#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 3.82 -4.67 1.61 7.64 -1.26 -4.92 113.62 115.84 2k6x n SER 26 Ca 0.00 -2.82 -0.42 0.00 1.01 0.00 0.00 58.87 56.64 2k6x n SER 26 Cb 0.00 -1.59 -0.04 0.00 -1.01 0.00 0.00 64.21 61.58 2k6x n SER 26 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2k6x s HIS 27 N 4.42 3.44 -0.52 1.43 2.46 -1.26 -5.01 115.29 120.25 2k6x s HIS 27 Ca 0.52 1.35 -0.05 0.00 0.47 0.00 0.00 55.06 57.35 2k6x s HIS 27 Cb 0.10 -3.07 0.14 0.00 -0.13 0.00 0.00 32.58 29.62 2k6x s HIS 27 CO 0.01 -0.25 0.36 -1.64 -2.47 0.00 0.00 174.74 170.75 2k6x s MET 28 N 2.16 2.42 0.46 2.88 1.00 -1.26 -4.95 119.30 122.00 2k6x s MET 28 Ca 0.41 -2.08 0.21 0.00 0.00 0.00 0.00 55.69 54.23 2k6x s MET 28 Cb -0.17 -3.78 1.20 0.00 0.00 0.00 0.00 34.83 32.07 2k6x s MET 28 CO 0.13 -1.15 1.89 -1.35 0.00 0.00 0.00 175.02 174.54 2k6x h PRO 29 N 7.81 0.27 0.00 2.03 0.11 -2.00 -0.68 132.00 139.55 2k6x h PRO 29 Ca -0.10 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.92 2k6x h PRO 29 Cb 1.02 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2k6x h PRO 29 CO 0.75 0.18 -0.37 -0.56 -0.21 0.00 0.00 178.00 177.79 2k6x h GLN 30 N 0.28 0.00 -0.14 1.05 -0.00 -1.98 0.11 115.11 114.43 2k6x h GLN 30 Ca 0.41 0.00 -0.06 0.00 -0.00 0.00 0.00 58.65 59.01 2k6x h GLN 30 Cb 1.19 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.67 2k6x h GLN 30 CO -0.11 0.37 -0.13 0.82 -0.00 0.00 0.00 178.83 179.77 2k6x h ILE 31 N 0.00 1.35 -0.42 1.86 1.08 -1.43 0.21 117.51 120.16 2k6x h ILE 31 Ca -0.00 -1.29 -0.01 0.00 -0.39 0.00 0.00 64.86 63.17 2k6x h ILE 31 Cb 1.02 1.89 -0.02 0.00 -3.07 0.00 0.00 36.82 36.64 2k6x h ILE 31 CO 0.05 0.38 0.22 -0.08 -0.69 0.00 0.00 178.15 178.02 2k6x h GLU 32 N -0.05 0.60 -0.61 2.37 4.81 -1.32 -1.20 114.58 119.17 2k6x h GLU 32 Ca 0.02 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2k6x h GLU 32 Cb 0.66 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2k6x h GLU 32 CO 0.03 0.49 0.33 0.00 -0.73 0.00 0.00 179.01 179.13 2k6x h ARG 33 N 0.55 0.86 -0.67 1.92 3.08 -0.79 -2.61 114.38 116.72 2k6x h ARG 33 Ca 0.15 -0.11 0.04 0.00 0.07 0.00 0.00 59.98 60.13 2k6x h ARG 33 Cb 0.08 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.93 2k6x h ARG 33 CO -0.02 0.67 0.44 -0.09 -1.07 0.00 0.00 179.97 179.90 2k6x h ARG 34 N 0.84 0.76 0.08 0.04 2.43 -0.03 0.29 114.38 118.78 2k6x h ARG 34 Ca 0.21 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.35 2k6x h ARG 34 Cb 0.06 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2k6x h ARG 34 CO -0.03 0.50 -0.10 0.82 -1.51 0.00 0.00 179.97 179.65 2k6x h ILE 35 N 0.78 0.76 -0.42 1.20 2.04 -0.84 0.56 117.51 121.61 2k6x h ILE 35 Ca 0.27 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.98 2k6x h ILE 35 Cb 0.10 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2k6x h ILE 35 CO -0.08 0.00 -0.33 0.11 0.00 0.00 0.00 178.15 177.86 2k6x h LYS 36 N -0.22 0.95 -0.86 2.37 6.56 -1.38 -2.19 116.57 121.80 2k6x h LYS 36 Ca 0.01 -0.47 0.03 0.00 -1.06 0.00 0.00 60.65 59.15 2k6x h LYS 36 Cb 0.22 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.83 2k6x h LYS 36 CO -0.04 1.13 0.57 0.87 -2.06 0.00 0.00 179.45 179.92 2k6x h LYS 37 N 0.79 1.08 -0.01 3.15 1.79 -0.15 0.34 116.57 123.55 2k6x h LYS 37 Ca 0.08 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2k6x h LYS 37 Cb 0.92 -0.24 -0.00 0.00 -1.58 0.00 0.00 32.23 31.33 2k6x h LYS 37 CO 0.09 0.71 0.00 -0.07 -1.08 0.00 0.00 179.45 179.10 2k6x h LEU 38 N 1.11 0.02 -1.28 2.94 3.38 0.31 0.34 115.31 122.13 2k6x h LEU 38 Ca 0.33 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2k6x h LEU 38 Cb -0.03 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2k6x h LEU 38 CO -0.09 0.28 0.11 0.40 0.09 0.00 0.00 178.44 179.24 2k6x h ILE 39 N -0.24 1.18 -0.11 1.22 5.03 -0.97 -1.36 117.51 122.26 2k6x h ILE 39 Ca 0.00 -0.63 -0.02 0.00 -0.12 0.00 0.00 64.86 64.10 2k6x h ILE 39 Cb 0.27 0.75 -0.00 0.00 -3.03 0.00 0.00 36.82 34.81 2k6x h ILE 39 CO 0.00 0.23 -0.02 0.28 -0.68 0.00 0.00 178.15 177.96 2k6x h SER 40 N 0.59 0.21 -0.94 1.72 0.02 -0.02 -2.38 113.55 112.76 2k6x h SER 40 Ca 0.14 -0.35 0.02 0.00 -0.84 0.00 0.00 61.79 60.76 2k6x h SER 40 Cb 0.21 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 2k6x h SER 40 CO -0.01 0.51 0.62 -0.07 -1.14 0.00 0.00 176.83 176.74 2k6x h LEU 41 N -0.09 1.05 -1.09 5.07 3.38 0.14 0.42 115.31 124.19 2k6x h LEU 41 Ca 0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2k6x h LEU 41 Cb 0.41 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2k6x h LEU 41 CO 0.01 0.74 -0.15 1.23 0.09 0.00 0.00 178.44 180.36 2k6x h GLY 42 N 1.23 0.50 2.00 0.83 0.00 -1.21 0.50 103.07 106.93 2k6x h GLY 42 Ca 0.35 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2k6x h GLY 42 CO -0.09 0.33 -0.58 1.70 0.00 0.00 0.00 176.54 177.90 2k6x h LYS 43 N 0.43 0.00 -0.01 4.80 1.63 -0.46 0.22 116.57 123.18 2k6x h LYS 43 Ca 0.08 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.77 2k6x h LYS 43 Cb 0.52 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2k6x h LYS 43 CO 0.03 0.58 -0.41 0.87 -3.45 0.00 0.00 179.45 177.07 2k6x h LYS 44 N 0.00 0.28 -0.18 1.90 6.56 -0.31 -3.34 116.57 121.48 2k6x h LYS 44 Ca -0.01 -0.30 -0.10 0.00 -1.06 0.00 0.00 60.65 59.18 2k6x h LYS 44 Cb 1.03 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.76 2k6x h LYS 44 CO 0.08 1.00 -0.34 0.87 -2.06 0.00 0.00 179.45 179.00 2k6x h LYS 45 N -0.31 0.37 0.00 3.15 1.79 0.34 -3.47 116.57 118.44 2k6x h LYS 45 Ca -0.05 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.26 2k6x h LYS 45 Cb 1.14 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2k6x h LYS 45 CO 0.08 0.66 0.00 0.41 -1.08 0.00 0.00 179.45 179.52 2k6x n GLY 46 N -0.27 -1.79 3.19 3.86 0.00 0.61 -5.07 105.19 105.73 2k6x n GLY 46 Ca -0.01 0.61 -0.09 0.00 0.00 0.00 0.00 46.02 46.53 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 0.65 -1.22 1.61 2.02 -0.21 -4.74 117.35 115.47 2k6x s TYR 47 Ca 0.00 -1.06 -0.14 0.00 -0.37 0.00 0.00 57.07 55.51 2k6x s TYR 47 Cb 0.00 -0.34 0.17 0.00 -0.40 0.00 0.00 41.96 41.39 2k6x s TYR 47 CO 0.00 -0.55 1.45 0.44 -1.57 0.00 0.00 175.55 175.33 2k6x n ILE 48 N -0.09 4.24 -4.05 2.71 -6.64 -1.26 -3.91 119.36 110.37 2k6x n ILE 48 Ca -0.08 -4.70 -0.09 0.00 -1.77 0.00 0.00 62.75 56.11 2k6x n ILE 48 Cb 0.63 -2.46 -0.11 0.00 -1.44 0.00 0.00 39.64 36.26 2k6x n ILE 48 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 2k6x s THR 49 N 1.67 0.27 0.29 7.28 -1.32 -1.26 0.21 115.64 122.78 2k6x s THR 49 Ca 0.43 -1.34 -0.01 0.00 -1.21 0.00 0.00 61.69 59.57 2k6x s THR 49 Cb -0.02 -0.87 0.28 0.00 -1.51 0.00 0.00 72.50 70.37 2k6x s THR 49 CO 0.01 -0.69 1.90 0.22 -2.21 0.00 0.00 174.62 173.85 2k6x h TYR 50 N 3.96 1.12 -0.27 9.09 3.20 -1.29 0.31 116.97 133.09 2k6x h TYR 50 Ca -0.34 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.45 2k6x h TYR 50 Cb 1.18 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 2k6x h TYR 50 CO 0.61 0.58 -0.31 0.93 -1.64 0.00 0.00 178.16 178.33 2k6x h GLU 51 N 1.10 0.56 -0.12 1.82 5.08 -1.83 -2.24 114.58 118.95 2k6x h GLU 51 Ca 0.41 -0.24 -0.15 0.00 -1.00 0.00 0.00 59.36 58.38 2k6x h GLU 51 Cb 0.19 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2k6x h GLU 51 CO -0.16 0.80 -0.58 0.22 -1.00 0.00 0.00 179.01 178.29 2k6x h ASP 52 N 0.48 0.44 -0.12 1.42 1.82 -1.31 -1.39 116.42 117.75 2k6x h ASP 52 Ca 0.06 -0.24 0.01 0.00 -0.39 0.00 0.00 57.03 56.47 2k6x h ASP 52 Cb 0.77 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.64 2k6x h ASP 52 CO 0.06 0.92 0.03 0.40 -1.61 0.00 0.00 179.24 179.05 2k6x h ILE 53 N 0.29 0.96 -0.27 2.25 1.08 -0.26 0.22 117.51 121.78 2k6x h ILE 53 Ca -0.00 -0.03 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 2k6x h ILE 53 Cb 1.10 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.70 2k6x h ILE 53 CO 0.10 0.02 0.12 -0.78 -0.69 0.00 0.00 178.15 176.92 2k6x h ASP 54 N 0.09 0.33 1.14 1.72 1.82 -1.27 -0.68 116.42 119.57 2k6x h ASP 54 Ca 0.05 -0.02 -0.09 0.00 -0.39 0.00 0.00 57.03 56.58 2k6x h ASP 54 Cb 0.04 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 39.95 2k6x h ASP 54 CO -0.06 0.29 -0.42 0.07 -1.61 0.00 0.00 179.24 177.51 2k6x h LYS 55 N 0.38 0.00 0.00 0.28 2.10 -0.36 -2.89 116.57 116.08 2k6x h LYS 55 Ca 0.10 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.70 2k6x h LYS 55 Cb 0.05 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.38 2k6x h LYS 55 CO -0.01 0.42 -0.24 0.00 -2.00 0.00 0.00 179.45 177.62 2k6x h ALA 56 N 1.58 0.98 -2.85 0.07 0.00 0.97 -3.44 119.26 116.57 2k6x h ALA 56 Ca -0.00 -0.22 -0.53 0.00 0.00 0.00 0.00 54.91 54.16 2k6x h ALA 56 Cb 1.11 -0.04 0.08 0.00 0.00 0.00 0.00 17.79 18.93 2k6x h ALA 56 CO 0.06 0.30 0.73 0.12 0.00 0.00 0.00 179.25 180.45 2k6x s PHE 57 N -3.56 2.89 0.17 0.00 5.36 -1.04 -3.60 117.98 118.20 2k6x s PHE 57 Ca 0.01 1.19 -0.30 0.00 -0.96 0.00 0.00 56.93 56.87 2k6x s PHE 57 Cb 0.10 -3.84 -0.07 0.00 -0.34 0.00 0.00 43.02 38.86 2k6x s PHE 57 CO 0.65 -2.53 0.95 -2.14 -1.46 0.00 0.00 175.22 170.69 2k6x s PRO 58 N -1.36 4.77 0.00 10.12 0.02 -1.26 -5.03 135.00 142.26 2k6x s PRO 58 Ca 0.54 1.47 0.00 0.00 0.02 0.00 0.00 61.00 63.03 2k6x s PRO 58 Cb -0.43 -3.33 0.00 0.00 0.02 0.00 0.00 34.50 30.76 2k6x s PRO 58 CO 0.52 0.36 0.00 -0.35 -0.33 0.00 0.00 177.00 177.21 2k6x n PRO 59 N 2.16 3.42 -0.68 5.54 -0.04 -1.24 -5.02 135.00 139.14 2k6x n PRO 59 Ca 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 2k6x n PRO 59 Cb 0.48 0.00 0.36 0.00 -0.04 0.00 0.00 33.50 34.30 2k6x n PRO 59 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2k6x n ASP 60 N 0.00 4.89 -4.67 3.54 5.75 -1.26 -4.99 116.55 119.81 2k6x n ASP 60 Ca 0.00 -2.57 -0.43 0.00 -0.01 0.00 0.00 54.79 51.77 2k6x n ASP 60 Cb 0.00 -0.61 -0.03 0.00 -1.03 0.00 0.00 41.12 39.45 2k6x n ASP 60 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 2k6x n PHE 61 N 0.93 2.50 0.33 2.11 -1.74 -1.26 -4.86 117.46 115.47 2k6x n PHE 61 Ca 0.25 -0.24 0.12 0.00 -0.56 0.00 0.00 57.45 57.02 2k6x n PHE 61 Cb 0.96 -2.76 0.22 0.00 1.52 0.00 0.00 39.48 39.42 2k6x n PHE 61 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 2k6x h GLU 62 N 9.77 0.00 -1.73 3.97 5.08 -1.94 -3.46 114.58 126.26 2k6x h GLU 62 Ca -0.49 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 57.92 2k6x h GLU 62 Cb 1.24 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.25 2k6x h GLU 62 CO 0.94 0.00 0.30 0.20 -1.00 0.00 0.00 179.01 179.45 2k6x s GLY 63 N -4.04 -0.28 -0.07 -3.84 0.00 -1.26 -5.11 107.32 92.72 2k6x s GLY 63 Ca 0.07 2.61 0.02 0.00 0.00 0.00 0.00 44.72 47.43 2k6x s GLY 63 CO 0.66 2.10 -0.12 -0.12 0.00 0.00 0.00 173.10 175.62 2k6x s PHE 64 N 0.77 2.79 0.03 1.90 5.36 -1.26 -4.79 117.98 122.78 2k6x s PHE 64 Ca -0.03 -0.16 -0.26 0.00 -0.96 0.00 0.00 56.93 55.53 2k6x s PHE 64 Cb -0.05 -1.69 0.06 0.00 -0.34 0.00 0.00 43.02 41.01 2k6x s PHE 64 CO -0.09 0.18 0.60 0.34 -1.46 0.00 0.00 175.22 174.79 2k6x s ASP 65 N -0.60 -0.55 0.53 6.13 -1.08 -1.26 -5.03 116.67 114.80 2k6x s ASP 65 Ca 0.09 0.36 0.26 0.00 -0.52 0.00 0.00 52.55 52.74 2k6x s ASP 65 Cb -0.11 0.53 1.50 0.00 -1.46 0.00 0.00 42.92 43.38 2k6x s ASP 65 CO 0.01 -0.72 2.12 0.00 0.52 0.00 0.00 175.17 177.10 2k6x h THR 66 N 2.72 0.63 -0.13 1.71 1.03 -2.02 -1.29 112.91 115.56 2k6x h THR 66 Ca -0.30 -0.38 -0.01 0.00 -0.01 0.00 0.00 66.41 65.71 2k6x h THR 66 Cb 1.20 1.24 -0.01 0.00 -1.07 0.00 0.00 68.15 69.52 2k6x h THR 66 CO 0.39 0.09 0.04 0.78 -0.01 0.00 0.00 175.52 176.81 2k6x h ASN 67 N 0.00 0.16 -0.97 0.00 -0.26 -2.00 -1.59 115.58 110.93 2k6x h ASN 67 Ca -0.00 -0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.76 2k6x h ASN 67 Cb 0.23 -0.04 -0.06 0.00 -1.06 0.00 0.00 38.32 37.40 2k6x h ASN 67 CO 0.01 0.16 0.63 0.25 -1.06 0.00 0.00 177.43 177.42 2k6x h LEU 68 N 0.18 1.06 -0.27 1.61 5.85 -1.62 0.29 115.31 122.40 2k6x h LEU 68 Ca 0.05 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2k6x h LEU 68 Cb 0.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2k6x h LEU 68 CO -0.00 0.73 0.09 0.40 -0.34 0.00 0.00 178.44 179.32 2k6x h ILE 69 N 1.23 1.19 -0.17 4.05 1.08 -1.40 0.29 117.51 123.78 2k6x h ILE 69 Ca 0.38 -0.61 -0.12 0.00 -0.39 0.00 0.00 64.86 64.12 2k6x h ILE 69 Cb -0.02 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 2k6x h ILE 69 CO -0.12 0.20 -0.42 1.05 -0.69 0.00 0.00 178.15 178.18 2k6x h GLU 70 N 0.28 0.40 -0.43 2.37 4.11 -1.44 -3.09 114.58 116.77 2k6x h GLU 70 Ca 0.09 -0.20 -0.12 0.00 0.07 0.00 0.00 59.36 59.20 2k6x h GLU 70 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2k6x h GLU 70 CO -0.00 0.75 -0.20 -0.09 0.07 0.00 0.00 179.01 179.54 2k6x h ARG 71 N 0.33 0.89 -0.47 1.06 9.65 0.22 -2.20 114.38 123.85 2k6x h ARG 71 Ca 0.03 -0.38 -0.00 0.00 -1.10 0.00 0.00 59.98 58.52 2k6x h ARG 71 Cb 0.88 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.41 2k6x h ARG 71 CO 0.07 1.03 0.29 0.82 2.80 0.00 0.00 179.97 184.98 2k6x h ILE 72 N 0.71 1.14 -0.65 1.20 2.04 -0.42 0.16 117.51 121.70 2k6x h ILE 72 Ca 0.10 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 2k6x h ILE 72 Cb 0.76 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 2k6x h ILE 72 CO 0.06 0.14 0.21 -0.74 0.00 0.00 0.00 178.15 177.82 2k6x h HIS 73 N 0.63 1.04 -0.16 1.37 -0.00 -1.45 -1.59 115.15 114.98 2k6x h HIS 73 Ca 0.17 -0.10 -0.13 0.00 -0.00 0.00 0.00 60.37 60.31 2k6x h HIS 73 Cb -0.02 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.08 2k6x h HIS 73 CO -0.03 0.84 -0.44 1.05 -0.00 0.00 0.00 177.93 179.35 2k6x h GLU 74 N 0.93 0.39 0.00 5.26 4.11 -1.13 -1.91 114.58 122.23 2k6x h GLU 74 Ca 0.21 -0.20 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 2k6x h GLU 74 Cb 0.29 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2k6x h GLU 74 CO -0.01 0.76 -0.07 0.93 0.07 0.00 0.00 179.01 180.69 2k6x h GLU 75 N 0.32 0.00 -0.10 1.06 4.39 -0.57 0.71 114.58 120.39 2k6x h GLU 75 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2k6x h GLU 75 Cb 0.91 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.55 2k6x h GLU 75 CO 0.08 0.07 0.06 -0.07 -1.16 0.00 0.00 179.01 177.99 2k6x h LEU 76 N 0.00 0.11 0.00 1.33 3.38 -0.46 0.31 115.31 119.98 2k6x h LEU 76 Ca -0.00 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2k6x h LEU 76 Cb 0.13 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2k6x h LEU 76 CO 0.01 0.08 -0.37 -0.08 0.09 0.00 0.00 178.44 178.17 2k6x h GLU 77 N 0.13 0.00 -0.20 1.13 4.57 -1.42 -2.72 114.58 116.07 2k6x h GLU 77 Ca 0.04 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 2k6x h GLU 77 Cb -0.01 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 2k6x h GLU 77 CO -0.01 0.99 -0.20 -0.22 -1.18 0.00 0.00 179.01 178.39 2k6x h LYS 78 N -1.00 0.50 0.00 1.92 3.64 0.35 -3.31 116.57 118.67 2k6x h LYS 78 Ca -0.10 -0.26 -0.19 0.00 -1.27 0.00 0.00 60.65 58.82 2k6x h LYS 78 Cb 1.08 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 2k6x h LYS 78 CO -0.06 0.84 -1.90 1.58 -2.27 0.00 0.00 179.45 177.64 2k6x n HIS 79 N -4.44 0.39 -0.83 1.91 -0.00 0.73 -4.97 115.22 108.01 2k6x n HIS 79 Ca -0.05 0.13 0.00 0.00 0.46 0.00 0.00 57.72 58.26 2k6x n HIS 79 Cb 0.41 -0.90 0.00 0.00 -0.12 0.00 0.00 29.99 29.38 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 1.48 0.60 3.77 1.57 0.00 0.73 -4.99 105.19 108.36 2k6x n GLY 80 Ca -0.16 -0.77 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 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 3.40 -0.07 -0.61 2.07 -0.75 -4.96 121.20 118.28 2k6x s ILE 81 Ca 0.00 1.11 0.04 0.00 -1.41 0.00 0.00 60.65 60.39 2k6x s ILE 81 Cb 0.00 -3.59 -0.02 0.00 0.13 0.00 0.00 42.46 38.99 2k6x s ILE 81 CO 0.00 0.04 -0.19 0.20 -1.91 0.00 0.00 174.94 173.08 2k6x s ASN 82 N -1.37 3.60 -0.28 4.50 0.02 -1.26 -4.37 114.94 115.77 2k6x s ASN 82 Ca 0.59 -0.36 -0.16 0.00 -1.02 0.00 0.00 52.86 51.91 2k6x s ASN 82 Cb -0.26 -0.97 0.10 0.00 0.02 0.00 0.00 41.25 40.14 2k6x s ASN 82 CO 0.33 0.27 0.76 -0.51 0.02 0.00 0.00 177.10 177.97 2k6x s ILE 83 N -0.29 -0.04 0.12 0.60 1.10 -1.26 -4.88 121.20 116.57 2k6x s ILE 83 Ca 0.01 0.00 -0.02 0.00 -0.51 0.00 0.00 60.65 60.13 2k6x s ILE 83 Cb -0.13 -1.00 -0.05 0.00 0.15 0.00 0.00 42.46 41.44 2k6x s ILE 83 CO 0.03 0.00 0.31 0.54 -2.11 0.00 0.00 174.94 173.71 2k6x s VAL 84 N 1.61 5.26 -0.12 4.00 0.11 0.57 -4.92 120.40 126.91 2k6x s VAL 84 Ca -0.10 -0.22 0.17 0.00 -2.93 0.00 0.00 61.98 58.90 2k6x s VAL 84 Cb -0.05 -3.65 -0.20 0.00 -1.53 0.00 0.00 36.38 30.95 2k6x s VAL 84 CO -0.19 0.03 0.58 -0.62 -3.33 0.00 0.00 175.10 171.58 2k6x n GLU 85 N -0.00 0.64 -1.54 1.54 -0.58 -1.26 -0.93 120.64 118.51 2k6x n GLU 85 Ca -0.04 0.12 -0.11 0.00 -0.42 0.00 0.00 57.16 56.71 2k6x n GLU 85 Cb 0.52 -1.70 -0.04 0.00 -0.57 0.00 0.00 31.44 29.65 2k6x n GLU 85 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2k6x n ASN 86 N -2.79 -4.19 -4.71 1.62 5.15 -1.26 -4.63 115.26 104.45 2k6x n ASN 86 Ca -0.15 0.21 -0.42 0.00 -0.60 0.00 0.00 54.58 53.62 2k6x n ASN 86 Cb 0.90 -2.86 -0.03 0.00 -0.53 0.00 0.00 39.78 37.27 2k6x n ASN 86 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2k6x s GLU 87 N -3.33 4.14 0.14 1.20 2.02 -1.26 -4.89 118.70 116.71 2k6x s GLU 87 Ca 0.00 2.58 -0.30 0.00 0.02 0.00 0.00 54.97 57.27 2k6x s GLU 87 Cb 0.00 -3.23 -0.07 0.00 0.10 0.00 0.00 34.13 30.92 2k6x s GLU 87 CO 0.00 -0.77 1.23 -2.14 0.02 0.00 0.00 175.26 173.61 2k6x s PRO 88 N 1.64 4.44 -1.08 0.39 0.02 -1.26 -4.97 135.00 134.17 2k6x s PRO 88 Ca 0.76 1.89 -0.15 0.00 0.02 0.00 0.00 61.00 63.51 2k6x s PRO 88 Cb -0.48 -3.27 0.17 0.00 0.02 0.00 0.00 34.50 30.94 2k6x s PRO 88 CO 0.33 -0.20 1.27 -2.00 -0.33 0.00 0.00 177.00 176.07 2k6x s GLU 89 N 0.34 3.90 0.09 5.54 2.56 -1.26 -4.69 118.70 125.18 2k6x s GLU 89 Ca 0.56 -2.33 -0.04 0.00 0.00 0.00 0.00 54.97 53.17 2k6x s GLU 89 Cb -0.33 -4.95 -0.23 0.00 2.00 0.00 0.00 34.13 30.63 2k6x s GLU 89 CO 0.34 -1.71 1.19 1.05 -0.56 0.00 0.00 175.26 175.57 2k6x h GLU 90 N 7.75 0.30 0.00 4.30 4.11 -1.97 -3.46 114.58 125.61 2k6x h GLU 90 Ca 0.24 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.23 2k6x h GLU 90 Cb 0.94 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.34 2k6x h GLU 90 CO 1.16 1.18 0.00 0.39 0.07 0.00 0.00 179.01 181.81 2k6x n GLU 91 N -3.59 0.00 -2.70 1.06 1.02 -1.26 -5.01 120.64 110.16 2k6x n GLU 91 Ca -0.08 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.01 2k6x n GLU 91 Cb 0.97 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 32.49 2k6x n GLU 91 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2k6x n GLU 92 N -2.81 1.30 -1.44 3.49 0.28 -1.26 -4.93 120.64 115.26 2k6x n GLU 92 Ca 0.00 -2.16 -0.15 0.00 -0.16 0.00 0.00 57.16 54.69 2k6x n GLU 92 Cb 0.00 -0.36 -0.07 0.00 1.43 0.00 0.00 31.44 32.45 2k6x n GLU 92 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2k6x n ILE 93 N -0.74 0.00 -3.85 3.84 5.41 -1.26 -3.09 119.36 119.67 2k6x n ILE 93 Ca -0.03 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.46 2k6x n ILE 93 Cb 0.85 -1.66 0.01 0.00 -0.71 0.00 0.00 39.64 38.13 2k6x n ILE 93 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2k6x n SER 94 N -0.99 -2.11 -4.20 4.38 7.64 -1.26 -4.98 113.62 112.10 2k6x n SER 94 Ca -0.15 -0.86 -0.12 0.00 1.01 0.00 0.00 58.87 58.75 2k6x n SER 94 Cb 0.58 -3.70 -0.10 0.00 -1.01 0.00 0.00 64.21 59.99 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 -3.61 1.11 -0.89 -0.43 0.00 -1.18 -5.18 121.76 111.58 2k6x s ALA 95 Ca 0.24 -1.47 0.07 0.00 0.00 0.00 0.00 51.96 50.80 2k6x s ALA 95 Cb -0.12 0.44 0.06 0.00 0.00 0.00 0.00 23.12 23.49 2k6x s ALA 95 CO 0.84 -0.31 0.73 0.41 0.00 0.00 0.00 175.76 177.42