#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 3.54 -1.28 1.61 0.15 -1.26 -4.76 113.70 111.71 2k6x s SER 26 Ca 0.00 -0.44 -0.01 0.00 0.70 0.00 0.00 55.95 56.19 2k6x s SER 26 Cb 0.00 -1.50 0.01 0.00 -1.71 0.00 0.00 66.02 62.81 2k6x s SER 26 CO 0.00 0.16 0.09 1.41 1.20 0.00 0.00 173.24 176.11 2k6x n HIS 27 N 3.51 -1.40 0.05 3.44 -0.00 -1.26 -4.78 115.22 114.78 2k6x n HIS 27 Ca -0.19 0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.62 2k6x n HIS 27 Cb 0.53 -3.18 0.00 0.00 -0.00 0.00 0.00 29.99 27.34 2k6x n HIS 27 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2k6x n MET 28 N -3.03 0.00 0.09 -0.41 1.56 -1.26 -4.73 117.12 109.34 2k6x n MET 28 Ca -0.15 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.28 2k6x n MET 28 Cb 0.62 -0.17 0.31 0.00 2.15 0.00 0.00 33.22 36.13 2k6x n MET 28 CO 0.00 0.00 0.00 -1.35 -0.73 0.00 0.00 175.97 173.89 2k6x h PRO 29 N 0.00 0.28 0.00 2.12 0.11 -1.89 -2.02 132.00 130.59 2k6x h PRO 29 Ca 0.00 -0.09 -0.06 0.00 0.11 0.00 0.00 66.00 65.96 2k6x h PRO 29 Cb 0.00 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 2k6x h PRO 29 CO 0.00 0.50 -0.29 -0.56 -0.21 0.00 0.00 178.00 177.44 2k6x h GLN 30 N 0.25 0.00 0.08 1.05 3.07 -1.93 -1.78 115.11 115.85 2k6x h GLN 30 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.78 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 0.04 0.29 -0.04 0.82 0.09 0.00 0.00 178.83 180.03 2k6x h ILE 31 N 0.00 1.16 -0.61 1.86 1.08 -1.65 0.34 117.51 119.69 2k6x h ILE 31 Ca -0.00 -0.99 0.04 0.00 -0.39 0.00 0.00 64.86 63.52 2k6x h ILE 31 Cb 0.60 1.79 -0.05 0.00 -3.07 0.00 0.00 36.82 36.09 2k6x h ILE 31 CO 0.04 0.24 0.35 -0.08 -0.69 0.00 0.00 178.15 178.00 2k6x h GLU 32 N -0.58 0.64 -0.31 2.37 4.22 -1.43 -1.52 114.58 117.98 2k6x h GLU 32 Ca -0.01 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.26 2k6x h GLU 32 Cb 0.48 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2k6x h GLU 32 CO 0.02 0.43 -0.35 0.07 -2.18 0.00 0.00 179.01 177.00 2k6x h ARG 33 N 0.66 0.69 -0.44 1.92 0.11 -1.31 -2.93 114.38 113.08 2k6x h ARG 33 Ca 0.26 -0.33 -0.10 0.00 0.10 0.00 0.00 59.98 59.91 2k6x h ARG 33 Cb 0.11 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.17 2k6x h ARG 33 CO -0.14 0.93 -0.12 -0.09 0.10 0.00 0.00 179.97 180.65 2k6x h ARG 34 N 0.58 0.86 -0.20 0.08 1.12 -0.31 0.13 114.38 116.64 2k6x h ARG 34 Ca 0.06 -0.33 0.01 0.00 -1.11 0.00 0.00 59.98 58.60 2k6x h ARG 34 Cb 0.87 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.77 2k6x h ARG 34 CO 0.08 0.97 0.12 0.82 -3.11 0.00 0.00 179.97 178.85 2k6x h ILE 35 N 0.70 1.03 -0.28 1.20 1.08 -1.25 -1.07 117.51 118.92 2k6x h ILE 35 Ca 0.11 -0.09 -0.10 0.00 -0.39 0.00 0.00 64.86 64.40 2k6x h ILE 35 Cb 0.66 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.16 2k6x h ILE 35 CO 0.05 0.05 -0.25 0.11 -0.69 0.00 0.00 178.15 177.42 2k6x h LYS 36 N 0.25 0.53 -0.85 2.37 6.56 -1.39 -2.52 116.57 121.52 2k6x h LYS 36 Ca 0.08 -0.20 0.01 0.00 -1.06 0.00 0.00 60.65 59.47 2k6x h LYS 36 Cb -0.01 -0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 31.58 2k6x h LYS 36 CO -0.03 0.74 0.55 0.87 -2.06 0.00 0.00 179.45 179.52 2k6x h LYS 37 N 0.47 1.12 -0.64 3.15 1.57 -0.31 -0.57 116.57 121.37 2k6x h LYS 37 Ca 0.07 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2k6x h LYS 37 Cb 0.68 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 2k6x h LYS 37 CO 0.05 0.75 0.42 -0.07 -0.57 0.00 0.00 179.45 180.03 2k6x h LEU 38 N 1.15 0.71 -0.97 2.94 3.38 -0.78 0.19 115.31 121.94 2k6x h LEU 38 Ca 0.31 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 2k6x h LEU 38 Cb -0.11 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 2k6x h LEU 38 CO -0.06 0.51 0.42 0.40 0.09 0.00 0.00 178.44 179.80 2k6x h ILE 39 N 0.84 1.25 -0.02 1.22 1.08 -1.11 0.24 117.51 121.01 2k6x h ILE 39 Ca 0.24 -0.65 -0.00 0.00 -0.39 0.00 0.00 64.86 64.06 2k6x h ILE 39 Cb -0.07 0.16 -0.00 0.00 -3.07 0.00 0.00 36.82 33.85 2k6x h ILE 39 CO -0.06 0.29 -0.00 -1.28 -0.69 0.00 0.00 178.15 176.40 2k6x h SER 40 N 1.16 0.03 -0.36 1.72 0.87 -0.29 -1.71 113.55 114.97 2k6x h SER 40 Ca 0.29 -0.37 -0.12 0.00 -1.23 0.00 0.00 61.79 60.36 2k6x h SER 40 Cb 0.07 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 2k6x h SER 40 CO -0.04 0.39 -0.23 -0.07 -0.53 0.00 0.00 176.83 176.36 2k6x h LEU 41 N -0.33 0.83 -0.55 2.23 3.38 -0.44 -0.84 115.31 119.60 2k6x h LEU 41 Ca 0.00 -0.43 -0.14 0.00 0.09 0.00 0.00 57.88 57.41 2k6x h LEU 41 Cb 0.38 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2k6x h LEU 41 CO 0.00 1.07 -0.31 1.23 0.09 0.00 0.00 178.44 180.53 2k6x h GLY 42 N 0.59 0.91 0.94 0.83 0.00 -0.56 0.45 103.07 106.22 2k6x h GLY 42 Ca 0.07 -0.85 -0.03 0.00 0.00 0.00 0.00 47.33 46.52 2k6x h GLY 42 CO 0.06 0.77 0.13 1.70 0.00 0.00 0.00 176.54 179.21 2k6x h LYS 43 N 0.71 0.59 -0.87 4.80 1.63 -1.21 -0.63 116.57 121.59 2k6x h LYS 43 Ca 0.08 -0.12 0.05 0.00 -0.85 0.00 0.00 60.65 59.80 2k6x h LYS 43 Cb 0.86 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 32.35 2k6x h LYS 43 CO 0.08 0.59 0.57 0.87 -3.45 0.00 0.00 179.45 178.10 2k6x h LYS 44 N 0.48 1.02 0.00 1.90 6.56 -0.76 -1.81 116.57 123.96 2k6x h LYS 44 Ca 0.13 -0.06 -0.02 0.00 -1.06 0.00 0.00 60.65 59.64 2k6x h LYS 44 Cb 0.23 -0.23 -0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2k6x h LYS 44 CO -0.01 0.67 -0.09 0.87 -2.06 0.00 0.00 179.45 178.83 2k6x h LYS 45 N 1.05 0.00 0.00 3.15 1.79 0.85 -3.47 116.57 119.93 2k6x h LYS 45 Ca 0.36 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.83 2k6x h LYS 45 Cb 0.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 2k6x h LYS 45 CO -0.12 0.09 0.00 0.41 -1.08 0.00 0.00 179.45 178.75 2k6x n GLY 46 N -0.09 2.37 3.24 3.86 0.00 -0.33 -5.06 105.19 109.17 2k6x n GLY 46 Ca -0.00 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 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 1.22 -0.98 1.61 2.02 -1.09 -4.85 117.35 115.27 2k6x s TYR 47 Ca 0.00 -0.96 -0.13 0.00 -0.37 0.00 0.00 57.07 55.61 2k6x s TYR 47 Cb 0.00 -0.69 0.22 0.00 -0.40 0.00 0.00 41.96 41.09 2k6x s TYR 47 CO 0.00 -0.14 1.02 0.96 -1.57 0.00 0.00 175.55 175.82 2k6x s ILE 48 N -3.58 5.51 0.06 2.71 -5.25 -1.26 -3.73 121.20 115.65 2k6x s ILE 48 Ca 0.22 -2.64 -0.01 0.00 -0.99 0.00 0.00 60.65 57.23 2k6x s ILE 48 Cb 0.05 -4.62 -0.04 0.00 2.95 0.00 0.00 42.46 40.80 2k6x s ILE 48 CO 0.03 -1.24 -0.04 0.42 -1.79 0.00 0.00 174.94 172.33 2k6x s THR 49 N 0.33 0.29 0.32 8.37 -4.23 -1.24 0.90 115.64 120.38 2k6x s THR 49 Ca 0.28 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.99 2k6x s THR 49 Cb -0.08 -1.52 0.28 0.00 1.34 0.00 0.00 72.50 72.52 2k6x s THR 49 CO -0.08 -0.97 1.93 0.22 -0.54 0.00 0.00 174.62 175.18 2k6x h TYR 50 N 3.15 0.96 -0.24 3.99 3.20 -0.90 0.11 116.97 127.24 2k6x h TYR 50 Ca -0.34 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.51 2k6x h TYR 50 Cb 1.14 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 2k6x h TYR 50 CO 0.54 0.52 0.00 0.93 -1.64 0.00 0.00 178.16 178.51 2k6x h GLU 51 N 0.96 0.43 -0.08 1.82 5.08 -1.86 -1.73 114.58 119.20 2k6x h GLU 51 Ca 0.36 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 2k6x h GLU 51 Cb 0.19 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2k6x h GLU 51 CO -0.13 0.60 -0.29 -0.44 -1.00 0.00 0.00 179.01 177.75 2k6x h ASP 52 N 0.20 0.15 -0.09 1.42 3.32 -1.62 0.15 116.42 119.95 2k6x h ASP 52 Ca 0.07 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 2k6x h ASP 52 Cb 0.41 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 2k6x h ASP 52 CO 0.01 0.45 0.03 0.40 -1.72 0.00 0.00 179.24 178.41 2k6x h ILE 53 N 0.14 1.17 -0.63 0.35 1.08 -0.72 -0.90 117.51 118.00 2k6x h ILE 53 Ca 0.02 -0.52 -0.02 0.00 -0.39 0.00 0.00 64.86 63.94 2k6x h ILE 53 Cb 0.60 1.35 -0.03 0.00 -3.07 0.00 0.00 36.82 35.67 2k6x h ILE 53 CO 0.04 0.15 0.30 -0.78 -0.69 0.00 0.00 178.15 177.17 2k6x h ASP 54 N -0.04 0.80 1.32 1.72 3.58 -0.56 -0.20 116.42 123.05 2k6x h ASP 54 Ca 0.03 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2k6x h ASP 54 Cb 0.21 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2k6x h ASP 54 CO -0.00 0.68 0.00 0.07 -2.88 0.00 0.00 179.24 177.11 2k6x h LYS 55 N 0.88 0.00 0.00 0.28 5.09 -0.66 -2.78 116.57 119.38 2k6x h LYS 55 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.96 2k6x h LYS 55 Cb 0.10 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.43 2k6x h LYS 55 CO -0.03 0.00 0.00 0.00 -2.09 0.00 0.00 179.45 177.33 2k6x h ALA 56 N 2.41 1.00 -2.31 0.07 0.00 0.43 -3.45 119.26 117.41 2k6x h ALA 56 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 2k6x h ALA 56 Cb 0.66 0.00 0.16 0.00 0.00 0.00 0.00 17.79 18.61 2k6x h ALA 56 CO 0.00 0.00 0.22 -0.06 0.00 0.00 0.00 179.25 179.41 2k6x s PHE 57 N -3.33 2.15 0.52 0.00 0.08 -1.05 -4.67 117.98 111.69 2k6x s PHE 57 Ca 0.06 1.28 -0.12 0.00 0.12 0.00 0.00 56.93 58.27 2k6x s PHE 57 Cb 0.07 -3.17 -0.06 0.00 -0.57 0.00 0.00 43.02 39.29 2k6x s PHE 57 CO 0.61 -2.59 0.92 -1.25 -0.10 0.00 0.00 175.22 172.80 2k6x s PRO 58 N -4.86 3.74 0.23 0.24 0.04 -1.26 -5.06 135.00 128.07 2k6x s PRO 58 Ca 0.64 0.66 0.03 0.00 0.04 0.00 0.00 61.00 62.38 2k6x s PRO 58 Cb -0.19 -2.22 0.03 0.00 0.04 0.00 0.00 34.50 32.17 2k6x s PRO 58 CO 0.58 -0.30 0.26 -0.35 0.04 0.00 0.00 177.00 177.23 2k6x n PRO 59 N -1.98 0.98 -0.67 0.56 -0.04 -1.26 -5.02 135.00 127.57 2k6x n PRO 59 Ca 0.04 -1.34 0.08 0.00 -0.04 0.00 0.00 63.50 62.24 2k6x n PRO 59 Cb 0.54 0.01 0.35 0.00 -0.04 0.00 0.00 33.50 34.37 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 -2.37 4.84 -4.68 3.54 5.75 -1.26 -5.00 116.55 117.37 2k6x n ASP 60 Ca 0.03 -2.57 -0.42 0.00 -0.01 0.00 0.00 54.79 51.82 2k6x n ASP 60 Cb 0.25 -0.60 -0.03 0.00 -1.03 0.00 0.00 41.12 39.71 2k6x n ASP 60 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2k6x n PHE 61 N 0.92 2.60 0.70 2.11 7.35 -1.26 -4.86 117.46 125.02 2k6x n PHE 61 Ca 0.25 -0.19 0.13 0.00 -0.76 0.00 0.00 57.45 56.88 2k6x n PHE 61 Cb 0.95 -2.74 0.46 0.00 0.35 0.00 0.00 39.48 38.50 2k6x n PHE 61 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2k6x n GLU 62 N 6.02 0.19 -3.59 -4.13 1.02 -1.26 -4.72 120.64 114.16 2k6x n GLU 62 Ca 0.19 0.17 -0.02 0.00 -0.02 0.00 0.00 57.16 57.48 2k6x n GLU 62 Cb 0.38 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 30.02 2k6x n GLU 62 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k6x s GLY 63 N -3.41 -0.36 -0.16 0.62 0.00 -1.26 -5.15 107.32 97.59 2k6x s GLY 63 Ca 0.11 2.77 -0.06 0.00 0.00 0.00 0.00 44.72 47.54 2k6x s GLY 63 CO 0.56 2.80 0.02 -0.12 0.00 0.00 0.00 173.10 176.36 2k6x s PHE 64 N 2.01 3.16 0.04 1.90 5.36 -1.26 -5.05 117.98 124.14 2k6x s PHE 64 Ca -0.07 -0.06 -0.12 0.00 -0.96 0.00 0.00 56.93 55.71 2k6x s PHE 64 Cb -0.06 -2.01 0.01 0.00 -0.34 0.00 0.00 43.02 40.62 2k6x s PHE 64 CO -0.18 0.11 0.27 0.34 -1.46 0.00 0.00 175.22 174.30 2k6x s ASP 65 N 0.27 -0.07 0.52 6.13 -1.08 -1.26 -5.03 116.67 116.15 2k6x s ASP 65 Ca 0.01 -0.26 0.25 0.00 -0.52 0.00 0.00 52.55 52.03 2k6x s ASP 65 Cb -0.13 0.34 1.43 0.00 -1.46 0.00 0.00 42.92 43.10 2k6x s ASP 65 CO 0.01 -0.60 2.09 0.00 0.52 0.00 0.00 175.17 177.19 2k6x h THR 66 N 3.27 0.67 -0.32 1.71 1.03 -2.02 -1.82 112.91 115.43 2k6x h THR 66 Ca -0.32 -0.45 -0.01 0.00 -0.01 0.00 0.00 66.41 65.62 2k6x h THR 66 Cb 1.20 1.28 -0.02 0.00 -1.07 0.00 0.00 68.15 69.54 2k6x h THR 66 CO 0.47 0.11 0.17 -1.13 -0.01 0.00 0.00 175.52 175.13 2k6x h ASN 67 N 0.00 0.38 -0.93 0.00 -0.73 -2.00 -0.03 115.58 112.27 2k6x h ASN 67 Ca -0.00 -0.02 0.13 0.00 1.87 0.00 0.00 56.30 58.28 2k6x h ASN 67 Cb 0.27 -0.10 -0.08 0.00 0.27 0.00 0.00 38.32 38.69 2k6x h ASN 67 CO 0.01 0.31 0.60 0.25 -0.37 0.00 0.00 177.43 178.23 2k6x h LEU 68 N 0.44 0.77 -1.06 0.34 5.85 -1.74 0.22 115.31 120.13 2k6x h LEU 68 Ca 0.12 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2k6x h LEU 68 Cb 0.02 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2k6x h LEU 68 CO -0.02 0.40 0.34 0.40 -0.34 0.00 0.00 178.44 179.23 2k6x h ILE 69 N 0.82 1.23 -0.30 4.05 1.08 -1.10 0.62 117.51 123.90 2k6x h ILE 69 Ca 0.47 -0.63 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 2k6x h ILE 69 Cb 0.61 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 2k6x h ILE 69 CO -0.23 0.27 -0.00 -0.33 -0.69 0.00 0.00 178.15 177.16 2k6x h GLU 70 N 1.00 0.54 -0.82 2.37 4.39 -1.11 -3.07 114.58 117.88 2k6x h GLU 70 Ca 0.25 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2k6x h GLU 70 Cb 0.10 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 2k6x h GLU 70 CO -0.03 0.68 0.53 0.00 -1.16 0.00 0.00 179.01 179.03 2k6x h ARG 71 N 0.33 1.09 0.12 2.33 2.47 0.54 -0.84 114.38 120.43 2k6x h ARG 71 Ca 0.09 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2k6x h ARG 71 Cb 0.44 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.52 2k6x h ARG 71 CO 0.02 0.74 -0.06 0.82 0.56 0.00 0.00 179.97 182.04 2k6x h ILE 72 N 1.12 0.91 -0.04 2.04 2.04 0.28 0.45 117.51 124.31 2k6x h ILE 72 Ca 0.30 -0.14 -0.10 0.00 1.00 0.00 0.00 64.86 65.92 2k6x h ILE 72 Cb -0.10 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2k6x h ILE 72 CO -0.06 0.03 -0.42 1.12 0.00 0.00 0.00 178.15 178.82 2k6x h HIS 73 N -0.23 0.10 -0.01 1.37 2.07 -1.42 0.24 115.15 117.27 2k6x h HIS 73 Ca -0.02 -0.03 0.01 0.00 -2.85 0.00 0.00 60.37 57.48 2k6x h HIS 73 Cb 0.18 -0.02 -0.01 0.00 2.57 0.00 0.00 27.41 30.13 2k6x h HIS 73 CO -0.05 0.50 -0.02 0.93 -3.07 0.00 0.00 177.93 176.22 2k6x h GLU 74 N 0.07 -0.03 0.00 5.12 5.08 -0.83 -1.27 114.58 122.72 2k6x h GLU 74 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2k6x h GLU 74 Cb 0.78 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 2k6x h GLU 74 CO 0.06 -0.02 -0.02 0.93 -1.00 0.00 0.00 179.01 178.96 2k6x h GLU 75 N -0.03 0.00 -0.43 2.33 4.39 -0.48 0.49 114.58 120.85 2k6x h GLU 75 Ca 0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2k6x h GLU 75 Cb 0.05 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 2k6x h GLU 75 CO -0.03 0.02 0.24 1.25 -1.16 0.00 0.00 179.01 179.33 2k6x h LEU 76 N 0.00 0.54 0.00 1.33 5.85 -0.20 0.83 115.31 123.65 2k6x h LEU 76 Ca -0.00 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.58 2k6x h LEU 76 Cb 0.04 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2k6x h LEU 76 CO 0.00 0.47 -0.35 -0.08 -0.34 0.00 0.00 178.44 178.14 2k6x h GLU 77 N 0.56 0.00 -0.07 1.25 4.81 -0.06 -2.14 114.58 118.93 2k6x h GLU 77 Ca 0.15 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.15 2k6x h GLU 77 Cb 0.05 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.44 2k6x h GLU 77 CO -0.02 0.69 -0.87 1.57 -0.73 0.00 0.00 179.01 179.65 2k6x h LYS 78 N -1.00 0.62 0.00 1.92 2.10 -0.20 -3.24 116.57 116.77 2k6x h LYS 78 Ca -0.08 -0.57 -0.16 0.00 -2.00 0.00 0.00 60.65 57.84 2k6x h LYS 78 Cb 0.82 0.14 -0.03 0.00 -0.90 0.00 0.00 32.23 32.26 2k6x h LYS 78 CO -0.05 1.18 -1.71 0.72 -2.00 0.00 0.00 179.45 177.59 2k6x n HIS 79 N -3.86 0.56 -0.99 0.07 8.25 -0.39 -4.99 115.22 113.88 2k6x n HIS 79 Ca -0.07 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2k6x n HIS 79 Cb 0.79 -0.93 0.00 0.00 1.12 0.00 0.00 29.99 30.97 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 1.42 0.68 3.67 -1.41 0.00 0.15 -4.98 105.19 104.72 2k6x n GLY 80 Ca -0.12 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 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 4.00 -0.32 -0.61 2.07 -1.03 -4.96 121.20 118.35 2k6x s ILE 81 Ca 0.00 1.28 -0.12 0.00 -1.41 0.00 0.00 60.65 60.39 2k6x s ILE 81 Cb 0.00 -3.82 -0.03 0.00 0.13 0.00 0.00 42.46 38.74 2k6x s ILE 81 CO 0.00 -0.07 0.23 0.20 -1.91 0.00 0.00 174.94 173.39 2k6x s ASN 82 N 2.16 6.06 -0.14 4.50 -0.87 -1.26 -4.62 114.94 120.77 2k6x s ASN 82 Ca 0.61 -0.24 -0.08 0.00 -1.57 0.00 0.00 52.86 51.58 2k6x s ASN 82 Cb -0.27 -2.14 0.05 0.00 -0.02 0.00 0.00 41.25 38.88 2k6x s ASN 82 CO 0.21 -0.17 0.34 -0.63 -2.57 0.00 0.00 177.10 174.28 2k6x s ILE 83 N 1.76 -0.02 0.32 0.60 1.01 -1.26 -4.94 121.20 118.66 2k6x s ILE 83 Ca 0.07 0.09 -0.07 0.00 0.00 0.00 0.00 60.65 60.74 2k6x s ILE 83 Cb -0.17 -0.50 -0.06 0.00 0.01 0.00 0.00 42.46 41.74 2k6x s ILE 83 CO 0.11 0.04 0.62 0.54 0.00 0.00 0.00 174.94 176.25 2k6x s VAL 84 N 1.08 4.93 -0.02 2.92 0.11 0.26 -4.91 120.40 124.78 2k6x s VAL 84 Ca -0.07 0.31 0.07 0.00 -2.93 0.00 0.00 61.98 59.35 2k6x s VAL 84 Cb -0.08 -3.71 -0.24 0.00 -1.53 0.00 0.00 36.38 30.82 2k6x s VAL 84 CO -0.08 -0.34 0.77 -0.33 -3.33 0.00 0.00 175.10 171.79 2k6x h GLU 85 N 1.69 0.07 -0.30 1.54 5.08 -1.93 0.10 114.58 120.83 2k6x h GLU 85 Ca -0.47 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 57.64 2k6x h GLU 85 Cb 1.19 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.43 2k6x h GLU 85 CO 0.66 0.76 -0.12 -1.71 -1.00 0.00 0.00 179.01 177.60 2k6x n ASN 86 N -3.21 -4.38 -4.74 1.42 5.15 -1.26 -3.89 115.26 104.35 2k6x n ASN 86 Ca -0.15 0.16 -0.41 0.00 -0.60 0.00 0.00 54.58 53.58 2k6x n ASN 86 Cb 1.03 -2.44 -0.04 0.00 -0.53 0.00 0.00 39.78 37.80 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 -2.14 4.65 0.35 1.20 0.41 -1.26 -5.02 118.70 116.88 2k6x s GLU 87 Ca 0.00 1.68 -0.27 0.00 -0.41 0.00 0.00 54.97 55.97 2k6x s GLU 87 Cb 0.00 -3.27 -0.09 0.00 -1.78 0.00 0.00 34.13 28.99 2k6x s GLU 87 CO 0.00 0.17 1.13 -2.14 -0.49 0.00 0.00 175.26 173.93 2k6x s PRO 88 N -0.63 4.33 -1.41 0.39 0.02 -1.26 -4.94 135.00 131.50 2k6x s PRO 88 Ca 0.47 1.79 -0.14 0.00 0.02 0.00 0.00 61.00 63.14 2k6x s PRO 88 Cb -0.29 -2.88 0.07 0.00 0.02 0.00 0.00 34.50 31.43 2k6x s PRO 88 CO 0.35 -0.07 2.10 -1.91 -0.33 0.00 0.00 177.00 177.14 2k6x n GLU 89 N 0.53 3.03 -4.76 5.54 2.13 -1.26 -4.89 120.64 120.96 2k6x n GLU 89 Ca 0.02 -2.86 -0.26 0.00 0.66 0.00 0.00 57.16 54.72 2k6x n GLU 89 Cb 0.46 -3.24 -0.16 0.00 0.27 0.00 0.00 31.44 28.77 2k6x n GLU 89 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2k6x s GLU 90 N 2.76 1.83 -0.17 5.31 2.56 -1.26 -5.04 118.70 124.68 2k6x s GLU 90 Ca 0.46 -0.55 -0.14 0.00 0.00 0.00 0.00 54.97 54.74 2k6x s GLU 90 Cb 0.12 -1.53 -0.22 0.00 2.00 0.00 0.00 34.13 34.49 2k6x s GLU 90 CO -0.05 0.16 0.25 0.39 -0.56 0.00 0.00 175.26 175.44 2k6x n GLU 91 N 3.41 0.66 0.00 4.30 -0.58 -1.26 -4.93 120.64 122.24 2k6x n GLU 91 Ca -0.20 0.42 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 2k6x n GLU 91 Cb 0.53 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 2k6x n GLU 91 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2k6x n GLU 92 N -3.98 0.00 -3.29 3.49 2.13 -1.26 -4.98 120.64 112.75 2k6x n GLU 92 Ca -0.33 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 57.25 2k6x n GLU 92 Cb 0.86 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.61 2k6x n GLU 92 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2k6x n ILE 93 N 0.00 -2.15 -3.36 6.31 2.08 -1.26 -1.91 119.36 119.08 2k6x n ILE 93 Ca 0.00 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.14 2k6x n ILE 93 Cb 0.00 -3.37 0.07 0.00 -0.75 0.00 0.00 39.64 35.59 2k6x n ILE 93 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 2k6x n SER 94 N -2.66 -4.73 -4.69 4.38 7.64 -1.26 -4.91 113.62 107.39 2k6x n SER 94 Ca -0.06 -0.70 -0.42 0.00 1.01 0.00 0.00 58.87 58.70 2k6x n SER 94 Cb 0.59 -5.04 -0.03 0.00 -1.01 0.00 0.00 64.21 58.72 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 3.63 0.00 -0.43 0.00 -0.80 -5.10 121.76 115.65 2k6x s ALA 95 Ca 0.28 1.00 0.00 0.00 0.00 0.00 0.00 51.96 53.24 2k6x s ALA 95 Cb -0.04 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2k6x s ALA 95 CO 0.75 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.89