#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 -0.53 6.12 7.64 -1.26 -4.00 113.62 122.05 1cfp n SER 1 Ca 0.00 0.13 0.44 0.00 1.01 0.00 0.00 58.87 60.45 1cfp n SER 1 Cb 0.00 -0.08 0.76 0.00 -1.01 0.00 0.00 64.21 63.87 1cfp n SER 1 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1cfp h GLU 2 N 0.00 0.03 0.07 1.43 5.08 -2.04 -0.01 114.58 119.14 1cfp h GLU 2 Ca 0.00 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1cfp h GLU 2 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1cfp h GLU 2 CO 0.00 0.02 -0.03 -0.07 -1.00 0.00 0.00 179.01 177.93 1cfp h LEU 3 N 0.03 -0.08 -0.90 1.33 4.07 -1.98 -1.25 115.31 116.53 1cfp h LEU 3 Ca 0.79 0.00 0.25 0.00 0.08 0.00 0.00 57.88 59.01 1cfp h LEU 3 Cb 3.01 0.02 -0.15 0.00 1.08 0.00 0.00 40.66 44.62 1cfp h LEU 3 CO -0.11 0.24 0.22 -0.08 -1.08 0.00 0.00 178.44 177.63 1cfp h GLU 4 N -0.68 0.16 -0.39 1.13 4.81 -1.53 2.91 114.58 120.97 1cfp h GLU 4 Ca -0.01 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 1cfp h GLU 4 Cb 0.07 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1cfp h GLU 4 CO 0.02 0.10 -0.13 0.87 -0.73 0.00 0.00 179.01 179.14 1cfp h LYS 5 N 0.16 0.71 -0.33 1.92 1.79 -1.15 -0.16 116.57 119.51 1cfp h LYS 5 Ca 0.58 -0.24 -0.16 0.00 -2.18 0.00 0.00 60.65 58.65 1cfp h LYS 5 Cb 1.20 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.78 1cfp h LYS 5 CO -0.71 0.82 -0.42 0.00 -1.08 0.00 0.00 179.45 178.06 1cfp h ALA 6 N 1.21 0.50 -0.25 3.86 0.00 0.37 -2.64 119.26 122.31 1cfp h ALA 6 Ca 0.11 -0.46 0.06 0.00 0.00 0.00 0.00 54.91 54.61 1cfp h ALA 6 Cb 0.60 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 1cfp h ALA 6 CO 0.04 0.62 -0.34 0.28 0.00 0.00 0.00 179.25 179.85 1cfp h VAL 7 N 0.66 0.23 -0.93 0.00 2.07 0.51 1.09 116.25 119.89 1cfp h VAL 7 Ca 0.04 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.80 1cfp h VAL 7 Cb 1.01 0.23 -0.13 0.00 -1.52 0.00 0.00 31.29 30.89 1cfp h VAL 7 CO 0.10 0.00 0.45 0.58 0.02 0.00 0.00 177.57 178.72 1cfp h VAL 8 N -0.35 0.45 -0.14 2.57 2.07 -0.89 1.88 116.25 121.85 1cfp h VAL 8 Ca 0.12 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1cfp h VAL 8 Cb 0.56 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1cfp h VAL 8 CO -0.44 0.08 -0.17 0.00 0.02 0.00 0.00 177.57 177.06 1cfp h ALA 9 N 1.74 1.46 0.00 1.67 0.00 0.13 -1.69 119.26 122.57 1cfp h ALA 9 Ca 0.60 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 1cfp h ALA 9 Cb 1.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1cfp h ALA 9 CO -0.54 0.38 -0.21 -0.07 0.00 0.00 0.00 179.25 178.81 1cfp h LEU 10 N 0.21 0.00 0.21 0.00 3.38 0.79 -1.73 115.31 118.16 1cfp h LEU 10 Ca 0.04 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.71 1cfp h LEU 10 Cb 0.43 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.21 1cfp h LEU 10 CO 0.03 0.21 -1.31 0.16 0.09 0.00 0.00 178.44 177.62 1cfp h ILE 11 N 0.00 1.32 -0.18 1.22 -0.00 -0.13 -0.90 117.51 118.83 1cfp h ILE 11 Ca -0.00 -2.61 -0.01 0.00 -0.00 0.00 0.00 64.86 62.23 1cfp h ILE 11 Cb 0.83 3.00 -0.01 0.00 -0.00 0.00 0.00 36.82 40.64 1cfp h ILE 11 CO 0.03 0.78 0.04 -0.78 -0.00 0.00 0.00 178.15 178.22 1cfp h ASP 12 N 0.08 0.22 0.36 2.16 1.82 -1.18 0.34 116.42 120.23 1cfp h ASP 12 Ca -0.22 -0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.38 1cfp h ASP 12 Cb 2.02 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 41.98 1cfp h ASP 12 CO 0.25 0.23 -0.18 0.58 -1.61 0.00 0.00 179.24 178.52 1cfp h VAL 13 N 0.25 0.00 -1.01 2.25 2.07 -1.17 -2.85 116.25 115.79 1cfp h VAL 13 Ca 0.06 -0.30 0.17 0.00 0.82 0.00 0.00 66.70 67.45 1cfp h VAL 13 Cb 0.10 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.77 1cfp h VAL 13 CO -0.00 0.00 0.62 -0.26 0.02 0.00 0.00 177.57 177.95 1cfp h PHE 14 N -0.79 1.10 -0.77 1.57 -1.00 -0.94 0.49 116.94 116.60 1cfp h PHE 14 Ca -0.05 0.03 0.10 0.00 2.81 0.00 0.00 57.97 60.87 1cfp h PHE 14 Cb 0.38 -0.34 -0.12 0.00 3.61 0.00 0.00 35.95 39.48 1cfp h PHE 14 CO 0.04 0.30 -0.46 1.25 -1.61 0.00 0.00 178.31 177.83 1cfp h HIS 15 N 0.84 -1.39 0.03 -0.55 -0.00 -0.27 1.86 115.15 115.67 1cfp h HIS 15 Ca 0.56 0.10 -0.00 0.00 -0.00 0.00 0.00 60.37 61.02 1cfp h HIS 15 Cb 0.78 0.71 0.00 0.00 -0.00 0.00 0.00 27.41 28.90 1cfp h HIS 15 CO -0.00 -0.41 -0.01 1.96 -0.00 0.00 0.00 177.93 179.46 1cfp h GLN 16 N -0.13 -0.04 0.00 5.26 1.08 -0.88 0.87 115.11 121.27 1cfp h GLN 16 Ca 0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.41 1cfp h GLN 16 Cb 0.54 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1cfp h GLN 16 CO -0.81 -0.02 0.00 0.66 -0.95 0.00 0.00 178.83 177.70 1cfp n TYR 17 N -2.49 0.00 1.68 2.96 4.01 0.16 0.30 117.16 123.77 1cfp n TYR 17 Ca -0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.76 1cfp n TYR 17 Cb 0.02 -0.47 0.12 0.00 -0.31 0.00 0.00 39.34 38.69 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 -2.86 0.55 -1.05 7.72 7.64 0.60 -3.71 113.62 122.50 1cfp n SER 18 Ca 0.00 -1.92 0.01 0.00 1.01 0.00 0.00 58.87 57.97 1cfp n SER 18 Cb 0.00 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 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 0.70 0.78 0.11 0.23 0.00 0.69 -3.69 105.19 104.01 1cfp n GLY 19 Ca 0.05 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.68 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 0.25 2.74 0.00 1.61 1.85 0.87 -4.58 116.66 119.39 1cfp n ARG 20 Ca -0.00 -1.75 0.00 0.00 -1.00 0.00 0.00 57.85 55.10 1cfp n ARG 20 Cb 0.91 -1.12 0.00 0.00 -1.05 0.00 0.00 32.46 31.19 1cfp n ARG 20 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1cfp n GLU 21 N -0.52 0.00 0.09 2.89 1.02 -1.26 -5.03 120.64 117.83 1cfp n GLU 21 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1cfp n GLU 21 Cb 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.76 1cfp n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1cfp n GLY 22 N 0.66 -0.37 3.10 0.62 0.00 -1.26 -5.11 105.19 102.83 1cfp n GLY 22 Ca 0.00 0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1cfp n GLY 22 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cfp n ASP 23 N -3.05 -4.76 0.00 1.61 5.68 -1.26 -4.98 116.55 109.80 1cfp n ASP 23 Ca 0.00 0.19 0.00 0.00 -0.50 0.00 0.00 54.79 54.48 1cfp n ASP 23 Cb 0.00 -0.85 0.00 0.00 -1.14 0.00 0.00 41.12 39.13 1cfp n ASP 23 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1cfp n LYS 24 N 1.39 0.00 -2.75 0.11 4.01 -1.24 -4.37 118.16 115.31 1cfp n LYS 24 Ca 0.00 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.51 1cfp n LYS 24 Cb 0.57 -0.13 -0.02 0.00 -0.51 0.00 0.00 35.03 34.95 1cfp n LYS 24 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1cfp n HIS 25 N -1.76 3.73 -3.80 2.13 8.25 -1.26 -4.12 115.22 118.39 1cfp n HIS 25 Ca 0.00 -3.56 -0.10 0.00 -0.26 0.00 0.00 57.72 53.81 1cfp n HIS 25 Cb 0.00 -0.50 -0.00 0.00 1.12 0.00 0.00 29.99 30.61 1cfp n HIS 25 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1cfp n LYS 26 N -0.30 0.71 -4.06 -0.41 4.01 -1.26 -4.32 118.16 112.53 1cfp n LYS 26 Ca 0.36 -2.01 -0.17 0.00 -0.51 0.00 0.00 58.31 55.98 1cfp n LYS 26 Cb 0.43 2.17 -0.05 0.00 -0.51 0.00 0.00 35.03 37.07 1cfp n LYS 26 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1cfp n LEU 27 N 0.00 0.00 -3.96 -0.35 4.77 0.85 -4.01 117.00 114.31 1cfp n LEU 27 Ca -0.03 -2.96 -0.09 0.00 -0.03 0.00 0.00 56.01 52.90 1cfp n LEU 27 Cb 0.47 2.16 -0.10 0.00 -2.33 0.00 0.00 43.42 43.62 1cfp n LEU 27 CO 0.23 -0.59 -0.26 -0.75 -1.33 0.00 0.00 177.39 174.68 1cfp s LYS 28 N -3.02 0.52 0.42 3.23 2.20 -1.26 0.14 119.74 121.97 1cfp s LYS 28 Ca 0.33 -0.75 0.28 0.00 -0.36 0.00 0.00 55.97 55.47 1cfp s LYS 28 Cb 0.00 0.20 1.39 0.00 -1.51 0.00 0.00 37.83 37.91 1cfp s LYS 28 CO 0.24 -0.12 1.62 0.87 -0.36 0.00 0.00 175.35 177.60 1cfp h LYS 29 N 3.88 0.09 0.31 4.03 1.57 -1.91 1.05 116.57 125.59 1cfp h LYS 29 Ca -0.32 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.44 1cfp h LYS 29 Cb 1.19 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1cfp h LYS 29 CO 0.49 0.06 -0.15 1.03 -0.57 0.00 0.00 179.45 180.31 1cfp h SER 30 N 0.09 -0.35 -0.17 0.86 0.87 -1.95 -0.86 113.55 112.03 1cfp h SER 30 Ca 0.82 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 61.20 1cfp h SER 30 Cb 2.47 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 64.51 1cfp h SER 30 CO -0.48 0.10 0.09 -0.33 -0.53 0.00 0.00 176.83 175.67 1cfp h GLU 31 N -0.94 0.29 -0.62 2.24 5.08 -1.19 -1.07 114.58 118.36 1cfp h GLU 31 Ca -0.04 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1cfp h GLU 31 Cb 0.51 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1cfp h GLU 31 CO 0.07 0.24 0.06 -0.07 -1.00 0.00 0.00 179.01 178.32 1cfp h LEU 32 N 0.29 1.01 0.16 1.33 3.38 0.10 -2.09 115.31 119.51 1cfp h LEU 32 Ca 0.08 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.78 1cfp h LEU 32 Cb 0.06 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1cfp h LEU 32 CO -0.01 1.04 -0.39 0.50 0.09 0.00 0.00 178.44 179.67 1cfp h LYS 33 N 0.95 -0.62 -0.98 1.13 3.11 0.19 0.10 116.57 120.45 1cfp h LYS 33 Ca 0.18 0.04 0.19 0.00 -2.81 0.00 0.00 60.65 58.26 1cfp h LYS 33 Cb 0.48 0.14 -0.09 0.00 -1.00 0.00 0.00 32.23 31.76 1cfp h LYS 33 CO 0.02 -0.42 0.61 1.49 -2.81 0.00 0.00 179.45 178.35 1cfp h GLU 34 N -0.65 0.65 -0.10 1.90 4.81 -1.37 0.45 114.58 120.26 1cfp h GLU 34 Ca 0.02 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1cfp h GLU 34 Cb 0.66 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1cfp h GLU 34 CO -0.20 0.43 -0.05 1.25 -0.73 0.00 0.00 179.01 179.71 1cfp h LEU 35 N 0.67 -0.16 -0.26 1.64 6.46 -0.14 1.78 115.31 125.28 1cfp h LEU 35 Ca 0.54 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 58.34 1cfp h LEU 35 Cb 0.97 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 1cfp h LEU 35 CO -0.31 -0.07 0.00 0.40 -0.62 0.00 0.00 178.44 177.84 1cfp h ILE 36 N -0.04 0.00 0.00 4.05 5.03 0.28 -3.12 117.51 123.71 1cfp h ILE 36 Ca 0.06 -0.61 -0.27 0.00 -0.12 0.00 0.00 64.86 63.91 1cfp h ILE 36 Cb 0.13 1.58 -0.05 0.00 -3.03 0.00 0.00 36.82 35.45 1cfp h ILE 36 CO -0.13 0.00 -1.67 -3.20 -0.68 0.00 0.00 178.15 172.47 1cfp n ASN 37 N -2.62 0.87 -0.05 1.72 5.15 0.14 -1.55 115.26 118.91 1cfp n ASN 37 Ca 0.04 0.41 0.14 0.00 -0.60 0.00 0.00 54.58 54.57 1cfp n ASN 37 Cb 0.42 -0.03 0.61 0.00 -0.53 0.00 0.00 39.78 40.26 1cfp n ASN 37 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1cfp n ASN 38 N -3.02 0.26 -0.00 1.20 4.13 0.59 -3.75 115.26 114.67 1cfp n ASN 38 Ca -0.16 -0.23 -0.00 0.00 1.68 0.00 0.00 54.58 55.87 1cfp n ASN 38 Cb 1.02 -0.18 -0.00 0.00 -1.54 0.00 0.00 39.78 39.09 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 -1.20 0.01 -3.35 3.52 0.28 -1.18 -4.87 120.64 113.84 1cfp n GLU 39 Ca 0.12 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.83 1cfp n GLU 39 Cb 0.29 -0.87 -0.07 0.00 1.43 0.00 0.00 31.44 32.21 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 -2.64 4.12 0.09 -1.84 4.77 -0.60 -4.86 117.00 116.05 1cfp n LEU 40 Ca -0.00 -5.43 0.20 0.00 -0.03 0.00 0.00 56.01 50.74 1cfp n LEU 40 Cb 0.50 -0.74 0.75 0.00 -2.33 0.00 0.00 43.42 41.61 1cfp n LEU 40 CO 0.00 2.03 1.17 -1.28 -1.33 0.00 0.00 177.39 177.98 1cfp h SER 41 N 4.27 0.00 0.15 -1.43 0.87 -1.74 -1.14 113.55 114.54 1cfp h SER 41 Ca 0.20 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 1cfp h SER 41 Cb 0.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1cfp h SER 41 CO 0.90 0.00 -0.07 0.45 -0.53 0.00 0.00 176.83 177.57 1cfp h HIS 42 N 0.00 -0.19 0.00 2.24 3.86 -1.91 -2.15 115.15 117.00 1cfp h HIS 42 Ca 0.19 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1cfp h HIS 42 Cb 0.91 0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.44 1cfp h HIS 42 CO 0.00 0.12 0.00 0.34 0.86 0.00 0.00 177.93 179.25 1cfp n PHE 43 N -5.04 0.29 -0.14 2.45 -0.00 -0.46 -2.18 117.46 112.37 1cfp n PHE 43 Ca -0.09 0.14 -0.04 0.00 -0.00 0.00 0.00 57.45 57.47 1cfp n PHE 43 Cb 0.21 -0.72 0.04 0.00 -0.00 0.00 0.00 39.48 39.01 1cfp n PHE 43 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1cfp h LEU 44 N 0.00 -0.08 -0.93 -2.13 5.85 -0.99 0.24 115.31 117.27 1cfp h LEU 44 Ca 0.00 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1cfp h LEU 44 Cb 0.07 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1cfp h LEU 44 CO 0.00 -0.01 -0.37 -0.33 -0.34 0.00 0.00 178.44 177.40 1cfp h GLU 45 N 0.17 0.33 -1.28 1.25 4.39 -1.57 -3.45 114.58 114.42 1cfp h GLU 45 Ca 0.22 -0.15 -0.12 0.00 0.34 0.00 0.00 59.36 59.65 1cfp h GLU 45 Cb 0.30 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.89 1cfp h GLU 45 CO -0.32 0.65 -0.11 -1.91 -1.16 0.00 0.00 179.01 176.16 1cfp n GLU 46 N -4.06 -1.35 0.02 2.33 2.13 0.84 -4.71 120.64 115.85 1cfp n GLU 46 Ca -0.01 0.40 -0.11 0.00 0.66 0.00 0.00 57.16 58.09 1cfp n GLU 46 Cb 0.46 -4.35 -0.14 0.00 0.27 0.00 0.00 31.44 27.68 1cfp n GLU 46 CO 0.00 0.00 0.00 0.97 -0.41 0.00 0.00 177.13 177.69 1cfp h ILE 47 N 0.00 1.11 -0.40 6.31 -0.00 -1.87 -3.28 117.51 119.38 1cfp h ILE 47 Ca -0.12 -2.86 0.12 0.00 -0.00 0.00 0.00 64.86 61.99 1cfp h ILE 47 Cb 0.48 2.61 -0.02 0.00 -0.00 0.00 0.00 36.82 39.90 1cfp h ILE 47 CO 0.18 0.72 0.72 0.11 -0.00 0.00 0.00 178.15 179.88 1cfp h LYS 48 N 0.02 0.00 -2.27 2.19 1.79 -1.92 -3.19 116.57 113.19 1cfp h LYS 48 Ca -0.22 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.79 1cfp h LYS 48 Cb 1.96 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 32.26 1cfp h LYS 48 CO 0.11 0.00 -0.75 -1.83 -1.08 0.00 0.00 179.45 175.90 1cfp s GLU 49 N -4.33 0.54 0.06 3.15 1.03 -1.24 -5.03 118.70 112.89 1cfp s GLU 49 Ca -0.03 -0.94 -0.36 0.00 0.03 0.00 0.00 54.97 53.67 1cfp s GLU 49 Cb 0.11 -0.96 -0.19 0.00 -0.80 0.00 0.00 34.13 32.28 1cfp s GLU 49 CO 0.36 -1.17 1.54 1.96 -1.33 0.00 0.00 175.26 176.62 1cfp h GLN 50 N 7.27 -1.17 -1.66 -4.83 1.08 -1.71 -1.77 115.11 112.31 1cfp h GLN 50 Ca 0.02 0.08 0.48 0.00 -1.45 0.00 0.00 58.65 57.78 1cfp h GLN 50 Cb 1.02 0.27 -0.07 0.00 -0.05 0.00 0.00 27.48 28.65 1cfp h GLN 50 CO 0.25 -0.78 1.27 1.49 -0.95 0.00 0.00 178.83 180.12 1cfp h GLU 51 N -1.22 0.00 0.03 1.46 4.81 -1.93 1.12 114.58 118.85 1cfp h GLU 51 Ca -0.11 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.91 1cfp h GLU 51 Cb 0.96 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.36 1cfp h GLU 51 CO 0.14 0.00 -0.83 0.28 -0.73 0.00 0.00 179.01 177.87 1cfp h VAL 52 N 0.00 1.37 -1.08 0.32 2.07 -1.68 -2.53 116.25 114.71 1cfp h VAL 52 Ca 0.79 -2.21 0.29 0.00 0.82 0.00 0.00 66.70 66.39 1cfp h VAL 52 Cb 3.33 2.60 -0.08 0.00 -1.52 0.00 0.00 31.29 35.62 1cfp h VAL 52 CO -0.01 0.66 0.73 0.58 0.02 0.00 0.00 177.57 179.55 1cfp h VAL 53 N 0.07 0.48 -0.27 2.57 2.07 0.18 1.93 116.25 123.26 1cfp h VAL 53 Ca -0.11 -0.08 -0.14 0.00 0.82 0.00 0.00 66.70 67.19 1cfp h VAL 53 Cb 1.53 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1cfp h VAL 53 CO 0.16 0.04 -0.36 -0.78 0.02 0.00 0.00 177.57 176.65 1cfp h ASP 54 N 0.23 0.79 0.09 0.57 1.82 -1.26 -2.36 116.42 116.29 1cfp h ASP 54 Ca 0.58 -0.50 -0.00 0.00 -0.39 0.00 0.00 57.03 56.71 1cfp h ASP 54 Cb 1.79 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 41.57 1cfp h ASP 54 CO -0.19 1.14 -0.04 0.11 -1.61 0.00 0.00 179.24 178.65 1cfp h LYS 55 N 0.47 -0.11 -1.52 0.28 6.56 0.27 -1.04 116.57 121.47 1cfp h LYS 55 Ca 0.03 0.01 0.49 0.00 -1.06 0.00 0.00 60.65 60.12 1cfp h LYS 55 Cb 0.95 0.03 -0.12 0.00 -0.57 0.00 0.00 32.23 32.52 1cfp h LYS 55 CO 0.09 -0.07 1.02 0.28 -2.06 0.00 0.00 179.45 178.70 1cfp h VAL 56 N -0.57 0.05 0.05 0.50 2.07 0.19 1.39 116.25 119.93 1cfp h VAL 56 Ca -0.01 -0.01 -0.27 0.00 0.82 0.00 0.00 66.70 67.23 1cfp h VAL 56 Cb 0.09 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1cfp h VAL 56 CO 0.02 0.00 -1.38 0.24 0.02 0.00 0.00 177.57 176.47 1cfp h MET 57 N 0.02 0.11 -0.51 1.57 2.86 -1.48 -2.59 114.93 114.92 1cfp h MET 57 Ca 0.88 -0.20 0.03 0.00 -2.06 0.00 0.00 59.70 58.35 1cfp h MET 57 Cb 3.01 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 34.72 1cfp h MET 57 CO -0.32 0.95 0.34 1.05 1.06 0.00 0.00 176.91 179.99 1cfp h GLU 58 N 0.03 0.56 0.14 1.72 -0.00 0.33 -2.39 114.58 114.96 1cfp h GLU 58 Ca -0.17 -0.03 -0.36 0.00 -0.00 0.00 0.00 59.36 58.80 1cfp h GLU 58 Cb 1.93 -0.13 -0.01 0.00 -0.00 0.00 0.00 28.75 30.55 1cfp h GLU 58 CO 0.14 0.37 -1.93 1.15 -0.00 0.00 0.00 179.01 178.73 1cfp h THR 59 N 0.57 0.70 -1.00 -1.06 2.02 -1.52 -3.14 112.91 109.49 1cfp h THR 59 Ca 0.21 -2.39 0.28 0.00 0.77 0.00 0.00 66.41 65.28 1cfp h THR 59 Cb 0.12 2.57 -0.04 0.00 -1.74 0.00 0.00 68.15 69.05 1cfp h THR 59 CO -0.05 0.89 0.71 0.25 0.37 0.00 0.00 175.52 177.68 1cfp h LEU 60 N 0.08 0.05 0.00 2.58 5.85 -1.16 1.61 115.31 124.32 1cfp h LEU 60 Ca -0.40 0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.15 1cfp h LEU 60 Cb 2.05 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 43.05 1cfp h LEU 60 CO 0.11 0.01 -1.42 -0.78 -0.34 0.00 0.00 178.44 176.02 1cfp h ASP 61 N 0.04 0.00 0.77 1.25 1.82 -1.55 -3.34 116.42 115.41 1cfp h ASP 61 Ca 0.48 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.12 1cfp h ASP 61 Cb 1.85 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.86 1cfp h ASP 61 CO -0.03 0.62 -0.80 -1.54 -1.61 0.00 0.00 179.24 175.88 1cfp n SER 62 N -2.91 0.70 -4.51 2.28 3.41 0.15 -4.19 113.62 108.55 1cfp n SER 62 Ca -0.10 0.07 -0.25 0.00 -0.26 0.00 0.00 58.87 58.33 1cfp n SER 62 Cb 0.86 0.38 -0.19 0.00 -0.26 0.00 0.00 64.21 65.00 1cfp n SER 62 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1cfp n ASP 63 N -2.16 -0.71 -2.34 4.04 8.00 0.50 -0.35 116.55 123.53 1cfp n ASP 63 Ca 0.02 -0.53 -0.03 0.00 0.71 0.00 0.00 54.79 54.96 1cfp n ASP 63 Cb 0.46 -0.75 -0.00 0.00 -0.02 0.00 0.00 41.12 40.80 1cfp n ASP 63 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cfp n GLY 64 N 5.83 -0.41 0.00 0.44 0.00 -1.26 -4.14 105.19 105.64 1cfp n GLY 64 Ca 0.65 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.67 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 -1.35 0.00 0.00 1.61 2.03 0.53 0.06 116.55 119.42 1cfp n ASP 65 Ca -0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1cfp n ASP 65 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 1cfp n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfp n GLY 66 N 0.00 2.91 2.90 0.27 0.00 -1.26 -5.00 105.19 105.02 1cfp n GLY 66 Ca 0.00 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 1cfp n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1cfp s GLU 67 N 0.00 0.35 -0.59 1.61 2.56 0.11 -4.92 118.70 117.81 1cfp s GLU 67 Ca 0.00 0.47 -0.22 0.00 0.00 0.00 0.00 54.97 55.22 1cfp s GLU 67 Cb 0.00 -0.49 0.06 0.00 2.00 0.00 0.00 34.13 35.70 1cfp s GLU 67 CO 0.00 -0.69 0.86 0.00 -0.56 0.00 0.00 175.26 174.87 1cfp s ASP 69 N 3.23 3.87 0.00 0.00 1.01 -1.26 0.29 116.67 123.82 1cfp s ASP 69 Ca 0.22 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.42 1cfp s ASP 69 Cb -0.17 -0.20 0.00 0.00 1.01 0.00 0.00 42.92 43.56 1cfp s ASP 69 CO 0.13 -2.20 0.26 0.49 0.21 0.00 0.00 175.17 174.06 1cfp n PHE 70 N -3.22 0.00 0.31 4.23 3.01 -1.26 0.22 117.46 120.75 1cfp n PHE 70 Ca 0.15 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.70 1cfp n PHE 70 Cb 0.60 -0.00 0.51 0.00 -0.01 0.00 0.00 39.48 40.58 1cfp n PHE 70 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 1cfp h GLN 71 N 0.00 0.00 0.23 -1.08 3.07 -1.98 0.15 115.11 115.51 1cfp h GLN 71 Ca 0.00 0.00 -0.31 0.00 0.09 0.00 0.00 58.65 58.43 1cfp h GLN 71 Cb 0.00 0.00 0.04 0.00 0.08 0.00 0.00 27.48 27.60 1cfp h GLN 71 CO 0.00 0.00 -1.37 0.93 0.09 0.00 0.00 178.83 178.48 1cfp h GLU 72 N 0.00 0.52 -0.18 0.06 5.08 0.24 0.40 114.58 120.70 1cfp h GLU 72 Ca 0.00 -0.87 -0.12 0.00 -1.00 0.00 0.00 59.36 57.37 1cfp h GLU 72 Cb 1.07 0.32 -0.01 0.00 0.50 0.00 0.00 28.75 30.63 1cfp h GLU 72 CO 0.00 1.42 -0.41 0.35 -1.00 0.00 0.00 179.01 179.37 1cfp h PHE 73 N 0.08 0.49 0.00 4.33 3.57 0.61 -1.16 116.94 124.87 1cfp h PHE 73 Ca -0.24 -0.14 -0.10 0.00 3.53 0.00 0.00 57.97 61.03 1cfp h PHE 73 Cb 2.08 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 40.70 1cfp h PHE 73 CO 0.14 0.76 -0.47 0.52 -2.23 0.00 0.00 178.31 177.03 1cfp h MET 74 N 0.34 0.00 0.21 1.11 0.00 -1.49 -2.42 114.93 112.68 1cfp h MET 74 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.72 1cfp h MET 74 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.47 1cfp h MET 74 CO 0.07 0.47 -0.10 0.00 0.00 0.00 0.00 176.91 177.36 1cfp h ALA 75 N 1.53 -0.35 -0.19 6.32 0.00 -0.44 -2.69 119.26 123.44 1cfp h ALA 75 Ca -0.00 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1cfp h ALA 75 Cb 1.29 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 1cfp h ALA 75 CO 0.06 -0.33 0.05 0.35 0.00 0.00 0.00 179.25 179.38 1cfp h PHE 76 N -0.81 0.09 -0.95 0.00 3.57 -1.36 0.40 116.94 117.89 1cfp h PHE 76 Ca -0.03 0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.69 1cfp h PHE 76 Cb 0.21 -0.01 -0.12 0.00 2.79 0.00 0.00 35.95 38.82 1cfp h PHE 76 CO 0.02 0.04 0.52 -0.24 -2.23 0.00 0.00 178.31 176.42 1cfp h VAL 77 N 0.14 0.59 -0.18 1.41 3.04 -1.57 0.29 116.25 119.97 1cfp h VAL 77 Ca 0.08 -0.20 -0.06 0.00 -1.01 0.00 0.00 66.70 65.51 1cfp h VAL 77 Cb 0.06 -0.04 -0.00 0.00 -2.01 0.00 0.00 31.29 29.29 1cfp h VAL 77 CO -0.10 0.11 -0.13 0.00 -1.01 0.00 0.00 177.57 176.44 1cfp h ALA 78 N 1.68 0.26 -0.81 3.17 0.00 -0.70 -0.96 119.26 121.90 1cfp h ALA 78 Ca 0.58 -0.31 0.14 0.00 0.00 0.00 0.00 54.91 55.31 1cfp h ALA 78 Cb 1.01 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1cfp h ALA 78 CO -0.45 0.12 0.53 1.98 0.00 0.00 0.00 179.25 181.43 1cfp h MET 79 N 0.07 0.56 0.20 0.00 -1.53 0.30 0.23 114.93 114.76 1cfp h MET 79 Ca 0.03 -0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.25 1cfp h MET 79 Cb 0.64 -0.13 0.00 0.00 -0.55 0.00 0.00 31.60 31.57 1cfp h MET 79 CO 0.03 0.37 -0.09 0.82 0.14 0.00 0.00 176.91 178.18 1cfp h ILE 80 N 0.57 0.00 -1.31 1.77 1.08 -0.36 -3.21 117.51 116.04 1cfp h ILE 80 Ca 0.39 -0.34 0.38 0.00 -0.39 0.00 0.00 64.86 64.91 1cfp h ILE 80 Cb 0.72 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.40 1cfp h ILE 80 CO -0.15 0.00 0.93 0.74 -0.69 0.00 0.00 178.15 178.97 1cfp h THR 81 N -0.60 0.34 0.00 -0.27 2.02 -0.89 0.85 112.91 114.34 1cfp h THR 81 Ca -0.03 -0.02 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1cfp h THR 81 Cb 0.20 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1cfp h THR 81 CO 0.04 0.01 -0.19 0.71 0.37 0.00 0.00 175.52 176.46 1cfp h THR 82 N 0.05 0.62 -0.23 3.16 1.35 -0.55 -2.52 112.91 114.79 1cfp h THR 82 Ca 0.65 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 1cfp h THR 82 Cb 2.45 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 70.42 1cfp h THR 82 CO -0.07 0.19 0.00 0.00 -0.25 0.00 0.00 175.52 175.39 1cfp n ALA 83 N -2.27 2.49 -1.13 6.62 0.00 0.29 -4.68 120.51 121.83 1cfp n ALA 83 Ca -0.01 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1cfp n ALA 83 Cb 0.33 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.75 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 -0.75 -0.28 -0.31 0.00 8.25 -1.05 -4.89 115.22 116.20 1cfp n HIS 85 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1cfp n HIS 85 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1cfp n HIS 85 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1cfp n GLU 86 N 0.00 0.00 0.01 -0.41 -0.58 -1.26 -3.27 120.64 115.13 1cfp n GLU 86 Ca 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1cfp n GLU 86 Cb 0.00 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1cfp n GLU 86 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1cfp h PHE 87 N 0.00 -0.02 0.00 -0.32 3.04 -1.97 -3.44 116.94 114.23 1cfp h PHE 87 Ca 0.00 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1cfp h PHE 87 Cb 0.00 0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.52 1cfp h PHE 87 CO 0.00 -0.01 0.00 1.19 -2.02 0.00 0.00 178.31 177.47 1cfp n PHE 88 N -2.05 0.00 -3.83 0.41 3.01 -1.22 -4.77 117.46 109.02 1cfp n PHE 88 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1cfp n PHE 88 Cb 0.01 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.32 1cfp n PHE 88 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1cfp s GLU 89 N 0.32 1.06 -1.24 -1.08 -6.30 -0.97 -2.52 118.70 107.97 1cfp s GLU 89 Ca 0.00 -0.96 -0.27 0.00 -2.50 0.00 0.00 54.97 51.24 1cfp s GLU 89 Cb 0.00 -2.32 0.03 0.00 0.00 0.00 0.00 34.13 31.84 1cfp s GLU 89 CO 0.00 -0.78 0.62 0.72 0.02 0.00 0.00 175.26 175.85 1cfp n HIS 90 N 4.79 -1.50 0.00 5.30 -0.00 -1.20 -4.83 115.22 117.77 1cfp n HIS 90 Ca -0.06 0.24 0.00 0.00 -0.00 0.00 0.00 57.72 57.90 1cfp n HIS 90 Cb 0.44 -2.98 0.00 0.00 -0.00 0.00 0.00 29.99 27.45 1cfp n HIS 90 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.34 175.49