#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fkx n ILE 2 N 0.00 0.00 0.00 0.52 5.41 -1.26 -4.76 119.36 119.27 2fkx n ILE 2 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2fkx n ILE 2 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2fkx n ILE 2 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2fkx n THR 3 N 0.00 0.00 -0.05 1.39 5.66 -1.26 -4.25 114.28 115.77 2fkx n THR 3 Ca 0.00 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.88 2fkx n THR 3 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 2fkx n THR 3 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 2fkx h LYS 4 N 0.00 0.27 -0.00 1.09 3.64 -2.00 0.84 116.57 120.41 2fkx h LYS 4 Ca 0.00 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2fkx h LYS 4 Cb 0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2fkx h LYS 4 CO 0.00 0.52 -0.10 0.39 -2.27 0.00 0.00 179.45 177.99 2fkx n GLU 5 N -4.74 0.20 0.04 1.90 1.02 -1.26 -2.23 120.64 115.58 2fkx n GLU 5 Ca -0.05 -0.04 -0.06 0.00 -0.02 0.00 0.00 57.16 56.98 2fkx n GLU 5 Cb 0.23 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.04 2fkx n GLU 5 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2fkx h GLU 6 N 0.10 0.00 -0.11 3.49 4.39 -1.76 -1.76 114.58 118.92 2fkx h GLU 6 Ca 0.00 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.61 2fkx h GLU 6 Cb 0.43 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2fkx h GLU 6 CO 0.00 0.77 -0.27 -0.22 -1.16 0.00 0.00 179.01 178.13 2fkx h LYS 7 N 0.00 0.38 -0.74 2.33 3.64 -0.55 -1.38 116.57 120.25 2fkx h LYS 7 Ca -0.10 -0.26 0.05 0.00 -1.27 0.00 0.00 60.65 59.07 2fkx h LYS 7 Cb 1.80 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.60 2fkx h LYS 7 CO 0.11 0.87 0.45 1.96 -2.27 0.00 0.00 179.45 180.57 2fkx h GLN 8 N -0.05 0.83 -0.38 1.90 4.20 -1.43 -0.57 115.11 119.60 2fkx h GLN 8 Ca -0.00 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 2fkx h GLN 8 Cb 0.88 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 2fkx h GLN 8 CO 0.06 0.55 0.13 -0.22 -0.67 0.00 0.00 178.83 178.67 2fkx h LYS 9 N 0.85 0.54 -0.29 1.46 3.64 -1.25 -0.49 116.57 121.03 2fkx h LYS 9 Ca 0.32 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.57 2fkx h LYS 9 Cb 0.11 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2fkx h LYS 9 CO -0.15 0.47 -0.01 0.28 -2.27 0.00 0.00 179.45 177.77 2fkx h VAL 10 N 0.54 1.26 0.00 2.00 2.07 0.04 -1.28 116.25 120.87 2fkx h VAL 10 Ca 0.13 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2fkx h VAL 10 Cb 0.15 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2fkx h VAL 10 CO -0.01 0.30 0.00 0.40 0.02 0.00 0.00 177.57 178.29 2fkx h ILE 11 N 0.30 0.00 0.11 4.57 1.08 -1.08 0.25 117.51 122.74 2fkx h ILE 11 Ca 0.08 -0.49 -0.01 0.00 -0.39 0.00 0.00 64.86 64.05 2fkx h ILE 11 Cb 0.44 1.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.63 2fkx h ILE 11 CO 0.02 0.00 -0.05 -0.61 -0.69 0.00 0.00 178.15 176.81 2fkx h GLN 12 N 0.00 -0.14 -0.00 2.37 4.15 -0.86 -3.38 115.11 117.25 2fkx h GLN 12 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2fkx h GLN 12 Cb 0.68 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.40 2fkx h GLN 12 CO 0.00 -0.10 -0.50 0.39 -1.93 0.00 0.00 178.83 176.70 2fkx n GLU 13 N -3.40 0.31 -1.83 1.69 -0.58 -0.50 -5.03 120.64 111.29 2fkx n GLU 13 Ca -0.02 -0.20 0.00 0.00 -0.42 0.00 0.00 57.16 56.53 2fkx n GLU 13 Cb 0.06 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 2fkx n GLU 13 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2fkx n PHE 14 N -1.18 -4.73 0.32 -0.32 3.72 0.89 -4.74 117.46 111.42 2fkx n PHE 14 Ca 0.07 2.49 0.16 0.00 -0.05 0.00 0.00 57.45 60.12 2fkx n PHE 14 Cb 0.35 -3.64 0.61 0.00 -0.94 0.00 0.00 39.48 35.86 2fkx n PHE 14 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2fkx h ALA 15 N 2.49 1.00 -5.91 4.37 0.00 -1.88 -3.47 119.26 115.86 2fkx h ALA 15 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.54 2fkx h ALA 15 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 17.79 17.90 2fkx h ALA 15 CO 0.00 0.00 -0.86 0.54 0.00 0.00 0.00 179.25 178.93 2fkx n ARG 16 N -2.84 -3.27 -4.03 0.00 3.00 -1.26 -5.02 116.66 103.23 2fkx n ARG 16 Ca 0.01 0.66 -0.12 0.00 -0.01 0.00 0.00 57.85 58.39 2fkx n ARG 16 Cb 0.29 -5.12 -0.12 0.00 0.00 0.00 0.00 32.46 27.52 2fkx n ARG 16 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2fkx s PHE 17 N -3.51 0.48 0.59 -1.55 0.08 -1.26 -5.02 117.98 107.78 2fkx s PHE 17 Ca 0.26 -0.44 0.29 0.00 0.12 0.00 0.00 56.93 57.16 2fkx s PHE 17 Cb -0.06 -0.30 1.52 0.00 -0.57 0.00 0.00 43.02 43.61 2fkx s PHE 17 CO 0.80 -0.10 1.95 -1.35 -0.10 0.00 0.00 175.22 176.42 2fkx h PRO 18 N 4.81 0.00 -0.77 0.24 0.11 -1.98 -1.94 132.00 132.47 2fkx h PRO 18 Ca -0.33 0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.28 2fkx h PRO 18 Cb 1.20 0.00 -0.42 0.00 0.11 0.00 0.00 31.00 31.89 2fkx h PRO 18 CO 0.42 0.00 -0.86 0.41 -0.21 0.00 0.00 178.00 177.76 2fkx n GLY 19 N -1.48 5.60 0.34 -0.55 0.00 -1.26 -3.99 105.19 103.85 2fkx n GLY 19 Ca 0.06 -2.41 -0.17 0.00 0.00 0.00 0.00 46.02 43.50 2fkx n GLY 19 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2fkx h ASP 20 N 2.29 -0.69 0.00 1.61 2.03 -1.75 -3.37 116.42 116.55 2fkx h ASP 20 Ca 0.28 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 2fkx h ASP 20 Cb 1.44 0.18 0.00 0.00 -0.83 0.00 0.00 39.33 40.12 2fkx h ASP 20 CO 0.68 -0.46 0.00 0.41 -1.03 0.00 0.00 179.24 178.83 2fkx n THR 21 N -5.42 0.00 -3.41 1.15 -1.04 -1.26 -4.96 114.28 99.34 2fkx n THR 21 Ca -0.13 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.69 2fkx n THR 21 Cb 0.34 1.60 0.08 0.00 -1.82 0.00 0.00 70.33 70.52 2fkx n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fkx n GLY 22 N 0.00 -0.35 3.86 3.41 0.00 -1.26 -4.99 105.19 105.87 2fkx n GLY 22 Ca 0.00 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2fkx n GLY 22 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fkx s SER 23 N -3.70 6.44 0.08 1.61 0.15 -1.26 -4.97 113.70 112.05 2fkx s SER 23 Ca 0.30 1.40 0.02 0.00 0.70 0.00 0.00 55.95 58.37 2fkx s SER 23 Cb -0.13 -2.45 -0.25 0.00 -1.71 0.00 0.00 66.02 61.48 2fkx s SER 23 CO 0.66 -0.66 1.15 0.74 1.20 0.00 0.00 173.24 176.33 2fkx h THR 24 N 0.44 1.53 -0.18 6.45 2.02 -2.00 -3.27 112.91 117.90 2fkx h THR 24 Ca -0.46 -3.18 -0.01 0.00 0.77 0.00 0.00 66.41 63.53 2fkx h THR 24 Cb 1.19 2.86 -0.01 0.00 -1.74 0.00 0.00 68.15 70.45 2fkx h THR 24 CO 0.62 0.90 0.06 -0.33 0.37 0.00 0.00 175.52 177.14 2fkx h GLU 25 N 0.04 0.27 -0.20 6.66 5.08 -1.97 -2.15 114.58 122.31 2fkx h GLU 25 Ca -0.10 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2fkx h GLU 25 Cb 1.89 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.09 2fkx h GLU 25 CO 0.16 0.38 0.14 -0.24 -1.00 0.00 0.00 179.01 178.45 2fkx h VAL 26 N 0.11 0.95 -0.00 3.13 3.04 -1.97 -0.00 116.25 121.52 2fkx h VAL 26 Ca 0.06 -0.04 -0.24 0.00 -1.01 0.00 0.00 66.70 65.47 2fkx h VAL 26 Cb 0.22 0.84 0.01 0.00 -2.01 0.00 0.00 31.29 30.35 2fkx h VAL 26 CO -0.00 0.02 -0.99 -0.61 -1.01 0.00 0.00 177.57 174.98 2fkx h GLN 27 N 0.10 0.55 -0.01 4.17 4.15 -1.49 0.11 115.11 122.69 2fkx h GLN 27 Ca 0.09 -0.59 -0.11 0.00 0.77 0.00 0.00 58.65 58.81 2fkx h GLN 27 Cb 0.23 0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 2fkx h GLN 27 CO -0.01 1.21 -0.52 0.28 -1.93 0.00 0.00 178.83 177.85 2fkx h VAL 28 N 0.31 1.37 -0.41 2.39 2.07 -0.76 0.53 116.25 121.75 2fkx h VAL 28 Ca -0.10 -1.80 -0.08 0.00 0.82 0.00 0.00 66.70 65.54 2fkx h VAL 28 Cb 1.63 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.34 2fkx h VAL 28 CO 0.18 0.52 -0.04 0.00 0.02 0.00 0.00 177.57 178.25 2fkx h ALA 29 N 1.45 0.56 0.00 1.67 0.00 -0.69 0.14 119.26 122.38 2fkx h ALA 29 Ca -0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2fkx h ALA 29 Cb 0.94 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2fkx h ALA 29 CO 0.07 0.38 -0.39 1.37 0.00 0.00 0.00 179.25 180.67 2fkx h LEU 30 N 0.57 0.00 -0.23 0.00 8.10 -0.42 -0.85 115.31 122.49 2fkx h LEU 30 Ca 0.11 0.00 -0.21 0.00 0.11 0.00 0.00 57.88 57.89 2fkx h LEU 30 Cb 0.54 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.77 2fkx h LEU 30 CO 0.03 0.39 -0.69 0.17 -4.11 0.00 0.00 178.44 174.23 2fkx h LEU 31 N 0.00 0.93 -0.45 0.17 8.10 0.35 0.19 115.31 124.61 2fkx h LEU 31 Ca -0.00 -0.57 -0.13 0.00 0.11 0.00 0.00 57.88 57.29 2fkx h LEU 31 Cb 1.14 -0.27 -0.01 0.00 -0.44 0.00 0.00 40.66 41.08 2fkx h LEU 31 CO 0.05 1.36 -0.21 0.74 -4.11 0.00 0.00 178.44 176.27 2fkx h THR 32 N 0.57 1.27 -0.33 0.15 2.02 -0.62 0.55 112.91 116.52 2fkx h THR 32 Ca -0.03 -1.37 -0.05 0.00 0.77 0.00 0.00 66.41 65.74 2fkx h THR 32 Cb 1.31 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 2fkx h THR 32 CO 0.15 0.47 0.00 0.25 0.37 0.00 0.00 175.52 176.75 2fkx h LEU 33 N 0.78 0.48 0.06 2.58 5.85 -1.05 0.13 115.31 124.13 2fkx h LEU 33 Ca 0.10 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 2fkx h LEU 33 Cb 0.78 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2fkx h LEU 33 CO 0.06 0.55 -0.03 -0.09 -0.34 0.00 0.00 178.44 178.59 2fkx h ARG 34 N 0.49 -0.08 -0.50 1.25 2.43 -0.12 -1.06 114.38 116.80 2fkx h ARG 34 Ca 0.11 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.35 2fkx h ARG 34 Cb 0.32 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.83 2fkx h ARG 34 CO 0.01 0.26 0.19 0.82 -1.51 0.00 0.00 179.97 179.74 2fkx h ILE 35 N -0.43 0.85 -0.23 1.20 2.04 -0.58 0.48 117.51 120.85 2fkx h ILE 35 Ca -0.01 -0.13 0.06 0.00 1.00 0.00 0.00 64.86 65.78 2fkx h ILE 35 Cb 0.38 0.44 -0.07 0.00 -0.74 0.00 0.00 36.82 36.83 2fkx h ILE 35 CO 0.01 0.07 -0.30 -1.13 0.00 0.00 0.00 178.15 176.80 2fkx h ASN 36 N 0.38 -0.97 0.74 1.72 -0.73 -0.66 0.34 115.58 116.40 2fkx h ASN 36 Ca 0.24 0.16 -0.22 0.00 1.87 0.00 0.00 56.30 58.34 2fkx h ASN 36 Cb 0.24 0.43 -0.01 0.00 0.27 0.00 0.00 38.32 39.24 2fkx h ASN 36 CO -0.23 -0.33 -1.01 0.03 -0.37 0.00 0.00 177.43 175.52 2fkx h ARG 37 N -0.32 0.14 -0.23 6.67 3.08 -0.75 -2.30 114.38 120.66 2fkx h ARG 37 Ca 0.12 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2fkx h ARG 37 Cb 0.52 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 2fkx h ARG 37 CO -0.41 1.03 0.09 1.25 -1.07 0.00 0.00 179.97 180.86 2fkx h LEU 38 N 0.06 0.33 -1.25 3.04 7.12 0.24 -1.66 115.31 123.20 2fkx h LEU 38 Ca -0.06 -0.17 -0.04 0.00 0.13 0.00 0.00 57.88 57.74 2fkx h LEU 38 Cb 1.71 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 41.73 2fkx h LEU 38 CO 0.15 0.41 0.11 -1.28 -0.13 0.00 0.00 178.44 177.70 2fkx h SER 39 N 0.22 0.58 0.78 1.25 0.87 -0.33 -1.03 113.55 115.89 2fkx h SER 39 Ca 0.08 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2fkx h SER 39 Cb 0.19 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2fkx h SER 39 CO -0.01 0.57 0.00 -0.62 -0.53 0.00 0.00 176.83 176.25 2fkx n GLU 40 N -4.32 0.09 -0.01 2.24 1.02 -0.87 -1.36 120.64 117.43 2fkx n GLU 40 Ca 0.03 0.06 -0.09 0.00 -0.02 0.00 0.00 57.16 57.14 2fkx n GLU 40 Cb 0.20 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.98 2fkx n GLU 40 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2fkx h HIS 41 N 0.00 0.01 0.00 -0.32 3.86 -0.33 -3.33 115.15 115.03 2fkx h HIS 41 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2fkx h HIS 41 Cb 0.39 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.86 2fkx h HIS 41 CO 0.00 1.01 0.00 -0.07 0.86 0.00 0.00 177.93 179.73 2fkx h LEU 42 N 0.00 0.00 0.00 2.43 3.38 -0.14 -1.09 115.31 119.89 2fkx h LEU 42 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2fkx h LEU 42 Cb 2.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.75 2fkx h LEU 42 CO 0.08 0.00 0.00 2.29 0.09 0.00 0.00 178.44 180.90 2fkx n LYS 43 N -2.60 0.09 -0.12 1.13 2.85 -0.46 -2.66 118.16 116.40 2fkx n LYS 43 Ca 0.03 0.06 -0.24 0.00 -1.05 0.00 0.00 58.31 57.11 2fkx n LYS 43 Cb 0.36 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 33.15 2fkx n LYS 43 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2fkx n VAL 44 N -1.45 1.52 -1.38 0.58 0.31 -0.78 -4.39 118.33 112.75 2fkx n VAL 44 Ca 0.08 -0.18 -0.39 0.00 -0.01 0.00 0.00 64.34 63.83 2fkx n VAL 44 Cb 0.28 -2.01 -0.02 0.00 -0.91 0.00 0.00 33.84 31.17 2fkx n VAL 44 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2fkx n HIS 45 N -4.35 2.61 -0.36 3.52 8.25 -0.48 -4.81 115.22 119.59 2fkx n HIS 45 Ca -0.40 -3.04 -0.09 0.00 -0.26 0.00 0.00 57.72 53.93 2fkx n HIS 45 Cb 0.75 -2.48 -0.07 0.00 1.12 0.00 0.00 29.99 29.30 2fkx n HIS 45 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2fkx n LYS 46 N 4.11 -0.36 -0.58 -0.41 4.81 -1.09 -2.40 118.16 122.25 2fkx n LYS 46 Ca 0.73 1.29 0.03 0.00 -0.87 0.00 0.00 58.31 59.49 2fkx n LYS 46 Cb 0.26 -1.90 0.05 0.00 0.02 0.00 0.00 35.03 33.46 2fkx n LYS 46 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2fkx n LYS 47 N -5.08 0.42 0.00 1.64 5.02 -1.26 -4.73 118.16 114.16 2fkx n LYS 47 Ca 0.02 -1.71 0.11 0.00 -2.02 0.00 0.00 58.31 54.72 2fkx n LYS 47 Cb 0.23 -0.73 0.04 0.00 -0.02 0.00 0.00 35.03 34.55 2fkx n LYS 47 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2fkx n ASP 48 N -0.33 0.79 -4.74 4.39 2.03 -1.01 -4.96 116.55 112.73 2fkx n ASP 48 Ca 0.06 -0.69 -0.41 0.00 0.52 0.00 0.00 54.79 54.27 2fkx n ASP 48 Cb 0.76 0.68 -0.04 0.00 -0.72 0.00 0.00 41.12 41.80 2fkx n ASP 48 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 2fkx s HIS 49 N -3.00 3.51 -0.02 -0.67 -3.43 -1.13 -4.89 115.29 105.66 2fkx s HIS 49 Ca 0.09 1.51 0.12 0.00 -0.80 0.00 0.00 55.06 55.98 2fkx s HIS 49 Cb 0.17 -3.35 0.21 0.00 -1.43 0.00 0.00 32.58 28.18 2fkx s HIS 49 CO 0.80 -0.89 1.09 1.58 -2.00 0.00 0.00 174.74 175.32 2fkx n HIS 50 N 2.53 0.00 -2.00 0.38 -0.00 -1.26 -4.97 115.22 109.90 2fkx n HIS 50 Ca 0.04 -0.34 -0.42 0.00 -0.00 0.00 0.00 57.72 56.99 2fkx n HIS 50 Cb 0.46 -0.11 0.00 0.00 -0.00 0.00 0.00 29.99 30.34 2fkx n HIS 50 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2fkx n SER 51 N 0.02 4.26 0.22 0.26 3.41 -1.26 -4.75 113.62 115.78 2fkx n SER 51 Ca 0.04 -2.89 0.07 0.00 -0.26 0.00 0.00 58.87 55.83 2fkx n SER 51 Cb 0.86 -1.65 0.57 0.00 -0.26 0.00 0.00 64.21 63.73 2fkx n SER 51 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2fkx h HIS 52 N 6.29 0.05 0.00 7.33 3.86 -1.96 -1.03 115.15 129.70 2fkx h HIS 52 Ca 0.52 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.73 2fkx h HIS 52 Cb 0.69 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.14 2fkx h HIS 52 CO 1.42 0.10 0.00 0.54 0.86 0.00 0.00 177.93 180.84 2fkx n ARG 53 N -4.46 0.32 -0.08 2.45 1.74 -1.26 -2.60 116.66 112.77 2fkx n ARG 53 Ca -0.02 0.08 0.01 0.00 -0.77 0.00 0.00 57.85 57.14 2fkx n ARG 53 Cb 0.14 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.09 2fkx n ARG 53 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fkx n GLY 54 N 0.53 -0.71 0.00 -0.13 0.00 -0.69 -4.65 105.19 99.53 2fkx n GLY 54 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2fkx n GLY 54 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2fkx n LEU 55 N -0.19 0.00 -0.09 0.99 7.94 -0.48 -4.67 117.00 120.51 2fkx n LEU 55 Ca 0.01 0.00 0.23 0.00 -1.11 0.00 0.00 56.01 55.14 2fkx n LEU 55 Cb 0.48 0.00 0.68 0.00 0.53 0.00 0.00 43.42 45.11 2fkx n LEU 55 CO 0.00 -0.21 1.22 -0.07 -1.11 0.00 0.00 177.39 177.21 2fkx h LEU 56 N 0.00 0.06 -0.38 -1.96 3.38 -1.89 0.06 115.31 114.58 2fkx h LEU 56 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2fkx h LEU 56 Cb 0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 2fkx h LEU 56 CO 0.00 0.03 0.13 -0.03 0.09 0.00 0.00 178.44 178.65 2fkx h MET 57 N 0.06 0.27 -0.55 1.13 4.05 -1.92 0.26 114.93 118.22 2fkx h MET 57 Ca 0.33 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.67 2fkx h MET 57 Cb 1.25 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.97 2fkx h MET 57 CO -0.02 0.18 0.06 1.98 0.23 0.00 0.00 176.91 179.33 2fkx h MET 58 N 0.28 0.94 -0.64 0.39 1.85 -1.16 -0.60 114.93 115.99 2fkx h MET 58 Ca 0.17 -0.27 0.04 0.00 -0.61 0.00 0.00 59.70 59.04 2fkx h MET 58 Cb 0.16 -0.10 -0.05 0.00 0.43 0.00 0.00 31.60 32.04 2fkx h MET 58 CO -0.18 0.92 0.38 0.28 -0.40 0.00 0.00 176.91 177.90 2fkx h VAL 59 N 0.82 1.03 -0.24 -5.77 2.07 -0.95 -1.11 116.25 112.11 2fkx h VAL 59 Ca 0.16 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.32 2fkx h VAL 59 Cb 0.46 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2fkx h VAL 59 CO 0.02 0.13 -0.34 1.23 0.02 0.00 0.00 177.57 178.63 2fkx h GLY 60 N 0.72 0.55 2.00 2.17 0.00 -0.18 -1.25 103.07 107.08 2fkx h GLY 60 Ca 0.27 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 2fkx h GLY 60 CO -0.14 0.46 -0.12 1.46 0.00 0.00 0.00 176.54 178.20 2fkx h GLN 61 N 0.43 0.00 0.00 4.80 4.20 -0.45 -1.33 115.11 122.76 2fkx h GLN 61 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2fkx h GLN 61 Cb 0.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.58 2fkx h GLN 61 CO 0.07 0.12 -0.92 0.07 -0.67 0.00 0.00 178.83 177.50 2fkx h ARG 62 N 0.00 0.00 0.00 1.46 -0.00 -1.00 -2.86 114.38 111.98 2fkx h ARG 62 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.96 2fkx h ARG 62 Cb 0.76 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 30.72 2fkx h ARG 62 CO 0.02 0.00 -0.10 -0.09 -0.00 0.00 0.00 179.97 179.80 2fkx h ARG 63 N 0.00 0.00 -0.18 0.08 2.43 -0.44 -2.90 114.38 113.37 2fkx h ARG 63 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2fkx h ARG 63 Cb 0.98 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 2fkx h ARG 63 CO 0.00 0.10 0.00 0.54 -1.51 0.00 0.00 179.97 179.10 2fkx n ARG 64 N -3.13 2.25 0.14 0.20 5.12 -0.58 -4.35 116.66 116.31 2fkx n ARG 64 Ca 0.03 -2.01 0.06 0.00 -1.93 0.00 0.00 57.85 54.00 2fkx n ARG 64 Cb 0.54 -1.45 0.05 0.00 -1.16 0.00 0.00 32.46 30.44 2fkx n ARG 64 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2fkx h LEU 65 N 4.33 0.00 0.63 0.55 5.85 -1.28 -3.31 115.31 122.08 2fkx h LEU 65 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2fkx h LEU 65 Cb 0.94 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2fkx h LEU 65 CO 0.00 0.32 -0.40 -0.07 -0.34 0.00 0.00 178.44 177.95 2fkx h LEU 66 N 0.00 -1.00 -0.46 2.25 -0.00 -1.76 0.40 115.31 114.74 2fkx h LEU 66 Ca -0.02 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.92 2fkx h LEU 66 Cb 1.26 0.30 0.00 0.00 -0.00 0.00 0.00 40.66 42.22 2fkx h LEU 66 CO 0.04 -0.62 0.00 -2.11 -0.00 0.00 0.00 178.44 175.75 2fkx n ARG 67 N -5.53 1.25 -0.12 1.13 1.85 -1.26 -2.00 116.66 111.98 2fkx n ARG 67 Ca -0.13 -0.33 -0.24 0.00 -1.00 0.00 0.00 57.85 56.15 2fkx n ARG 67 Cb 0.42 -1.14 -0.10 0.00 -1.05 0.00 0.00 32.46 30.59 2fkx n ARG 67 CO 0.00 0.00 0.00 0.98 -0.01 0.00 0.00 177.63 178.60 2fkx n TYR 68 N -0.19 0.58 0.22 2.89 9.36 -0.55 -4.33 117.16 125.12 2fkx n TYR 68 Ca 0.03 0.25 0.11 0.00 3.32 0.00 0.00 57.90 61.61 2fkx n TYR 68 Cb 0.11 -1.03 0.31 0.00 -0.63 0.00 0.00 39.34 38.11 2fkx n TYR 68 CO 0.00 0.00 0.00 1.37 0.22 0.00 0.00 176.86 178.45 2fkx h LEU 69 N -1.00 0.00 -2.20 2.98 8.10 -0.92 -3.07 115.31 119.20 2fkx h LEU 69 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.51 2fkx h LEU 69 Cb 1.39 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.60 2fkx h LEU 69 CO -0.28 0.14 -0.04 0.06 -4.11 0.00 0.00 178.44 174.21 2fkx h GLN 70 N 0.00 0.00 -0.00 0.17 3.07 -1.57 -1.88 115.11 114.91 2fkx h GLN 70 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.61 2fkx h GLN 70 Cb 0.92 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.46 2fkx h GLN 70 CO 0.02 0.04 -0.60 0.00 0.09 0.00 0.00 178.83 178.38 2fkx h ARG 71 N 0.00 0.01 -0.02 0.06 3.08 -1.73 -2.72 114.38 113.06 2fkx h ARG 71 Ca -0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2fkx h ARG 71 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2fkx h ARG 71 CO 0.01 0.60 -0.03 0.39 -1.07 0.00 0.00 179.97 179.87 2fkx n GLU 72 N -3.83 1.86 0.00 0.04 1.02 -0.72 -4.80 120.64 114.22 2fkx n GLU 72 Ca -0.01 -1.32 0.00 0.00 -0.02 0.00 0.00 57.16 55.81 2fkx n GLU 72 Cb 0.60 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 2fkx n GLU 72 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2fkx n ASP 73 N 0.58 0.00 0.25 1.62 -0.08 -1.14 -5.05 116.55 112.73 2fkx n ASP 73 Ca 0.16 0.00 0.16 0.00 -1.51 0.00 0.00 54.79 53.60 2fkx n ASP 73 Cb 0.45 0.00 0.53 0.00 2.34 0.00 0.00 41.12 44.44 2fkx n ASP 73 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2fkx h PRO 74 N 0.00 0.00 0.11 -0.67 0.13 -1.77 -3.10 132.00 126.70 2fkx h PRO 74 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.83 2fkx h PRO 74 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2fkx h PRO 74 CO 0.00 0.00 -1.47 0.93 -0.23 0.00 0.00 178.00 177.23 2fkx h GLU 75 N 0.00 0.23 0.00 0.86 5.08 -1.95 -3.17 114.58 115.63 2fkx h GLU 75 Ca 0.00 -0.39 -0.06 0.00 -1.00 0.00 0.00 59.36 57.91 2fkx h GLU 75 Cb 0.65 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2fkx h GLU 75 CO 0.00 1.10 -0.28 0.00 -1.00 0.00 0.00 179.01 178.83 2fkx h ARG 76 N 0.06 0.00 0.66 2.33 2.47 -1.90 0.27 114.38 118.27 2fkx h ARG 76 Ca -0.22 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.48 2fkx h ARG 76 Cb 2.00 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.31 2fkx h ARG 76 CO 0.16 0.28 -0.49 -0.92 0.56 0.00 0.00 179.97 179.57 2fkx h TYR 77 N 0.00 -1.32 -0.50 3.04 3.20 -1.53 0.24 116.97 120.09 2fkx h TYR 77 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2fkx h TYR 77 Cb 0.54 0.49 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2fkx h TYR 77 CO 0.00 -0.69 0.28 0.00 -1.64 0.00 0.00 178.16 176.11 2fkx h ARG 78 N -1.10 0.70 0.01 1.82 3.08 -1.48 -1.99 114.38 115.42 2fkx h ARG 78 Ca -0.09 -0.08 -0.20 0.00 0.07 0.00 0.00 59.98 59.68 2fkx h ARG 78 Cb 0.91 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 2fkx h ARG 78 CO 0.03 0.54 -0.96 0.00 -1.07 0.00 0.00 179.97 178.51 2fkx h ALA 79 N 1.12 0.42 0.00 0.04 0.00 -0.43 -2.27 119.26 118.14 2fkx h ALA 79 Ca 0.18 -0.86 -0.08 0.00 0.00 0.00 0.00 54.91 54.14 2fkx h ALA 79 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2fkx h ALA 79 CO -0.03 1.16 -0.40 1.25 0.00 0.00 0.00 179.25 181.23 2fkx h LEU 80 N 0.01 0.00 -0.26 0.00 5.85 -0.41 0.50 115.31 121.00 2fkx h LEU 80 Ca -0.02 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.51 2fkx h LEU 80 Cb 1.69 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.70 2fkx h LEU 80 CO 0.13 0.40 -0.88 0.16 -0.34 0.00 0.00 178.44 177.91 2fkx h ILE 81 N 0.00 1.59 -0.11 4.05 -0.00 -1.28 -0.10 117.51 121.66 2fkx h ILE 81 Ca -0.00 -2.91 -0.23 0.00 -0.00 0.00 0.00 64.86 61.72 2fkx h ILE 81 Cb 1.01 2.59 0.01 0.00 -0.00 0.00 0.00 36.82 40.43 2fkx h ILE 81 CO 0.05 0.83 -0.84 -0.08 -0.00 0.00 0.00 178.15 178.11 2fkx h GLU 82 N 0.02 0.74 -0.13 0.16 4.81 -1.02 0.87 114.58 120.03 2fkx h GLU 82 Ca -0.02 -0.65 -0.19 0.00 -0.13 0.00 0.00 59.36 58.37 2fkx h GLU 82 Cb 1.54 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 31.07 2fkx h GLU 82 CO 0.12 1.25 -0.69 0.87 -0.73 0.00 0.00 179.01 179.83 2fkx h LYS 83 N 0.48 0.55 0.00 1.92 1.57 0.10 -3.06 116.57 118.13 2fkx h LYS 83 Ca -0.07 -0.42 -0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2fkx h LYS 83 Cb 1.48 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.86 2fkx h LYS 83 CO 0.17 1.04 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.89 2fkx h LEU 84 N 0.39 0.00 -2.40 2.94 3.38 -1.08 -3.48 115.31 115.06 2fkx h LEU 84 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2fkx h LEU 84 Cb 1.27 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.04 2fkx h LEU 84 CO 0.13 0.01 -0.11 0.61 0.09 0.00 0.00 178.44 179.17 2fkx n GLY 85 N 1.11 0.48 0.10 0.83 0.00 -0.53 -4.99 105.19 102.19 2fkx n GLY 85 Ca 0.03 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.82 2fkx n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2fkx n ILE 86 N -1.55 0.85 -0.14 -0.61 5.41 0.19 -3.91 119.36 119.59 2fkx n ILE 86 Ca -0.02 -0.61 -0.01 0.00 1.00 0.00 0.00 62.75 63.10 2fkx n ILE 86 Cb 0.52 -0.50 0.24 0.00 -0.71 0.00 0.00 39.64 39.19 2fkx n ILE 86 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 2fkx h ARG 87 N 0.00 0.85 0.00 0.38 3.08 -1.95 -3.51 114.38 113.22 2fkx h ARG 87 Ca -0.08 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2fkx h ARG 87 Cb 1.27 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.16 2fkx h ARG 87 CO 0.02 0.67 0.00 0.41 -1.07 0.00 0.00 179.97 180.00