#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 6.45 0.15 1.61 1.04 -1.26 -4.94 113.70 116.75 2k6x s SER 26 Ca 0.00 2.24 0.00 0.00 0.48 0.00 0.00 55.95 58.67 2k6x s SER 26 Cb 0.00 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.52 2k6x s SER 26 CO 0.00 -0.72 0.00 1.57 0.98 0.00 0.00 173.24 175.07 2k6x n HIS 27 N -0.20 -1.57 -3.26 5.02 -0.00 -1.26 -5.08 115.22 108.88 2k6x n HIS 27 Ca 0.06 0.30 -0.15 0.00 -0.00 0.00 0.00 57.72 57.93 2k6x n HIS 27 Cb 0.48 0.77 -0.06 0.00 -0.00 0.00 0.00 29.99 31.18 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 -1.47 0.77 0.56 1.57 -2.45 -1.26 -5.00 119.30 112.02 2k6x s MET 28 Ca 0.00 -1.03 0.30 0.00 -1.25 0.00 0.00 55.69 53.71 2k6x s MET 28 Cb 0.00 -0.65 1.68 0.00 1.25 0.00 0.00 34.83 37.11 2k6x s MET 28 CO 0.00 -1.25 2.17 -1.00 1.05 0.00 0.00 175.02 175.99 2k6x h PRO 29 N 6.53 0.00 -0.60 4.11 0.13 -1.99 -2.82 132.00 137.35 2k6x h PRO 29 Ca 0.09 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.13 2k6x h PRO 29 Cb 1.05 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 2k6x h PRO 29 CO 0.19 0.06 0.04 0.37 -0.23 0.00 0.00 178.00 178.42 2k6x h GLN 30 N 0.00 1.02 -0.22 0.86 -0.00 -1.98 0.33 115.11 115.11 2k6x h GLN 30 Ca -0.00 -0.29 -0.19 0.00 -0.00 0.00 0.00 58.65 58.17 2k6x h GLN 30 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 27.48 27.55 2k6x h GLN 30 CO 0.01 0.98 -0.61 0.97 0.00 0.00 0.00 178.83 180.17 2k6x h ILE 31 N 0.94 1.29 -0.34 2.39 6.09 -1.91 -2.54 117.51 123.44 2k6x h ILE 31 Ca 0.18 -1.83 -0.16 0.00 -1.37 0.00 0.00 64.86 61.68 2k6x h ILE 31 Cb 0.49 1.77 -0.00 0.00 0.47 0.00 0.00 36.82 39.55 2k6x h ILE 31 CO 0.02 0.58 -0.42 -0.33 -3.07 0.00 0.00 178.15 174.93 2k6x h GLU 32 N 0.57 0.88 -0.56 2.19 5.08 -1.50 -2.89 114.58 118.34 2k6x h GLU 32 Ca -0.00 -0.50 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 2k6x h GLU 32 Cb 1.21 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2k6x h GLU 32 CO 0.13 1.14 0.29 0.07 -1.00 0.00 0.00 179.01 179.64 2k6x h ARG 33 N 0.68 0.77 -0.40 2.33 0.11 -0.34 -2.04 114.38 115.49 2k6x h ARG 33 Ca 0.04 -0.08 -0.07 0.00 0.10 0.00 0.00 59.98 59.97 2k6x h ARG 33 Cb 1.02 -0.16 -0.02 0.00 1.11 0.00 0.00 29.97 31.92 2k6x h ARG 33 CO 0.10 0.58 -0.04 -0.09 0.10 0.00 0.00 179.97 180.62 2k6x h ARG 34 N 0.78 0.65 -0.47 0.08 2.43 -1.25 -1.92 114.38 114.67 2k6x h ARG 34 Ca 0.20 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2k6x h ARG 34 Cb 0.04 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2k6x h ARG 34 CO -0.03 0.70 0.30 0.82 -1.51 0.00 0.00 179.97 180.24 2k6x h ILE 35 N 0.61 1.14 -0.54 1.20 2.04 -1.19 0.37 117.51 121.13 2k6x h ILE 35 Ca 0.12 -0.28 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 2k6x h ILE 35 Cb 0.44 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2k6x h ILE 35 CO 0.02 0.13 -0.11 0.11 0.00 0.00 0.00 178.15 178.31 2k6x h LYS 36 N 0.63 1.02 -0.86 2.37 6.56 -1.45 0.98 116.57 125.82 2k6x h LYS 36 Ca 0.17 -0.37 -0.02 0.00 -1.06 0.00 0.00 60.65 59.37 2k6x h LYS 36 Cb -0.04 -0.07 -0.04 0.00 -0.57 0.00 0.00 32.23 31.51 2k6x h LYS 36 CO -0.03 1.06 0.46 0.87 -2.06 0.00 0.00 179.45 179.75 2k6x h LYS 37 N 0.91 1.21 -0.25 3.15 1.79 -0.86 0.79 116.57 123.32 2k6x h LYS 37 Ca 0.14 -0.15 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2k6x h LYS 37 Cb 0.67 -0.23 -0.01 0.00 -1.58 0.00 0.00 32.23 31.08 2k6x h LYS 37 CO 0.05 0.90 0.09 -0.07 -1.08 0.00 0.00 179.45 179.33 2k6x h LEU 38 N 1.21 0.35 -1.28 2.94 3.38 0.06 -1.73 115.31 120.24 2k6x h LEU 38 Ca 0.30 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2k6x h LEU 38 Cb 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2k6x h LEU 38 CO -0.05 0.44 0.20 0.40 0.09 0.00 0.00 178.44 179.53 2k6x h ILE 39 N 0.24 1.18 -0.22 1.22 1.08 -0.31 -0.56 117.51 120.15 2k6x h ILE 39 Ca 0.08 -0.55 -0.05 0.00 -0.39 0.00 0.00 64.86 63.96 2k6x h ILE 39 Cb 0.21 0.59 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 2k6x h ILE 39 CO -0.00 0.22 -0.06 0.77 -0.69 0.00 0.00 178.15 178.38 2k6x h SER 40 N 0.69 0.43 -0.45 1.72 4.64 -0.61 -0.62 113.55 119.36 2k6x h SER 40 Ca 0.17 -0.38 0.01 0.00 -0.47 0.00 0.00 61.79 61.13 2k6x h SER 40 Cb 0.13 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.07 2k6x h SER 40 CO -0.02 0.71 0.27 -0.07 -0.87 0.00 0.00 176.83 176.85 2k6x h LEU 41 N 0.15 0.45 -0.80 5.97 3.38 -0.74 0.49 115.31 124.21 2k6x h LEU 41 Ca 0.05 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2k6x h LEU 41 Cb 0.52 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2k6x h LEU 41 CO 0.02 0.33 -0.36 1.23 0.09 0.00 0.00 178.44 179.75 2k6x h GLY 42 N 0.55 0.52 1.01 0.83 0.00 -1.05 0.21 103.07 105.14 2k6x h GLY 42 Ca 0.17 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 2k6x h GLY 42 CO -0.07 0.44 -0.04 1.70 0.00 0.00 0.00 176.54 178.58 2k6x h LYS 43 N 0.40 0.85 -0.75 4.80 1.63 -0.45 0.16 116.57 123.22 2k6x h LYS 43 Ca 0.04 -0.29 -0.06 0.00 -0.85 0.00 0.00 60.65 59.49 2k6x h LYS 43 Cb 0.82 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 32.35 2k6x h LYS 43 CO 0.07 0.92 0.23 0.87 -3.45 0.00 0.00 179.45 178.08 2k6x h LYS 44 N 0.70 1.17 -0.08 1.90 6.56 -0.59 -2.86 116.57 123.37 2k6x h LYS 44 Ca 0.13 -0.26 -0.09 0.00 -1.06 0.00 0.00 60.65 59.37 2k6x h LYS 44 Cb 0.56 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 32.04 2k6x h LYS 44 CO 0.03 1.00 -0.36 0.87 -2.06 0.00 0.00 179.45 178.92 2k6x h LYS 45 N 1.12 0.15 0.00 3.15 1.79 0.11 -3.47 116.57 119.42 2k6x h LYS 45 Ca 0.24 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 2k6x h LYS 45 Cb 0.32 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 2k6x h LYS 45 CO -0.01 0.50 0.00 0.41 -1.08 0.00 0.00 179.45 179.28 2k6x n GLY 46 N -0.36 -1.18 3.26 3.86 0.00 0.49 -5.07 105.19 106.20 2k6x n GLY 46 Ca -0.01 0.48 -0.15 0.00 0.00 0.00 0.00 46.02 46.33 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 1.38 -1.10 1.61 2.02 -0.95 -4.79 117.35 115.52 2k6x s TYR 47 Ca 0.00 -1.33 -0.19 0.00 -0.37 0.00 0.00 57.07 55.17 2k6x s TYR 47 Cb 0.00 -0.72 0.09 0.00 -0.40 0.00 0.00 41.96 40.93 2k6x s TYR 47 CO 0.00 -0.54 1.45 0.96 -1.57 0.00 0.00 175.55 175.85 2k6x s ILE 48 N -3.91 4.31 0.01 2.71 -0.00 -1.26 -3.67 121.20 119.39 2k6x s ILE 48 Ca 0.38 -1.51 -0.09 0.00 -0.00 0.00 0.00 60.65 59.44 2k6x s ILE 48 Cb 0.07 -5.01 0.00 0.00 -0.00 0.00 0.00 42.46 37.52 2k6x s ILE 48 CO 0.14 -1.82 0.17 -0.89 -0.00 0.00 0.00 174.94 172.54 2k6x s THR 49 N 3.78 0.09 0.36 8.37 2.01 -1.26 0.72 115.64 129.72 2k6x s THR 49 Ca 0.45 -0.76 0.04 0.00 0.31 0.00 0.00 61.69 61.72 2k6x s THR 49 Cb -0.00 -0.63 0.27 0.00 0.01 0.00 0.00 72.50 72.15 2k6x s THR 49 CO -0.04 -0.42 2.00 0.22 -0.69 0.00 0.00 174.62 175.70 2k6x h TYR 50 N 3.94 0.76 -0.92 4.92 3.20 -1.62 -1.64 116.97 125.61 2k6x h TYR 50 Ca -0.31 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.61 2k6x h TYR 50 Cb 1.19 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 39.15 2k6x h TYR 50 CO 0.56 0.46 0.59 0.93 -1.64 0.00 0.00 178.16 179.06 2k6x h GLU 51 N 0.80 1.12 -0.06 1.82 5.08 -1.88 0.16 114.58 121.62 2k6x h GLU 51 Ca 0.24 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.39 2k6x h GLU 51 Cb -0.01 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 2k6x h GLU 51 CO -0.06 0.74 -0.59 -0.44 -1.00 0.00 0.00 179.01 177.67 2k6x h ASP 52 N 1.15 0.23 -0.02 1.42 5.19 -1.61 0.29 116.42 123.08 2k6x h ASP 52 Ca 0.36 -0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.64 2k6x h ASP 52 Cb 0.00 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 39.44 2k6x h ASP 52 CO -0.12 0.76 -0.00 0.40 -3.12 0.00 0.00 179.24 177.16 2k6x h ILE 53 N 0.15 1.28 -0.27 0.35 1.08 -0.72 -1.54 117.51 117.84 2k6x h ILE 53 Ca -0.00 -0.82 -0.06 0.00 -0.39 0.00 0.00 64.86 63.58 2k6x h ILE 53 Cb 1.07 1.79 -0.02 0.00 -3.07 0.00 0.00 36.82 36.60 2k6x h ILE 53 CO 0.09 0.22 -0.08 -0.78 -0.69 0.00 0.00 178.15 176.90 2k6x h ASP 54 N -0.30 0.41 1.63 1.72 3.58 -0.53 -1.10 116.42 121.83 2k6x h ASP 54 Ca 0.01 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2k6x h ASP 54 Cb 0.36 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.30 2k6x h ASP 54 CO 0.00 0.54 0.00 0.07 -2.88 0.00 0.00 179.24 176.97 2k6x h LYS 55 N 0.41 0.00 0.00 0.28 2.10 -0.39 -2.76 116.57 116.20 2k6x h LYS 55 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2k6x h LYS 55 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 2k6x h LYS 55 CO 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.47 2k6x h ALA 56 N 2.00 1.00 -2.50 0.07 0.00 -0.13 -3.45 119.26 116.25 2k6x h ALA 56 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 2k6x h ALA 56 Cb 0.82 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.68 2k6x h ALA 56 CO 0.00 0.00 0.82 0.34 0.00 0.00 0.00 179.25 180.41 2k6x n PHE 57 N -2.93 2.50 -2.32 0.00 7.35 -1.04 -3.48 117.46 117.53 2k6x n PHE 57 Ca 0.02 0.26 -0.41 0.00 -0.76 0.00 0.00 57.45 56.56 2k6x n PHE 57 Cb 0.38 -2.56 -0.03 0.00 0.35 0.00 0.00 39.48 37.61 2k6x n PHE 57 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2k6x s PRO 58 N 0.26 4.44 0.00 -7.13 0.04 -1.26 -5.08 135.00 126.26 2k6x s PRO 58 Ca 0.71 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.67 2k6x s PRO 58 Cb -0.59 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 30.70 2k6x s PRO 58 CO 0.42 -0.20 0.00 -0.35 0.04 0.00 0.00 177.00 176.92 2k6x n PRO 59 N 2.96 3.31 -0.49 0.56 -0.05 -1.23 -5.01 135.00 135.05 2k6x n PRO 59 Ca 0.06 0.00 0.09 0.00 -0.05 0.00 0.00 63.50 63.60 2k6x n PRO 59 Cb 0.44 0.00 0.31 0.00 -0.05 0.00 0.00 33.50 34.20 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 0.00 4.04 -4.66 3.54 2.03 -1.26 -4.95 116.55 115.29 2k6x n ASP 60 Ca 0.00 -2.29 -0.42 0.00 0.52 0.00 0.00 54.79 52.60 2k6x n ASP 60 Cb 0.00 -0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 39.86 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 -1.64 1.59 -0.05 -0.67 -0.71 -1.26 -4.84 117.98 110.40 2k6x s PHE 61 Ca 0.44 -0.18 0.13 0.00 -1.04 0.00 0.00 56.93 56.28 2k6x s PHE 61 Cb 0.27 -4.11 0.01 0.00 -1.21 0.00 0.00 43.02 37.98 2k6x s PHE 61 CO 0.24 -4.84 1.41 0.93 -1.34 0.00 0.00 175.22 171.61 2k6x h GLU 62 N 10.10 0.00 -1.71 1.99 5.08 -1.94 -3.46 114.58 124.64 2k6x h GLU 62 Ca -0.45 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 57.96 2k6x h GLU 62 Cb 1.21 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.21 2k6x h GLU 62 CO 0.95 0.66 0.31 0.20 -1.00 0.00 0.00 179.01 180.13 2k6x s GLY 63 N -4.54 -0.25 -0.16 -3.84 0.00 -1.26 -5.15 107.32 92.13 2k6x s GLY 63 Ca 0.03 2.67 -0.14 0.00 0.00 0.00 0.00 44.72 47.27 2k6x s GLY 63 CO 0.77 2.13 0.32 -0.11 0.00 0.00 0.00 173.10 176.20 2k6x s PHE 64 N 0.80 3.47 0.02 1.90 -0.71 -1.26 -5.06 117.98 117.13 2k6x s PHE 64 Ca -0.03 0.63 0.01 0.00 -1.04 0.00 0.00 56.93 56.50 2k6x s PHE 64 Cb -0.05 -2.37 -0.01 0.00 -1.21 0.00 0.00 43.02 39.38 2k6x s PHE 64 CO -0.10 0.23 -0.05 -0.51 -1.34 0.00 0.00 175.22 173.44 2k6x s ASP 65 N 0.50 0.58 0.47 1.98 1.01 -1.26 -5.00 116.67 114.95 2k6x s ASP 65 Ca 0.18 -0.32 0.21 0.00 0.71 0.00 0.00 52.55 53.33 2k6x s ASP 65 Cb -0.13 0.00 1.17 0.00 1.01 0.00 0.00 42.92 44.97 2k6x s ASP 65 CO 0.05 -0.10 1.99 0.00 0.21 0.00 0.00 175.17 177.32 2k6x h THR 66 N 4.78 0.85 -0.21 -1.27 1.03 -2.02 -2.29 112.91 113.77 2k6x h THR 66 Ca -0.31 -0.73 -0.01 0.00 -0.01 0.00 0.00 66.41 65.35 2k6x h THR 66 Cb 1.20 1.43 -0.01 0.00 -1.07 0.00 0.00 68.15 69.70 2k6x h THR 66 CO 0.45 0.19 0.08 0.78 -0.01 0.00 0.00 175.52 177.01 2k6x h ASN 67 N 0.00 0.26 -0.87 0.00 4.21 -2.00 -1.38 115.58 115.80 2k6x h ASN 67 Ca -0.00 -0.02 0.11 0.00 1.21 0.00 0.00 56.30 57.60 2k6x h ASN 67 Cb 0.41 -0.06 -0.08 0.00 -1.12 0.00 0.00 38.32 37.47 2k6x h ASN 67 CO 0.02 0.24 0.50 0.25 -1.29 0.00 0.00 177.43 177.16 2k6x h LEU 68 N 0.29 0.70 -0.49 1.61 7.12 -1.80 0.61 115.31 123.36 2k6x h LEU 68 Ca 0.07 0.06 -0.06 0.00 0.13 0.00 0.00 57.88 58.08 2k6x h LEU 68 Cb 0.07 -0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.11 2k6x h LEU 68 CO -0.01 0.37 0.07 0.40 -0.13 0.00 0.00 178.44 179.15 2k6x h ILE 69 N 0.80 1.25 -0.35 4.05 1.08 -1.37 0.55 117.51 123.51 2k6x h ILE 69 Ca 0.44 -0.94 -0.04 0.00 -0.39 0.00 0.00 64.86 63.93 2k6x h ILE 69 Cb 0.46 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 2k6x h ILE 69 CO -0.28 0.34 0.08 -0.33 -0.69 0.00 0.00 178.15 177.27 2k6x h GLU 70 N 0.69 0.57 -0.06 2.37 5.08 -1.34 -3.20 114.58 118.69 2k6x h GLU 70 Ca 0.15 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.24 2k6x h GLU 70 Cb 0.41 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2k6x h GLU 70 CO 0.01 0.62 -0.55 -0.09 -1.00 0.00 0.00 179.01 178.00 2k6x h ARG 71 N 0.42 0.19 -0.26 2.33 9.65 0.93 -1.91 114.38 125.72 2k6x h ARG 71 Ca 0.11 -0.12 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 2k6x h ARG 71 Cb 0.31 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 2k6x h ARG 71 CO 0.00 0.69 0.09 -0.84 2.80 0.00 0.00 179.97 182.72 2k6x h ILE 72 N 0.14 1.18 -0.15 1.20 3.07 0.08 0.38 117.51 123.41 2k6x h ILE 72 Ca -0.00 -0.58 -0.11 0.00 1.55 0.00 0.00 64.86 65.73 2k6x h ILE 72 Cb 1.02 1.08 -0.01 0.00 -0.27 0.00 0.00 36.82 38.64 2k6x h ILE 72 CO 0.08 0.19 -0.37 1.12 -1.05 0.00 0.00 178.15 178.13 2k6x h HIS 73 N 0.26 0.38 0.00 0.16 2.07 -1.54 0.23 115.15 116.72 2k6x h HIS 73 Ca 0.09 -0.10 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 2k6x h HIS 73 Cb 0.21 -0.09 0.00 0.00 2.57 0.00 0.00 27.41 30.10 2k6x h HIS 73 CO -0.00 0.66 -0.00 0.93 -3.07 0.00 0.00 177.93 176.45 2k6x h GLU 74 N 0.28 -0.00 0.00 5.12 4.39 -1.02 -2.41 114.58 120.93 2k6x h GLU 74 Ca 0.03 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 2k6x h GLU 74 Cb 0.78 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2k6x h GLU 74 CO 0.06 0.25 -0.12 0.93 -1.16 0.00 0.00 179.01 178.97 2k6x h GLU 75 N -0.26 0.00 -0.93 2.33 4.39 -0.16 0.27 114.58 120.23 2k6x h GLU 75 Ca -0.00 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2k6x h GLU 75 Cb 0.25 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.84 2k6x h GLU 75 CO 0.00 0.12 0.59 1.25 -1.16 0.00 0.00 179.01 179.82 2k6x h LEU 76 N 0.00 0.96 0.00 1.33 5.85 -0.20 0.28 115.31 123.53 2k6x h LEU 76 Ca -0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2k6x h LEU 76 Cb 0.25 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2k6x h LEU 76 CO 0.02 0.63 -0.43 -0.08 -0.34 0.00 0.00 178.44 178.23 2k6x h GLU 77 N 1.11 0.00 -0.16 1.25 4.81 -0.46 -2.12 114.58 119.00 2k6x h GLU 77 Ca 0.39 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.47 2k6x h GLU 77 Cb 0.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2k6x h GLU 77 CO -0.15 0.82 -0.48 1.57 -0.73 0.00 0.00 179.01 180.04 2k6x h LYS 78 N -1.00 0.61 0.00 1.92 2.10 -0.61 -3.29 116.57 116.30 2k6x h LYS 78 Ca -0.11 -0.44 -0.09 0.00 -2.00 0.00 0.00 60.65 58.01 2k6x h LYS 78 Cb 0.95 0.07 -0.02 0.00 -0.90 0.00 0.00 32.23 32.34 2k6x h LYS 78 CO -0.07 1.06 -1.70 1.58 -2.00 0.00 0.00 179.45 178.32 2k6x n HIS 79 N -4.20 0.43 -0.94 0.07 -0.00 0.70 -5.00 115.22 106.29 2k6x n HIS 79 Ca -0.07 0.14 0.00 0.00 0.46 0.00 0.00 57.72 58.25 2k6x n HIS 79 Cb 0.58 -0.81 0.00 0.00 -0.12 0.00 0.00 29.99 29.64 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 1.34 0.71 3.66 1.57 0.00 0.46 -4.97 105.19 107.96 2k6x n GLY 80 Ca -0.09 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 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 4.13 -0.12 -0.61 2.07 -1.15 -4.95 121.20 118.57 2k6x s ILE 81 Ca 0.00 1.37 -0.19 0.00 -1.41 0.00 0.00 60.65 60.42 2k6x s ILE 81 Cb 0.00 -3.89 -0.04 0.00 0.13 0.00 0.00 42.46 38.66 2k6x s ILE 81 CO 0.00 -0.13 0.53 0.20 -1.91 0.00 0.00 174.94 173.63 2k6x s ASN 82 N 2.28 6.72 -0.29 4.50 0.02 -1.26 -4.57 114.94 122.34 2k6x s ASN 82 Ca 0.59 0.86 -0.18 0.00 -1.02 0.00 0.00 52.86 53.11 2k6x s ASN 82 Cb -0.24 -2.31 0.17 0.00 0.02 0.00 0.00 41.25 38.89 2k6x s ASN 82 CO 0.18 -0.05 1.13 -0.51 0.02 0.00 0.00 177.10 177.87 2k6x s ILE 83 N 0.81 0.00 0.26 0.60 2.07 -1.26 -4.91 121.20 118.78 2k6x s ILE 83 Ca 0.28 0.00 -0.08 0.00 -1.41 0.00 0.00 60.65 59.44 2k6x s ILE 83 Cb -0.16 -1.00 -0.07 0.00 0.13 0.00 0.00 42.46 41.37 2k6x s ILE 83 CO 0.11 0.00 0.57 0.54 -1.91 0.00 0.00 174.94 174.26 2k6x s VAL 84 N 1.00 4.95 -0.16 4.00 0.11 0.22 -4.93 120.40 125.59 2k6x s VAL 84 Ca -0.06 0.36 0.19 0.00 -2.93 0.00 0.00 61.98 59.54 2k6x s VAL 84 Cb -0.03 -3.66 -0.10 0.00 -1.53 0.00 0.00 36.38 31.06 2k6x s VAL 84 CO -0.12 -0.19 0.87 -0.62 -3.33 0.00 0.00 175.10 171.71 2k6x n GLU 85 N -0.48 0.62 0.00 1.54 4.71 -1.26 -2.04 120.64 123.73 2k6x n GLU 85 Ca 0.00 0.16 0.00 0.00 -0.01 0.00 0.00 57.16 57.31 2k6x n GLU 85 Cb 0.53 -1.80 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 2k6x n GLU 85 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2k6x n ASN 86 N -2.78 0.00 -4.75 1.62 4.05 -1.26 -4.40 115.26 107.74 2k6x n ASN 86 Ca -0.06 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.55 2k6x n ASN 86 Cb 0.73 0.00 -0.02 0.00 1.23 0.00 0.00 39.78 41.72 2k6x n ASN 86 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2k6x s GLU 87 N -0.17 4.19 -0.07 1.20 0.41 -1.26 -4.90 118.70 118.11 2k6x s GLU 87 Ca 0.00 2.44 -0.34 0.00 -0.41 0.00 0.00 54.97 56.66 2k6x s GLU 87 Cb 0.00 -3.07 -0.11 0.00 -1.78 0.00 0.00 34.13 29.17 2k6x s GLU 87 CO 0.00 -0.53 1.89 -2.30 -0.49 0.00 0.00 175.26 173.84 2k6x n PRO 88 N 2.26 2.28 -0.35 0.39 -0.02 -1.26 -4.87 135.00 133.43 2k6x n PRO 88 Ca 0.07 0.84 -0.01 0.00 -2.02 0.00 0.00 63.50 62.38 2k6x n PRO 88 Cb 0.39 -2.70 0.12 0.00 -0.02 0.00 0.00 33.50 31.29 2k6x n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2k6x h GLU 89 N 9.38 1.20 0.00 -0.52 9.09 -2.04 -3.37 114.58 128.32 2k6x h GLU 89 Ca -0.49 -0.07 0.00 0.00 0.05 0.00 0.00 59.36 58.85 2k6x h GLU 89 Cb 1.27 -0.27 0.00 0.00 -1.65 0.00 0.00 28.75 28.10 2k6x h GLU 89 CO 0.95 0.79 -0.31 0.39 0.05 0.00 0.00 179.01 180.88 2k6x n GLU 90 N -4.46 2.82 -2.06 1.06 1.02 -1.26 -4.93 120.64 112.83 2k6x n GLU 90 Ca 0.12 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.84 2k6x n GLU 90 Cb 0.06 -0.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 2k6x n GLU 90 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2k6x n GLU 91 N -0.69 3.14 0.00 3.49 -0.58 -1.26 -4.40 120.64 120.35 2k6x n GLU 91 Ca 0.00 -3.01 0.00 0.00 -0.42 0.00 0.00 57.16 53.73 2k6x n GLU 91 Cb 0.07 -3.19 0.00 0.00 -0.57 0.00 0.00 31.44 27.75 2k6x n GLU 91 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2k6x n GLU 92 N 5.63 0.00 -0.05 3.49 1.02 -1.26 -4.71 120.64 124.75 2k6x n GLU 92 Ca 0.47 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.52 2k6x n GLU 92 Cb 0.39 0.00 -0.15 0.00 -0.02 0.00 0.00 31.44 31.66 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 -1.17 1.53 -3.78 -3.67 0.13 -1.26 -5.02 119.36 106.12 2k6x n ILE 93 Ca 0.00 -0.81 -0.34 0.00 -1.10 0.00 0.00 62.75 60.50 2k6x n ILE 93 Cb 0.00 -0.86 0.03 0.00 -0.84 0.00 0.00 39.64 37.97 2k6x n ILE 93 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 2k6x n SER 94 N -2.95 -5.06 -3.93 9.51 7.64 -1.26 -4.98 113.62 112.59 2k6x n SER 94 Ca -0.23 -1.05 -0.11 0.00 1.01 0.00 0.00 58.87 58.49 2k6x n SER 94 Cb 1.09 -2.74 -0.13 0.00 -1.01 0.00 0.00 64.21 61.42 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 -3.40 0.10 -1.69 -0.43 0.00 -1.26 -5.14 121.76 109.94 2k6x s ALA 95 Ca 0.40 -0.30 0.14 0.00 0.00 0.00 0.00 51.96 52.20 2k6x s ALA 95 Cb -0.17 0.06 0.11 0.00 0.00 0.00 0.00 23.12 23.11 2k6x s ALA 95 CO 0.89 -0.06 0.93 0.41 0.00 0.00 0.00 175.76 177.93