#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fkx s ILE 2 N 0.00 4.97 0.79 4.25 -4.36 -1.26 -5.08 121.20 120.51 2fkx s ILE 2 Ca 0.00 0.04 -0.12 0.00 -0.26 0.00 0.00 60.65 60.31 2fkx s ILE 2 Cb 0.00 -3.27 0.06 0.00 1.25 0.00 0.00 42.46 40.51 2fkx s ILE 2 CO 0.00 0.43 1.11 -0.89 0.24 0.00 0.00 174.94 175.83 2fkx s THR 3 N 0.55 2.95 0.08 8.37 2.01 -1.26 -4.66 115.64 123.68 2fkx s THR 3 Ca 0.05 0.31 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 2fkx s THR 3 Cb -0.12 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 2fkx s THR 3 CO 0.01 -0.40 1.27 0.50 -0.69 0.00 0.00 174.62 175.30 2fkx h LYS 4 N -1.01 -0.01 -0.01 4.92 1.63 -1.99 0.60 116.57 120.69 2fkx h LYS 4 Ca -0.47 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 2fkx h LYS 4 Cb 1.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 2fkx h LYS 4 CO 0.62 -0.01 -0.03 0.39 -3.45 0.00 0.00 179.45 176.97 2fkx n GLU 5 N -4.13 1.26 0.09 1.90 1.02 -1.26 -2.24 120.64 117.28 2fkx n GLU 5 Ca 0.01 -0.51 -0.19 0.00 -0.02 0.00 0.00 57.16 56.45 2fkx n GLU 5 Cb 0.13 -1.49 -0.15 0.00 -0.02 0.00 0.00 31.44 29.92 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 1.24 0.35 -0.23 3.49 3.07 -1.28 -1.15 114.58 120.07 2fkx h GLU 6 Ca 0.00 -0.59 -0.06 0.00 -0.50 0.00 0.00 59.36 58.20 2fkx h GLU 6 Cb 0.31 0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 2fkx h GLU 6 CO 0.00 1.25 -0.11 -0.22 -1.40 0.00 0.00 179.01 178.53 2fkx h LYS 7 N 0.09 0.47 -0.43 2.33 3.11 0.21 -2.14 116.57 120.22 2fkx h LYS 7 Ca -0.23 -0.21 -0.03 0.00 -2.81 0.00 0.00 60.65 57.37 2fkx h LYS 7 Cb 2.06 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 33.25 2fkx h LYS 7 CO 0.20 0.75 0.15 1.96 -2.81 0.00 0.00 179.45 179.70 2fkx h GLN 8 N 0.18 0.61 -0.09 1.90 4.20 -1.46 -1.62 115.11 118.83 2fkx h GLN 8 Ca 0.05 -0.09 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 2fkx h GLN 8 Cb 0.60 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2fkx h GLN 8 CO 0.03 0.53 -0.47 -0.22 -0.67 0.00 0.00 178.83 178.03 2fkx h LYS 9 N 0.61 0.22 -0.64 1.46 3.64 -1.00 0.21 116.57 121.07 2fkx h LYS 9 Ca 0.15 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2fkx h LYS 9 Cb 0.16 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2fkx h LYS 9 CO -0.01 0.65 0.39 0.28 -2.27 0.00 0.00 179.45 178.49 2fkx h VAL 10 N 0.18 1.19 -0.11 2.00 2.07 -0.63 0.16 116.25 121.11 2fkx h VAL 10 Ca 0.01 -0.41 -0.14 0.00 0.82 0.00 0.00 66.70 66.97 2fkx h VAL 10 Cb 0.90 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2fkx h VAL 10 CO 0.07 0.19 -0.56 0.40 0.02 0.00 0.00 177.57 177.69 2fkx h ILE 11 N 0.87 1.36 -0.37 4.57 5.03 -1.15 -1.17 117.51 126.64 2fkx h ILE 11 Ca 0.23 -1.87 -0.05 0.00 -0.12 0.00 0.00 64.86 63.06 2fkx h ILE 11 Cb -0.03 1.89 -0.01 0.00 -3.03 0.00 0.00 36.82 35.64 2fkx h ILE 11 CO -0.04 0.56 0.04 -0.61 -0.68 0.00 0.00 178.15 177.42 2fkx h GLN 12 N 0.25 0.63 0.01 2.37 5.75 0.07 -2.14 115.11 122.05 2fkx h GLN 12 Ca 0.00 -0.18 -0.05 0.00 -0.15 0.00 0.00 58.65 58.28 2fkx h GLN 12 Cb 1.06 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.55 2fkx h GLN 12 CO 0.09 0.70 -0.19 0.93 -2.65 0.00 0.00 178.83 177.71 2fkx h GLU 13 N 0.46 0.11 0.00 1.69 4.39 -0.62 -3.43 114.58 117.18 2fkx h GLU 13 Ca 0.11 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2fkx h GLU 13 Cb 0.39 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2fkx h GLU 13 CO 0.01 0.93 -0.18 0.74 -1.16 0.00 0.00 179.01 179.35 2fkx h PHE 14 N -0.65 0.00 -2.60 4.33 -1.00 -1.30 -3.47 116.94 112.25 2fkx h PHE 14 Ca -0.03 0.00 -0.58 0.00 2.81 0.00 0.00 57.97 60.17 2fkx h PHE 14 Cb 1.01 0.00 0.08 0.00 3.61 0.00 0.00 35.95 40.64 2fkx h PHE 14 CO 0.21 0.00 0.68 0.00 -1.61 0.00 0.00 178.31 177.58 2fkx n ALA 15 N -2.75 1.25 -0.12 2.45 0.00 -0.80 -4.88 120.51 115.65 2fkx n ALA 15 Ca -0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.83 2fkx n ALA 15 Cb 0.09 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.24 2fkx n ALA 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fkx n ARG 16 N 2.39 0.46 -3.91 0.00 1.74 -1.26 -4.62 116.66 111.46 2fkx n ARG 16 Ca 0.13 -0.80 -0.10 0.00 -0.77 0.00 0.00 57.85 56.31 2fkx n ARG 16 Cb 0.31 -0.94 -0.09 0.00 -1.02 0.00 0.00 32.46 30.72 2fkx n ARG 16 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2fkx s PHE 17 N -0.34 0.17 0.55 -1.55 0.08 -1.26 -5.01 117.98 110.62 2fkx s PHE 17 Ca 0.00 -0.46 0.21 0.00 0.12 0.00 0.00 56.93 56.80 2fkx s PHE 17 Cb 0.00 -0.11 1.47 0.00 -0.57 0.00 0.00 43.02 43.80 2fkx s PHE 17 CO 0.00 -0.39 2.17 -1.35 -0.10 0.00 0.00 175.22 175.55 2fkx h PRO 18 N 3.55 0.00 0.00 0.24 0.11 -2.01 -0.09 132.00 133.81 2fkx h PRO 18 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2fkx h PRO 18 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2fkx h PRO 18 CO 0.50 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.70 2fkx n GLY 19 N -1.47 -1.58 0.00 -0.55 0.00 -1.26 -3.06 105.19 97.26 2fkx n GLY 19 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2fkx n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fkx n ASP 20 N -2.23 0.00 0.02 1.61 8.00 -0.05 -1.36 116.55 122.55 2fkx n ASP 20 Ca 0.05 -1.10 0.14 0.00 0.71 0.00 0.00 54.79 54.58 2fkx n ASP 20 Cb 0.37 0.00 0.53 0.00 -0.02 0.00 0.00 41.12 42.00 2fkx n ASP 20 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2fkx n THR 21 N -0.87 0.11 -0.26 -3.53 -1.04 -1.17 -2.50 114.28 105.02 2fkx n THR 21 Ca 0.16 -0.06 0.03 0.00 -2.04 0.00 0.00 64.05 62.14 2fkx n THR 21 Cb 0.07 -0.41 0.05 0.00 -1.82 0.00 0.00 70.33 68.22 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 1.46 3.40 3.89 3.41 0.00 -0.46 -4.92 105.19 111.97 2fkx n GLY 22 Ca 0.06 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 2fkx n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fkx s SER 23 N -1.41 6.52 0.35 1.61 0.01 -1.04 -4.99 113.70 114.75 2fkx s SER 23 Ca 0.09 0.67 0.14 0.00 1.31 0.00 0.00 55.95 58.16 2fkx s SER 23 Cb 0.08 -2.12 1.02 0.00 0.21 0.00 0.00 66.02 65.20 2fkx s SER 23 CO 0.02 0.01 1.72 0.74 0.41 0.00 0.00 173.24 176.14 2fkx h THR 24 N 1.98 0.46 -0.13 1.44 2.02 -1.95 -2.31 112.91 114.42 2fkx h THR 24 Ca -0.46 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 66.61 2fkx h THR 24 Cb 1.17 -0.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.50 2fkx h THR 24 CO 0.71 0.08 -0.18 -0.33 0.37 0.00 0.00 175.52 176.17 2fkx h GLU 25 N 0.45 -0.22 -0.07 6.66 5.08 -1.94 0.42 114.58 124.96 2fkx h GLU 25 Ca 0.66 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.93 2fkx h GLU 25 Cb 1.47 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 2fkx h GLU 25 CO -0.44 -0.15 -0.43 0.28 -1.00 0.00 0.00 179.01 177.27 2fkx h VAL 26 N -0.23 1.32 -0.03 3.13 2.07 -1.61 -0.66 116.25 120.23 2fkx h VAL 26 Ca 0.10 -1.53 -0.22 0.00 0.82 0.00 0.00 66.70 65.87 2fkx h VAL 26 Cb 0.38 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2fkx h VAL 26 CO -0.27 0.45 -0.89 1.56 0.02 0.00 0.00 177.57 178.44 2fkx h GLN 27 N 0.13 0.47 0.00 1.57 4.20 -1.11 0.68 115.11 121.06 2fkx h GLN 27 Ca 0.01 -0.46 -0.12 0.00 0.06 0.00 0.00 58.65 58.14 2fkx h GLN 27 Cb 0.81 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 2fkx h GLN 27 CO 0.06 1.11 -0.58 0.28 -0.67 0.00 0.00 178.83 179.03 2fkx h VAL 28 N 0.28 1.30 -0.32 -0.54 2.07 -0.09 0.20 116.25 119.16 2fkx h VAL 28 Ca -0.07 -2.05 -0.04 0.00 0.82 0.00 0.00 66.70 65.36 2fkx h VAL 28 Cb 1.51 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 33.41 2fkx h VAL 28 CO 0.16 0.57 0.04 0.00 0.02 0.00 0.00 177.57 178.35 2fkx h ALA 29 N 1.42 0.42 0.00 1.67 0.00 -0.81 0.29 119.26 122.25 2fkx h ALA 29 Ca -0.01 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2fkx h ALA 29 Cb 1.09 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2fkx h ALA 29 CO 0.08 0.13 -0.47 1.37 0.00 0.00 0.00 179.25 180.35 2fkx h LEU 30 N 0.36 0.00 -0.33 0.00 8.10 -0.64 -0.80 115.31 121.99 2fkx h LEU 30 Ca 0.10 0.00 -0.19 0.00 0.11 0.00 0.00 57.88 57.90 2fkx h LEU 30 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.59 2fkx h LEU 30 CO 0.01 0.47 -0.60 0.17 -4.11 0.00 0.00 178.44 174.38 2fkx h LEU 31 N 0.00 0.86 -0.38 0.17 8.10 -0.27 -0.11 115.31 123.67 2fkx h LEU 31 Ca -0.00 -0.48 -0.09 0.00 0.11 0.00 0.00 57.88 57.41 2fkx h LEU 31 Cb 1.02 -0.25 -0.01 0.00 -0.44 0.00 0.00 40.66 40.99 2fkx h LEU 31 CO 0.06 1.26 -0.11 0.74 -4.11 0.00 0.00 178.44 176.28 2fkx h THR 32 N 0.57 1.28 -0.48 0.15 2.02 -0.19 0.23 112.91 116.48 2fkx h THR 32 Ca -0.00 -1.20 -0.06 0.00 0.77 0.00 0.00 66.41 65.92 2fkx h THR 32 Cb 1.19 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 2fkx h THR 32 CO 0.12 0.40 0.04 -0.07 0.37 0.00 0.00 175.52 176.38 2fkx h LEU 33 N 0.55 0.72 -0.05 2.58 3.38 -1.09 -0.00 115.31 121.40 2fkx h LEU 33 Ca 0.09 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2fkx h LEU 33 Cb 0.63 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2fkx h LEU 33 CO 0.04 0.77 0.03 -0.09 0.09 0.00 0.00 178.44 179.28 2fkx h ARG 34 N 0.72 0.08 -0.78 1.13 2.43 -0.70 -0.02 114.38 117.24 2fkx h ARG 34 Ca 0.15 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.37 2fkx h ARG 34 Cb 0.39 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.87 2fkx h ARG 34 CO 0.01 0.16 0.47 0.82 -1.51 0.00 0.00 179.97 179.92 2fkx h ILE 35 N -0.02 1.02 -0.40 1.20 2.04 -0.56 -0.67 117.51 120.12 2fkx h ILE 35 Ca 0.02 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 2fkx h ILE 35 Cb 0.10 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 2fkx h ILE 35 CO -0.00 0.16 -0.04 0.78 0.00 0.00 0.00 178.15 179.05 2fkx h ASN 36 N 0.86 0.62 -0.52 1.72 2.35 -0.75 0.26 115.58 120.13 2fkx h ASN 36 Ca 0.34 -0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2fkx h ASN 36 Cb 0.17 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 2fkx h ASN 36 CO -0.17 0.72 0.03 -0.09 -1.65 0.00 0.00 177.43 176.27 2fkx h ARG 37 N 0.61 0.89 -0.54 0.81 2.43 0.12 0.13 114.38 118.84 2fkx h ARG 37 Ca 0.12 -0.27 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 2fkx h ARG 37 Cb 0.44 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2fkx h ARG 37 CO 0.02 0.90 -0.07 -0.07 -1.51 0.00 0.00 179.97 179.24 2fkx h LEU 38 N 0.77 0.98 -0.37 3.80 -0.00 -0.77 -1.75 115.31 117.98 2fkx h LEU 38 Ca 0.15 -0.30 -0.01 0.00 -0.00 0.00 0.00 57.88 57.72 2fkx h LEU 38 Cb 0.48 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 40.86 2fkx h LEU 38 CO 0.02 1.08 0.20 -1.28 -0.00 0.00 0.00 178.44 178.46 2fkx h SER 39 N 0.89 0.46 0.77 -0.43 0.87 -0.02 0.43 113.55 116.52 2fkx h SER 39 Ca 0.15 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2fkx h SER 39 Cb 0.62 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2fkx h SER 39 CO 0.04 0.41 0.00 -1.84 -0.53 0.00 0.00 176.83 174.92 2fkx n GLU 40 N -4.76 0.06 -0.05 2.24 0.28 0.42 -1.49 120.64 117.34 2fkx n GLU 40 Ca -0.00 0.21 -0.21 0.00 -0.16 0.00 0.00 57.16 56.99 2fkx n GLU 40 Cb 0.08 -1.59 -0.13 0.00 1.43 0.00 0.00 31.44 31.23 2fkx n GLU 40 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2fkx n HIS 41 N -1.70 0.86 0.27 -1.84 8.25 -0.67 -4.17 115.22 116.22 2fkx n HIS 41 Ca 0.04 0.21 0.14 0.00 -0.26 0.00 0.00 57.72 57.85 2fkx n HIS 41 Cb 0.25 -1.11 0.75 0.00 1.12 0.00 0.00 29.99 31.01 2fkx n HIS 41 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2fkx h LEU 42 N -0.17 0.00 -1.35 2.41 3.38 0.12 0.55 115.31 120.25 2fkx h LEU 42 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2fkx h LEU 42 Cb 1.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.62 2fkx h LEU 42 CO -0.03 0.10 0.00 0.29 0.09 0.00 0.00 178.44 178.89 2fkx n LYS 43 N -3.56 1.93 0.00 1.13 5.02 -0.55 -3.28 118.16 118.85 2fkx n LYS 43 Ca -0.02 -1.10 0.00 0.00 -2.02 0.00 0.00 58.31 55.17 2fkx n LYS 43 Cb 0.23 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 2fkx n LYS 43 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2fkx n VAL 44 N 0.32 0.00 -1.55 -0.18 0.31 0.17 -4.98 118.33 112.42 2fkx n VAL 44 Ca 0.10 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.17 2fkx n VAL 44 Cb 0.36 -0.57 -0.06 0.00 -0.91 0.00 0.00 33.84 32.65 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 -1.45 1.21 -0.01 3.52 8.25 0.17 -4.59 115.22 122.31 2fkx n HIS 45 Ca 0.00 0.07 0.02 0.00 -0.26 0.00 0.00 57.72 57.55 2fkx n HIS 45 Cb 0.30 -2.53 -0.06 0.00 1.12 0.00 0.00 29.99 28.82 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 8.75 0.90 -0.39 -0.41 4.81 -1.26 -4.42 118.16 126.14 2fkx n LYS 46 Ca 0.44 -0.05 0.09 0.00 -0.87 0.00 0.00 58.31 57.92 2fkx n LYS 46 Cb 0.45 -1.18 0.28 0.00 0.02 0.00 0.00 35.03 34.61 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 -1.89 3.07 -3.42 1.64 4.76 -1.26 -4.72 118.16 116.35 2fkx n LYS 47 Ca -0.04 -2.56 -0.18 0.00 -2.87 0.00 0.00 58.31 52.66 2fkx n LYS 47 Cb 0.33 -1.59 -0.10 0.00 -1.84 0.00 0.00 35.03 31.83 2fkx n LYS 47 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2fkx s ASP 48 N -1.05 1.70 -0.05 4.39 -1.08 -1.26 -5.04 116.67 114.28 2fkx s ASP 48 Ca 0.41 -0.70 0.00 0.00 -0.52 0.00 0.00 52.55 51.74 2fkx s ASP 48 Cb 0.24 0.47 0.05 0.00 -1.46 0.00 0.00 42.92 42.22 2fkx s ASP 48 CO 0.24 -0.38 1.66 1.41 0.52 0.00 0.00 175.17 178.62 2fkx n HIS 49 N 5.31 0.27 0.66 -5.34 8.25 -1.26 -3.80 115.22 119.32 2fkx n HIS 49 Ca -0.03 -0.97 0.05 0.00 -0.26 0.00 0.00 57.72 56.52 2fkx n HIS 49 Cb 0.47 -0.48 0.17 0.00 1.12 0.00 0.00 29.99 31.26 2fkx n HIS 49 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2fkx n HIS 50 N 0.95 0.61 -1.54 4.41 8.25 -1.26 -4.72 115.22 121.92 2fkx n HIS 50 Ca 0.05 -0.27 -0.21 0.00 -0.26 0.00 0.00 57.72 57.03 2fkx n HIS 50 Cb 0.55 -0.06 -0.10 0.00 1.12 0.00 0.00 29.99 31.49 2fkx n HIS 50 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2fkx n SER 51 N 0.52 1.07 -1.38 0.41 7.64 -1.25 -1.75 113.62 118.89 2fkx n SER 51 Ca 0.13 -1.00 -0.18 0.00 1.01 0.00 0.00 58.87 58.83 2fkx n SER 51 Cb 0.40 -1.35 -0.07 0.00 -1.01 0.00 0.00 64.21 62.17 2fkx n SER 51 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2fkx n HIS 52 N 14.80 -0.02 -0.10 1.43 8.25 -1.26 -4.91 115.22 133.41 2fkx n HIS 52 Ca 0.51 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.95 2fkx n HIS 52 Cb 0.36 -3.05 -0.02 0.00 1.12 0.00 0.00 29.99 28.39 2fkx n HIS 52 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2fkx n ARG 53 N -2.49 -0.11 -0.47 -0.41 0.63 -0.71 -2.68 116.66 110.42 2fkx n ARG 53 Ca -0.18 1.04 0.06 0.00 -0.92 0.00 0.00 57.85 57.85 2fkx n ARG 53 Cb 0.59 -1.55 0.11 0.00 0.45 0.00 0.00 32.46 32.06 2fkx n ARG 53 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2fkx n GLY 54 N -1.06 3.42 0.40 5.14 0.00 -1.26 -4.71 105.19 107.12 2fkx n GLY 54 Ca 0.00 -0.87 0.14 0.00 0.00 0.00 0.00 46.02 45.29 2fkx n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fkx n LEU 55 N -0.79 1.34 -0.04 0.99 7.99 -1.09 -3.67 117.00 121.73 2fkx n LEU 55 Ca 0.12 -0.42 -0.16 0.00 -0.01 0.00 0.00 56.01 55.54 2fkx n LEU 55 Cb 0.73 -0.04 -0.08 0.00 -0.11 0.00 0.00 43.42 43.92 2fkx n LEU 55 CO -0.01 0.23 0.39 -0.07 -1.51 0.00 0.00 177.39 176.42 2fkx h LEU 56 N 1.97 0.68 -0.60 2.23 3.38 -1.84 -0.83 115.31 120.30 2fkx h LEU 56 Ca 0.00 -0.61 -0.00 0.00 0.09 0.00 0.00 57.88 57.36 2fkx h LEU 56 Cb 0.50 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2fkx h LEU 56 CO 0.00 1.18 0.37 -0.03 0.09 0.00 0.00 178.44 180.05 2fkx h MET 57 N 0.22 0.82 0.02 1.13 4.05 -1.92 -0.21 114.93 119.04 2fkx h MET 57 Ca -0.02 -0.07 -0.21 0.00 -0.28 0.00 0.00 59.70 59.12 2fkx h MET 57 Cb 1.13 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.74 2fkx h MET 57 CO 0.11 0.58 -0.96 0.00 0.23 0.00 0.00 176.91 176.87 2fkx h MET 58 N 0.82 0.10 -0.26 0.39 -0.00 -1.69 0.13 114.93 114.42 2fkx h MET 58 Ca 0.22 -0.13 -0.13 0.00 -0.00 0.00 0.00 59.70 59.66 2fkx h MET 58 Cb -0.03 0.04 -0.01 0.00 -0.00 0.00 0.00 31.60 31.60 2fkx h MET 58 CO -0.04 0.97 -0.36 0.28 -0.00 0.00 0.00 176.91 177.76 2fkx h VAL 59 N 0.04 1.29 -0.41 -0.10 2.07 -1.01 0.70 116.25 118.84 2fkx h VAL 59 Ca -0.04 -1.50 -0.13 0.00 0.82 0.00 0.00 66.70 65.86 2fkx h VAL 59 Cb 1.65 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 2fkx h VAL 59 CO 0.14 0.48 -0.26 1.23 0.02 0.00 0.00 177.57 179.18 2fkx h GLY 60 N 1.03 0.92 2.00 2.17 0.00 -0.92 -0.15 103.07 108.12 2fkx h GLY 60 Ca 0.05 -0.82 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2fkx h GLY 60 CO 0.07 0.75 0.00 -0.18 0.00 0.00 0.00 176.54 177.18 2fkx n GLN 61 N -4.10 0.19 0.05 4.80 -0.06 0.46 -1.01 117.38 117.71 2fkx n GLN 61 Ca -0.00 0.30 0.11 0.00 -2.00 0.00 0.00 57.00 55.41 2fkx n GLN 61 Cb 0.46 -1.79 0.00 0.00 -4.06 0.00 0.00 30.24 24.86 2fkx n GLN 61 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2fkx n ARG 62 N -2.13 0.44 0.04 3.69 0.00 0.21 0.04 116.66 118.95 2fkx n ARG 62 Ca 0.04 0.02 -0.11 0.00 -0.00 0.00 0.00 57.85 57.80 2fkx n ARG 62 Cb 0.30 -1.67 -0.13 0.00 0.00 0.00 0.00 32.46 30.97 2fkx n ARG 62 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2fkx h ARG 63 N 0.00 0.08 0.06 -0.14 2.43 0.18 -3.35 114.38 113.64 2fkx h ARG 63 Ca 0.00 -0.14 -0.33 0.00 -0.81 0.00 0.00 59.98 58.70 2fkx h ARG 63 Cb 0.85 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.42 2fkx h ARG 63 CO 0.00 0.89 -1.88 0.54 -1.51 0.00 0.00 179.97 178.01 2fkx n ARG 64 N -3.29 0.70 -1.32 0.20 1.74 -0.18 -4.97 116.66 109.53 2fkx n ARG 64 Ca -0.10 0.27 -0.13 0.00 -0.77 0.00 0.00 57.85 57.12 2fkx n ARG 64 Cb 1.01 -1.74 -0.05 0.00 -1.02 0.00 0.00 32.46 30.65 2fkx n ARG 64 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2fkx n LEU 65 N -3.26 -0.69 0.31 0.55 4.77 0.11 -4.89 117.00 113.90 2fkx n LEU 65 Ca -0.25 0.31 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 2fkx n LEU 65 Cb 1.05 -2.40 -0.06 0.00 -2.33 0.00 0.00 43.42 39.68 2fkx n LEU 65 CO 0.44 -0.89 0.52 -0.07 -1.33 0.00 0.00 177.39 176.06 2fkx h LEU 66 N 0.00 -0.74 0.00 2.23 3.38 -1.94 -1.42 115.31 116.82 2fkx h LEU 66 Ca -0.26 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2fkx h LEU 66 Cb 1.06 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2fkx h LEU 66 CO 0.38 -0.50 0.00 0.54 0.09 0.00 0.00 178.44 178.95 2fkx n ARG 67 N -4.29 0.69 -0.02 1.13 5.12 -1.26 -1.58 116.66 116.46 2fkx n ARG 67 Ca -0.10 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.77 2fkx n ARG 67 Cb 0.33 -1.24 -0.02 0.00 -1.16 0.00 0.00 32.46 30.38 2fkx n ARG 67 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2fkx n TYR 68 N -0.74 0.00 -0.07 -1.55 4.19 -1.18 -4.59 117.16 113.23 2fkx n TYR 68 Ca 0.08 0.00 -0.09 0.00 3.31 0.00 0.00 57.90 61.20 2fkx n TYR 68 Cb 0.04 -0.19 -0.06 0.00 0.49 0.00 0.00 39.34 39.61 2fkx n TYR 68 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 2fkx h LEU 69 N -0.24 0.00 -1.52 2.98 4.07 -1.30 -3.31 115.31 116.01 2fkx h LEU 69 Ca -0.11 -0.43 -0.05 0.00 0.08 0.00 0.00 57.88 57.38 2fkx h LEU 69 Cb 0.83 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.56 2fkx h LEU 69 CO -0.07 0.85 -0.19 -0.61 -1.08 0.00 0.00 178.44 177.35 2fkx h GLN 70 N -1.00 0.08 -0.57 1.13 4.15 -1.32 -2.18 115.11 115.40 2fkx h GLN 70 Ca -0.05 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.36 2fkx h GLN 70 Cb 0.61 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.26 2fkx h GLN 70 CO -0.03 0.27 0.37 -0.09 -1.93 0.00 0.00 178.83 177.42 2fkx h ARG 71 N 0.07 0.75 0.00 1.69 2.43 -1.61 -2.81 114.38 114.90 2fkx h ARG 71 Ca 0.01 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 58.94 2fkx h ARG 71 Cb 0.38 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 2fkx h ARG 71 CO 0.03 0.50 -0.94 1.49 -1.51 0.00 0.00 179.97 179.54 2fkx h GLU 72 N 0.77 0.00 -0.24 0.20 4.81 -1.51 -3.45 114.58 115.16 2fkx h GLU 72 Ca 0.21 0.00 0.26 0.00 -0.13 0.00 0.00 59.36 59.70 2fkx h GLU 72 Cb -0.08 0.00 -0.22 0.00 0.63 0.00 0.00 28.75 29.08 2fkx h GLU 72 CO -0.04 0.94 0.23 0.34 -0.73 0.00 0.00 179.01 179.74 2fkx s ASP 73 N -6.70 -0.30 0.45 1.04 -1.08 -0.87 -5.04 116.67 104.18 2fkx s ASP 73 Ca 0.01 0.21 0.31 0.00 -0.52 0.00 0.00 52.55 52.56 2fkx s ASP 73 Cb 0.10 1.26 1.52 0.00 -1.46 0.00 0.00 42.92 44.34 2fkx s ASP 73 CO 0.81 -0.06 1.94 -0.65 0.52 0.00 0.00 175.17 177.74 2fkx h PRO 74 N 7.90 0.00 0.05 4.34 0.11 -1.72 0.51 132.00 143.19 2fkx h PRO 74 Ca -0.12 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.86 2fkx h PRO 74 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fkx h PRO 74 CO -0.13 0.00 -0.63 0.93 -0.21 0.00 0.00 178.00 177.96 2fkx h GLU 75 N 0.00 0.11 0.00 1.05 3.07 -1.92 -3.26 114.58 113.63 2fkx h GLU 75 Ca 0.00 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 2fkx h GLU 75 Cb 0.20 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 2fkx h GLU 75 CO 0.00 1.09 0.00 0.00 -1.40 0.00 0.00 179.01 178.70 2fkx h ARG 76 N -0.74 0.00 -0.10 2.33 3.08 -1.83 -2.24 114.38 114.87 2fkx h ARG 76 Ca -0.14 0.00 0.04 0.00 0.07 0.00 0.00 59.98 59.95 2fkx h ARG 76 Cb 1.32 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.32 2fkx h ARG 76 CO 0.01 0.00 -0.28 -0.92 -1.07 0.00 0.00 179.97 177.71 2fkx h TYR 77 N 0.00 -0.75 0.01 3.04 3.20 -0.94 0.21 116.97 121.73 2fkx h TYR 77 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2fkx h TYR 77 Cb 0.42 0.35 -0.00 0.00 1.54 0.00 0.00 36.73 39.03 2fkx h TYR 77 CO 0.00 -0.36 -0.02 0.00 -1.64 0.00 0.00 178.16 176.14 2fkx h ARG 78 N -0.36 -0.03 -0.30 1.82 3.08 -1.52 -1.69 114.38 115.38 2fkx h ARG 78 Ca 0.09 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 2fkx h ARG 78 Cb 0.50 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 2fkx h ARG 78 CO -0.31 -0.02 -0.26 0.00 -1.07 0.00 0.00 179.97 178.30 2fkx h ALA 79 N 0.96 0.98 0.00 0.04 0.00 -1.23 -1.12 119.26 118.89 2fkx h ALA 79 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2fkx h ALA 79 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2fkx h ALA 79 CO -0.01 0.60 0.00 1.25 0.00 0.00 0.00 179.25 181.09 2fkx h LEU 80 N 0.52 0.00 0.00 0.00 5.85 -0.48 -1.50 115.31 119.70 2fkx h LEU 80 Ca 0.07 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2fkx h LEU 80 Cb 0.73 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2fkx h LEU 80 CO 0.06 0.00 -0.70 0.16 -0.34 0.00 0.00 178.44 177.62 2fkx h ILE 81 N 0.00 0.52 0.00 4.05 3.07 -0.72 -0.92 117.51 123.52 2fkx h ILE 81 Ca 0.00 -1.81 -0.12 0.00 1.55 0.00 0.00 64.86 64.48 2fkx h ILE 81 Cb 0.79 2.14 -0.02 0.00 -0.27 0.00 0.00 36.82 39.47 2fkx h ILE 81 CO 0.00 0.30 -0.57 -0.33 -1.05 0.00 0.00 178.15 176.50 2fkx h GLU 82 N 0.00 0.00 0.02 0.16 5.08 -0.95 0.17 114.58 119.06 2fkx h GLU 82 Ca -0.04 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2fkx h GLU 82 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2fkx h GLU 82 CO 0.04 0.57 -0.01 0.87 -1.00 0.00 0.00 179.01 179.48 2fkx h LYS 83 N 0.00 -0.03 0.00 2.33 1.79 -1.08 -3.31 116.57 116.27 2fkx h LYS 83 Ca -0.01 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2fkx h LYS 83 Cb 1.29 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.94 2fkx h LYS 83 CO 0.07 0.67 -0.15 -0.07 -1.08 0.00 0.00 179.45 178.89 2fkx h LEU 84 N -0.80 0.00 -1.78 2.94 3.38 -1.24 -3.47 115.31 114.34 2fkx h LEU 84 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fkx h LEU 84 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2fkx h LEU 84 CO 0.01 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.30 2fkx n GLY 85 N -0.01 0.60 0.09 0.83 0.00 -0.24 -5.01 105.19 101.46 2fkx n GLY 85 Ca -0.00 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 2fkx n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2fkx h ILE 86 N 0.00 0.92 0.00 -0.61 5.03 -1.07 -3.33 117.51 118.46 2fkx h ILE 86 Ca 0.00 -2.72 0.00 0.00 -0.12 0.00 0.00 64.86 62.02 2fkx h ILE 86 Cb 0.77 2.52 0.00 0.00 -3.03 0.00 0.00 36.82 37.07 2fkx h ILE 86 CO 0.00 0.65 -1.08 0.54 -0.68 0.00 0.00 178.15 177.57 2fkx n ARG 87 N -3.20 0.32 -0.65 2.37 1.74 -1.26 -5.11 116.66 110.87 2fkx n ARG 87 Ca -0.18 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 2fkx n ARG 87 Cb 1.04 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.88 2fkx n ARG 87 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52