#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfp n SER 1 N 0.00 0.46 0.12 6.12 3.41 -1.26 -4.03 113.62 118.44 1cfp n SER 1 Ca 0.00 -0.30 0.16 0.00 -0.26 0.00 0.00 58.87 58.47 1cfp n SER 1 Cb 0.00 -0.03 0.50 0.00 -0.26 0.00 0.00 64.21 64.41 1cfp n SER 1 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1cfp h GLU 2 N 0.37 0.00 0.15 4.33 4.39 -2.03 0.66 114.58 122.44 1cfp h GLU 2 Ca 0.00 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.39 1cfp h GLU 2 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1cfp h GLU 2 CO 0.00 0.00 -1.47 -0.07 -1.16 0.00 0.00 179.01 176.31 1cfp h LEU 3 N 0.00 0.49 0.21 1.33 3.38 -1.97 -1.51 115.31 117.23 1cfp h LEU 3 Ca 0.19 -0.60 -0.31 0.00 0.09 0.00 0.00 57.88 57.24 1cfp h LEU 3 Cb 1.73 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 42.35 1cfp h LEU 3 CO -0.00 1.49 -1.42 -0.08 0.09 0.00 0.00 178.44 178.52 1cfp h GLU 4 N 0.08 0.43 -0.37 1.13 4.22 -0.17 0.23 114.58 120.15 1cfp h GLU 4 Ca -0.22 -0.74 -0.09 0.00 0.08 0.00 0.00 59.36 58.38 1cfp h GLU 4 Cb 2.03 0.28 -0.02 0.00 0.50 0.00 0.00 28.75 31.54 1cfp h GLU 4 CO 0.19 1.36 -0.17 0.87 -2.18 0.00 0.00 179.01 179.08 1cfp h LYS 5 N -0.01 0.67 0.00 1.92 1.57 -0.58 0.14 116.57 120.29 1cfp h LYS 5 Ca -0.26 -0.23 -0.22 0.00 -1.87 0.00 0.00 60.65 58.06 1cfp h LYS 5 Cb 2.02 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 34.27 1cfp h LYS 5 CO 0.21 0.80 -0.92 0.00 -0.57 0.00 0.00 179.45 178.97 1cfp h ALA 6 N 1.22 0.42 -0.51 3.86 0.00 -1.32 -2.50 119.26 120.42 1cfp h ALA 6 Ca 0.10 -0.72 0.03 0.00 0.00 0.00 0.00 54.91 54.32 1cfp h ALA 6 Cb 0.62 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1cfp h ALA 6 CO 0.04 0.85 0.29 0.28 0.00 0.00 0.00 179.25 180.71 1cfp h VAL 7 N 0.18 1.01 -0.88 0.00 2.07 0.21 0.11 116.25 118.95 1cfp h VAL 7 Ca -0.07 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.27 1cfp h VAL 7 Cb 1.56 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1cfp h VAL 7 CO 0.15 0.10 0.58 0.58 0.02 0.00 0.00 177.57 179.01 1cfp h VAL 8 N 0.57 1.22 -0.70 2.57 2.07 -0.64 0.03 116.25 121.36 1cfp h VAL 8 Ca 0.21 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1cfp h VAL 8 Cb 0.07 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.73 1cfp h VAL 8 CO -0.12 0.22 0.46 0.00 0.02 0.00 0.00 177.57 178.15 1cfp h ALA 9 N 1.45 1.59 -0.43 1.67 0.00 -0.40 -1.03 119.26 122.11 1cfp h ALA 9 Ca 0.32 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 1cfp h ALA 9 Cb -0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1cfp h ALA 9 CO -0.07 0.34 -0.05 -0.07 0.00 0.00 0.00 179.25 179.40 1cfp h LEU 10 N 0.85 0.70 -1.87 0.00 3.38 0.59 -1.33 115.31 117.64 1cfp h LEU 10 Ca 0.28 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1cfp h LEU 10 Cb 0.05 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1cfp h LEU 10 CO -0.08 0.80 -0.13 0.16 0.09 0.00 0.00 178.44 179.29 1cfp h ILE 11 N 0.67 0.65 -0.05 1.22 -0.00 -0.74 0.15 117.51 119.42 1cfp h ILE 11 Ca 0.13 -0.55 -0.15 0.00 -0.00 0.00 0.00 64.86 64.28 1cfp h ILE 11 Cb 0.49 1.35 -0.01 0.00 -0.00 0.00 0.00 36.82 38.64 1cfp h ILE 11 CO 0.03 0.13 -0.65 -0.78 -0.00 0.00 0.00 178.15 176.87 1cfp h ASP 12 N 0.00 0.24 0.27 2.16 3.58 -0.91 -1.86 116.42 119.91 1cfp h ASP 12 Ca -0.00 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.29 1cfp h ASP 12 Cb 0.34 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.32 1cfp h ASP 12 CO 0.02 0.83 -0.13 0.58 -2.88 0.00 0.00 179.24 177.65 1cfp h VAL 13 N 0.15 0.00 -0.99 2.25 2.07 -0.13 -2.82 116.25 116.77 1cfp h VAL 13 Ca -0.01 -0.08 0.19 0.00 0.82 0.00 0.00 66.70 67.62 1cfp h VAL 13 Cb 1.18 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.85 1cfp h VAL 13 CO 0.10 0.00 0.61 -0.26 0.02 0.00 0.00 177.57 178.04 1cfp h PHE 14 N -0.44 1.00 -0.90 1.57 -1.00 -1.41 0.67 116.94 116.44 1cfp h PHE 14 Ca -0.04 0.03 0.25 0.00 2.81 0.00 0.00 57.97 61.02 1cfp h PHE 14 Cb 0.28 -0.30 -0.15 0.00 3.61 0.00 0.00 35.95 39.39 1cfp h PHE 14 CO 0.12 0.23 0.21 1.25 -1.61 0.00 0.00 178.31 178.51 1cfp h HIS 15 N 0.72 0.30 0.00 -0.55 -0.00 -1.22 -1.69 115.15 112.72 1cfp h HIS 15 Ca 0.56 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.99 1cfp h HIS 15 Cb 0.93 0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.35 1cfp h HIS 15 CO -0.00 -0.26 -0.11 1.96 -0.00 0.00 0.00 177.93 179.52 1cfp h GLN 16 N 0.16 0.00 0.00 5.26 4.20 0.03 -3.30 115.11 121.47 1cfp h GLN 16 Ca 0.57 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.28 1cfp h GLN 16 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1cfp h GLN 16 CO -0.70 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.12 1cfp n TYR 17 N -3.07 0.00 -0.10 2.96 4.01 0.19 0.22 117.16 121.38 1cfp n TYR 17 Ca -0.02 0.00 0.22 0.00 -0.16 0.00 0.00 57.90 57.95 1cfp n TYR 17 Cb 0.06 0.00 0.37 0.00 -0.31 0.00 0.00 39.34 39.46 1cfp n TYR 17 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1cfp h SER 18 N 0.00 0.00 -1.74 7.72 4.64 -1.51 -3.04 113.55 119.62 1cfp h SER 18 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1cfp h SER 18 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 1cfp h SER 18 CO 0.00 0.00 -0.73 -0.83 -0.87 0.00 0.00 176.83 174.40 1cfp s GLY 19 N -3.38 -0.00 -0.00 -0.77 0.00 -0.32 -3.11 107.32 99.74 1cfp s GLY 19 Ca -0.02 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.35 1cfp s GLY 19 CO 0.38 2.85 0.05 -0.96 0.00 0.00 0.00 173.10 175.42 1cfp n ARG 20 N 3.16 3.21 0.00 2.90 1.85 0.59 -3.91 116.66 124.45 1cfp n ARG 20 Ca 0.22 -0.01 0.00 0.00 -1.00 0.00 0.00 57.85 57.06 1cfp n ARG 20 Cb 0.51 -0.81 0.00 0.00 -1.05 0.00 0.00 32.46 31.11 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 -1.30 0.00 0.00 2.89 0.00 -1.26 -5.06 120.64 115.91 1cfp n GLU 21 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1cfp n GLU 21 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.47 1cfp n GLU 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1cfp n GLY 22 N -1.48 5.45 7.00 8.31 0.00 -1.26 -5.10 105.19 118.11 1cfp n GLY 22 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.29 0.15 1.61 8.00 -1.26 -4.61 116.55 120.15 1cfp n ASP 23 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1cfp n ASP 23 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1cfp n ASP 23 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cfp n LYS 24 N -0.01 0.00 -2.98 -1.24 5.02 -1.18 -4.91 118.16 112.86 1cfp n LYS 24 Ca 0.00 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1cfp n LYS 24 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.03 1cfp n LYS 24 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1cfp n HIS 25 N -3.31 -1.25 -3.70 2.13 8.25 -1.23 -4.04 115.22 112.07 1cfp n HIS 25 Ca 0.00 -3.03 -0.14 0.00 -0.26 0.00 0.00 57.72 54.29 1cfp n HIS 25 Cb 0.00 0.52 -0.08 0.00 1.12 0.00 0.00 29.99 31.54 1cfp n HIS 25 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1cfp s LYS 26 N -1.13 0.70 0.12 -0.41 2.36 -1.25 -4.67 119.74 115.46 1cfp s LYS 26 Ca 0.32 0.13 0.10 0.00 -2.55 0.00 0.00 55.97 53.97 1cfp s LYS 26 Cb 0.31 0.32 -0.04 0.00 -1.05 0.00 0.00 37.83 37.38 1cfp s LYS 26 CO -0.07 -0.18 -0.23 -0.51 1.55 0.00 0.00 175.35 175.91 1cfp s LEU 27 N -0.84 2.48 0.14 5.43 2.01 0.51 -4.27 118.68 124.13 1cfp s LEU 27 Ca -0.09 -0.65 0.04 0.00 0.01 0.00 0.00 54.13 53.44 1cfp s LEU 27 Cb -0.04 -1.37 -0.04 0.00 0.01 0.00 0.00 46.19 44.75 1cfp s LEU 27 CO 0.04 0.18 -0.09 -0.54 1.01 0.00 0.00 176.35 176.95 1cfp s LYS 28 N -2.04 1.03 0.21 1.70 1.02 -1.26 0.91 119.74 121.31 1cfp s LYS 28 Ca 0.16 -1.44 -0.14 0.00 0.02 0.00 0.00 55.97 54.57 1cfp s LYS 28 Cb -0.10 -0.56 0.23 0.00 -0.52 0.00 0.00 37.83 36.89 1cfp s LYS 28 CO 0.08 0.06 1.36 0.36 -0.92 0.00 0.00 175.35 176.28 1cfp n LYS 29 N -0.18 -0.19 -0.09 1.68 2.85 0.03 0.18 118.16 122.45 1cfp n LYS 29 Ca -0.10 1.35 -0.07 0.00 -1.05 0.00 0.00 58.31 58.44 1cfp n LYS 29 Cb 0.61 -2.01 -0.00 0.00 -0.65 0.00 0.00 35.03 32.98 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 -0.68 -0.40 -5.58 0.02 -1.95 0.33 113.55 105.28 1cfp h SER 30 Ca 0.32 0.14 -0.14 0.00 -0.84 0.00 0.00 61.79 61.28 1cfp h SER 30 Cb 0.54 0.35 -0.01 0.00 0.14 0.00 0.00 62.40 63.42 1cfp h SER 30 CO -0.87 -0.24 -0.29 -0.33 -1.14 0.00 0.00 176.83 173.96 1cfp h GLU 31 N -0.16 0.90 0.35 3.45 5.08 -0.08 -2.80 114.58 121.32 1cfp h GLU 31 Ca 0.17 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1cfp h GLU 31 Cb 0.43 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 1cfp h GLU 31 CO -0.43 1.09 -0.48 1.25 -1.00 0.00 0.00 179.01 179.43 1cfp h LEU 32 N 0.72 -1.36 -0.58 1.33 5.85 0.32 0.28 115.31 121.87 1cfp h LEU 32 Ca 0.08 0.12 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1cfp h LEU 32 Cb 0.87 0.47 -0.11 0.00 0.37 0.00 0.00 40.66 42.25 1cfp h LEU 32 CO 0.08 -0.60 -0.29 0.50 -0.34 0.00 0.00 178.44 177.79 1cfp h LYS 33 N -0.87 -0.13 -0.56 1.25 3.11 -0.41 0.44 116.57 119.39 1cfp h LYS 33 Ca -0.03 0.01 0.11 0.00 -2.81 0.00 0.00 60.65 57.93 1cfp h LYS 33 Cb 0.80 0.03 -0.09 0.00 -1.00 0.00 0.00 32.23 31.97 1cfp h LYS 33 CO -0.14 -0.09 0.02 1.49 -2.81 0.00 0.00 179.45 177.92 1cfp h GLU 34 N -0.14 0.13 -1.05 1.90 4.81 -1.08 0.14 114.58 119.30 1cfp h GLU 34 Ca 0.25 -0.01 0.27 0.00 -0.13 0.00 0.00 59.36 59.74 1cfp h GLU 34 Cb 0.53 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 29.79 1cfp h GLU 34 CO -0.66 0.09 0.67 1.25 -0.73 0.00 0.00 179.01 179.63 1cfp h LEU 35 N 0.14 0.45 0.15 1.64 6.46 0.35 1.72 115.31 126.22 1cfp h LEU 35 Ca 0.29 0.09 -0.24 0.00 -0.12 0.00 0.00 57.88 57.89 1cfp h LEU 35 Cb 0.45 0.02 0.02 0.00 -0.73 0.00 0.00 40.66 40.41 1cfp h LEU 35 CO -0.46 0.08 -1.14 0.40 -0.62 0.00 0.00 178.44 176.70 1cfp h ILE 36 N 0.39 1.30 0.00 4.05 1.08 -0.20 -3.25 117.51 120.89 1cfp h ILE 36 Ca 0.61 -2.52 0.00 0.00 -0.39 0.00 0.00 64.86 62.56 1cfp h ILE 36 Cb 1.53 3.01 0.00 0.00 -3.07 0.00 0.00 36.82 38.28 1cfp h ILE 36 CO -0.31 0.73 0.00 -0.55 -0.69 0.00 0.00 178.15 177.33 1cfp h ASN 37 N -0.26 0.00 0.45 1.72 -1.07 0.14 0.24 115.58 116.80 1cfp h ASN 37 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.15 1cfp h ASN 37 Cb 1.77 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 38.02 1cfp h ASN 37 CO 0.14 0.00 -0.20 0.59 0.07 0.00 0.00 177.43 178.03 1cfp n ASN 38 N -2.55 0.52 0.00 6.14 4.13 0.57 -3.97 115.26 120.11 1cfp n ASN 38 Ca 0.03 -0.43 0.00 0.00 1.68 0.00 0.00 54.58 55.86 1cfp n ASN 38 Cb 0.36 -0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.58 1cfp n ASN 38 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1cfp n GLU 39 N -1.07 0.00 -3.37 3.52 0.28 -1.06 -4.86 120.64 114.08 1cfp n GLU 39 Ca 0.11 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.74 1cfp n GLU 39 Cb 0.31 -0.84 -0.04 0.00 1.43 0.00 0.00 31.44 32.30 1cfp n GLU 39 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1cfp n LEU 40 N -2.47 4.95 -0.29 -1.84 4.77 0.83 -4.90 117.00 118.06 1cfp n LEU 40 Ca 0.00 -5.21 0.25 0.00 -0.03 0.00 0.00 56.01 51.01 1cfp n LEU 40 Cb 0.43 -1.11 0.41 0.00 -2.33 0.00 0.00 43.42 40.83 1cfp n LEU 40 CO 0.00 1.68 0.74 -0.24 -1.33 0.00 0.00 177.39 178.24 1cfp n SER 41 N 1.74 0.12 -0.24 -1.43 2.88 -1.25 0.33 113.62 115.76 1cfp n SER 41 Ca 0.25 0.82 0.12 0.00 -1.33 0.00 0.00 58.87 58.73 1cfp n SER 41 Cb 0.37 -0.40 0.40 0.00 -0.75 0.00 0.00 64.21 63.83 1cfp n SER 41 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 1cfp h HIS 42 N 0.00 0.74 0.00 0.66 3.86 -1.90 0.50 115.15 119.01 1cfp h HIS 42 Ca 0.53 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.76 1cfp h HIS 42 Cb 1.73 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 29.97 1cfp h HIS 42 CO -0.00 0.28 0.00 0.74 0.86 0.00 0.00 177.93 179.81 1cfp h PHE 43 N 0.63 0.00 -0.60 2.45 -1.00 0.50 0.17 116.94 119.09 1cfp h PHE 43 Ca 0.42 0.00 0.09 0.00 2.81 0.00 0.00 57.97 61.29 1cfp h PHE 43 Cb 0.71 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 40.20 1cfp h PHE 43 CO -0.00 0.00 0.23 1.25 -1.61 0.00 0.00 178.31 178.18 1cfp h LEU 44 N 0.00 0.23 0.00 1.54 5.85 -0.02 0.45 115.31 123.36 1cfp h LEU 44 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1cfp h LEU 44 Cb 0.54 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1cfp h LEU 44 CO 0.00 0.14 -1.06 -0.62 -0.34 0.00 0.00 178.44 176.56 1cfp n GLU 45 N -4.99 0.55 0.00 1.25 -0.58 -1.07 -4.93 120.64 110.86 1cfp n GLU 45 Ca 0.08 0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 1cfp n GLU 45 Cb 0.27 -1.76 0.00 0.00 -0.57 0.00 0.00 31.44 29.38 1cfp n GLU 45 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1cfp n GLU 46 N -2.51 0.00 -0.30 3.49 2.13 0.56 -4.45 120.64 119.57 1cfp n GLU 46 Ca 0.00 0.00 0.29 0.00 0.66 0.00 0.00 57.16 58.11 1cfp n GLU 46 Cb 0.53 0.00 0.54 0.00 0.27 0.00 0.00 31.44 32.77 1cfp n GLU 46 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1cfp n ILE 47 N 0.00 -0.39 -0.37 6.31 0.13 -1.26 1.00 119.36 124.78 1cfp n ILE 47 Ca 0.00 1.89 0.36 0.00 -1.10 0.00 0.00 62.75 63.90 1cfp n ILE 47 Cb 0.00 -3.06 0.60 0.00 -0.84 0.00 0.00 39.64 36.34 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 -2.04 9.51 6.56 -1.78 -0.20 116.57 128.63 1cfp h LYS 48 Ca 0.78 0.00 -0.50 0.00 -1.06 0.00 0.00 60.65 59.87 1cfp h LYS 48 Cb 2.05 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 33.30 1cfp h LYS 48 CO -0.72 0.00 -1.12 -0.85 -2.06 0.00 0.00 179.45 174.70 1cfp n GLU 49 N -3.55 1.24 -0.15 3.15 0.00 0.28 -5.00 120.64 116.62 1cfp n GLU 49 Ca 0.29 -3.56 -0.04 0.00 0.00 0.00 0.00 57.16 53.85 1cfp n GLU 49 Cb 1.63 -1.75 -0.03 0.00 0.00 0.00 0.00 31.44 31.28 1cfp n GLU 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1cfp n GLN 50 N 0.29 -0.15 -0.34 3.44 10.64 -0.09 0.96 117.38 132.13 1cfp n GLN 50 Ca 0.26 1.04 0.31 0.00 -1.83 0.00 0.00 57.00 56.77 1cfp n GLN 50 Cb 0.62 -1.55 0.57 0.00 -0.86 0.00 0.00 30.24 29.02 1cfp n GLN 50 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 1cfp h GLU 51 N 0.00 0.09 -0.10 2.61 4.81 -1.93 0.86 114.58 120.92 1cfp h GLU 51 Ca 0.06 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 1cfp h GLU 51 Cb 0.14 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1cfp h GLU 51 CO -0.33 0.06 -0.32 0.28 -0.73 0.00 0.00 179.01 177.97 1cfp h VAL 52 N 0.09 1.39 -0.93 0.32 2.07 0.38 -2.08 116.25 117.51 1cfp h VAL 52 Ca 0.82 -1.66 0.24 0.00 0.82 0.00 0.00 66.70 66.92 1cfp h VAL 52 Cb 2.16 2.19 -0.06 0.00 -1.52 0.00 0.00 31.29 34.06 1cfp h VAL 52 CO -0.68 0.48 0.63 0.58 0.02 0.00 0.00 177.57 178.61 1cfp h VAL 53 N -0.05 0.60 -0.35 2.57 2.07 0.32 1.58 116.25 122.99 1cfp h VAL 53 Ca -0.01 -0.09 -0.14 0.00 0.82 0.00 0.00 66.70 67.28 1cfp h VAL 53 Cb 0.95 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1cfp h VAL 53 CO 0.07 0.05 -0.34 -0.78 0.02 0.00 0.00 177.57 176.58 1cfp h ASP 54 N 0.25 0.90 0.12 0.57 3.58 -0.55 -2.64 116.42 118.65 1cfp h ASP 54 Ca 0.48 -0.47 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 1cfp h ASP 54 Cb 1.44 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.24 1cfp h ASP 54 CO -0.13 1.18 -0.06 0.11 -2.88 0.00 0.00 179.24 177.47 1cfp h LYS 55 N 0.63 -0.15 -0.77 0.28 6.56 0.16 -2.46 116.57 120.82 1cfp h LYS 55 Ca 0.06 0.01 0.24 0.00 -1.06 0.00 0.00 60.65 59.90 1cfp h LYS 55 Cb 0.93 0.03 -0.14 0.00 -0.57 0.00 0.00 32.23 32.48 1cfp h LYS 55 CO 0.08 -0.10 0.11 0.28 -2.06 0.00 0.00 179.45 177.77 1cfp n VAL 56 N -3.76 -0.33 -0.06 0.50 0.31 0.45 0.19 118.33 115.64 1cfp n VAL 56 Ca -0.02 1.67 -0.16 0.00 -0.01 0.00 0.00 64.34 65.83 1cfp n VAL 56 Cb 0.06 -2.51 -0.05 0.00 -0.91 0.00 0.00 33.84 30.43 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 0.83 0.00 5.55 2.86 -1.56 -2.83 114.93 119.77 1cfp h MET 57 Ca 0.52 -0.57 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1cfp h MET 57 Cb 1.16 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.90 1cfp h MET 57 CO -0.70 1.20 -0.02 1.05 1.06 0.00 0.00 176.91 179.50 1cfp h GLU 58 N 0.59 0.00 0.12 1.72 -0.00 0.26 -2.48 114.58 114.79 1cfp h GLU 58 Ca -0.01 0.00 -0.18 0.00 -0.00 0.00 0.00 59.36 59.17 1cfp h GLU 58 Cb 1.22 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.99 1cfp h GLU 58 CO 0.13 0.02 -0.84 1.15 -0.00 0.00 0.00 179.01 179.48 1cfp h THR 59 N 0.00 1.46 -0.86 -1.06 2.02 -0.96 -1.64 112.91 111.88 1cfp h THR 59 Ca -0.00 -2.50 0.08 0.00 0.77 0.00 0.00 66.41 64.76 1cfp h THR 59 Cb 0.09 3.14 -0.07 0.00 -1.74 0.00 0.00 68.15 69.57 1cfp h THR 59 CO 0.00 0.70 0.52 -0.07 0.37 0.00 0.00 175.52 177.04 1cfp h LEU 60 N -0.43 0.79 -1.32 2.58 3.38 -1.22 0.44 115.31 119.53 1cfp h LEU 60 Ca -0.16 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1cfp h LEU 60 Cb 1.60 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.22 1cfp h LEU 60 CO 0.12 0.48 0.00 -0.67 0.09 0.00 0.00 178.44 178.46 1cfp n ASP 61 N -4.66 1.99 -0.38 -0.43 -0.08 -1.01 -3.44 116.55 108.54 1cfp n ASP 61 Ca 0.13 -1.76 0.01 0.00 -1.51 0.00 0.00 54.79 51.67 1cfp n ASP 61 Cb 0.22 -0.12 0.05 0.00 2.34 0.00 0.00 41.12 43.61 1cfp n ASP 61 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1cfp n SER 62 N 0.54 0.96 -0.28 1.67 2.88 0.14 -5.00 113.62 114.54 1cfp n SER 62 Ca 0.17 -2.05 0.03 0.00 -1.33 0.00 0.00 58.87 55.69 1cfp n SER 62 Cb 0.38 -0.24 -0.02 0.00 -0.75 0.00 0.00 64.21 63.58 1cfp n SER 62 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1cfp n ASP 63 N -0.09 -1.59 -1.81 -3.46 2.03 -1.26 -4.81 116.55 105.56 1cfp n ASP 63 Ca 0.04 0.26 -0.15 0.00 0.52 0.00 0.00 54.79 55.46 1cfp n ASP 63 Cb 0.20 -0.96 -0.04 0.00 -0.72 0.00 0.00 41.12 39.60 1cfp n ASP 63 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfp n GLY 64 N -2.58 0.71 1.38 0.27 0.00 -1.26 -4.70 105.19 99.01 1cfp n GLY 64 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1cfp n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cfp n ASP 65 N -1.15 0.12 -0.38 1.61 -0.08 -1.26 -4.70 116.55 110.71 1cfp n ASP 65 Ca -0.16 0.05 0.31 0.00 -1.51 0.00 0.00 54.79 53.48 1cfp n ASP 65 Cb 0.55 -0.01 0.57 0.00 2.34 0.00 0.00 41.12 44.57 1cfp n ASP 65 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1cfp h GLY 66 N 0.00 1.70 -7.46 0.27 0.00 -1.83 -2.31 103.07 93.44 1cfp h GLY 66 Ca 0.00 -0.17 -0.71 0.00 0.00 0.00 0.00 47.33 46.45 1cfp h GLY 66 CO 0.00 -0.47 -0.17 -1.83 0.00 0.00 0.00 176.54 174.07 1cfp s GLU 67 N -5.47 3.06 -0.32 4.80 -1.05 -1.26 -0.79 118.70 117.67 1cfp s GLU 67 Ca -0.09 -2.93 -0.19 0.00 -0.15 0.00 0.00 54.97 51.61 1cfp s GLU 67 Cb 0.30 -3.92 -0.01 0.00 -0.44 0.00 0.00 34.13 30.06 1cfp s GLU 67 CO 0.80 -1.23 0.57 0.00 0.95 0.00 0.00 175.26 176.35 1cfp s ASP 69 N 1.70 3.37 0.00 0.00 1.11 -1.26 0.19 116.67 121.77 1cfp s ASP 69 Ca 0.22 -0.45 0.00 0.00 0.18 0.00 0.00 52.55 52.50 1cfp s ASP 69 Cb -0.15 -1.13 0.00 0.00 1.07 0.00 0.00 42.92 42.71 1cfp s ASP 69 CO 0.12 0.22 0.00 0.49 1.18 0.00 0.00 175.17 177.18 1cfp n PHE 70 N 3.12 0.00 0.03 4.23 3.01 -1.26 -0.66 117.46 125.93 1cfp n PHE 70 Ca -0.18 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.29 1cfp n PHE 70 Cb 0.52 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.91 1cfp n PHE 70 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1cfp n GLN 71 N 0.00 0.62 -0.14 -1.08 -0.00 -1.26 -4.11 117.38 111.41 1cfp n GLN 71 Ca 0.00 0.20 -0.07 0.00 -0.00 0.00 0.00 57.00 57.13 1cfp n GLN 71 Cb 0.00 -1.79 0.10 0.00 -0.00 0.00 0.00 30.24 28.55 1cfp n GLN 71 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1cfp h GLU 72 N 0.00 0.89 0.33 2.61 5.08 -1.20 0.36 114.58 122.65 1cfp h GLU 72 Ca -0.16 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 1cfp h GLU 72 Cb 1.55 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.71 1cfp h GLU 72 CO 0.04 0.91 -0.18 0.35 -1.00 0.00 0.00 179.01 179.14 1cfp h PHE 73 N 0.82 -0.46 -0.18 4.33 3.57 -1.78 0.34 116.94 123.58 1cfp h PHE 73 Ca 0.15 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1cfp h PHE 73 Cb 0.55 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 1cfp h PHE 73 CO 0.03 -0.28 0.09 0.52 -2.23 0.00 0.00 178.31 176.44 1cfp h MET 74 N -0.47 0.24 0.45 1.11 2.86 -1.66 0.63 114.93 118.08 1cfp h MET 74 Ca -0.04 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1cfp h MET 74 Cb 0.38 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1cfp h MET 74 CO 0.06 0.19 -0.21 0.00 1.06 0.00 0.00 176.91 178.00 1cfp h ALA 75 N 1.85 -0.60 -0.04 6.32 0.00 0.90 -2.29 119.26 125.40 1cfp h ALA 75 Ca 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1cfp h ALA 75 Cb 0.02 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1cfp h ALA 75 CO -0.01 -0.64 -0.07 0.35 0.00 0.00 0.00 179.25 178.89 1cfp h PHE 76 N -1.00 0.15 -1.04 0.00 3.57 -0.18 -1.69 116.94 116.76 1cfp h PHE 76 Ca -0.06 -0.05 0.30 0.00 3.53 0.00 0.00 57.97 61.68 1cfp h PHE 76 Cb 0.57 -0.03 -0.13 0.00 2.79 0.00 0.00 35.95 39.15 1cfp h PHE 76 CO 0.02 0.63 0.62 -0.24 -2.23 0.00 0.00 178.31 177.10 1cfp h VAL 77 N -0.37 0.40 -0.41 1.41 3.04 0.15 2.26 116.25 122.73 1cfp h VAL 77 Ca 0.00 -0.14 -0.07 0.00 -1.01 0.00 0.00 66.70 65.49 1cfp h VAL 77 Cb 0.61 -0.04 -0.01 0.00 -2.01 0.00 0.00 31.29 29.84 1cfp h VAL 77 CO 0.02 0.07 -0.00 0.00 -1.01 0.00 0.00 177.57 176.65 1cfp h ALA 78 N 1.75 0.55 -0.76 3.17 0.00 -1.16 -1.61 119.26 121.20 1cfp h ALA 78 Ca 0.69 -0.26 0.12 0.00 0.00 0.00 0.00 54.91 55.45 1cfp h ALA 78 Cb 1.57 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 1cfp h ALA 78 CO -0.49 0.34 0.50 0.52 0.00 0.00 0.00 179.25 180.11 1cfp h MET 79 N 0.56 0.55 0.13 0.00 2.07 0.45 0.25 114.93 118.94 1cfp h MET 79 Ca 0.12 -0.03 -0.01 0.00 -2.07 0.00 0.00 59.70 57.71 1cfp h MET 79 Cb 0.48 -0.12 -0.00 0.00 -1.87 0.00 0.00 31.60 30.09 1cfp h MET 79 CO 0.02 0.37 -0.08 0.82 1.07 0.00 0.00 176.91 179.11 1cfp h ILE 80 N 0.57 0.00 -0.77 -1.22 1.08 0.68 1.43 117.51 119.27 1cfp h ILE 80 Ca 0.36 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.98 1cfp h ILE 80 Cb 0.62 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.27 1cfp h ILE 80 CO -0.13 0.00 0.32 0.74 -0.69 0.00 0.00 178.15 178.39 1cfp h THR 81 N -0.19 0.65 0.00 -0.27 2.02 -1.04 0.47 112.91 114.55 1cfp h THR 81 Ca -0.02 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 66.94 1cfp h THR 81 Cb 0.15 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 1cfp h THR 81 CO 0.02 0.08 -0.32 0.74 0.37 0.00 0.00 175.52 176.41 1cfp h THR 82 N 0.46 0.99 -0.36 3.16 2.02 -0.34 -1.46 112.91 117.37 1cfp h THR 82 Ca 0.43 -1.22 0.11 0.00 0.77 0.00 0.00 66.41 66.50 1cfp h THR 82 Cb 0.65 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1cfp h THR 82 CO -0.41 0.32 0.51 0.00 0.37 0.00 0.00 175.52 176.31 1cfp h ALA 83 N 1.68 2.02 0.00 6.16 0.00 0.69 0.82 119.26 130.63 1cfp h ALA 83 Ca -0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 1cfp h ALA 83 Cb 0.68 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1cfp h ALA 83 CO 0.04 -0.69 -1.71 0.00 0.00 0.00 0.00 179.25 176.89 1cfp n HIS 85 N -3.06 -1.61 -2.50 0.00 -0.00 0.29 -4.76 115.22 103.58 1cfp n HIS 85 Ca -0.17 0.39 -0.03 0.00 0.46 0.00 0.00 57.72 58.37 1cfp n HIS 85 Cb 1.05 -1.82 0.05 0.00 -0.12 0.00 0.00 29.99 29.15 1cfp n HIS 85 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 1cfp n GLU 86 N -3.42 1.68 0.00 1.57 4.07 -1.26 -4.52 120.64 118.75 1cfp n GLU 86 Ca 0.04 -3.27 0.00 0.00 -0.06 0.00 0.00 57.16 53.87 1cfp n GLU 86 Cb 0.49 -1.37 0.00 0.00 -0.06 0.00 0.00 31.44 30.50 1cfp n GLU 86 CO 0.00 0.00 0.00 1.97 -0.06 0.00 0.00 177.13 179.04 1cfp n PHE 87 N -0.41 0.00 0.00 4.31 -1.74 -1.26 -4.43 117.46 113.93 1cfp n PHE 87 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.04 1cfp n PHE 87 Cb 0.90 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.90 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 0.00 0.00 -2.60 2.97 3.72 -1.26 -2.15 117.46 118.14 1cfp n PHE 88 Ca 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1cfp n PHE 88 Cb 0.00 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.55 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 0.00 0.23 -2.36 -1.08 0.00 -1.26 -5.06 120.64 111.11 1cfp n GLU 89 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 57.16 56.67 1cfp n GLU 89 Cb 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 31.44 31.47 1cfp n GLU 89 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.13 178.71 1cfp n HIS 90 N -0.40 -2.86 0.00 4.31 -0.00 -0.91 -5.19 115.22 110.16 1cfp n HIS 90 Ca -0.15 1.28 0.00 0.00 -0.00 0.00 0.00 57.72 58.84 1cfp n HIS 90 Cb 0.61 -3.29 0.00 0.00 -0.00 0.00 0.00 29.99 27.31 1cfp n HIS 90 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73