0.43 -0.08 -0.34 0.00 0.00 178.44 177.92 2k6x h GLU 77 N 0.62 0.00 -0.18 1.25 4.57 -0.34 -1.96 114.58 118.54 2k6x h GLU 77 Ca 0.25 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.21 2k6x h GLU 77 Cb 0.11 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2k6x h GLU 77 CO -0.14 0.73 -0.72 1.57 -1.18 0.00 0.00 179.01 179.27 2k6x h LYS 78 N -1.00 0.81 0.00 1.92 2.10 -0.69 -3.29 116.57 116.42 2k6x h LYS 78 Ca -0.10 -0.62 -0.22 0.00 -2.00 0.00 0.00 60.65 57.70 2k6x h LYS 78 Cb 0.88 0.12 -0.04 0.00 -0.90 0.00 0.00 32.23 32.29 2k6x h LYS 78 CO -0.06 1.23 -1.73 1.58 -2.00 0.00 0.00 179.45 178.47 2k6x n HIS 79 N -3.95 0.70 -0.38 0.07 -0.00 0.29 -5.00 115.22 106.95 2k6x n HIS 79 Ca -0.07 0.24 0.00 0.00 0.46 0.00 0.00 57.72 58.35 2k6x n HIS 79 Cb 0.72 -1.04 0.00 0.00 -0.12 0.00 0.00 29.99 29.55 2k6x n HIS 79 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2k6x n GLY 80 N 1.49 1.04 3.68 1.57 0.00 0.18 -4.98 105.19 108.17 2k6x n GLY 80 Ca -0.15 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 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 4.15 -0.28 -0.61 2.07 -1.06 -4.95 121.20 118.52 2k6x s ILE 81 Ca 0.00 1.46 -0.27 0.00 -1.41 0.00 0.00 60.65 60.43 2k6x s ILE 81 Cb 0.00 -3.94 0.01 0.00 0.13 0.00 0.00 42.46 38.66 2k6x s ILE 81 CO 0.00 -0.04 0.95 0.20 -1.91 0.00 0.00 174.94 174.14 2k6x s ASN 82 N 1.75 6.90 -0.23 4.50 0.02 -1.26 -4.54 114.94 122.08 2k6x s ASN 82 Ca 0.57 1.05 -0.19 0.00 -1.02 0.00 0.00 52.86 53.27 2k6x s ASN 82 Cb -0.25 -2.49 0.06 0.00 0.02 0.00 0.00 41.25 38.59 2k6x s ASN 82 CO 0.21 -0.69 0.61 -0.51 0.02 0.00 0.00 177.10 176.73 2k6x s ILE 83 N 3.21 -0.00 0.13 0.60 1.10 -1.26 -4.89 121.20 120.08 2k6x s ILE 83 Ca 0.40 0.01 0.05 0.00 -0.51 0.00 0.00 60.65 60.60 2k6x s ILE 83 Cb -0.14 -0.85 -0.04 0.00 0.15 0.00 0.00 42.46 41.58 2k6x s ILE 83 CO 0.11 0.00 0.04 0.54 -2.11 0.00 0.00 174.94 173.52 2k6x s VAL 84 N 0.62 4.12 -0.12 4.00 0.11 0.18 -4.94 120.40 124.37 2k6x s VAL 84 Ca -0.02 -1.08 0.16 0.00 -2.93 0.00 0.00 61.98 58.10 2k6x s VAL 84 Cb -0.05 -3.03 -0.11 0.00 -1.53 0.00 0.00 36.38 31.67 2k6x s VAL 84 CO -0.04 0.01 0.93 -0.33 -3.33 0.00 0.00 175.10 172.35 2k6x h GLU 85 N 3.01 0.00 0.00 1.54 4.39 -1.95 0.84 114.58 122.41 2k6x h GLU 85 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 2k6x h GLU 85 Cb 1.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2k6x h GLU 85 CO 0.61 0.35 0.00 -1.71 -1.16 0.00 0.00 179.01 177.10 2k6x n ASN 86 N -2.96 0.00 -4.72 1.42 5.15 -1.26 -4.61 115.26 108.28 2k6x n ASN 86 Ca -0.08 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.49 2k6x n ASN 86 Cb 0.83 -0.15 -0.04 0.00 -0.53 0.00 0.00 39.78 39.89 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 0.00 4.53 -0.90 1.20 2.56 -1.26 -4.95 118.70 119.88 2k6x s GLU 87 Ca 0.00 1.25 -0.19 0.00 0.00 0.00 0.00 54.97 56.03 2k6x s GLU 87 Cb 0.00 -3.44 -0.12 0.00 2.00 0.00 0.00 34.13 32.57 2k6x s GLU 87 CO 0.00 0.02 2.00 -2.30 -0.56 0.00 0.00 175.26 174.42 2k6x n PRO 88 N 3.72 1.79 -0.36 4.30 -0.02 -1.26 -4.53 135.00 138.63 2k6x n PRO 88 Ca 0.03 -1.94 0.05 0.00 -2.02 0.00 0.00 63.50 59.62 2k6x n PRO 88 Cb 0.51 -2.94 0.20 0.00 -0.02 0.00 0.00 33.50 31.25 2k6x n PRO 88 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2k6x n GLU 89 N 6.60 2.60 -3.87 -0.52 -0.00 -1.26 -4.30 120.64 119.88 2k6x n GLU 89 Ca 0.50 -1.60 -0.28 0.00 -0.00 0.00 0.00 57.16 55.78 2k6x n GLU 89 Cb 0.38 -1.65 -0.12 0.00 -0.00 0.00 0.00 31.44 30.05 2k6x n GLU 89 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2k6x n GLU 90 N 0.49 1.82 -4.02 3.44 2.13 -1.26 -5.07 120.64 118.16 2k6x n GLU 90 Ca 0.14 -4.46 -0.08 0.00 0.66 0.00 0.00 57.16 53.42 2k6x n GLU 90 Cb 0.58 -2.27 -0.11 0.00 0.27 0.00 0.00 31.44 29.91 2k6x n GLU 90 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2k6x s GLU 91 N -1.47 0.45 0.00 5.31 -6.30 -1.26 -5.10 118.70 110.33 2k6x s GLU 91 Ca 0.26 -0.87 0.00 0.00 -2.50 0.00 0.00 54.97 51.86 2k6x s GLU 91 Cb -0.03 0.16 0.00 0.00 0.00 0.00 0.00 34.13 34.26 2k6x s GLU 91 CO -0.17 -0.08 0.00 0.39 0.02 0.00 0.00 175.26 175.42 2k6x n GLU 92 N 0.94 0.00 -0.36 4.30 1.02 -1.26 -4.97 120.64 120.31 2k6x n GLU 92 Ca -0.20 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.02 2k6x n GLU 92 Cb 0.58 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.24 2k6x n GLU 92 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 2k6x n ILE 93 N -0.91 1.43 -3.44 -3.67 3.06 -1.26 -4.96 119.36 109.61 2k6x n ILE 93 Ca 0.00 -1.20 -0.19 0.00 -2.50 0.00 0.00 62.75 58.85 2k6x n ILE 93 Cb 0.00 0.28 0.06 0.00 0.54 0.00 0.00 39.64 40.52 2k6x n ILE 93 CO 0.00 0.00 0.00 -1.20 -2.50 0.00 0.00 176.55 172.85 2k6x n SER 94 N 0.65 -4.50 -2.97 9.51 7.64 -1.26 -4.97 113.62 117.73 2k6x n SER 94 Ca 0.19 -0.76 -0.14 0.00 1.01 0.00 0.00 58.87 59.16 2k6x n SER 94 Cb 0.65 -4.69 0.02 0.00 -1.01 0.00 0.00 64.21 59.18 2k6x n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k6x n ALA 95 N -3.76 0.59 -0.26 -0.43 0.00 -1.26 -5.26 120.51 110.12 2k6x n ALA 95 Ca -0.16 -2.43 0.00 0.00 0.00 0.00 0.00 53.44 50.85 2k6x n ALA 95 Cb 0.64 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 19.03 2k6x n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91