#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cfx s LYS 2 N 0.00 3.26 0.37 2.12 -2.85 -1.26 -5.06 119.74 116.32 2cfx s LYS 2 Ca 0.00 -0.55 -0.26 0.00 -1.00 0.00 0.00 55.97 54.15 2cfx s LYS 2 Cb 0.00 -3.92 -0.09 0.00 -2.06 0.00 0.00 37.83 31.76 2cfx s LYS 2 CO 0.00 -0.82 1.17 -0.51 0.10 0.00 0.00 175.35 175.30 2cfx s LEU 3 N 2.30 4.29 0.00 2.77 1.02 -1.26 -5.08 118.68 122.72 2cfx s LEU 3 Ca 0.15 2.38 0.01 0.00 0.02 0.00 0.00 54.13 56.68 2cfx s LEU 3 Cb -0.16 -3.90 -0.00 0.00 0.02 0.00 0.00 46.19 42.14 2cfx s LEU 3 CO 0.14 -0.56 0.03 -0.90 0.02 0.00 0.00 176.35 175.08 2cfx n ASP 4 N 0.37 2.21 0.05 2.29 5.68 -1.26 -5.04 116.55 120.84 2cfx n ASP 4 Ca 0.03 -2.17 0.00 0.00 -0.50 0.00 0.00 54.79 52.14 2cfx n ASP 4 Cb 0.46 0.31 0.31 0.00 -1.14 0.00 0.00 41.12 41.05 2cfx n ASP 4 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2cfx h GLN 5 N 0.00 0.39 -0.58 0.11 5.75 -1.99 -2.50 115.11 116.29 2cfx h GLN 5 Ca -0.21 -0.10 -0.09 0.00 -0.15 0.00 0.00 58.65 58.10 2cfx h GLN 5 Cb 0.67 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 2cfx h GLN 5 CO 0.34 0.52 0.02 0.82 -2.65 0.00 0.00 178.83 177.87 2cfx h ILE 6 N 0.37 1.26 -0.91 2.39 1.08 -1.99 -2.08 117.51 117.63 2cfx h ILE 6 Ca 0.07 -1.10 0.04 0.00 -0.39 0.00 0.00 64.86 63.48 2cfx h ILE 6 Cb 0.43 0.80 -0.05 0.00 -3.07 0.00 0.00 36.82 34.92 2cfx h ILE 6 CO 0.02 0.40 0.59 0.44 -0.69 0.00 0.00 178.15 178.91 2cfx h ASP 7 N 0.92 0.97 -0.28 1.72 3.32 -1.88 -1.59 116.42 119.61 2cfx h ASP 7 Ca 0.17 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 2cfx h ASP 7 Cb 0.51 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2cfx h ASP 7 CO 0.02 0.67 -0.13 -0.07 -1.72 0.00 0.00 179.24 178.01 2cfx h LEU 8 N 1.13 0.69 -0.55 1.55 3.38 -0.98 -2.48 115.31 118.05 2cfx h LEU 8 Ca 0.36 -0.20 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 2cfx h LEU 8 Cb 0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2cfx h LEU 8 CO -0.12 0.84 -0.59 0.78 0.09 0.00 0.00 178.44 179.44 2cfx h ASN 9 N 0.63 0.49 0.19 -0.43 2.35 -0.97 -0.04 115.58 117.81 2cfx h ASN 9 Ca 0.11 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2cfx h ASN 9 Cb 0.58 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.81 2cfx h ASN 9 CO 0.04 0.97 -0.09 0.40 -1.65 0.00 0.00 177.43 177.09 2cfx h ILE 10 N 0.33 0.85 -0.50 2.81 2.04 -1.14 0.30 117.51 122.20 2cfx h ILE 10 Ca -0.00 -0.19 0.06 0.00 1.00 0.00 0.00 64.86 65.73 2cfx h ILE 10 Cb 1.12 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 2cfx h ILE 10 CO 0.10 0.04 0.21 0.40 0.00 0.00 0.00 178.15 178.91 2cfx h ILE 11 N -0.35 0.89 -0.87 -0.67 2.04 -1.41 0.12 117.51 117.26 2cfx h ILE 11 Ca -0.03 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.72 2cfx h ILE 11 Cb 0.27 0.43 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 2cfx h ILE 11 CO 0.04 0.08 0.56 -0.33 0.00 0.00 0.00 178.15 178.50 2cfx h GLU 12 N 0.42 1.06 -0.28 2.37 4.39 -0.75 0.28 114.58 122.07 2cfx h GLU 12 Ca 0.23 -0.06 -0.10 0.00 0.34 0.00 0.00 59.36 59.76 2cfx h GLU 12 Cb 0.20 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2cfx h GLU 12 CO -0.20 0.70 -0.23 0.93 -1.16 0.00 0.00 179.01 179.05 2cfx h GLU 13 N 1.09 0.65 -0.02 2.33 4.39 -0.27 -1.81 114.58 120.94 2cfx h GLU 13 Ca 0.35 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.59 2cfx h GLU 13 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 2cfx h GLU 13 CO -0.12 0.92 -0.58 -0.07 -1.16 0.00 0.00 179.01 178.01 2cfx h LEU 14 N 0.38 0.07 0.03 1.33 3.38 -0.51 -1.12 115.31 118.88 2cfx h LEU 14 Ca 0.05 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2cfx h LEU 14 Cb 0.78 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2cfx h LEU 14 CO 0.06 0.64 -0.06 0.11 0.09 0.00 0.00 178.44 179.27 2cfx h LYS 15 N 0.05 -0.12 -0.88 1.13 1.57 -0.38 -2.01 116.57 115.92 2cfx h LYS 15 Ca -0.00 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2cfx h LYS 15 Cb 1.04 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 2cfx h LYS 15 CO 0.08 -0.08 0.54 0.87 -0.57 0.00 0.00 179.45 180.28 2cfx h LYS 16 N -0.13 1.19 -1.16 3.15 1.57 -1.07 -3.42 116.57 116.70 2cfx h LYS 16 Ca 0.02 -0.10 0.06 0.00 -1.87 0.00 0.00 60.65 58.75 2cfx h LYS 16 Cb 0.14 -0.25 -0.22 0.00 0.08 0.00 0.00 32.23 31.98 2cfx h LYS 16 CO -0.04 0.82 -0.29 0.34 -0.57 0.00 0.00 179.45 179.71 2cfx s ASP 17 N -6.25 -1.16 0.00 0.86 -1.08 -0.45 -5.05 116.67 103.55 2cfx s ASP 17 Ca -0.12 0.82 0.27 0.00 -0.52 0.00 0.00 52.55 53.00 2cfx s ASP 17 Cb 0.17 2.03 0.91 0.00 -1.46 0.00 0.00 42.92 44.58 2cfx s ASP 17 CO 0.81 -0.26 1.67 -1.54 0.52 0.00 0.00 175.17 176.36 2cfx n SER 18 N 5.42 0.84 0.00 -0.34 3.41 -0.77 -3.72 113.62 118.47 2cfx n SER 18 Ca -0.02 -0.78 0.10 0.00 -0.26 0.00 0.00 58.87 57.92 2cfx n SER 18 Cb 0.51 0.06 0.53 0.00 -0.26 0.00 0.00 64.21 65.05 2cfx n SER 18 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cfx n ARG 19 N -0.75 0.32 -1.98 4.33 1.74 -1.26 -4.94 116.66 114.11 2cfx n ARG 19 Ca 0.13 0.08 -0.42 0.00 -0.77 0.00 0.00 57.85 56.88 2cfx n ARG 19 Cb 0.32 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.24 2cfx n ARG 19 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cfx s LEU 20 N -2.54 4.38 0.81 0.55 1.43 -1.24 -5.00 118.68 117.05 2cfx s LEU 20 Ca 0.20 2.64 -0.11 0.00 -1.03 0.00 0.00 54.13 55.83 2cfx s LEU 20 Cb 0.14 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 42.83 2cfx s LEU 20 CO 0.32 -0.76 1.10 -0.94 0.23 0.00 0.00 176.35 176.29 2cfx s SER 21 N 0.76 4.19 0.23 2.29 1.04 -1.26 -4.84 113.70 116.12 2cfx s SER 21 Ca 0.65 1.80 -0.05 0.00 0.48 0.00 0.00 55.95 58.82 2cfx s SER 21 Cb -0.43 -2.47 0.23 0.00 0.10 0.00 0.00 66.02 63.46 2cfx s SER 21 CO 0.37 -2.23 1.75 0.24 0.98 0.00 0.00 173.24 174.36 2cfx h MET 22 N -1.26 1.01 0.23 4.02 0.00 -1.98 -0.89 114.93 116.06 2cfx h MET 22 Ca -0.45 -0.24 -0.00 0.00 0.00 0.00 0.00 59.70 59.02 2cfx h MET 22 Cb 1.24 -0.14 -0.02 0.00 0.00 0.00 0.00 31.60 32.68 2cfx h MET 22 CO 0.51 0.90 -0.35 -0.09 0.00 0.00 0.00 176.91 177.88 2cfx h ARG 23 N 0.96 -0.59 -0.08 1.72 2.43 -1.93 0.29 114.38 117.18 2cfx h ARG 23 Ca 0.20 0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.43 2cfx h ARG 23 Cb 0.36 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2cfx h ARG 23 CO 0.00 -0.40 0.07 0.93 -1.51 0.00 0.00 179.97 179.07 2cfx h GLU 24 N -0.62 0.00 0.03 0.20 5.08 -1.89 -1.81 114.58 115.56 2cfx h GLU 24 Ca -0.03 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.08 2cfx h GLU 24 Cb 0.56 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.83 2cfx h GLU 24 CO -0.11 0.00 -1.05 1.25 -1.00 0.00 0.00 179.01 178.10 2cfx h LEU 25 N 0.00 0.72 -1.04 1.33 5.85 -0.73 -2.84 115.31 118.61 2cfx h LEU 25 Ca 0.04 -0.60 0.06 0.00 0.84 0.00 0.00 57.88 58.21 2cfx h LEU 25 Cb 0.17 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 2cfx h LEU 25 CO -0.00 1.41 0.64 1.23 -0.34 0.00 0.00 178.44 181.38 2cfx h GLY 26 N 0.80 1.47 1.46 3.75 0.00 0.38 -1.58 103.07 109.36 2cfx h GLY 26 Ca -0.12 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 2cfx h GLY 26 CO 0.19 0.35 -0.05 -0.09 0.00 0.00 0.00 176.54 176.95 2cfx h ARG 27 N 1.17 0.66 0.01 4.80 2.43 -1.36 0.48 114.38 122.58 2cfx h ARG 27 Ca 0.42 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 59.32 2cfx h ARG 27 Cb 0.13 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2cfx h ARG 27 CO -0.16 0.71 -0.36 0.87 -1.51 0.00 0.00 179.97 179.52 2cfx h LYS 28 N 0.61 0.22 -0.01 0.20 1.57 -1.20 -3.35 116.57 114.61 2cfx h LYS 28 Ca 0.12 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2cfx h LYS 28 Cb 0.46 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2cfx h LYS 28 CO 0.02 1.00 -0.50 0.44 -0.57 0.00 0.00 179.45 179.84 2cfx n ILE 29 N -4.41 0.00 -2.27 1.86 -6.64 -0.63 -5.01 119.36 102.25 2cfx n ILE 29 Ca -0.10 -0.16 -0.01 0.00 -1.77 0.00 0.00 62.75 60.71 2cfx n ILE 29 Cb 0.57 0.87 0.00 0.00 -1.44 0.00 0.00 39.64 39.64 2cfx n ILE 29 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 2cfx n LYS 30 N -0.58 -0.85 -3.81 6.28 4.76 0.15 -5.06 118.16 119.06 2cfx n LYS 30 Ca 0.09 1.11 -0.12 0.00 -2.87 0.00 0.00 58.31 56.52 2cfx n LYS 30 Cb 0.40 -3.68 -0.10 0.00 -1.84 0.00 0.00 35.03 29.80 2cfx n LYS 30 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2cfx s LEU 31 N -2.66 1.15 0.76 -0.35 1.43 -0.35 -5.03 118.68 113.64 2cfx s LEU 31 Ca 0.04 0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 2cfx s LEU 31 Cb -0.01 0.89 0.05 0.00 0.03 0.00 0.00 46.19 47.15 2cfx s LEU 31 CO 0.39 -0.25 1.24 -0.94 0.23 0.00 0.00 176.35 177.02 2cfx s SER 32 N -0.63 3.90 0.18 2.29 1.04 -1.26 -4.50 113.70 114.72 2cfx s SER 32 Ca -0.07 2.45 -0.13 0.00 0.48 0.00 0.00 55.95 58.68 2cfx s SER 32 Cb -0.04 -2.60 0.14 0.00 0.10 0.00 0.00 66.02 63.62 2cfx s SER 32 CO 0.02 -2.47 1.77 -0.65 0.98 0.00 0.00 173.24 172.89 2cfx h PRO 33 N -0.44 0.41 -0.13 4.02 0.11 -1.97 -1.31 132.00 132.69 2cfx h PRO 33 Ca -0.48 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 2cfx h PRO 33 Cb 1.31 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2cfx h PRO 33 CO 0.48 0.27 -0.23 -1.00 -0.21 0.00 0.00 178.00 177.31 2cfx h PRO 34 N 0.42 0.23 -0.21 1.05 0.13 -1.99 -2.09 132.00 129.54 2cfx h PRO 34 Ca 0.22 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 65.20 2cfx h PRO 34 Cb 0.17 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.27 2cfx h PRO 34 CO -0.18 0.46 -0.17 1.03 -0.23 0.00 0.00 178.00 178.90 2cfx h SER 35 N 0.21 0.52 0.18 1.44 0.87 -1.76 -1.94 113.55 113.08 2cfx h SER 35 Ca 0.04 -0.46 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2cfx h SER 35 Cb 0.54 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2cfx h SER 35 CO 0.04 0.87 -0.13 0.58 -0.53 0.00 0.00 176.83 177.65 2cfx h VAL 36 N 0.17 0.72 -0.73 2.23 2.07 -1.19 -2.37 116.25 117.16 2cfx h VAL 36 Ca 0.04 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 2cfx h VAL 36 Cb 0.71 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 2cfx h VAL 36 CO 0.05 0.00 0.21 0.71 0.02 0.00 0.00 177.57 178.56 2cfx h THR 37 N -0.32 1.26 0.43 2.57 1.35 -1.39 -0.24 112.91 116.57 2cfx h THR 37 Ca -0.01 -0.92 -0.02 0.00 -0.55 0.00 0.00 66.41 64.91 2cfx h THR 37 Cb 0.28 0.48 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 2cfx h THR 37 CO 0.00 0.36 -0.26 -0.08 -0.25 0.00 0.00 175.52 175.29 2cfx h GLU 38 N 1.08 -0.64 -0.74 4.72 4.57 -1.39 -0.11 114.58 122.07 2cfx h GLU 38 Ca 0.23 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.59 2cfx h GLU 38 Cb 0.32 0.14 -0.09 0.00 -0.16 0.00 0.00 28.75 28.97 2cfx h GLU 38 CO -0.00 -0.42 0.31 0.00 -1.18 0.00 0.00 179.01 177.71 2cfx h ARG 39 N -0.66 0.46 -0.66 1.92 3.08 -1.05 -0.43 114.38 117.04 2cfx h ARG 39 Ca -0.05 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.89 2cfx h ARG 39 Cb 0.54 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2cfx h ARG 39 CO 0.05 0.30 0.08 0.28 -1.07 0.00 0.00 179.97 179.62 2cfx h VAL 40 N 0.47 1.26 0.09 2.04 2.07 -0.93 -1.43 116.25 119.82 2cfx h VAL 40 Ca 0.40 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.87 2cfx h VAL 40 Cb 0.57 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2cfx h VAL 40 CO -0.37 0.40 -0.21 0.03 0.02 0.00 0.00 177.57 177.43 2cfx h ARG 41 N 1.03 -0.37 -0.12 1.57 -0.00 -0.00 -2.43 114.38 114.05 2cfx h ARG 41 Ca 0.20 0.03 0.04 0.00 -0.50 0.00 0.00 59.98 59.74 2cfx h ARG 41 Cb 0.47 0.08 -0.04 0.00 0.00 0.00 0.00 29.97 30.49 2cfx h ARG 41 CO 0.02 -0.25 -0.12 1.96 0.00 0.00 0.00 179.97 181.58 2cfx h GLN 42 N -0.39 -0.14 -0.99 0.04 1.08 -1.02 -0.57 115.11 113.12 2cfx h GLN 42 Ca 0.03 0.01 0.24 0.00 -1.45 0.00 0.00 58.65 57.49 2cfx h GLN 42 Cb 0.42 0.03 -0.08 0.00 -0.05 0.00 0.00 27.48 27.80 2cfx h GLN 42 CO -0.14 -0.10 0.65 -0.07 -0.95 0.00 0.00 178.83 178.23 2cfx h LEU 43 N -0.15 0.41 0.22 1.46 3.38 -1.12 -1.46 115.31 118.05 2cfx h LEU 43 Ca 0.09 0.06 -0.33 0.00 0.09 0.00 0.00 57.88 57.78 2cfx h LEU 43 Cb 0.27 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.04 2cfx h LEU 43 CO -0.21 0.12 -1.54 -0.33 0.09 0.00 0.00 178.44 176.57 2cfx h GLU 44 N 0.39 0.46 0.03 1.13 5.08 -0.82 0.07 114.58 120.92 2cfx h GLU 44 Ca 0.54 -0.78 -0.26 0.00 -1.00 0.00 0.00 59.36 57.86 2cfx h GLU 44 Cb 1.39 0.29 0.01 0.00 0.50 0.00 0.00 28.75 30.95 2cfx h GLU 44 CO -0.23 1.37 -1.06 0.66 -1.00 0.00 0.00 179.01 178.75 2cfx h SER 45 N 0.12 0.72 0.00 1.42 4.64 -0.82 -2.59 113.55 117.05 2cfx h SER 45 Ca -0.27 -0.61 0.00 0.00 -0.47 0.00 0.00 61.79 60.44 2cfx h SER 45 Cb 2.13 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.99 2cfx h SER 45 CO 0.24 1.42 0.00 0.49 -0.87 0.00 0.00 176.83 178.10 2cfx n PHE 46 N -3.78 0.00 -1.11 4.77 3.01 -0.58 -4.93 117.46 114.85 2cfx n PHE 46 Ca -0.10 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.33 2cfx n PHE 46 Cb 0.90 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.35 2cfx n PHE 46 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2cfx n GLY 47 N 0.53 0.60 0.23 1.37 0.00 -0.98 -4.89 105.19 102.05 2cfx n GLY 47 Ca 0.09 -0.23 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2cfx n GLY 47 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2cfx h ILE 48 N 0.00 1.23 -3.61 -0.61 5.03 -1.24 -3.38 117.51 114.92 2cfx h ILE 48 Ca -0.07 -0.77 -0.62 0.00 -0.12 0.00 0.00 64.86 63.28 2cfx h ILE 48 Cb 0.51 0.82 -0.13 0.00 -3.03 0.00 0.00 36.82 34.99 2cfx h ILE 48 CO 0.11 0.28 -0.24 -0.63 -0.68 0.00 0.00 178.15 176.99 2cfx s ILE 49 N -5.39 5.20 -0.25 -0.67 1.01 -1.07 -4.94 121.20 115.09 2cfx s ILE 49 Ca -0.13 0.59 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 2cfx s ILE 49 Cb 0.11 -3.69 -0.17 0.00 0.01 0.00 0.00 42.46 38.72 2cfx s ILE 49 CO 0.78 0.21 -0.19 0.29 0.00 0.00 0.00 174.94 176.03 2cfx n LYS 50 N 4.91 0.64 -3.59 2.79 5.02 -1.26 -4.68 118.16 122.00 2cfx n LYS 50 Ca -0.09 0.20 -0.16 0.00 -2.02 0.00 0.00 58.31 56.24 2cfx n LYS 50 Cb 0.51 -1.54 -0.07 0.00 -0.02 0.00 0.00 35.03 33.92 2cfx n LYS 50 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2cfx s GLN 51 N -2.52 0.93 -0.29 1.97 0.74 -1.26 -5.13 119.66 114.10 2cfx s GLN 51 Ca -0.35 0.66 -0.17 0.00 0.05 0.00 0.00 55.36 55.55 2cfx s GLN 51 Cb 0.10 0.44 -0.02 0.00 1.10 0.00 0.00 33.01 34.63 2cfx s GLN 51 CO 0.59 -0.20 0.45 0.71 -0.55 0.00 0.00 175.29 176.30 2cfx s TYR 52 N -0.32 3.23 0.00 1.67 1.51 -1.26 -5.03 117.35 117.16 2cfx s TYR 52 Ca -0.05 0.40 0.00 0.00 -1.01 0.00 0.00 57.07 56.41 2cfx s TYR 52 Cb -0.03 -2.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.10 2cfx s TYR 52 CO 0.05 -0.34 0.00 -2.37 -1.11 0.00 0.00 175.55 171.78 2cfx n THR 53 N 5.22 0.00 -3.85 -0.71 5.66 -1.26 -5.15 114.28 114.18 2cfx n THR 53 Ca -0.06 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.82 2cfx n THR 53 Cb 0.50 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.18 2cfx n THR 53 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 2cfx s LEU 54 N 0.00 1.43 -0.18 1.09 2.96 -1.26 -4.91 118.68 117.81 2cfx s LEU 54 Ca 0.00 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 2cfx s LEU 54 Cb 0.00 0.75 0.04 0.00 0.50 0.00 0.00 46.19 47.47 2cfx s LEU 54 CO 0.00 -0.34 -0.10 -0.70 -1.32 0.00 0.00 176.35 173.88 2cfx s GLU 55 N -1.20 1.97 -0.03 1.98 2.12 -1.26 -5.11 118.70 117.17 2cfx s GLU 55 Ca -0.13 -0.70 -0.00 0.00 0.36 0.00 0.00 54.97 54.50 2cfx s GLU 55 Cb -0.07 -2.24 -0.04 0.00 0.26 0.00 0.00 34.13 32.05 2cfx s GLU 55 CO 0.02 -0.38 0.03 0.08 -0.54 0.00 0.00 175.26 174.47 2cfx s VAL 56 N 1.47 4.44 -0.51 3.70 1.01 -1.26 -5.07 120.40 124.18 2cfx s VAL 56 Ca 0.01 -0.42 -0.27 0.00 0.00 0.00 0.00 61.98 61.30 2cfx s VAL 56 Cb -0.15 -2.97 0.03 0.00 0.00 0.00 0.00 36.38 33.29 2cfx s VAL 56 CO -0.09 0.43 1.06 -0.62 0.00 0.00 0.00 175.10 175.89 2cfx s ASP 57 N -1.44 6.50 0.17 3.32 -1.08 -1.26 -4.93 116.67 117.95 2cfx s ASP 57 Ca 0.19 0.15 -0.12 0.00 -0.52 0.00 0.00 52.55 52.26 2cfx s ASP 57 Cb -0.12 -2.51 0.06 0.00 -1.46 0.00 0.00 42.92 38.90 2cfx s ASP 57 CO 0.09 -1.25 1.68 1.56 0.52 0.00 0.00 175.17 177.77 2cfx h GLN 58 N 9.28 0.91 -0.82 4.34 1.08 -1.97 -2.43 115.11 125.50 2cfx h GLN 58 Ca -0.24 -0.22 0.15 0.00 -1.45 0.00 0.00 58.65 56.89 2cfx h GLN 58 Cb 1.07 -0.12 -0.10 0.00 -0.05 0.00 0.00 27.48 28.28 2cfx h GLN 58 CO 1.11 0.85 0.39 -0.22 -0.95 0.00 0.00 178.83 180.01 2cfx h LYS 59 N 0.82 0.53 0.00 1.46 3.64 -1.89 -1.21 116.57 119.91 2cfx h LYS 59 Ca 0.18 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2cfx h LYS 59 Cb 0.35 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2cfx h LYS 59 CO 0.00 0.35 -0.15 1.63 -2.27 0.00 0.00 179.45 179.01 2cfx n LYS 60 N -4.93 0.15 -0.35 1.90 5.02 -1.06 -2.12 118.16 116.78 2cfx n LYS 60 Ca 0.17 0.10 0.08 0.00 -2.02 0.00 0.00 58.31 56.64 2cfx n LYS 60 Cb 0.45 -1.66 0.25 0.00 -0.02 0.00 0.00 35.03 34.06 2cfx n LYS 60 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2cfx n LEU 61 N -1.91 3.20 0.00 -0.35 4.77 -0.70 -4.96 117.00 117.05 2cfx n LEU 61 Ca 0.06 -1.61 0.00 0.00 -0.03 0.00 0.00 56.01 54.43 2cfx n LEU 61 Cb 0.39 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2cfx n LEU 61 CO 0.31 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 2cfx n GLY 62 N 1.17 0.70 2.31 -0.72 0.00 -0.90 -5.02 105.19 102.74 2cfx n GLY 62 Ca 0.18 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 2cfx n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cfx n LEU 63 N 0.00 1.67 -0.05 0.99 4.77 -0.54 -4.06 117.00 119.78 2cfx n LEU 63 Ca 0.00 -5.03 0.14 0.00 -0.03 0.00 0.00 56.01 51.10 2cfx n LEU 63 Cb 0.00 0.15 0.68 0.00 -2.33 0.00 0.00 43.42 41.93 2cfx n LEU 63 CO 0.00 2.11 0.94 -0.81 -1.33 0.00 0.00 177.39 178.30 2cfx n PRO 64 N 1.02 0.54 -4.33 3.23 -0.04 -0.96 -3.26 135.00 131.19 2cfx n PRO 64 Ca 0.25 -0.10 -0.35 0.00 -0.04 0.00 0.00 63.50 63.26 2cfx n PRO 64 Cb 0.50 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 2cfx n PRO 64 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2cfx s VAL 65 N -2.53 4.29 -0.00 0.52 1.01 -0.56 -4.89 120.40 118.24 2cfx s VAL 65 Ca 0.28 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2cfx s VAL 65 Cb 0.20 -2.84 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 2cfx s VAL 65 CO 0.47 0.56 -0.09 -0.55 0.00 0.00 0.00 175.10 175.50 2cfx s SER 66 N -0.45 1.02 0.04 3.32 0.15 -1.26 0.45 113.70 116.96 2cfx s SER 66 Ca 0.08 -0.18 -0.02 0.00 0.70 0.00 0.00 55.95 56.54 2cfx s SER 66 Cb -0.12 -0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.06 2cfx s SER 66 CO 0.02 0.09 -0.00 0.00 1.20 0.00 0.00 173.24 174.55 2cfx s ILE 68 N -2.80 5.27 -0.14 0.00 -1.09 0.20 -1.88 121.20 120.76 2cfx s ILE 68 Ca -0.03 0.57 0.02 0.00 -2.23 0.00 0.00 60.65 58.97 2cfx s ILE 68 Cb -0.00 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.27 2cfx s ILE 68 CO -0.06 0.47 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.23 2cfx s VAL 69 N -0.10 1.91 -0.22 2.92 1.01 0.36 0.94 120.40 127.23 2cfx s VAL 69 Ca 0.18 -0.88 -0.21 0.00 0.00 0.00 0.00 61.98 61.07 2cfx s VAL 69 Cb -0.14 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 2cfx s VAL 69 CO 0.06 0.52 0.65 -1.61 0.00 0.00 0.00 175.10 174.72 2cfx s GLU 70 N 0.99 4.18 -0.11 2.72 2.02 0.33 -0.90 118.70 127.93 2cfx s GLU 70 Ca -0.04 0.64 0.01 0.00 0.02 0.00 0.00 54.97 55.60 2cfx s GLU 70 Cb -0.15 -3.61 -0.02 0.00 0.10 0.00 0.00 34.13 30.46 2cfx s GLU 70 CO -0.05 -0.33 -0.13 0.00 0.02 0.00 0.00 175.26 174.77 2cfx s ALA 71 N 2.21 2.64 -0.23 5.21 0.00 -0.23 -1.09 121.76 130.27 2cfx s ALA 71 Ca 0.29 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.35 2cfx s ALA 71 Cb -0.16 -1.16 0.03 0.00 0.00 0.00 0.00 23.12 21.84 2cfx s ALA 71 CO 0.09 0.33 -0.13 -0.08 0.00 0.00 0.00 175.76 175.97 2cfx s THR 72 N 0.08 2.34 0.32 0.00 -1.32 0.17 -0.46 115.64 116.76 2cfx s THR 72 Ca -0.05 -1.18 -0.29 0.00 -1.21 0.00 0.00 61.69 58.95 2cfx s THR 72 Cb -0.15 -2.17 -0.12 0.00 -1.51 0.00 0.00 72.50 68.56 2cfx s THR 72 CO 0.04 0.26 1.45 0.52 -2.21 0.00 0.00 174.62 174.69 2cfx n VAL 73 N 4.57 1.51 -3.06 5.08 0.31 -1.26 -1.22 118.33 124.27 2cfx n VAL 73 Ca -0.17 -0.38 -0.38 0.00 -0.01 0.00 0.00 64.34 63.40 2cfx n VAL 73 Cb 0.47 -1.77 -0.06 0.00 -0.91 0.00 0.00 33.84 31.56 2cfx n VAL 73 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2cfx s LYS 74 N -1.25 4.39 -1.83 5.55 1.02 -0.61 -4.13 119.74 122.87 2cfx s LYS 74 Ca 0.60 0.99 0.00 0.00 0.02 0.00 0.00 55.97 57.58 2cfx s LYS 74 Cb -0.54 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 2cfx s LYS 74 CO 0.56 0.50 0.00 0.09 -0.92 0.00 0.00 175.35 175.58 2cfx n ASN 75 N 1.21 -5.88 -1.53 2.83 3.02 -1.26 -1.87 115.26 111.78 2cfx n ASN 75 Ca -0.05 0.04 -0.18 0.00 -0.03 0.00 0.00 54.58 54.36 2cfx n ASN 75 Cb 0.50 -4.92 -0.08 0.00 -0.61 0.00 0.00 39.78 34.67 2cfx n ASN 75 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cfx n ALA 76 N -1.65 -0.28 -3.36 5.41 0.00 -1.26 -4.88 120.51 114.49 2cfx n ALA 76 Ca -0.24 0.30 -0.45 0.00 0.00 0.00 0.00 53.44 53.04 2cfx n ALA 76 Cb 0.69 -1.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 2cfx n ALA 76 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2cfx s ASP 77 N -2.56 6.91 0.14 0.00 -1.08 -0.78 -4.83 116.67 114.47 2cfx s ASP 77 Ca 0.00 -3.13 -0.12 0.00 -0.52 0.00 0.00 52.55 48.79 2cfx s ASP 77 Cb 0.00 -2.18 -0.04 0.00 -1.46 0.00 0.00 42.92 39.23 2cfx s ASP 77 CO 0.00 -0.43 1.47 1.88 0.52 0.00 0.00 175.17 178.62 2cfx h TYR 78 N 7.20 1.09 -0.66 -5.34 -1.99 -1.89 -2.86 116.97 112.52 2cfx h TYR 78 Ca 0.14 -0.32 -0.03 0.00 2.00 0.00 0.00 58.73 60.51 2cfx h TYR 78 Cb 0.96 -0.23 -0.03 0.00 2.00 0.00 0.00 36.73 39.43 2cfx h TYR 78 CO 0.90 1.14 0.28 0.93 -0.00 0.00 0.00 178.16 181.40 2cfx h GLU 79 N 0.72 0.98 -0.53 4.88 5.08 -1.99 0.09 114.58 123.82 2cfx h GLU 79 Ca 0.07 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 2cfx h GLU 79 Cb 0.94 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2cfx h GLU 79 CO 0.09 0.81 0.06 -0.09 -1.00 0.00 0.00 179.01 178.88 2cfx h ARG 80 N 0.93 0.85 -0.01 2.33 2.43 -1.95 0.01 114.38 118.97 2cfx h ARG 80 Ca 0.22 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2cfx h ARG 80 Cb 0.18 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2cfx h ARG 80 CO -0.02 0.82 -0.04 0.35 -1.51 0.00 0.00 179.97 179.56 2cfx h PHE 81 N 0.81 0.06 -0.37 2.20 3.57 -1.37 -2.13 116.94 119.70 2cfx h PHE 81 Ca 0.17 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.72 2cfx h PHE 81 Cb 0.40 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 39.04 2cfx h PHE 81 CO 0.02 0.71 -0.23 -0.22 -2.23 0.00 0.00 178.31 176.37 2cfx h LYS 82 N -0.61 -0.16 -0.52 1.11 3.64 -0.74 -0.17 116.57 119.12 2cfx h LYS 82 Ca -0.00 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.47 2cfx h LYS 82 Cb 0.72 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.51 2cfx h LYS 82 CO 0.01 -0.11 0.15 0.77 -2.27 0.00 0.00 179.45 178.00 2cfx h SER 83 N -0.17 0.10 -0.05 4.20 0.02 -1.02 -2.27 113.55 114.36 2cfx h SER 83 Ca 0.18 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.22 2cfx h SER 83 Cb 0.45 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2cfx h SER 83 CO -0.47 0.08 -0.04 0.22 -1.14 0.00 0.00 176.83 175.48 2cfx h TYR 84 N 0.30 -0.09 -0.24 3.45 3.20 -1.07 -2.83 116.97 119.70 2cfx h TYR 84 Ca 0.26 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 2cfx h TYR 84 Cb 0.33 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 2cfx h TYR 84 CO -0.20 -0.06 0.10 0.82 -1.64 0.00 0.00 178.16 177.18 2cfx h ILE 85 N -0.04 1.10 0.00 1.81 1.08 -0.74 -2.55 117.51 118.17 2cfx h ILE 85 Ca 0.03 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.21 2cfx h ILE 85 Cb 0.09 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 2cfx h ILE 85 CO -0.08 0.11 -0.03 0.00 -0.69 0.00 0.00 178.15 177.47 2cfx n GLN 86 N -4.44 0.04 -0.00 2.37 6.02 -0.88 -2.47 117.38 118.01 2cfx n GLN 86 Ca 0.01 0.03 0.02 0.00 -0.01 0.00 0.00 57.00 57.05 2cfx n GLN 86 Cb 0.12 -1.54 0.14 0.00 1.02 0.00 0.00 30.24 29.98 2cfx n GLN 86 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2cfx n THR 87 N -1.60 0.00 -5.02 5.09 -2.24 -0.96 -4.94 114.28 104.60 2cfx n THR 87 Ca 0.07 -0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.54 2cfx n THR 87 Cb 0.35 -0.07 -0.15 0.00 -2.10 0.00 0.00 70.33 68.37 2cfx n THR 87 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2cfx s LEU 88 N -1.14 2.27 0.47 3.22 1.43 -1.03 -5.12 118.68 118.78 2cfx s LEU 88 Ca 0.07 -0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 2cfx s LEU 88 Cb 0.03 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 2cfx s LEU 88 CO 0.05 0.29 0.79 -2.16 0.23 0.00 0.00 176.35 175.56 2cfx s PRO 89 N -0.96 3.58 -0.79 1.29 0.04 -1.26 -4.53 135.00 132.36 2cfx s PRO 89 Ca 0.11 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.41 2cfx s PRO 89 Cb -0.10 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.07 2cfx s PRO 89 CO 0.01 -0.19 0.00 0.09 0.04 0.00 0.00 177.00 176.95 2cfx n ASN 90 N -2.13 -4.34 -4.55 6.66 3.02 -1.26 -4.95 115.26 107.71 2cfx n ASN 90 Ca 0.01 0.18 -0.42 0.00 -0.03 0.00 0.00 54.58 54.32 2cfx n ASN 90 Cb 0.55 -2.50 -0.06 0.00 -0.61 0.00 0.00 39.78 37.16 2cfx n ASN 90 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2cfx s ILE 91 N -2.13 4.80 -0.10 2.41 -1.09 -1.26 -0.74 121.20 123.09 2cfx s ILE 91 Ca 0.00 0.44 -0.19 0.00 -2.23 0.00 0.00 60.65 58.67 2cfx s ILE 91 Cb 0.00 -4.19 -0.28 0.00 -1.58 0.00 0.00 42.46 36.42 2cfx s ILE 91 CO 0.00 -0.51 0.64 -0.08 -1.23 0.00 0.00 174.94 173.76 2cfx h GLU 92 N 8.71 0.23 -4.58 2.79 4.81 -1.37 -3.48 114.58 121.69 2cfx h GLU 92 Ca -0.26 -0.39 -0.38 0.00 -0.13 0.00 0.00 59.36 58.21 2cfx h GLU 92 Cb 1.10 0.14 -0.11 0.00 0.63 0.00 0.00 28.75 30.51 2cfx h GLU 92 CO 0.89 1.19 -0.39 -0.59 -0.73 0.00 0.00 179.01 179.38 2cfx s PHE 93 N -2.44 1.44 -0.31 0.92 -0.12 -1.25 -4.97 117.98 111.25 2cfx s PHE 93 Ca -0.19 -1.50 0.05 0.00 -0.05 0.00 0.00 56.93 55.24 2cfx s PHE 93 Cb 0.03 -0.46 0.20 0.00 -0.63 0.00 0.00 43.02 42.15 2cfx s PHE 93 CO 0.77 -0.95 0.64 0.00 -0.05 0.00 0.00 175.22 175.63 2cfx s TYR 95 N 2.70 3.45 -0.21 0.00 1.51 0.11 -4.93 117.35 120.00 2cfx s TYR 95 Ca 0.12 0.37 -0.29 0.00 -1.01 0.00 0.00 57.07 56.27 2cfx s TYR 95 Cb -0.08 -2.01 0.00 0.00 -0.11 0.00 0.00 41.96 39.76 2cfx s TYR 95 CO -0.23 0.50 1.09 0.50 -1.11 0.00 0.00 175.55 176.30 2cfx s ARG 96 N -0.40 4.26 0.25 -0.62 6.06 -1.26 -0.86 118.95 126.37 2cfx s ARG 96 Ca 0.11 1.44 0.10 0.00 -2.50 0.00 0.00 55.73 54.88 2cfx s ARG 96 Cb -0.12 -3.66 -0.05 0.00 0.06 0.00 0.00 34.95 31.18 2cfx s ARG 96 CO 0.01 -0.63 -0.18 0.96 -2.50 0.00 0.00 175.30 172.96 2cfx s ILE 97 N 3.21 2.21 -0.57 4.11 -4.36 0.63 -4.96 121.20 121.46 2cfx s ILE 97 Ca 0.47 -2.31 -0.19 0.00 -0.26 0.00 0.00 60.65 58.37 2cfx s ILE 97 Cb -0.17 -2.19 0.10 0.00 1.25 0.00 0.00 42.46 41.45 2cfx s ILE 97 CO 0.09 -0.44 0.67 0.00 0.24 0.00 0.00 174.94 175.49 2cfx s ALA 98 N -2.59 3.43 0.00 2.27 0.00 -1.26 -4.64 121.76 118.97 2cfx s ALA 98 Ca 0.26 -2.18 0.00 0.00 0.00 0.00 0.00 51.96 50.04 2cfx s ALA 98 Cb -0.04 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2cfx s ALA 98 CO 0.12 -2.26 0.00 0.41 0.00 0.00 0.00 175.76 174.02 2cfx n GLY 99 N 5.26 -0.86 0.09 0.00 0.00 -1.26 -5.01 105.19 103.41 2cfx n GLY 99 Ca -0.10 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 2cfx n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cfx n ALA 100 N 0.00 1.67 -1.97 4.61 0.00 -1.26 -4.85 120.51 118.71 2cfx n ALA 100 Ca 0.00 -0.68 -0.28 0.00 0.00 0.00 0.00 53.44 52.48 2cfx n ALA 100 Cb 0.00 -0.89 0.05 0.00 0.00 0.00 0.00 19.45 18.61 2cfx n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cfx s ALA 101 N -2.72 3.05 -0.12 0.00 0.00 -1.26 -4.97 121.76 115.74 2cfx s ALA 101 Ca -0.04 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.33 2cfx s ALA 101 Cb 0.08 -2.80 -0.24 0.00 0.00 0.00 0.00 23.12 20.16 2cfx s ALA 101 CO 0.82 -1.10 0.38 0.00 0.00 0.00 0.00 175.76 175.85 2cfx s TYR 103 N -2.56 -0.04 -0.10 0.00 1.51 -0.90 -0.27 117.35 114.99 2cfx s TYR 103 Ca -0.18 0.05 0.04 0.00 -1.01 0.00 0.00 57.07 55.97 2cfx s TYR 103 Cb 0.07 -0.00 -0.00 0.00 -0.11 0.00 0.00 41.96 41.92 2cfx s TYR 103 CO 0.77 -0.28 -0.24 -1.64 -1.11 0.00 0.00 175.55 173.05 2cfx s MET 104 N -1.14 3.03 0.15 -0.62 -1.94 -0.04 -1.07 119.30 117.67 2cfx s MET 104 Ca -0.12 -0.88 0.02 0.00 -1.71 0.00 0.00 55.69 52.99 2cfx s MET 104 Cb -0.06 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.44 2cfx s MET 104 CO 0.02 0.19 -0.01 -0.48 -0.01 0.00 0.00 175.02 174.73 2cfx s LEU 105 N 0.32 2.19 -0.12 -0.03 0.05 -0.08 0.09 118.68 121.09 2cfx s LEU 105 Ca -0.18 -1.13 0.03 0.00 0.05 0.00 0.00 54.13 52.90 2cfx s LEU 105 Cb -0.18 -0.03 0.01 0.00 -2.05 0.00 0.00 46.19 43.94 2cfx s LEU 105 CO 0.09 -0.55 -0.21 -0.75 -0.55 0.00 0.00 176.35 174.37 2cfx s LYS 106 N -3.90 2.89 0.06 1.48 2.20 -1.10 -0.49 119.74 120.88 2cfx s LYS 106 Ca 0.21 -0.81 0.06 0.00 -0.36 0.00 0.00 55.97 55.06 2cfx s LYS 106 Cb 0.06 -2.31 -0.04 0.00 -1.51 0.00 0.00 37.83 34.04 2cfx s LYS 106 CO 0.01 0.03 -0.10 0.96 -0.36 0.00 0.00 175.35 175.89 2cfx s ILE 107 N 0.72 3.36 -0.08 5.43 -4.36 -0.79 -0.84 121.20 124.65 2cfx s ILE 107 Ca -0.10 -1.11 0.02 0.00 -0.26 0.00 0.00 60.65 59.20 2cfx s ILE 107 Cb -0.16 -2.52 -0.02 0.00 1.25 0.00 0.00 42.46 41.01 2cfx s ILE 107 CO 0.01 0.23 -0.12 0.20 0.24 0.00 0.00 174.94 175.50 2cfx s ASN 108 N -1.85 4.23 0.05 4.36 0.02 0.08 -1.33 114.94 120.50 2cfx s ASN 108 Ca 0.19 -0.17 0.00 0.00 -1.02 0.00 0.00 52.86 51.86 2cfx s ASN 108 Cb -0.11 -1.14 -0.03 0.00 0.02 0.00 0.00 41.25 39.99 2cfx s ASN 108 CO 0.11 0.30 -0.04 0.00 0.02 0.00 0.00 177.10 177.48 2cfx s ALA 109 N -0.47 0.49 0.37 0.60 0.00 0.17 -4.82 121.76 118.11 2cfx s ALA 109 Ca 0.06 -0.98 0.04 0.00 0.00 0.00 0.00 51.96 51.08 2cfx s ALA 109 Cb -0.12 0.18 0.73 0.00 0.00 0.00 0.00 23.12 23.91 2cfx s ALA 109 CO 0.02 -0.23 2.02 1.49 0.00 0.00 0.00 175.76 179.06 2cfx h GLU 110 N 3.77 0.69 -1.99 0.00 4.81 -1.84 -1.37 114.58 118.65 2cfx h GLU 110 Ca -0.34 -0.05 0.24 0.00 -0.13 0.00 0.00 59.36 59.08 2cfx h GLU 110 Cb 1.17 -0.15 -0.10 0.00 0.63 0.00 0.00 28.75 30.31 2cfx h GLU 110 CO 0.54 0.47 0.62 -1.54 -0.73 0.00 0.00 179.01 178.37 2cfx s SER 111 N -6.58 -0.13 0.20 1.04 1.04 -1.26 -4.41 113.70 103.59 2cfx s SER 111 Ca -0.09 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 55.93 2cfx s SER 111 Cb 0.17 0.36 0.21 0.00 0.10 0.00 0.00 66.02 66.87 2cfx s SER 111 CO 0.75 -0.67 1.77 -0.07 0.98 0.00 0.00 173.24 176.00 2cfx h LEU 112 N 2.00 0.32 -0.88 2.42 3.38 -1.96 -2.65 115.31 117.93 2cfx h LEU 112 Ca -0.26 0.05 0.18 0.00 0.09 0.00 0.00 57.88 57.93 2cfx h LEU 112 Cb 1.22 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.86 2cfx h LEU 112 CO 0.27 0.21 0.45 -0.08 0.09 0.00 0.00 178.44 179.37 2cfx h GLU 113 N 0.48 0.56 -0.33 1.13 4.81 -1.98 0.41 114.58 119.64 2cfx h GLU 113 Ca 0.27 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 2cfx h GLU 113 Cb 0.25 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 2cfx h GLU 113 CO -0.23 0.37 -0.00 0.00 -0.73 0.00 0.00 179.01 178.42 2cfx h ALA 114 N 1.62 1.38 -0.21 2.92 0.00 -1.87 -0.14 119.26 122.97 2cfx h ALA 114 Ca 0.51 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2cfx h ALA 114 Cb 0.82 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2cfx h ALA 114 CO -0.42 0.43 -0.02 0.28 0.00 0.00 0.00 179.25 179.53 2cfx h VAL 115 N 0.49 1.27 -0.63 0.00 2.07 -1.20 -1.33 116.25 116.92 2cfx h VAL 115 Ca 0.11 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.70 2cfx h VAL 115 Cb 0.32 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 2cfx h VAL 115 CO 0.01 0.28 0.42 -0.08 0.02 0.00 0.00 177.57 178.22 2cfx h GLU 116 N 0.12 0.83 -0.95 1.57 4.81 -0.52 -1.37 114.58 119.07 2cfx h GLU 116 Ca 0.06 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2cfx h GLU 116 Cb 0.43 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.57 2cfx h GLU 116 CO 0.01 0.55 0.63 -0.44 -0.73 0.00 0.00 179.01 179.03 2cfx h ASP 117 N 0.85 1.05 -0.15 1.04 3.32 -0.94 -1.37 116.42 120.22 2cfx h ASP 117 Ca 0.23 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.29 2cfx h ASP 117 Cb -0.09 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 2cfx h ASP 117 CO -0.05 0.74 0.02 0.15 -1.72 0.00 0.00 179.24 178.37 2cfx h PHE 118 N 1.23 0.02 -0.29 4.55 3.57 -0.92 0.75 116.94 125.84 2cfx h PHE 118 Ca 0.37 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 2cfx h PHE 118 Cb -0.04 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2cfx h PHE 118 CO -0.00 -0.00 0.09 0.82 -2.23 0.00 0.00 178.31 176.99 2cfx h ILE 119 N 0.07 1.20 -0.45 1.41 1.08 -1.05 -0.26 117.51 119.52 2cfx h ILE 119 Ca 0.07 -0.64 0.08 0.00 -0.39 0.00 0.00 64.86 63.97 2cfx h ILE 119 Cb 0.07 1.07 -0.06 0.00 -3.07 0.00 0.00 36.82 34.83 2cfx h ILE 119 CO -0.10 0.21 0.07 0.78 -0.69 0.00 0.00 178.15 178.42 2cfx h ASN 120 N 0.31 -0.03 0.68 1.72 4.21 -1.14 -2.01 115.58 119.32 2cfx h ASN 120 Ca 0.09 0.08 -0.11 0.00 1.21 0.00 0.00 56.30 57.57 2cfx h ASN 120 Cb 0.24 0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.55 2cfx h ASN 120 CO -0.00 0.02 -0.54 0.11 -1.29 0.00 0.00 177.43 175.72 2cfx h LYS 121 N 0.20 0.00 0.00 0.81 6.56 -0.53 -3.13 116.57 120.47 2cfx h LYS 121 Ca 0.22 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.81 2cfx h LYS 121 Cb 0.29 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.95 2cfx h LYS 121 CO -0.31 0.54 -0.42 0.00 -2.06 0.00 0.00 179.45 177.21 2cfx h THR 122 N 0.00 0.00 -0.01 -0.16 1.03 -0.82 -3.39 112.91 109.56 2cfx h THR 122 Ca -0.01 -0.82 0.00 0.00 -0.01 0.00 0.00 66.41 65.58 2cfx h THR 122 Cb 1.03 1.59 -0.00 0.00 -1.07 0.00 0.00 68.15 69.70 2cfx h THR 122 CO 0.07 0.00 0.01 0.77 -0.01 0.00 0.00 175.52 176.36 2cfx h SER 123 N 0.00 0.00 -0.28 0.00 4.64 -1.31 0.44 113.55 117.04 2cfx h SER 123 Ca 0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 2cfx h SER 123 Cb 0.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 2cfx h SER 123 CO 0.00 0.00 0.23 -0.65 -0.87 0.00 0.00 176.83 175.54 2cfx h PRO 124 N 0.00 0.00 0.00 4.77 0.11 -1.79 -3.30 132.00 131.79 2cfx h PRO 124 Ca 0.01 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 2cfx h PRO 124 Cb 0.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2cfx h PRO 124 CO -0.00 0.00 -1.71 0.66 -0.21 0.00 0.00 178.00 176.74 2cfx n TYR 125 N -4.16 0.00 -3.64 0.65 4.02 0.15 -4.86 117.16 109.32 2cfx n TYR 125 Ca 0.04 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.85 2cfx n TYR 125 Cb 0.39 -0.40 -0.07 0.00 -0.02 0.00 0.00 39.34 39.24 2cfx n TYR 125 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2cfx s ALA 126 N -2.86 -2.03 0.41 -0.72 0.00 -0.94 -1.58 121.76 114.05 2cfx s ALA 126 Ca -0.06 2.08 -0.23 0.00 0.00 0.00 0.00 51.96 53.75 2cfx s ALA 126 Cb 0.08 -1.49 -0.09 0.00 0.00 0.00 0.00 23.12 21.62 2cfx s ALA 126 CO 0.59 -0.30 1.06 -0.65 0.00 0.00 0.00 175.76 176.45 2cfx s GLN 127 N 0.79 4.09 0.07 0.00 -0.21 -0.35 -4.06 119.66 119.98 2cfx s GLN 127 Ca -0.03 1.51 0.06 0.00 0.02 0.00 0.00 55.36 56.92 2cfx s GLN 127 Cb -0.05 -2.47 -0.03 0.00 1.00 0.00 0.00 33.01 31.46 2cfx s GLN 127 CO -0.10 -0.21 -0.15 0.95 -2.12 0.00 0.00 175.29 173.66 2cfx s THR 128 N -1.69 1.21 -0.10 -0.19 -4.23 -1.25 0.43 115.64 109.81 2cfx s THR 128 Ca 0.59 -1.25 0.03 0.00 -1.18 0.00 0.00 61.69 59.88 2cfx s THR 128 Cb -0.22 -1.13 0.01 0.00 1.34 0.00 0.00 72.50 72.50 2cfx s THR 128 CO 0.27 -0.13 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.36 2cfx s VAL 129 N -1.13 1.60 -0.18 2.29 1.01 -0.25 -4.95 120.40 118.79 2cfx s VAL 129 Ca 0.00 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.23 2cfx s VAL 129 Cb -0.09 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 2cfx s VAL 129 CO 0.02 0.46 -0.08 -0.89 0.00 0.00 0.00 175.10 174.61 2cfx s THR 130 N 0.68 3.20 -0.25 3.92 2.01 -1.26 -0.51 115.64 123.43 2cfx s THR 130 Ca -0.13 -0.57 0.02 0.00 0.31 0.00 0.00 61.69 61.31 2cfx s THR 130 Cb -0.16 -2.41 0.05 0.00 0.01 0.00 0.00 72.50 69.99 2cfx s THR 130 CO 0.03 0.47 -0.11 -1.00 -0.69 0.00 0.00 174.62 173.32 2cfx s HIS 131 N 1.00 3.15 0.20 4.92 3.76 0.27 -4.97 115.29 123.63 2cfx s HIS 131 Ca -0.01 -2.06 -0.31 0.00 -0.15 0.00 0.00 55.06 52.54 2cfx s HIS 131 Cb -0.15 -1.96 -0.10 0.00 1.11 0.00 0.00 32.58 31.49 2cfx s HIS 131 CO -0.01 -0.84 1.45 0.08 -0.85 0.00 0.00 174.74 174.57 2cfx s VAL 132 N 1.18 2.81 -0.19 -0.90 1.01 -1.26 0.58 120.40 123.63 2cfx s VAL 132 Ca -0.05 0.64 -0.29 0.00 0.00 0.00 0.00 61.98 62.28 2cfx s VAL 132 Cb -0.18 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2cfx s VAL 132 CO -0.06 0.08 1.04 -0.63 0.00 0.00 0.00 175.10 175.53 2cfx s ILE 133 N 0.45 4.70 -0.05 2.22 1.01 -0.28 -4.88 121.20 124.36 2cfx s ILE 133 Ca 0.62 2.02 -0.13 0.00 0.00 0.00 0.00 60.65 63.16 2cfx s ILE 133 Cb -0.41 -4.30 -0.31 0.00 0.01 0.00 0.00 42.46 37.45 2cfx s ILE 133 CO 0.38 -0.12 0.69 -0.26 0.00 0.00 0.00 174.94 175.63 2cfx h PHE 134 N 7.36 0.69 -1.76 3.97 0.05 -1.94 -3.44 116.94 121.87 2cfx h PHE 134 Ca -0.23 -0.50 0.08 0.00 3.82 0.00 0.00 57.97 61.13 2cfx h PHE 134 Cb 1.09 -0.03 -0.01 0.00 2.00 0.00 0.00 35.95 39.00 2cfx h PHE 134 CO 0.74 1.63 0.24 -1.13 -0.18 0.00 0.00 178.31 179.61 2cfx n SER 135 N -3.70 -0.52 -3.74 2.17 3.41 -1.26 -5.15 113.62 104.82 2cfx n SER 135 Ca -0.23 -1.23 -0.12 0.00 -0.26 0.00 0.00 58.87 57.03 2cfx n SER 135 Cb 1.03 0.84 -0.12 0.00 -0.26 0.00 0.00 64.21 65.70 2cfx n SER 135 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2cfx s GLU 136 N -2.01 0.32 -0.10 4.33 2.12 -1.26 -5.13 118.70 116.96 2cfx s GLU 136 Ca 0.09 0.53 -0.29 0.00 0.36 0.00 0.00 54.97 55.66 2cfx s GLU 136 Cb -0.01 0.04 -0.02 0.00 0.26 0.00 0.00 34.13 34.41 2cfx s GLU 136 CO 0.01 -0.10 0.96 0.42 -0.54 0.00 0.00 175.26 176.01 2cfx s ILE 137 N 0.75 4.82 -0.14 -3.70 1.01 -1.26 -5.02 121.20 117.65 2cfx s ILE 137 Ca -0.05 1.96 -0.29 0.00 0.00 0.00 0.00 60.65 62.27 2cfx s ILE 137 Cb -0.06 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.11 2cfx s ILE 137 CO -0.05 0.04 1.27 -0.62 0.00 0.00 0.00 174.94 175.57 2cfx s ASP 138 N 1.08 6.95 0.00 3.58 2.15 -1.26 -4.89 116.67 124.28 2cfx s ASP 138 Ca 0.47 1.74 0.02 0.00 0.43 0.00 0.00 52.55 55.20 2cfx s ASP 138 Cb -0.18 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 39.93 2cfx s ASP 138 CO 0.18 -0.74 0.79 0.35 -0.17 0.00 0.00 175.17 175.58 2cfx n THR 139 N 5.25 0.46 -0.45 1.71 -2.24 -1.26 -5.38 114.28 112.37 2cfx n THR 139 Ca 0.14 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2cfx n THR 139 Cb 0.45 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2cfx n THR 139 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79