#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6x h SER 26 N 0.00 0.00 -1.79 1.61 0.02 -2.09 -3.37 113.55 107.93 2k6x h SER 26 Ca 0.00 0.00 -0.70 0.00 -0.84 0.00 0.00 61.79 60.25 2k6x h SER 26 Cb 0.00 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.39 2k6x h SER 26 CO 0.00 0.30 1.47 -2.28 -1.14 0.00 0.00 176.83 175.18 2k6x s HIS 27 N -3.50 3.15 -0.55 3.45 5.65 -1.26 -4.85 115.29 117.38 2k6x s HIS 27 Ca 0.01 -1.72 0.06 0.00 0.25 0.00 0.00 55.06 53.66 2k6x s HIS 27 Cb 0.10 -4.46 0.21 0.00 -1.18 0.00 0.00 32.58 27.25 2k6x s HIS 27 CO 0.67 -1.57 0.55 -1.33 -0.65 0.00 0.00 174.74 172.40 2k6x n MET 28 N 6.84 1.45 0.29 2.88 2.00 -1.26 -4.90 117.12 124.43 2k6x n MET 28 Ca 0.37 -3.98 0.15 0.00 0.00 0.00 0.00 57.70 54.23 2k6x n MET 28 Cb 0.46 -1.90 0.90 0.00 0.00 0.00 0.00 33.22 32.68 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 4.74 0.00 -0.55 0.03 0.11 -1.97 -1.82 132.00 132.54 2k6x h PRO 29 Ca 0.17 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.31 2k6x h PRO 29 Cb 0.79 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 2k6x h PRO 29 CO 0.62 0.01 0.36 -0.56 -0.21 0.00 0.00 178.00 178.22 2k6x h GLN 30 N 0.00 0.64 -0.43 1.05 3.07 -2.00 -2.14 115.11 115.31 2k6x h GLN 30 Ca -0.00 -0.04 -0.07 0.00 0.09 0.00 0.00 58.65 58.63 2k6x h GLN 30 Cb 0.02 -0.14 -0.01 0.00 0.08 0.00 0.00 27.48 27.42 2k6x h GLN 30 CO 0.00 0.42 -0.02 0.82 0.09 0.00 0.00 178.83 180.15 2k6x h ILE 31 N 0.66 1.26 -0.49 1.86 1.08 -1.75 0.15 117.51 120.29 2k6x h ILE 31 Ca 0.22 -1.06 0.03 0.00 -0.39 0.00 0.00 64.86 63.66 2k6x h ILE 31 Cb 0.05 1.10 -0.04 0.00 -3.07 0.00 0.00 36.82 34.86 2k6x h ILE 31 CO -0.05 0.36 0.27 -0.08 -0.69 0.00 0.00 178.15 177.95 2k6x h GLU 32 N 0.60 0.51 -0.36 2.37 4.81 -1.47 0.48 114.58 121.52 2k6x h GLU 32 Ca 0.12 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2k6x h GLU 32 Cb 0.51 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2k6x h GLU 32 CO 0.03 0.34 0.01 0.00 -0.73 0.00 0.00 179.01 178.65 2k6x h ARG 33 N 0.52 0.64 -0.55 1.92 2.47 -1.25 -3.11 114.38 115.02 2k6x h ARG 33 Ca 0.20 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.66 2k6x h ARG 33 Cb 0.08 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 2k6x h ARG 33 CO -0.12 0.74 0.06 -0.09 0.56 0.00 0.00 179.97 181.11 2k6x h ARG 34 N 0.45 0.90 -0.56 0.04 9.65 -0.08 -1.91 114.38 122.87 2k6x h ARG 34 Ca 0.10 -0.23 -0.07 0.00 -1.10 0.00 0.00 59.98 58.69 2k6x h ARG 34 Cb 0.45 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.89 2k6x h ARG 34 CO 0.02 0.86 0.08 0.82 2.80 0.00 0.00 179.97 184.54 2k6x h ILE 35 N 0.84 1.24 -0.33 1.20 2.04 -0.92 0.57 117.51 122.16 2k6x h ILE 35 Ca 0.17 -0.95 -0.09 0.00 1.00 0.00 0.00 64.86 64.99 2k6x h ILE 35 Cb 0.42 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2k6x h ILE 35 CO 0.01 0.35 -0.18 0.11 0.00 0.00 0.00 178.15 178.44 2k6x h LYS 36 N 0.85 0.61 -0.59 2.37 1.79 -1.33 -1.80 116.57 118.46 2k6x h LYS 36 Ca 0.17 -0.21 -0.08 0.00 -2.18 0.00 0.00 60.65 58.35 2k6x h LYS 36 Cb 0.39 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 2k6x h LYS 36 CO 0.01 0.76 0.06 0.87 -1.08 0.00 0.00 179.45 180.06 2k6x h LYS 37 N 0.55 1.00 -0.02 3.15 1.57 -0.75 -2.04 116.57 120.03 2k6x h LYS 37 Ca 0.09 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2k6x h LYS 37 Cb 0.61 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 2k6x h LYS 37 CO 0.04 0.97 -0.00 1.25 -0.57 0.00 0.00 179.45 181.13 2k6x h LEU 38 N 0.90 -0.02 -1.35 2.94 5.85 -0.30 0.33 115.31 123.66 2k6x h LEU 38 Ca 0.17 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2k6x h LEU 38 Cb 0.48 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 2k6x h LEU 38 CO 0.02 -0.01 0.18 0.40 -0.34 0.00 0.00 178.44 178.69 2k6x h ILE 39 N -0.00 1.16 -0.33 4.05 5.03 -1.35 -1.79 117.51 124.28 2k6x h ILE 39 Ca 0.01 -0.51 -0.05 0.00 -0.12 0.00 0.00 64.86 64.19 2k6x h ILE 39 Cb 0.01 0.64 -0.01 0.00 -3.03 0.00 0.00 36.82 34.43 2k6x h ILE 39 CO -0.02 0.20 0.01 -1.28 -0.68 0.00 0.00 178.15 176.38 2k6x h SER 40 N 0.62 0.57 -0.79 1.72 0.87 -0.52 -2.34 113.55 113.68 2k6x h SER 40 Ca 0.15 -0.30 0.03 0.00 -1.23 0.00 0.00 61.79 60.44 2k6x h SER 40 Cb 0.12 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 61.88 2k6x h SER 40 CO -0.02 0.74 0.52 -0.07 -0.53 0.00 0.00 176.83 177.47 2k6x h LEU 41 N 0.39 0.84 -0.61 2.23 3.38 0.42 0.11 115.31 122.07 2k6x h LEU 41 Ca 0.10 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 2k6x h LEU 41 Cb 0.44 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2k6x h LEU 41 CO 0.02 0.58 -0.20 1.23 0.09 0.00 0.00 178.44 180.15 2k6x h GLY 42 N 0.97 0.96 1.53 0.83 0.00 -1.12 0.50 103.07 106.75 2k6x h GLY 42 Ca 0.31 -0.82 -0.11 0.00 0.00 0.00 0.00 47.33 46.72 2k6x h GLY 42 CO -0.09 0.75 -0.29 1.70 0.00 0.00 0.00 176.54 178.61 2k6x h LYS 43 N 0.77 0.53 -0.32 4.80 1.63 -0.69 0.28 116.57 123.57 2k6x h LYS 43 Ca 0.11 -0.22 -0.15 0.00 -0.85 0.00 0.00 60.65 59.53 2k6x h LYS 43 Cb 0.74 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.35 2k6x h LYS 43 CO 0.06 0.77 -0.41 0.87 -3.45 0.00 0.00 179.45 177.28 2k6x h LYS 44 N 0.46 0.81 0.00 1.90 6.56 -0.35 -2.92 116.57 123.02 2k6x h LYS 44 Ca 0.06 -0.43 -0.08 0.00 -1.06 0.00 0.00 60.65 59.14 2k6x h LYS 44 Cb 0.74 0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.41 2k6x h LYS 44 CO 0.06 1.07 -0.39 0.87 -2.06 0.00 0.00 179.45 178.99 2k6x h LYS 45 N 0.65 0.00 0.00 3.15 1.79 0.49 -3.47 116.57 119.18 2k6x h LYS 45 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 2k6x h LYS 45 Cb 0.98 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 2k6x h LYS 45 CO 0.09 0.39 0.00 0.41 -1.08 0.00 0.00 179.45 179.26 2k6x n GLY 46 N -0.28 -0.38 3.13 3.86 0.00 0.88 -5.06 105.19 107.35 2k6x n GLY 46 Ca -0.02 0.30 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 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 0.80 -1.11 1.61 2.02 -0.50 -4.72 117.35 115.46 2k6x s TYR 47 Ca 0.00 -0.81 -0.21 0.00 -0.37 0.00 0.00 57.07 55.68 2k6x s TYR 47 Cb 0.00 -0.47 0.07 0.00 -0.40 0.00 0.00 41.96 41.15 2k6x s TYR 47 CO 0.00 -0.15 1.52 0.96 -1.57 0.00 0.00 175.55 176.31 2k6x s ILE 48 N -3.02 4.07 0.06 2.71 -5.25 -1.26 -3.63 121.20 114.88 2k6x s ILE 48 Ca 0.05 -1.23 -0.18 0.00 -0.99 0.00 0.00 60.65 58.30 2k6x s ILE 48 Cb 0.01 -5.08 0.04 0.00 2.95 0.00 0.00 42.46 40.38 2k6x s ILE 48 CO -0.04 -1.93 0.43 0.28 -1.79 0.00 0.00 174.94 171.89 2k6x s THR 49 N 4.49 0.05 0.26 8.37 -1.32 -1.24 0.28 115.64 126.54 2k6x s THR 49 Ca 0.48 -0.44 -0.03 0.00 -1.21 0.00 0.00 61.69 60.48 2k6x s THR 49 Cb 0.01 -0.99 0.26 0.00 -1.51 0.00 0.00 72.50 70.26 2k6x s THR 49 CO -0.04 -0.24 1.88 0.22 -2.21 0.00 0.00 174.62 174.23 2k6x h TYR 50 N 2.86 1.17 -0.22 9.09 3.20 -1.18 0.44 116.97 132.33 2k6x h TYR 50 Ca -0.32 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.48 2k6x h TYR 50 Cb 1.22 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 2k6x h TYR 50 CO 0.39 0.62 -0.30 0.93 -1.64 0.00 0.00 178.16 178.15 2k6x h GLU 51 N 1.16 0.44 -0.02 1.82 5.08 -1.87 0.27 114.58 121.46 2k6x h GLU 51 Ca 0.41 -0.18 -0.14 0.00 -1.00 0.00 0.00 59.36 58.45 2k6x h GLU 51 Cb 0.13 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2k6x h GLU 51 CO -0.16 0.70 -0.63 -0.44 -1.00 0.00 0.00 179.01 177.48 2k6x h ASP 52 N 0.39 0.09 -0.06 1.42 5.19 -1.61 -0.24 116.42 121.59 2k6x h ASP 52 Ca 0.05 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2k6x h ASP 52 Cb 0.73 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.21 2k6x h ASP 52 CO 0.06 0.70 0.01 0.40 -3.12 0.00 0.00 179.24 177.29 2k6x h ILE 53 N 0.06 1.19 -0.54 0.35 1.08 -0.18 -0.09 117.51 119.37 2k6x h ILE 53 Ca -0.01 -0.56 0.07 0.00 -0.39 0.00 0.00 64.86 63.97 2k6x h ILE 53 Cb 1.13 1.46 -0.03 0.00 -3.07 0.00 0.00 36.82 36.30 2k6x h ILE 53 CO 0.09 0.16 0.36 -0.78 -0.69 0.00 0.00 178.15 177.29 2k6x h ASP 54 N -0.12 0.39 1.49 1.72 3.58 -0.37 0.16 116.42 123.27 2k6x h ASP 54 Ca 0.02 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2k6x h ASP 54 Cb 0.24 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 2k6x h ASP 54 CO 0.00 0.25 -0.17 0.07 -2.88 0.00 0.00 179.24 176.51 2k6x h LYS 55 N 0.44 0.00 0.00 0.28 2.10 -0.75 -3.07 116.57 115.57 2k6x h LYS 55 Ca 0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.89 2k6x h LYS 55 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 2k6x h LYS 55 CO -0.07 0.17 -0.14 0.00 -2.00 0.00 0.00 179.45 177.42 2k6x h ALA 56 N 1.83 0.93 -2.62 0.07 0.00 0.12 -3.46 119.26 116.13 2k6x h ALA 56 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 2k6x h ALA 56 Cb 0.97 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.87 2k6x h ALA 56 CO 0.02 0.00 0.53 0.34 0.00 0.00 0.00 179.25 180.14 2k6x n PHE 57 N -2.93 2.31 -3.00 0.00 7.35 -0.81 -4.20 117.46 116.19 2k6x n PHE 57 Ca 0.04 0.53 -0.34 0.00 -0.76 0.00 0.00 57.45 56.92 2k6x n PHE 57 Cb 0.52 -2.42 -0.06 0.00 0.35 0.00 0.00 39.48 37.87 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 -1.99 4.16 0.00 -7.13 0.04 -1.26 -5.06 135.00 123.76 2k6x s PRO 58 Ca 0.57 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.50 2k6x s PRO 58 Cb -0.54 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.55 2k6x s PRO 58 CO 0.61 0.14 0.00 -0.35 0.04 0.00 0.00 177.00 177.45 2k6x n PRO 59 N -0.21 3.09 -0.40 0.56 -0.05 -1.26 -5.02 135.00 131.71 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 0.53 0.00 0.30 0.00 -0.05 0.00 0.00 33.50 34.28 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 -0.04 3.77 -4.65 3.54 8.00 -1.26 -4.96 116.55 120.96 2k6x n ASP 60 Ca 0.00 -2.11 -0.42 0.00 0.71 0.00 0.00 54.79 52.97 2k6x n ASP 60 Cb 0.00 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 40.60 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 -1.30 1.51 -0.87 1.24 0.08 -1.26 -4.84 117.98 112.55 2k6x s PHE 61 Ca 0.45 -0.08 0.27 0.00 0.12 0.00 0.00 56.93 57.69 2k6x s PHE 61 Cb 0.25 -4.10 0.90 0.00 -0.57 0.00 0.00 43.02 39.49 2k6x s PHE 61 CO 0.28 -4.72 1.74 0.39 -0.10 0.00 0.00 175.22 172.81 2k6x n GLU 62 N 7.60 0.12 -3.65 0.44 1.02 -1.26 -4.77 120.64 120.14 2k6x n GLU 62 Ca 0.20 0.08 -0.04 0.00 -0.02 0.00 0.00 57.16 57.38 2k6x n GLU 62 Cb 0.42 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 30.17 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 -3.26 -0.68 -0.08 0.62 0.00 -1.26 -5.15 107.32 97.51 2k6x s GLY 63 Ca 0.12 2.34 0.03 0.00 0.00 0.00 0.00 44.72 47.21 2k6x s GLY 63 CO 0.60 2.76 -0.15 -0.11 0.00 0.00 0.00 173.10 176.19 2k6x s PHE 64 N 2.35 2.71 0.25 1.90 -0.71 -1.26 -5.00 117.98 118.21 2k6x s PHE 64 Ca -0.08 -0.37 -0.22 0.00 -1.04 0.00 0.00 56.93 55.23 2k6x s PHE 64 Cb -0.09 -1.69 0.03 0.00 -1.21 0.00 0.00 43.02 40.06 2k6x s PHE 64 CO -0.19 0.02 0.72 0.34 -1.34 0.00 0.00 175.22 174.77 2k6x s ASP 65 N -0.33 -0.30 0.46 1.98 2.15 -1.26 -5.02 116.67 114.34 2k6x s ASP 65 Ca 0.03 -0.49 0.13 0.00 0.43 0.00 0.00 52.55 52.65 2k6x s ASP 65 Cb -0.13 0.69 1.08 0.00 -0.30 0.00 0.00 42.92 44.26 2k6x s ASP 65 CO 0.02 -1.25 2.06 0.74 -0.17 0.00 0.00 175.17 176.58 2k6x h THR 66 N 2.00 0.98 -0.38 1.71 2.02 -2.01 -0.75 112.91 116.49 2k6x h THR 66 Ca -0.22 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 2k6x h THR 66 Cb 1.26 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 2k6x h THR 66 CO 0.26 0.05 0.18 -1.13 0.37 0.00 0.00 175.52 175.25 2k6x h ASN 67 N 0.29 0.47 -0.86 4.18 -0.00 -1.99 -1.21 115.58 116.46 2k6x h ASN 67 Ca 0.15 -0.04 0.03 0.00 -0.00 0.00 0.00 56.30 56.44 2k6x h ASN 67 Cb 0.22 -0.12 -0.05 0.00 -0.00 0.00 0.00 38.32 38.38 2k6x h ASN 67 CO -0.03 0.40 0.55 0.25 -0.00 0.00 0.00 177.43 178.61 2k6x h LEU 68 N 0.53 0.93 -0.96 0.34 5.85 -1.52 0.39 115.31 120.87 2k6x h LEU 68 Ca 0.13 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 2k6x h LEU 68 Cb 0.06 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2k6x h LEU 68 CO -0.02 0.65 0.45 0.40 -0.34 0.00 0.00 178.44 179.58 2k6x h ILE 69 N 1.09 1.25 -0.35 4.05 1.08 -1.23 0.44 117.51 123.85 2k6x h ILE 69 Ca 0.34 -0.64 -0.09 0.00 -0.39 0.00 0.00 64.86 64.08 2k6x h ILE 69 Cb -0.02 0.11 -0.01 0.00 -3.07 0.00 0.00 36.82 33.83 2k6x h ILE 69 CO -0.11 0.28 -0.15 -0.33 -0.69 0.00 0.00 178.15 177.16 2k6x h GLU 70 N 1.19 0.71 -0.20 2.37 5.08 -1.06 -3.03 114.58 119.64 2k6x h GLU 70 Ca 0.30 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2k6x h GLU 70 Cb 0.04 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2k6x h GLU 70 CO -0.05 0.90 -0.12 0.00 -1.00 0.00 0.00 179.01 178.75 2k6x h ARG 71 N 0.49 0.32 0.13 2.33 3.08 0.69 0.57 114.38 122.00 2k6x h ARG 71 Ca 0.08 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2k6x h ARG 71 Cb 0.68 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2k6x h ARG 71 CO 0.05 0.45 -0.06 0.82 -1.07 0.00 0.00 179.97 180.15 2k6x h ILE 72 N 0.31 0.92 -0.13 2.04 2.04 -0.03 0.20 117.51 122.86 2k6x h ILE 72 Ca 0.06 -0.17 -0.11 0.00 1.00 0.00 0.00 64.86 65.64 2k6x h ILE 72 Cb 0.40 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2k6x h ILE 72 CO 0.02 0.04 -0.39 1.12 0.00 0.00 0.00 178.15 178.94 2k6x h HIS 73 N -0.25 0.32 -0.30 1.37 2.07 -1.41 0.99 115.15 117.94 2k6x h HIS 73 Ca -0.02 -0.08 0.01 0.00 -2.85 0.00 0.00 60.37 57.43 2k6x h HIS 73 Cb 0.20 -0.07 -0.02 0.00 2.57 0.00 0.00 27.41 30.09 2k6x h HIS 73 CO -0.04 0.63 0.18 0.93 -3.07 0.00 0.00 177.93 176.56 2k6x h GLU 74 N 0.23 0.35 -0.21 5.12 5.08 -0.64 0.12 114.58 124.63 2k6x h GLU 74 Ca 0.02 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 2k6x h GLU 74 Cb 0.80 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 2k6x h GLU 74 CO 0.06 0.23 -0.09 0.93 -1.00 0.00 0.00 179.01 179.14 2k6x h GLU 75 N 0.36 0.34 -0.31 2.33 4.39 -0.25 0.59 114.58 122.04 2k6x h GLU 75 Ca 0.12 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 2k6x h GLU 75 Cb -0.00 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2k6x h GLU 75 CO -0.06 0.44 0.18 1.25 -1.16 0.00 0.00 179.01 179.67 2k6x h LEU 76 N 0.32 0.37 0.00 1.33 5.85 0.04 0.20 115.31 123.43 2k6x h LEU 76 Ca 0.07 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 2k6x h LEU 76 Cb 0.37 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 2k6x h LEU 76 CO 0.02 0.32 -0.30 -0.08 -0.34 0.00 0.00 178.44 178.05 2k6x h GLU 77 N 0.39 0.00 -0.08 1.25 4.81 -0.37 -2.26 114.58 118.32 2k6x h GLU 77 Ca 0.11 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.23 2k6x h GLU 77 Cb 0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2k6x h GLU 77 CO -0.02 0.84 -0.37 0.87 -0.73 0.00 0.00 179.01 179.61 2k6x h LYS 78 N -1.00 0.39 0.00 1.92 1.57 0.07 -3.30 116.57 116.22 2k6x h LYS 78 Ca -0.08 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2k6x h LYS 78 Cb 0.93 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.31 2k6x h LYS 78 CO -0.05 0.95 -1.34 0.72 -0.57 0.00 0.00 179.45 179.17 2k6x n HIS 79 N -4.37 0.22 -1.18 -1.35 8.25 -0.26 -4.99 115.22 111.54 2k6x n HIS 79 Ca -0.08 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2k6x n HIS 79 Cb 0.53 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 1.33 0.58 3.66 -1.41 0.00 0.56 -4.96 105.19 104.95 2k6x n GLY 80 Ca 0.00 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.78 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 4.03 -0.12 -0.61 2.07 -1.03 -4.95 121.20 118.59 2k6x s ILE 81 Ca 0.00 1.23 -0.28 0.00 -1.41 0.00 0.00 60.65 60.19 2k6x s ILE 81 Cb 0.00 -3.82 -0.01 0.00 0.13 0.00 0.00 42.46 38.76 2k6x s ILE 81 CO 0.00 -0.13 0.95 0.20 -1.91 0.00 0.00 174.94 174.05 2k6x s ASN 82 N 2.55 7.16 -0.30 4.50 0.02 -1.26 -4.59 114.94 123.03 2k6x s ASN 82 Ca 0.61 1.43 -0.14 0.00 -1.02 0.00 0.00 52.86 53.74 2k6x s ASN 82 Cb -0.25 -2.53 0.14 0.00 0.02 0.00 0.00 41.25 38.64 2k6x s ASN 82 CO 0.20 -0.43 0.88 -0.51 0.02 0.00 0.00 177.10 177.26 2k6x s ILE 83 N 2.03 -0.46 0.29 0.60 1.10 -1.26 -4.96 121.20 118.54 2k6x s ILE 83 Ca 0.45 0.00 -0.09 0.00 -0.51 0.00 0.00 60.65 60.50 2k6x s ILE 83 Cb -0.18 -1.00 -0.07 0.00 0.15 0.00 0.00 42.46 41.37 2k6x s ILE 83 CO 0.16 0.00 0.61 0.54 -2.11 0.00 0.00 174.94 174.15 2k6x s VAL 84 N 2.23 4.90 -0.13 4.00 0.11 0.14 -4.92 120.40 126.74 2k6x s VAL 84 Ca -0.05 0.43 0.19 0.00 -2.93 0.00 0.00 61.98 59.61 2k6x s VAL 84 Cb -0.07 -3.67 -0.21 0.00 -1.53 0.00 0.00 36.38 30.89 2k6x s VAL 84 CO -0.17 -0.25 0.53 -0.62 -3.33 0.00 0.00 175.10 171.26 2k6x n GLU 85 N -0.64 0.65 -0.76 1.54 1.02 -1.26 -0.96 120.64 120.23 2k6x n GLU 85 Ca 0.01 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2k6x n GLU 85 Cb 0.53 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 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 -2.69 0.00 -4.21 1.62 5.15 -1.26 -4.00 115.26 109.87 2k6x n ASN 86 Ca -0.15 0.00 -0.17 0.00 -0.60 0.00 0.00 54.58 53.66 2k6x n ASN 86 Cb 0.85 -0.88 -0.11 0.00 -0.53 0.00 0.00 39.78 39.11 2k6x n ASN 86 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 2k6x s GLU 87 N -0.34 0.94 0.12 1.20 4.04 -1.26 -5.04 118.70 118.36 2k6x s GLU 87 Ca 0.00 -1.16 -0.25 0.00 0.04 0.00 0.00 54.97 53.60 2k6x s GLU 87 Cb 0.00 -0.79 -0.06 0.00 0.02 0.00 0.00 34.13 33.30 2k6x s GLU 87 CO 0.00 0.15 1.65 -1.35 -1.84 0.00 0.00 175.26 173.87 2k6x h PRO 88 N 3.67 -0.33 0.00 -4.83 0.11 -1.93 -3.46 132.00 125.23 2k6x h PRO 88 Ca -0.39 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2k6x h PRO 88 Cb 1.19 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2k6x h PRO 88 CO 0.49 -0.22 0.00 -1.91 -0.21 0.00 0.00 178.00 176.15 2k6x n GLU 89 N -5.34 0.00 -1.24 1.05 2.13 -1.26 -4.97 120.64 111.01 2k6x n GLU 89 Ca -0.05 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.75 2k6x n GLU 89 Cb 0.25 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.94 2k6x n GLU 89 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2k6x n GLU 90 N -1.75 0.01 -0.74 5.31 4.07 -1.26 -4.93 120.64 121.35 2k6x n GLU 90 Ca 0.00 -1.47 0.06 0.00 -0.06 0.00 0.00 57.16 55.69 2k6x n GLU 90 Cb 0.00 0.26 0.16 0.00 -0.06 0.00 0.00 31.44 31.80 2k6x n GLU 90 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2k6x n GLU 91 N 0.22 1.17 0.26 5.31 -0.58 -1.26 -3.73 120.64 122.03 2k6x n GLU 91 Ca -0.12 -2.89 -0.11 0.00 -0.42 0.00 0.00 57.16 53.62 2k6x n GLU 91 Cb 0.91 -1.23 -0.05 0.00 -0.57 0.00 0.00 31.44 30.50 2k6x n GLU 91 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2k6x h GLU 92 N 0.87 -0.66 0.00 3.49 4.22 -1.94 -3.38 114.58 117.18 2k6x h GLU 92 Ca -0.05 0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2k6x h GLU 92 Cb 1.20 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.60 2k6x h GLU 92 CO 0.02 -0.44 -0.95 0.44 -2.18 0.00 0.00 179.01 175.90 2k6x n ILE 93 N -4.29 0.00 -0.97 2.32 -5.35 -1.26 -5.00 119.36 104.82 2k6x n ILE 93 Ca -0.09 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2k6x n ILE 93 Cb 0.27 0.60 0.00 0.00 -1.74 0.00 0.00 39.64 38.77 2k6x n ILE 93 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2k6x n SER 94 N -1.53 -4.47 -2.59 7.28 2.88 -1.24 -4.86 113.62 109.09 2k6x n SER 94 Ca -0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.18 2k6x n SER 94 Cb 0.17 -2.41 0.05 0.00 -0.75 0.00 0.00 64.21 61.27 2k6x n SER 94 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k6x n ALA 95 N 1.00 6.16 -1.89 -1.46 0.00 -1.26 -4.98 120.51 118.08 2k6x n ALA 95 Ca 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 53.44 49.54 2k6x n ALA 95 Cb 0.30 -1.61 0.00 0.00 0.00 0.00 0.00 19.45 18.14 2k6x n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91