#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfp h SER 1 N 0.00 0.00 -1.21 6.12 4.64 -2.05 -3.33 113.55 117.72 1cfp h SER 1 Ca 0.00 -0.27 0.35 0.00 -0.47 0.00 0.00 61.79 61.40 1cfp h SER 1 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1cfp h SER 1 CO 0.00 0.91 1.14 -0.33 -0.87 0.00 0.00 176.83 177.67 1cfp h GLU 2 N -1.00 0.00 0.00 4.77 5.08 -2.05 -1.85 114.58 119.53 1cfp h GLU 2 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1cfp h GLU 2 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1cfp h GLU 2 CO -0.05 0.00 0.00 -0.11 -1.00 0.00 0.00 179.01 177.85 1cfp n LEU 3 N -3.58 0.00 -0.30 1.33 -0.00 -1.25 -0.04 117.00 113.16 1cfp n LEU 3 Ca 0.27 0.83 -0.03 0.00 -0.00 0.00 0.00 56.01 57.08 1cfp n LEU 3 Cb 1.51 -0.33 0.12 0.00 -0.00 0.00 0.00 43.42 44.72 1cfp n LEU 3 CO 0.31 -0.33 1.16 -0.33 -0.00 0.00 0.00 177.39 178.21 1cfp h GLU 4 N 0.00 1.19 -0.28 1.96 4.39 -1.57 0.25 114.58 120.53 1cfp h GLU 4 Ca 0.00 -0.14 0.08 0.00 0.34 0.00 0.00 59.36 59.64 1cfp h GLU 4 Cb 0.00 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.41 1cfp h GLU 4 CO 0.00 0.88 0.48 0.87 -1.16 0.00 0.00 179.01 180.08 1cfp h LYS 5 N 1.20 0.00 -0.40 2.33 1.79 -1.14 0.85 116.57 121.20 1cfp h LYS 5 Ca 0.30 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.71 1cfp h LYS 5 Cb 0.04 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 1cfp h LYS 5 CO -0.05 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.33 1cfp h ALA 6 N 1.30 0.54 -0.98 3.86 0.00 0.31 0.15 119.26 124.44 1cfp h ALA 6 Ca 0.13 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1cfp h ALA 6 Cb 1.09 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 1cfp h ALA 6 CO -0.00 0.32 0.63 0.28 0.00 0.00 0.00 179.25 180.48 1cfp h VAL 7 N 0.54 1.07 -0.67 0.00 2.07 0.68 0.53 116.25 120.46 1cfp h VAL 7 Ca 0.11 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1cfp h VAL 7 Cb 0.47 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 1cfp h VAL 7 CO 0.02 0.21 0.30 0.58 0.02 0.00 0.00 177.57 178.70 1cfp h VAL 8 N 1.12 1.22 0.00 2.57 2.07 -0.97 0.13 116.25 122.40 1cfp h VAL 8 Ca 0.43 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1cfp h VAL 8 Cb 0.21 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1cfp h VAL 8 CO -0.18 0.27 -0.09 0.00 0.02 0.00 0.00 177.57 177.59 1cfp h ALA 9 N 1.37 1.68 0.00 1.67 0.00 0.20 0.13 119.26 124.30 1cfp h ALA 9 Ca 0.23 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1cfp h ALA 9 Cb 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1cfp h ALA 9 CO -0.03 0.12 -0.13 -0.07 0.00 0.00 0.00 179.25 179.14 1cfp h LEU 10 N 0.00 0.00 -0.31 0.00 3.38 0.12 -2.68 115.31 115.82 1cfp h LEU 10 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1cfp h LEU 10 Cb 0.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1cfp h LEU 10 CO 0.01 0.13 -0.82 0.16 0.09 0.00 0.00 178.44 178.01 1cfp h ILE 11 N 0.00 1.56 -0.12 1.22 -0.00 -0.06 -0.05 117.51 120.06 1cfp h ILE 11 Ca -0.00 -2.84 -0.04 0.00 -0.00 0.00 0.00 64.86 61.97 1cfp h ILE 11 Cb 0.85 2.55 -0.00 0.00 -0.00 0.00 0.00 36.82 40.21 1cfp h ILE 11 CO 0.02 0.80 -0.09 -0.78 -0.00 0.00 0.00 178.15 178.10 1cfp h ASP 12 N 0.00 0.29 0.05 2.16 1.82 -1.17 -2.87 116.42 116.70 1cfp h ASP 12 Ca -0.01 -0.45 -0.00 0.00 -0.39 0.00 0.00 57.03 56.18 1cfp h ASP 12 Cb 1.48 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.41 1cfp h ASP 12 CO 0.11 0.68 -0.02 -0.37 -1.61 0.00 0.00 179.24 178.02 1cfp h VAL 13 N -0.09 1.26 -0.75 2.25 -1.51 -1.48 -2.85 116.25 113.09 1cfp h VAL 13 Ca 0.02 -1.07 0.15 0.00 -1.23 0.00 0.00 66.70 64.57 1cfp h VAL 13 Cb 0.58 1.96 -0.14 0.00 -2.13 0.00 0.00 31.29 31.56 1cfp h VAL 13 CO 0.02 0.27 -0.19 -0.26 -1.23 0.00 0.00 177.57 176.18 1cfp h PHE 14 N -0.54 -0.41 -0.27 5.19 0.04 -1.06 1.80 116.94 121.68 1cfp h PHE 14 Ca -0.01 0.07 0.06 0.00 2.80 0.00 0.00 57.97 60.89 1cfp h PHE 14 Cb 0.49 0.30 -0.08 0.00 2.20 0.00 0.00 35.95 38.85 1cfp h PHE 14 CO 0.08 -0.32 -0.33 1.25 -0.60 0.00 0.00 178.31 178.39 1cfp h HIS 15 N -0.00 -0.92 0.00 -0.55 -0.00 -1.48 0.45 115.15 112.65 1cfp h HIS 15 Ca 0.36 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.78 1cfp h HIS 15 Cb 0.55 0.45 0.00 0.00 -0.00 0.00 0.00 27.41 28.40 1cfp h HIS 15 CO -0.60 -0.39 0.00 1.04 -0.00 0.00 0.00 177.93 177.98 1cfp n GLN 16 N -5.41 0.00 -0.34 5.26 6.02 0.16 0.13 117.38 123.20 1cfp n GLN 16 Ca -0.01 0.50 -0.08 0.00 -0.01 0.00 0.00 57.00 57.40 1cfp n GLN 16 Cb 0.33 -1.29 -0.07 0.00 1.02 0.00 0.00 30.24 30.23 1cfp n GLN 16 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1cfp n TYR 17 N -2.00 -0.31 1.48 1.08 4.01 0.56 0.27 117.16 122.26 1cfp n TYR 17 Ca 0.00 1.02 0.13 0.00 -0.16 0.00 0.00 57.90 58.89 1cfp n TYR 17 Cb 0.00 -0.60 0.52 0.00 -0.31 0.00 0.00 39.34 38.95 1cfp n TYR 17 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1cfp n SER 18 N -5.05 1.45 -1.13 7.72 7.64 0.16 -3.97 113.62 120.45 1cfp n SER 18 Ca 0.03 -1.51 0.04 0.00 1.01 0.00 0.00 58.87 58.44 1cfp n SER 18 Cb 0.23 -0.02 0.07 0.00 -1.01 0.00 0.00 64.21 63.48 1cfp n SER 18 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1cfp n GLY 19 N 1.16 2.20 0.00 0.23 0.00 0.37 -2.92 105.19 106.22 1cfp n GLY 19 Ca 0.19 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1cfp n GLY 19 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1cfp n ARG 20 N -0.04 1.65 0.00 1.61 1.85 0.78 -4.64 116.66 117.87 1cfp n ARG 20 Ca 0.09 -0.32 0.00 0.00 -1.00 0.00 0.00 57.85 56.62 1cfp n ARG 20 Cb 0.97 -0.82 0.00 0.00 -1.05 0.00 0.00 32.46 31.57 1cfp n ARG 20 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1cfp n GLU 21 N -0.33 2.61 0.00 2.89 4.07 -1.26 -5.05 120.64 123.57 1cfp n GLU 21 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1cfp n GLU 21 Cb 0.00 -0.86 0.00 0.00 -0.06 0.00 0.00 31.44 30.52 1cfp n GLU 21 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1cfp n GLY 22 N 2.20 1.42 3.13 8.31 0.00 -1.26 -5.14 105.19 113.85 1cfp n GLY 22 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1cfp n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cfp n ASP 23 N 0.00 -3.35 0.00 1.61 9.92 -1.26 -4.90 116.55 118.57 1cfp n ASP 23 Ca 0.00 0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 1cfp n ASP 23 Cb 0.00 -0.78 0.00 0.00 -0.64 0.00 0.00 41.12 39.70 1cfp n ASP 23 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1cfp n LYS 24 N 0.66 0.00 -3.04 -1.24 4.76 -1.15 -4.03 118.16 114.12 1cfp n LYS 24 Ca -0.00 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.26 1cfp n LYS 24 Cb 0.65 -0.23 -0.02 0.00 -1.84 0.00 0.00 35.03 33.59 1cfp n LYS 24 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1cfp n HIS 25 N -0.60 0.96 -3.54 2.13 8.25 -1.25 -3.41 115.22 117.75 1cfp n HIS 25 Ca 0.00 -3.64 -0.09 0.00 -0.26 0.00 0.00 57.72 53.72 1cfp n HIS 25 Cb 0.00 -0.41 -0.09 0.00 1.12 0.00 0.00 29.99 30.60 1cfp n HIS 25 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1cfp s LYS 26 N -2.72 0.31 0.50 -0.41 3.01 -1.26 -4.42 119.74 114.75 1cfp s LYS 26 Ca 0.39 0.80 -0.03 0.00 -1.01 0.00 0.00 55.97 56.12 1cfp s LYS 26 Cb 0.36 -0.03 -0.01 0.00 -1.01 0.00 0.00 37.83 37.14 1cfp s LYS 26 CO -0.07 -0.40 0.78 -0.51 0.51 0.00 0.00 175.35 175.65 1cfp s LEU 27 N 2.56 3.50 0.00 3.17 1.43 0.28 -4.75 118.68 124.88 1cfp s LEU 27 Ca 0.04 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 53.69 1cfp s LEU 27 Cb -0.13 -3.46 0.01 0.00 0.03 0.00 0.00 46.19 42.64 1cfp s LEU 27 CO -0.13 -0.79 0.51 0.29 0.23 0.00 0.00 176.35 176.45 1cfp n LYS 28 N -2.29 0.73 -0.30 1.70 5.02 -1.26 0.24 118.16 122.01 1cfp n LYS 28 Ca 0.02 -2.57 0.25 0.00 -2.02 0.00 0.00 58.31 53.99 1cfp n LYS 28 Cb 0.57 2.57 0.43 0.00 -0.02 0.00 0.00 35.03 38.57 1cfp n LYS 28 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1cfp n LYS 29 N -0.54 -0.02 0.11 1.97 2.85 -0.79 0.23 118.16 121.96 1cfp n LYS 29 Ca -0.01 0.79 -0.05 0.00 -1.05 0.00 0.00 58.31 57.98 1cfp n LYS 29 Cb 0.56 -1.55 -0.03 0.00 -0.65 0.00 0.00 35.03 33.36 1cfp n LYS 29 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 177.40 178.12 1cfp h SER 30 N 0.00 -0.30 -0.16 -5.58 0.02 -1.94 -2.76 113.55 102.83 1cfp h SER 30 Ca 0.55 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.45 1cfp h SER 30 Cb 1.78 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 64.40 1cfp h SER 30 CO -0.29 0.07 -0.15 -0.33 -1.14 0.00 0.00 176.83 174.99 1cfp h GLU 31 N -0.92 0.38 -0.65 3.45 5.08 -0.44 -2.83 114.58 118.65 1cfp h GLU 31 Ca -0.04 -0.20 0.13 0.00 -1.00 0.00 0.00 59.36 58.26 1cfp h GLU 31 Cb 0.27 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.40 1cfp h GLU 31 CO 0.06 0.75 -0.14 1.25 -1.00 0.00 0.00 179.01 179.93 1cfp h LEU 32 N 0.02 -0.57 0.13 1.33 5.85 0.27 0.57 115.31 122.91 1cfp h LEU 32 Ca 0.03 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1cfp h LEU 32 Cb 0.68 0.39 -0.00 0.00 0.37 0.00 0.00 40.66 42.10 1cfp h LEU 32 CO 0.04 -0.21 -0.07 0.11 -0.34 0.00 0.00 178.44 177.97 1cfp h LYS 33 N 0.01 -0.19 -0.60 1.25 1.79 -1.45 -1.43 116.57 115.95 1cfp h LYS 33 Ca 0.32 0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.88 1cfp h LYS 33 Cb 0.49 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.15 1cfp h LYS 33 CO -0.66 -0.12 0.40 1.49 -1.08 0.00 0.00 179.45 179.48 1cfp h GLU 34 N -0.19 0.48 -0.20 3.15 4.81 -0.87 0.17 114.58 121.93 1cfp h GLU 34 Ca -0.01 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.24 1cfp h GLU 34 Cb 0.16 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 1cfp h GLU 34 CO 0.02 0.31 -0.19 1.25 -0.73 0.00 0.00 179.01 179.67 1cfp h LEU 35 N 0.49 -0.61 0.08 1.64 6.46 0.12 1.96 115.31 125.46 1cfp h LEU 35 Ca 0.27 0.11 -0.26 0.00 -0.12 0.00 0.00 57.88 57.89 1cfp h LEU 35 Cb 0.43 0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.64 1cfp h LEU 35 CO -0.08 -0.23 -1.24 0.16 -0.62 0.00 0.00 178.44 176.43 1cfp h ILE 36 N -0.21 1.48 0.00 4.05 -2.65 -1.12 -3.10 117.51 115.96 1cfp h ILE 36 Ca 0.12 -3.12 0.00 0.00 1.03 0.00 0.00 64.86 62.89 1cfp h ILE 36 Cb 0.39 2.87 0.00 0.00 -2.05 0.00 0.00 36.82 38.03 1cfp h ILE 36 CO -0.32 0.89 0.00 0.59 0.03 0.00 0.00 178.15 179.34 1cfp n ASN 37 N -3.44 0.00 -0.04 2.16 3.02 0.55 -0.16 115.26 117.36 1cfp n ASN 37 Ca -0.08 -0.80 -0.19 0.00 -0.03 0.00 0.00 54.58 53.49 1cfp n ASN 37 Cb 1.00 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 40.04 1cfp n ASN 37 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1cfp h ASN 38 N 0.00 0.18 0.00 6.41 -0.26 0.32 -3.44 115.58 118.79 1cfp h ASN 38 Ca 0.00 -0.85 0.00 0.00 -0.56 0.00 0.00 56.30 54.89 1cfp h ASN 38 Cb 0.00 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1cfp h ASN 38 CO 0.00 1.33 -0.65 1.21 -1.06 0.00 0.00 177.43 178.26 1cfp n GLU 39 N -4.31 2.35 -0.71 0.81 0.00 -1.21 -4.80 120.64 112.76 1cfp n GLU 39 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 57.16 56.89 1cfp n GLU 39 Cb 0.69 -0.83 -0.11 0.00 0.00 0.00 0.00 31.44 31.19 1cfp n GLU 39 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1cfp n LEU 40 N -1.23 3.98 0.09 4.31 7.94 0.77 -4.52 117.00 128.34 1cfp n LEU 40 Ca 0.00 -2.45 0.20 0.00 -1.11 0.00 0.00 56.01 52.65 1cfp n LEU 40 Cb 0.17 -1.05 0.67 0.00 0.53 0.00 0.00 43.42 43.74 1cfp n LEU 40 CO 0.00 1.12 1.18 0.77 -1.11 0.00 0.00 177.39 179.35 1cfp h SER 41 N 3.50 0.00 0.00 1.96 4.64 -1.87 -0.83 113.55 120.95 1cfp h SER 41 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1cfp h SER 41 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1cfp h SER 41 CO 0.26 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.63 1cfp n HIS 42 N -3.43 0.00 0.24 4.77 -0.00 -1.26 -2.87 115.22 112.67 1cfp n HIS 42 Ca 0.08 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.90 1cfp n HIS 42 Cb 0.76 0.00 0.51 0.00 -0.00 0.00 0.00 29.99 31.26 1cfp n HIS 42 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.34 176.69 1cfp h PHE 43 N 0.00 0.00 -0.96 4.41 3.04 -1.94 0.37 116.94 121.86 1cfp h PHE 43 Ca 0.00 0.00 0.27 0.00 3.98 0.00 0.00 57.97 62.22 1cfp h PHE 43 Cb 0.00 0.00 -0.05 0.00 2.56 0.00 0.00 35.95 38.46 1cfp h PHE 43 CO 0.00 0.00 0.68 1.25 -2.02 0.00 0.00 178.31 178.22 1cfp h LEU 44 N 0.00 0.08 -0.29 0.59 5.85 -1.00 3.05 115.31 123.59 1cfp h LEU 44 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1cfp h LEU 44 Cb 0.70 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1cfp h LEU 44 CO 0.00 0.02 0.00 1.21 -0.34 0.00 0.00 178.44 179.33 1cfp n GLU 45 N -4.31 0.17 -1.95 1.25 4.07 0.13 -4.84 120.64 115.16 1cfp n GLU 45 Ca 0.20 0.28 0.00 0.00 -0.06 0.00 0.00 57.16 57.59 1cfp n GLU 45 Cb 0.98 -1.76 0.00 0.00 -0.06 0.00 0.00 31.44 30.61 1cfp n GLU 45 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1cfp n GLU 46 N -2.06 -2.40 -0.00 5.31 0.28 1.02 -4.55 120.64 118.23 1cfp n GLU 46 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 1cfp n GLU 46 Cb 0.30 -3.49 -0.01 0.00 1.43 0.00 0.00 31.44 29.67 1cfp n GLU 46 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 1cfp n ILE 47 N -1.85 0.05 0.24 3.84 0.13 -1.26 -4.49 119.36 116.02 1cfp n ILE 47 Ca 0.00 -0.05 0.12 0.00 -1.10 0.00 0.00 62.75 61.72 1cfp n ILE 47 Cb 0.36 -0.13 0.61 0.00 -0.84 0.00 0.00 39.64 39.64 1cfp n ILE 47 CO 0.00 0.00 0.00 0.11 2.80 0.00 0.00 176.55 179.46 1cfp h LYS 48 N 0.00 0.00 -1.63 9.51 1.79 -1.91 -3.35 116.57 120.98 1cfp h LYS 48 Ca -0.02 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.24 1cfp h LYS 48 Cb 0.50 0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 30.88 1cfp h LYS 48 CO 0.00 0.00 -0.56 -1.83 -1.08 0.00 0.00 179.45 175.98 1cfp s GLU 49 N -3.53 0.55 0.11 3.15 -1.05 -1.26 -5.02 118.70 111.64 1cfp s GLU 49 Ca -0.01 -0.20 -0.17 0.00 -0.15 0.00 0.00 54.97 54.44 1cfp s GLU 49 Cb 0.08 -0.34 -0.05 0.00 -0.44 0.00 0.00 34.13 33.38 1cfp s GLU 49 CO 0.28 -1.11 1.57 -0.56 0.95 0.00 0.00 175.26 176.39 1cfp h GLN 50 N 7.65 0.56 -0.36 -4.83 3.07 -1.80 -2.41 115.11 116.99 1cfp h GLN 50 Ca -0.02 -0.16 0.10 0.00 0.09 0.00 0.00 58.65 58.66 1cfp h GLN 50 Cb 1.11 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 28.60 1cfp h GLN 50 CO 0.21 0.66 0.27 1.49 0.09 0.00 0.00 178.83 181.55 1cfp h GLU 51 N 0.38 0.00 -0.05 0.06 4.81 -1.95 -0.97 114.58 116.85 1cfp h GLU 51 Ca 0.10 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.26 1cfp h GLU 51 Cb 0.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1cfp h GLU 51 CO 0.01 0.00 -0.24 0.28 -0.73 0.00 0.00 179.01 178.33 1cfp h VAL 52 N 0.00 1.45 -1.11 0.32 2.07 -1.76 -2.46 116.25 114.76 1cfp h VAL 52 Ca 0.17 -1.67 0.31 0.00 0.82 0.00 0.00 66.70 66.33 1cfp h VAL 52 Cb 0.72 2.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.79 1cfp h VAL 52 CO -0.00 0.47 0.76 0.58 0.02 0.00 0.00 177.57 179.40 1cfp h VAL 53 N -0.27 0.45 -0.43 2.57 2.07 -0.78 2.50 116.25 122.35 1cfp h VAL 53 Ca -0.01 -0.07 -0.15 0.00 0.82 0.00 0.00 66.70 67.30 1cfp h VAL 53 Cb 0.89 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1cfp h VAL 53 CO 0.05 0.03 -0.30 -0.78 0.02 0.00 0.00 177.57 176.59 1cfp h ASP 54 N 0.19 1.00 0.16 0.57 3.58 -1.14 -2.15 116.42 118.62 1cfp h ASP 54 Ca 0.59 -0.42 -0.01 0.00 0.42 0.00 0.00 57.03 57.61 1cfp h ASP 54 Cb 1.90 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 42.68 1cfp h ASP 54 CO -0.17 1.21 -0.07 0.11 -2.88 0.00 0.00 179.24 177.44 1cfp h LYS 55 N 0.80 -0.20 -0.94 0.28 6.56 0.42 -1.73 116.57 121.76 1cfp h LYS 55 Ca 0.09 0.01 0.10 0.00 -1.06 0.00 0.00 60.65 59.79 1cfp h LYS 55 Cb 0.88 0.05 -0.12 0.00 -0.57 0.00 0.00 32.23 32.47 1cfp h LYS 55 CO 0.08 -0.13 -0.51 0.28 -2.06 0.00 0.00 179.45 177.10 1cfp n VAL 56 N -3.84 -0.61 -0.30 0.50 0.31 0.38 0.12 118.33 114.89 1cfp n VAL 56 Ca -0.03 2.26 -0.02 0.00 -0.01 0.00 0.00 64.34 66.55 1cfp n VAL 56 Cb 0.08 -2.83 0.15 0.00 -0.91 0.00 0.00 33.84 30.33 1cfp n VAL 56 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1cfp h MET 57 N 0.00 1.17 -0.60 5.55 2.86 -1.52 -2.27 114.93 120.12 1cfp h MET 57 Ca 0.19 -0.10 0.11 0.00 -2.06 0.00 0.00 59.70 57.84 1cfp h MET 57 Cb 0.42 -0.25 -0.08 0.00 0.06 0.00 0.00 31.60 31.75 1cfp h MET 57 CO -0.89 0.81 0.17 1.49 1.06 0.00 0.00 176.91 179.55 1cfp h GLU 58 N 1.20 0.31 -0.15 1.72 4.57 0.19 -1.04 114.58 121.38 1cfp h GLU 58 Ca 0.31 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.47 1cfp h GLU 58 Cb -0.07 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.44 1cfp h GLU 58 CO -0.06 0.20 0.09 1.15 -1.18 0.00 0.00 179.01 179.21 1cfp h THR 59 N 0.32 1.08 -0.30 0.32 2.02 -0.48 0.26 112.91 116.12 1cfp h THR 59 Ca 0.31 -0.21 0.09 0.00 0.77 0.00 0.00 66.41 67.37 1cfp h THR 59 Cb 0.44 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1cfp h THR 59 CO -0.37 0.07 0.23 -0.07 0.37 0.00 0.00 175.52 175.76 1cfp h LEU 60 N 0.15 0.00 -0.90 2.58 4.07 -1.09 0.79 115.31 120.91 1cfp h LEU 60 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1cfp h LEU 60 Cb 0.04 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.78 1cfp h LEU 60 CO -0.01 0.00 -0.16 0.47 -1.08 0.00 0.00 178.44 177.66 1cfp n ASP 61 N -4.34 1.56 0.07 -0.43 9.92 -0.48 -4.22 116.55 118.63 1cfp n ASP 61 Ca 0.04 -1.32 -0.13 0.00 -0.53 0.00 0.00 54.79 52.85 1cfp n ASP 61 Cb 0.40 0.11 -0.08 0.00 -0.64 0.00 0.00 41.12 40.90 1cfp n ASP 61 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1cfp h SER 62 N 2.20 -0.14 0.00 -2.24 0.87 0.41 -3.49 113.55 111.16 1cfp h SER 62 Ca 0.00 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1cfp h SER 62 Cb 0.59 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1cfp h SER 62 CO 0.00 0.17 0.00 0.47 -0.53 0.00 0.00 176.83 176.94 1cfp n ASP 63 N -5.03 0.00 -0.68 6.23 8.00 -1.23 -4.94 116.55 118.89 1cfp n ASP 63 Ca -0.09 0.00 0.52 0.00 0.71 0.00 0.00 54.79 55.94 1cfp n ASP 63 Cb 0.20 0.00 0.81 0.00 -0.02 0.00 0.00 41.12 42.11 1cfp n ASP 63 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1cfp h GLY 64 N 0.00 0.00 -0.18 0.44 0.00 -1.84 0.47 103.07 101.96 1cfp h GLY 64 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 1cfp h GLY 64 CO 0.00 0.00 -0.29 -1.80 0.00 0.00 0.00 176.54 174.45 1cfp h ASP 65 N 0.00 -0.97 -0.84 0.19 3.58 -1.78 1.48 116.42 118.08 1cfp h ASP 65 Ca 0.92 0.19 0.15 0.00 0.42 0.00 0.00 57.03 58.70 1cfp h ASP 65 Cb 3.72 0.48 -0.06 0.00 1.72 0.00 0.00 39.33 45.19 1cfp h ASP 65 CO -0.01 -0.29 0.55 1.23 -2.88 0.00 0.00 179.24 177.84 1cfp h GLY 66 N -0.19 1.01 -6.08 -0.78 0.00 -0.32 -2.10 103.07 94.61 1cfp h GLY 66 Ca 0.20 -0.25 -0.50 0.00 0.00 0.00 0.00 47.33 46.77 1cfp h GLY 66 CO -0.56 0.08 -0.89 -2.21 0.00 0.00 0.00 176.54 172.96 1cfp n GLU 67 N -4.53 0.28 -2.87 4.80 4.07 0.18 -4.76 120.64 117.81 1cfp n GLU 67 Ca 0.16 -2.95 -0.43 0.00 -0.06 0.00 0.00 57.16 53.88 1cfp n GLU 67 Cb 0.49 -1.61 -0.03 0.00 -0.06 0.00 0.00 31.44 30.23 1cfp n GLU 67 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1cfp n ASP 69 N 7.30 0.87 0.00 0.00 9.92 -1.26 0.10 116.55 133.48 1cfp n ASP 69 Ca 0.09 -1.83 0.00 0.00 -0.53 0.00 0.00 54.79 52.52 1cfp n ASP 69 Cb 0.47 -0.66 0.00 0.00 -0.64 0.00 0.00 41.12 40.29 1cfp n ASP 69 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1cfp n PHE 70 N -2.95 0.00 0.17 1.24 3.72 -1.26 0.26 117.46 118.65 1cfp n PHE 70 Ca 0.14 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.65 1cfp n PHE 70 Cb 0.51 -0.09 0.56 0.00 -0.94 0.00 0.00 39.48 39.53 1cfp n PHE 70 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1cfp h GLN 71 N 0.00 0.00 0.03 -1.08 -0.00 -1.99 -1.95 115.11 110.13 1cfp h GLN 71 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.65 58.48 1cfp h GLN 71 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 1cfp h GLN 71 CO 0.00 0.00 -0.90 0.93 0.00 0.00 0.00 178.83 178.86 1cfp h GLU 72 N 0.00 0.07 -0.36 1.69 5.08 0.34 -1.31 114.58 120.09 1cfp h GLU 72 Ca 0.00 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1cfp h GLU 72 Cb 0.17 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1cfp h GLU 72 CO 0.00 1.06 0.08 0.35 -1.00 0.00 0.00 179.01 179.50 1cfp h PHE 73 N -0.80 0.14 -0.27 4.33 3.57 0.98 0.15 116.94 125.03 1cfp h PHE 73 Ca -0.22 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.26 1cfp h PHE 73 Cb 1.34 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 40.05 1cfp h PHE 73 CO 0.16 0.04 -0.01 0.52 -2.23 0.00 0.00 178.31 176.79 1cfp h MET 74 N 0.21 0.41 0.68 1.11 2.86 -1.57 0.24 114.93 118.87 1cfp h MET 74 Ca 0.17 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 1cfp h MET 74 Cb 0.18 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 31.78 1cfp h MET 74 CO -0.21 0.45 -0.33 0.00 1.06 0.00 0.00 176.91 177.88 1cfp h ALA 75 N 1.60 -0.91 -0.03 6.32 0.00 0.40 -1.24 119.26 125.40 1cfp h ALA 75 Ca 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1cfp h ALA 75 Cb 0.28 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1cfp h ALA 75 CO 0.01 -0.89 -0.08 0.35 0.00 0.00 0.00 179.25 178.63 1cfp h PHE 76 N -1.15 0.14 -0.95 0.00 3.57 -0.84 -1.17 116.94 116.55 1cfp h PHE 76 Ca -0.09 -0.06 0.22 0.00 3.53 0.00 0.00 57.97 61.57 1cfp h PHE 76 Cb 0.73 -0.03 -0.12 0.00 2.79 0.00 0.00 35.95 39.32 1cfp h PHE 76 CO 0.00 0.69 0.51 -0.24 -2.23 0.00 0.00 178.31 177.04 1cfp h VAL 77 N -0.44 0.56 -0.32 1.41 3.04 -0.62 0.91 116.25 120.78 1cfp h VAL 77 Ca -0.00 -0.19 -0.01 0.00 -1.01 0.00 0.00 66.70 65.49 1cfp h VAL 77 Cb 0.68 -0.04 -0.01 0.00 -2.01 0.00 0.00 31.29 29.91 1cfp h VAL 77 CO 0.02 0.10 0.15 0.00 -1.01 0.00 0.00 177.57 176.82 1cfp h ALA 78 N 1.69 0.42 -0.98 3.17 0.00 -1.06 -0.83 119.26 121.67 1cfp h ALA 78 Ca 0.59 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.50 1cfp h ALA 78 Cb 1.07 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 1cfp h ALA 78 CO -0.47 -0.01 0.61 0.52 0.00 0.00 0.00 179.25 179.90 1cfp h MET 79 N 0.38 0.96 0.11 0.00 2.07 0.19 0.43 114.93 119.07 1cfp h MET 79 Ca 0.11 -0.06 -0.01 0.00 -2.07 0.00 0.00 59.70 57.68 1cfp h MET 79 Cb 0.14 -0.22 0.00 0.00 -1.87 0.00 0.00 31.60 29.66 1cfp h MET 79 CO -0.01 0.63 -0.05 0.82 1.07 0.00 0.00 176.91 179.37 1cfp h ILE 80 N 0.99 0.00 -0.82 -1.22 1.08 0.20 -0.58 117.51 117.16 1cfp h ILE 80 Ca 0.47 -0.04 0.20 0.00 -0.39 0.00 0.00 64.86 65.10 1cfp h ILE 80 Cb 0.43 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.06 1cfp h ILE 80 CO -0.25 0.00 0.26 0.74 -0.69 0.00 0.00 178.15 178.21 1cfp h THR 81 N -0.19 0.45 0.00 -0.27 2.02 -1.04 2.29 112.91 116.17 1cfp h THR 81 Ca -0.02 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1cfp h THR 81 Cb 0.11 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 1cfp h THR 81 CO 0.02 0.05 0.00 0.35 0.37 0.00 0.00 175.52 176.32 1cfp n THR 82 N -5.14 1.13 0.09 3.16 -2.24 0.15 -1.85 114.28 109.58 1cfp n THR 82 Ca 0.18 0.29 0.11 0.00 -2.27 0.00 0.00 64.05 62.37 1cfp n THR 82 Cb 0.57 -1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 67.69 1cfp n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cfp n ALA 83 N -1.52 2.56 1.58 6.98 0.00 0.77 -3.86 120.51 127.01 1cfp n ALA 83 Ca 0.03 -0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.21 1cfp n ALA 83 Cb 0.15 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.57 1cfp n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cfp n HIS 85 N -0.23 -0.21 -4.01 0.00 -0.00 -1.25 -5.04 115.22 104.48 1cfp n HIS 85 Ca 0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1cfp n HIS 85 Cb 0.12 0.06 -0.00 0.00 -0.12 0.00 0.00 29.99 30.05 1cfp n HIS 85 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1cfp n GLU 86 N 0.00 -0.05 -0.17 1.57 1.02 -1.26 -3.80 120.64 117.95 1cfp n GLU 86 Ca 0.00 0.03 0.16 0.00 -0.02 0.00 0.00 57.16 57.33 1cfp n GLU 86 Cb 0.00 -0.06 0.29 0.00 -0.02 0.00 0.00 31.44 31.65 1cfp n GLU 86 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 1cfp n PHE 87 N -0.58 0.46 -0.86 -0.32 -1.74 -1.26 -2.83 117.46 110.33 1cfp n PHE 87 Ca 0.00 0.46 -0.38 0.00 -0.56 0.00 0.00 57.45 56.98 1cfp n PHE 87 Cb 0.01 -0.89 -0.06 0.00 1.52 0.00 0.00 39.48 40.06 1cfp n PHE 87 CO 0.00 0.00 0.00 1.19 -0.56 0.00 0.00 176.76 177.39 1cfp n PHE 88 N -3.87 1.24 0.00 2.97 3.72 -1.25 -4.76 117.46 115.51 1cfp n PHE 88 Ca 0.18 -1.44 0.00 0.00 -0.05 0.00 0.00 57.45 56.14 1cfp n PHE 88 Cb 0.64 -1.40 0.00 0.00 -0.94 0.00 0.00 39.48 37.77 1cfp n PHE 88 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1cfp n GLU 89 N 6.67 0.00 0.00 -1.08 2.13 -1.13 -4.66 120.64 122.58 1cfp n GLU 89 Ca 0.45 0.26 0.00 0.00 0.66 0.00 0.00 57.16 58.52 1cfp n GLU 89 Cb 0.34 -0.77 0.00 0.00 0.27 0.00 0.00 31.44 31.28 1cfp n GLU 89 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1cfp n HIS 90 N -0.52 0.00 -0.41 4.31 8.25 -1.26 -4.96 115.22 120.63 1cfp n HIS 90 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1cfp n HIS 90 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1cfp n HIS 90 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37