#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 0.85 -0.50 6.12 2.88 -1.26 -4.24 113.62 117.48 1cfp n SER 1 Ca 0.00 -1.29 0.41 0.00 -1.33 0.00 0.00 58.87 56.66 1cfp n SER 1 Cb 0.00 -0.00 0.63 0.00 -0.75 0.00 0.00 64.21 64.09 1cfp n SER 1 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1cfp n GLU 2 N -0.33 0.00 -0.06 -1.46 1.02 -1.26 -0.21 120.64 118.35 1cfp n GLU 2 Ca 0.21 0.98 -0.05 0.00 -0.02 0.00 0.00 57.16 58.28 1cfp n GLU 2 Cb 0.25 -2.33 -0.04 0.00 -0.02 0.00 0.00 31.44 29.29 1cfp n GLU 2 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1cfp h LEU 3 N 0.00 -0.00 -1.32 -4.62 3.38 -1.98 -0.56 115.31 110.20 1cfp h LEU 3 Ca 0.73 -0.34 0.06 0.00 0.09 0.00 0.00 57.88 58.42 1cfp h LEU 3 Cb 3.24 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 43.94 1cfp h LEU 3 CO -0.01 0.67 0.50 -0.08 0.09 0.00 0.00 178.44 179.61 1cfp h GLU 4 N -1.00 0.80 -0.22 1.13 4.22 -0.90 1.46 114.58 120.07 1cfp h GLU 4 Ca -0.00 -0.05 -0.08 0.00 0.08 0.00 0.00 59.36 59.32 1cfp h GLU 4 Cb 0.34 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1cfp h GLU 4 CO 0.00 0.53 -0.16 0.87 -2.18 0.00 0.00 179.01 178.07 1cfp h LYS 5 N 0.83 0.50 0.00 1.92 1.79 -0.73 0.30 116.57 121.17 1cfp h LYS 5 Ca 0.33 -0.24 -0.08 0.00 -2.18 0.00 0.00 60.65 58.47 1cfp h LYS 5 Cb 0.23 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.86 1cfp h LYS 5 CO -0.11 0.80 -0.40 0.00 -1.08 0.00 0.00 179.45 178.66 1cfp h ALA 6 N 0.68 1.31 -0.16 3.86 0.00 0.16 -1.69 119.26 123.42 1cfp h ALA 6 Ca 0.04 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1cfp h ALA 6 Cb 0.68 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1cfp h ALA 6 CO 0.04 0.50 -0.05 0.28 0.00 0.00 0.00 179.25 180.02 1cfp h VAL 7 N 0.00 1.30 0.00 0.00 2.07 0.24 -0.15 116.25 119.71 1cfp h VAL 7 Ca -0.00 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1cfp h VAL 7 Cb 0.72 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1cfp h VAL 7 CO 0.05 0.31 0.00 0.58 0.02 0.00 0.00 177.57 178.53 1cfp h VAL 8 N 0.02 0.00 0.14 2.57 2.07 -0.09 -2.56 116.25 118.40 1cfp h VAL 8 Ca 0.04 -0.24 -0.24 0.00 0.82 0.00 0.00 66.70 67.08 1cfp h VAL 8 Cb 0.50 1.23 0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1cfp h VAL 8 CO 0.02 0.00 -1.12 0.00 0.02 0.00 0.00 177.57 176.49 1cfp h ALA 9 N 2.00 0.02 -0.87 1.67 0.00 -0.69 -3.29 119.26 118.11 1cfp h ALA 9 Ca 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 54.91 54.06 1cfp h ALA 9 Cb 0.25 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1cfp h ALA 9 CO 0.00 0.59 0.56 -0.07 0.00 0.00 0.00 179.25 180.34 1cfp h LEU 10 N -0.31 0.94 -1.52 0.00 3.38 -0.65 0.23 115.31 117.39 1cfp h LEU 10 Ca -0.22 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 57.88 1cfp h LEU 10 Cb 1.73 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 42.21 1cfp h LEU 10 CO 0.12 0.65 0.52 0.16 0.09 0.00 0.00 178.44 179.98 1cfp h ILE 11 N 1.10 0.81 -0.17 1.22 -0.00 -1.61 2.47 117.51 121.33 1cfp h ILE 11 Ca 0.34 -0.16 -0.04 0.00 -0.00 0.00 0.00 64.86 65.00 1cfp h ILE 11 Cb -0.02 0.29 -0.01 0.00 -0.00 0.00 0.00 36.82 37.08 1cfp h ILE 11 CO -0.11 0.09 -0.08 -0.78 -0.00 0.00 0.00 178.15 177.27 1cfp h ASP 12 N 0.48 0.23 0.16 2.16 3.58 -0.62 -1.86 116.42 120.54 1cfp h ASP 12 Ca 0.38 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.79 1cfp h ASP 12 Cb 0.80 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.80 1cfp h ASP 12 CO -0.13 0.35 -0.08 0.58 -2.88 0.00 0.00 179.24 177.08 1cfp h VAL 13 N 0.24 0.00 -0.86 2.25 2.07 0.48 -2.87 116.25 117.55 1cfp h VAL 13 Ca 0.05 -0.09 0.21 0.00 0.82 0.00 0.00 66.70 67.69 1cfp h VAL 13 Cb 0.30 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.91 1cfp h VAL 13 CO 0.01 0.00 -0.02 -0.26 0.02 0.00 0.00 177.57 177.33 1cfp h PHE 14 N -0.30 -0.11 -0.39 1.57 0.04 -1.03 0.20 116.94 116.91 1cfp h PHE 14 Ca -0.02 0.07 0.04 0.00 2.80 0.00 0.00 57.97 60.85 1cfp h PHE 14 Cb 0.16 0.19 -0.06 0.00 2.20 0.00 0.00 35.95 38.44 1cfp h PHE 14 CO 0.11 -0.33 -0.35 1.25 -0.60 0.00 0.00 178.31 178.39 1cfp h HIS 15 N 0.06 -1.10 0.00 -0.55 2.76 -1.35 1.95 115.15 116.93 1cfp h HIS 15 Ca 0.48 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.72 1cfp h HIS 15 Cb 0.89 0.53 0.00 0.00 1.55 0.00 0.00 27.41 30.38 1cfp h HIS 15 CO -0.49 -0.27 0.00 1.04 -1.30 0.00 0.00 177.93 176.91 1cfp n GLN 16 N -4.36 0.00 -0.25 5.26 6.02 -0.01 0.23 117.38 124.27 1cfp n GLN 16 Ca -0.01 0.43 -0.07 0.00 -0.01 0.00 0.00 57.00 57.35 1cfp n GLN 16 Cb 0.19 -1.35 -0.06 0.00 1.02 0.00 0.00 30.24 30.04 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 -1.80 -0.27 1.84 1.08 4.01 0.49 0.27 117.16 122.77 1cfp n TYR 17 Ca 0.00 0.76 0.13 0.00 -0.16 0.00 0.00 57.90 58.63 1cfp n TYR 17 Cb 0.00 -0.53 0.69 0.00 -0.31 0.00 0.00 39.34 39.19 1cfp n TYR 17 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1cfp n SER 18 N -4.42 0.41 -2.70 7.72 3.41 0.66 -4.00 113.62 114.71 1cfp n SER 18 Ca 0.01 -1.29 -0.07 0.00 -0.26 0.00 0.00 58.87 57.26 1cfp n SER 18 Cb 0.16 -0.01 0.08 0.00 -0.26 0.00 0.00 64.21 64.17 1cfp n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1cfp n GLY 19 N 0.97 1.53 0.01 5.00 0.00 0.64 -2.35 105.19 110.98 1cfp n GLY 19 Ca 0.19 -0.72 0.02 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.46 0.71 0.00 1.61 1.85 0.75 -4.31 116.66 116.81 1cfp n ARG 20 Ca 0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 1cfp n ARG 20 Cb 0.83 -1.12 0.00 0.00 -1.05 0.00 0.00 32.46 31.13 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 -1.76 0.16 0.00 2.89 1.02 -1.26 -5.07 120.64 116.61 1cfp n GLU 21 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1cfp n GLU 21 Cb 0.22 -0.58 0.00 0.00 -0.02 0.00 0.00 31.44 31.07 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 1.58 2.21 7.00 0.62 0.00 -1.26 -5.15 105.19 110.19 1cfp n GLY 22 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.41 0.00 1.61 8.00 -1.26 -4.23 116.55 120.26 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 2.29 -0.39 0.00 0.00 177.20 179.10 1cfp n LYS 24 N -0.07 0.00 -2.82 -1.24 2.85 -0.99 -4.79 118.16 111.10 1cfp n LYS 24 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 1cfp n LYS 24 Cb 0.00 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 1cfp n LYS 24 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1cfp n HIS 25 N 0.00 3.82 -3.68 5.58 8.25 -1.26 -3.85 115.22 124.07 1cfp n HIS 25 Ca 0.00 -3.76 -0.10 0.00 -0.26 0.00 0.00 57.72 53.60 1cfp n HIS 25 Cb 0.00 -0.38 -0.11 0.00 1.12 0.00 0.00 29.99 30.62 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 -3.48 0.34 0.65 -0.41 3.01 -1.26 -4.40 119.74 114.19 1cfp s LYS 26 Ca 0.48 0.85 -0.03 0.00 -1.01 0.00 0.00 55.97 56.26 1cfp s LYS 26 Cb 0.31 0.08 0.06 0.00 -1.01 0.00 0.00 37.83 37.27 1cfp s LYS 26 CO -0.15 -0.20 0.92 -0.51 0.51 0.00 0.00 175.35 175.92 1cfp s LEU 27 N 1.86 3.02 0.10 3.17 2.01 0.68 -4.67 118.68 124.84 1cfp s LEU 27 Ca -0.06 0.17 -0.13 0.00 0.01 0.00 0.00 54.13 54.12 1cfp s LEU 27 Cb -0.10 -2.87 0.02 0.00 0.01 0.00 0.00 46.19 43.24 1cfp s LEU 27 CO -0.12 -1.46 0.30 -0.75 1.01 0.00 0.00 176.35 175.33 1cfp s LYS 28 N -5.04 0.93 0.34 1.70 2.20 -1.26 0.49 119.74 119.10 1cfp s LYS 28 Ca 0.60 -0.77 0.12 0.00 -0.36 0.00 0.00 55.97 55.56 1cfp s LYS 28 Cb -0.10 0.40 1.07 0.00 -1.51 0.00 0.00 37.83 37.69 1cfp s LYS 28 CO 0.42 -0.33 1.57 0.87 -0.36 0.00 0.00 175.35 177.53 1cfp h LYS 29 N 2.67 0.00 0.60 4.03 1.57 -1.91 1.19 116.57 124.71 1cfp h LYS 29 Ca -0.34 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.42 1cfp h LYS 29 Cb 1.22 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1cfp h LYS 29 CO 0.50 0.00 -0.31 0.77 -0.57 0.00 0.00 179.45 179.85 1cfp h SER 30 N 0.00 -0.74 -0.55 0.86 0.02 -1.98 0.29 113.55 111.44 1cfp h SER 30 Ca 0.73 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.64 1cfp h SER 30 Cb 1.77 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 64.48 1cfp h SER 30 CO -0.85 -0.51 0.07 -0.33 -1.14 0.00 0.00 176.83 174.06 1cfp h GLU 31 N -0.83 0.97 -0.28 3.45 5.08 -0.74 -2.59 114.58 119.63 1cfp h GLU 31 Ca -0.08 -0.26 0.04 0.00 -1.00 0.00 0.00 59.36 58.07 1cfp h GLU 31 Cb 0.65 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 1cfp h GLU 31 CO 0.12 0.92 0.04 -0.07 -1.00 0.00 0.00 179.01 179.02 1cfp h LEU 32 N 0.91 -0.02 -0.08 1.33 -0.00 0.15 0.45 115.31 118.05 1cfp h LEU 32 Ca 0.18 0.05 0.02 0.00 -0.00 0.00 0.00 57.88 58.13 1cfp h LEU 32 Cb 0.44 0.07 -0.05 0.00 -0.00 0.00 0.00 40.66 41.12 1cfp h LEU 32 CO 0.01 0.03 -0.49 0.50 -0.00 0.00 0.00 178.44 178.49 1cfp h LYS 33 N 0.14 -0.53 -0.86 1.13 3.11 -0.05 0.42 116.57 119.93 1cfp h LYS 33 Ca 0.13 0.04 0.14 0.00 -2.81 0.00 0.00 60.65 58.15 1cfp h LYS 33 Cb 0.15 0.12 -0.07 0.00 -1.00 0.00 0.00 32.23 31.43 1cfp h LYS 33 CO -0.18 -0.36 0.56 1.49 -2.81 0.00 0.00 179.45 178.15 1cfp h GLU 34 N -0.55 0.63 0.00 1.90 4.57 -1.21 0.39 114.58 120.31 1cfp h GLU 34 Ca 0.02 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1cfp h GLU 34 Cb 0.63 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1cfp h GLU 34 CO -0.37 0.42 -0.05 1.25 -1.18 0.00 0.00 179.01 179.08 1cfp h LEU 35 N 0.65 0.00 0.04 1.64 6.46 0.40 0.50 115.31 124.99 1cfp h LEU 35 Ca 0.43 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.95 1cfp h LEU 35 Cb 0.73 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.63 1cfp h LEU 35 CO -0.19 0.05 -1.28 0.40 -0.62 0.00 0.00 178.44 176.80 1cfp h ILE 36 N 0.00 0.97 0.00 4.05 5.03 0.26 -3.32 117.51 124.50 1cfp h ILE 36 Ca -0.00 -2.25 -0.08 0.00 -0.12 0.00 0.00 64.86 62.41 1cfp h ILE 36 Cb 0.09 2.45 -0.01 0.00 -3.03 0.00 0.00 36.82 36.32 1cfp h ILE 36 CO 0.01 0.49 -0.38 0.78 -0.68 0.00 0.00 178.15 178.37 1cfp h ASN 37 N -0.73 0.00 0.86 1.72 -0.26 -0.93 1.79 115.58 118.03 1cfp h ASN 37 Ca -0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.42 1cfp h ASN 37 Cb 1.46 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.72 1cfp h ASN 37 CO -0.10 0.38 0.00 0.59 -1.06 0.00 0.00 177.43 177.23 1cfp n ASN 38 N -3.77 0.12 0.00 5.81 4.13 0.17 -3.66 115.26 118.07 1cfp n ASN 38 Ca -0.01 0.52 0.00 0.00 1.68 0.00 0.00 54.58 56.77 1cfp n ASN 38 Cb 0.46 -0.55 0.00 0.00 -1.54 0.00 0.00 39.78 38.15 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 -1.62 0.00 -3.15 3.52 0.28 -0.87 -4.87 120.64 113.92 1cfp n GLU 39 Ca 0.05 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.70 1cfp n GLU 39 Cb 0.28 -0.72 -0.03 0.00 1.43 0.00 0.00 31.44 32.40 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 -2.59 5.28 -0.34 -1.84 4.77 0.60 -4.85 117.00 118.04 1cfp n LEU 40 Ca 0.00 -5.35 0.14 0.00 -0.03 0.00 0.00 56.01 50.77 1cfp n LEU 40 Cb 0.43 -0.97 0.35 0.00 -2.33 0.00 0.00 43.42 40.90 1cfp n LEU 40 CO 0.00 1.91 1.20 -1.28 -1.33 0.00 0.00 177.39 177.89 1cfp h SER 41 N 4.68 0.73 -0.86 -1.43 0.87 -1.73 0.54 113.55 116.35 1cfp h SER 41 Ca 0.22 0.09 0.20 0.00 -1.23 0.00 0.00 61.79 61.07 1cfp h SER 41 Cb 0.61 -0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 62.47 1cfp h SER 41 CO 1.09 0.26 0.58 0.45 -0.53 0.00 0.00 176.83 178.68 1cfp h HIS 42 N 0.71 0.41 0.00 2.24 3.86 -1.92 1.16 115.15 121.61 1cfp h HIS 42 Ca 0.57 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.79 1cfp h HIS 42 Cb 0.96 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.30 1cfp h HIS 42 CO -0.00 0.11 0.00 1.19 0.86 0.00 0.00 177.93 180.09 1cfp n PHE 43 N -4.46 0.28 -0.16 2.45 3.72 0.19 -2.94 117.46 116.54 1cfp n PHE 43 Ca 0.18 0.09 0.20 0.00 -0.05 0.00 0.00 57.45 57.87 1cfp n PHE 43 Cb 0.72 -0.65 0.59 0.00 -0.94 0.00 0.00 39.48 39.20 1cfp n PHE 43 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1cfp h LEU 44 N 0.00 0.24 0.00 4.37 5.85 0.15 0.74 115.31 126.67 1cfp h LEU 44 Ca 0.00 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1cfp h LEU 44 Cb 0.48 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1cfp h LEU 44 CO 0.00 0.11 -1.13 1.21 -0.34 0.00 0.00 178.44 178.29 1cfp n GLU 45 N -4.43 0.61 -2.28 1.25 2.13 -1.15 -4.95 120.64 111.83 1cfp n GLU 45 Ca 0.16 0.16 -0.17 0.00 0.66 0.00 0.00 57.16 57.97 1cfp n GLU 45 Cb 0.69 -1.82 -0.02 0.00 0.27 0.00 0.00 31.44 30.56 1cfp n GLU 45 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1cfp n GLU 46 N -2.75 -1.86 -0.04 5.31 4.07 0.26 -4.81 120.64 120.82 1cfp n GLU 46 Ca -0.03 0.84 -0.01 0.00 -0.06 0.00 0.00 57.16 57.90 1cfp n GLU 46 Cb 0.64 -5.43 -0.11 0.00 -0.06 0.00 0.00 31.44 26.48 1cfp n GLU 46 CO 0.00 0.00 0.00 1.51 -0.06 0.00 0.00 177.13 178.58 1cfp n ILE 47 N -3.47 0.54 0.67 6.31 0.13 -1.26 -4.28 119.36 118.00 1cfp n ILE 47 Ca -0.19 -0.48 0.08 0.00 -1.10 0.00 0.00 62.75 61.05 1cfp n ILE 47 Cb 0.64 -0.29 0.37 0.00 -0.84 0.00 0.00 39.64 39.52 1cfp n ILE 47 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64 1cfp n LYS 48 N -2.30 0.15 -3.65 9.51 4.01 -1.26 -3.89 118.16 120.73 1cfp n LYS 48 Ca -0.14 0.17 -0.27 0.00 -0.51 0.00 0.00 58.31 57.56 1cfp n LYS 48 Cb 0.71 -1.50 -0.11 0.00 -0.51 0.00 0.00 35.03 33.62 1cfp n LYS 48 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 1cfp n GLU 49 N -1.36 1.14 0.00 1.97 0.28 -1.26 -5.02 120.64 116.40 1cfp n GLU 49 Ca 0.06 -3.91 0.00 0.00 -0.16 0.00 0.00 57.16 53.15 1cfp n GLU 49 Cb 0.14 -2.00 0.00 0.00 1.43 0.00 0.00 31.44 31.02 1cfp n GLU 49 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1cfp n GLN 50 N 2.26 0.00 0.05 3.44 3.00 -1.25 0.27 117.38 125.15 1cfp n GLN 50 Ca 0.25 0.00 0.20 0.00 -0.01 0.00 0.00 57.00 57.44 1cfp n GLN 50 Cb 0.41 -0.25 0.58 0.00 0.00 0.00 0.00 30.24 30.98 1cfp n GLN 50 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1cfp h GLU 51 N 0.00 0.00 0.01 -1.09 4.81 -1.96 0.79 114.58 117.14 1cfp h GLU 51 Ca 0.00 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.07 1cfp h GLU 51 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 1cfp h GLU 51 CO 0.00 0.00 -0.64 0.28 -0.73 0.00 0.00 179.01 177.92 1cfp h VAL 52 N 0.00 1.43 -1.08 0.32 2.07 -1.92 -2.55 116.25 114.52 1cfp h VAL 52 Ca 0.25 -2.12 0.29 0.00 0.82 0.00 0.00 66.70 65.93 1cfp h VAL 52 Cb 1.73 2.63 -0.08 0.00 -1.52 0.00 0.00 31.29 34.05 1cfp h VAL 52 CO -0.00 0.62 0.72 0.58 0.02 0.00 0.00 177.57 179.50 1cfp h VAL 53 N -0.10 0.48 -0.38 2.57 2.07 1.07 2.50 116.25 124.47 1cfp h VAL 53 Ca -0.08 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.26 1cfp h VAL 53 Cb 1.36 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1cfp h VAL 53 CO 0.13 0.05 -0.10 -0.78 0.02 0.00 0.00 177.57 176.89 1cfp h ASP 54 N 0.27 0.74 0.15 0.57 3.58 -1.27 -1.26 116.42 119.20 1cfp h ASP 54 Ca 0.59 -0.37 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 1cfp h ASP 54 Cb 1.74 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 42.59 1cfp h ASP 54 CO -0.22 0.94 -0.07 0.11 -2.88 0.00 0.00 179.24 177.12 1cfp h LYS 55 N 0.54 -0.19 -1.74 0.28 6.56 0.40 -0.47 116.57 121.96 1cfp h LYS 55 Ca 0.10 0.01 0.50 0.00 -1.06 0.00 0.00 60.65 60.20 1cfp h LYS 55 Cb 0.61 0.04 -0.07 0.00 -0.57 0.00 0.00 32.23 32.25 1cfp h LYS 55 CO 0.04 -0.13 1.33 0.28 -2.06 0.00 0.00 179.45 178.91 1cfp h VAL 56 N -0.39 0.05 0.19 0.50 2.07 0.16 0.86 116.25 119.69 1cfp h VAL 56 Ca -0.02 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.20 1cfp h VAL 56 Cb 0.15 0.05 0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1cfp h VAL 56 CO 0.03 0.00 -1.41 0.24 0.02 0.00 0.00 177.57 176.46 1cfp h MET 57 N 0.00 0.40 -0.54 1.57 2.86 -1.16 -2.68 114.93 115.38 1cfp h MET 57 Ca 0.82 -0.68 0.10 0.00 -2.06 0.00 0.00 59.70 57.89 1cfp h MET 57 Cb 3.48 0.25 -0.09 0.00 0.06 0.00 0.00 31.60 35.30 1cfp h MET 57 CO -0.01 1.32 0.03 1.05 1.06 0.00 0.00 176.91 180.36 1cfp h GLU 58 N -0.06 0.14 0.33 1.72 4.11 0.25 0.73 114.58 121.80 1cfp h GLU 58 Ca -0.27 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.14 1cfp h GLU 58 Cb 1.96 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.18 1cfp h GLU 58 CO 0.18 0.09 -0.16 1.15 0.07 0.00 0.00 179.01 180.35 1cfp h THR 59 N 0.15 0.56 -1.51 -1.06 2.02 -1.60 -0.82 112.91 110.65 1cfp h THR 59 Ca 0.28 -0.69 0.44 0.00 0.77 0.00 0.00 66.41 67.21 1cfp h THR 59 Cb 0.42 0.85 -0.08 0.00 -1.74 0.00 0.00 68.15 67.60 1cfp h THR 59 CO -0.43 0.11 1.07 0.25 0.37 0.00 0.00 175.52 176.89 1cfp h LEU 60 N -0.89 0.07 0.23 2.58 7.12 -1.10 1.92 115.31 125.25 1cfp h LEU 60 Ca -0.05 0.03 -0.33 0.00 0.13 0.00 0.00 57.88 57.66 1cfp h LEU 60 Cb 0.53 0.02 0.03 0.00 -0.53 0.00 0.00 40.66 40.71 1cfp h LEU 60 CO 0.08 -0.03 -1.51 -0.78 -0.13 0.00 0.00 178.44 176.07 1cfp h ASP 61 N 0.04 0.77 0.00 1.25 1.82 -0.63 -3.41 116.42 116.25 1cfp h ASP 61 Ca 0.76 -0.93 0.00 0.00 -0.39 0.00 0.00 57.03 56.47 1cfp h ASP 61 Cb 2.86 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 42.62 1cfp h ASP 61 CO -0.10 1.72 0.00 -1.54 -1.61 0.00 0.00 179.24 177.71 1cfp n SER 62 N -3.72 0.00 0.00 2.28 3.41 0.34 -4.82 113.62 111.11 1cfp n SER 62 Ca -0.19 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1cfp n SER 62 Cb 1.08 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1cfp n SER 62 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1cfp n ASP 63 N -2.15 0.00 0.00 4.04 2.03 0.57 0.05 116.55 121.09 1cfp n ASP 63 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1cfp n ASP 63 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 1.47 0.00 1.32 0.27 0.00 -1.26 -4.57 105.19 102.42 1cfp n GLY 64 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -2.23 0.00 1.61 2.03 0.11 -4.57 116.55 113.50 1cfp n ASP 65 Ca 0.00 0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1cfp n ASP 65 Cb 0.00 -1.30 0.00 0.00 -0.72 0.00 0.00 41.12 39.10 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 0.13 2.05 3.07 0.27 0.00 -1.26 -4.83 105.19 104.61 1cfp n GLY 66 Ca -0.01 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 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 0.31 -0.67 1.61 2.56 -1.26 -4.92 118.70 116.33 1cfp s GLU 67 Ca 0.00 0.77 -0.19 0.00 0.00 0.00 0.00 54.97 55.55 1cfp s GLU 67 Cb 0.00 -0.10 0.11 0.00 2.00 0.00 0.00 34.13 36.14 1cfp s GLU 67 CO 0.00 -0.44 0.81 0.00 -0.56 0.00 0.00 175.26 175.07 1cfp n ASP 69 N 6.39 0.91 0.00 0.00 9.92 -1.26 0.24 116.55 132.76 1cfp n ASP 69 Ca -0.02 -1.89 0.00 0.00 -0.53 0.00 0.00 54.79 52.34 1cfp n ASP 69 Cb 0.44 -0.74 0.00 0.00 -0.64 0.00 0.00 41.12 40.18 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 -3.12 0.00 0.18 1.24 3.01 -1.26 0.31 117.46 117.82 1cfp n PHE 70 Ca 0.16 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.70 1cfp n PHE 70 Cb 0.57 0.00 0.45 0.00 -0.01 0.00 0.00 39.48 40.49 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 0.06 -1.08 -0.00 -1.99 -1.12 115.11 110.98 1cfp h GLN 71 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 58.65 58.53 1cfp h GLN 71 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.49 1cfp h GLN 71 CO 0.00 0.00 -0.52 0.93 -0.00 0.00 0.00 178.83 179.24 1cfp h GLU 72 N 0.00 0.24 0.02 0.06 5.08 0.45 0.48 114.58 120.92 1cfp h GLU 72 Ca 0.00 -0.35 0.02 0.00 -1.00 0.00 0.00 59.36 58.03 1cfp h GLU 72 Cb 0.51 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1cfp h GLU 72 CO 0.00 1.11 -0.12 0.35 -1.00 0.00 0.00 179.01 179.35 1cfp h PHE 73 N -0.45 -0.31 0.00 4.33 3.57 -0.09 -0.42 116.94 123.56 1cfp h PHE 73 Ca -0.08 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 1cfp h PHE 73 Cb 1.34 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 40.22 1cfp h PHE 73 CO 0.20 -0.19 -0.20 0.52 -2.23 0.00 0.00 178.31 176.42 1cfp h MET 74 N -0.22 0.00 0.44 1.11 2.86 -1.63 -0.00 114.93 117.49 1cfp h MET 74 Ca 0.04 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1cfp h MET 74 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1cfp h MET 74 CO -0.11 0.20 -0.21 0.00 1.06 0.00 0.00 176.91 177.85 1cfp h ALA 75 N 1.80 -1.02 -0.08 6.32 0.00 0.73 -0.63 119.26 126.38 1cfp h ALA 75 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1cfp h ALA 75 Cb 0.39 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1cfp h ALA 75 CO 0.03 -0.98 -0.05 0.35 0.00 0.00 0.00 179.25 178.60 1cfp h PHE 76 N -0.66 0.21 -1.01 0.00 3.04 -1.30 -1.07 116.94 116.14 1cfp h PHE 76 Ca -0.06 -0.06 0.25 0.00 3.98 0.00 0.00 57.97 62.08 1cfp h PHE 76 Cb 0.45 -0.05 -0.10 0.00 2.56 0.00 0.00 35.95 38.82 1cfp h PHE 76 CO 0.10 0.57 0.64 -0.24 -2.02 0.00 0.00 178.31 177.36 1cfp h VAL 77 N -0.21 0.57 -0.23 1.41 3.04 -1.09 1.63 116.25 121.37 1cfp h VAL 77 Ca 0.02 -0.16 -0.13 0.00 -1.01 0.00 0.00 66.70 65.42 1cfp h VAL 77 Cb 0.52 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 29.84 1cfp h VAL 77 CO 0.01 0.09 -0.39 0.00 -1.01 0.00 0.00 177.57 176.28 1cfp h ALA 78 N 1.64 0.89 -0.30 3.17 0.00 -0.72 0.59 119.26 124.53 1cfp h ALA 78 Ca 0.59 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1cfp h ALA 78 Cb 1.34 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1cfp h ALA 78 CO -0.32 0.63 0.02 1.98 0.00 0.00 0.00 179.25 181.56 1cfp h MET 79 N 0.45 0.51 0.31 0.00 -1.53 0.35 -2.25 114.93 112.77 1cfp h MET 79 Ca 0.04 -0.15 -0.02 0.00 -3.44 0.00 0.00 59.70 56.13 1cfp h MET 79 Cb 0.87 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.87 1cfp h MET 79 CO 0.07 0.64 -0.15 0.82 0.14 0.00 0.00 176.91 178.44 1cfp h ILE 80 N 0.31 0.52 -1.78 1.77 1.08 -0.25 -2.62 117.51 116.55 1cfp h ILE 80 Ca 0.09 -0.78 0.54 0.00 -0.39 0.00 0.00 64.86 64.32 1cfp h ILE 80 Cb 0.40 0.83 -0.10 0.00 -3.07 0.00 0.00 36.82 34.88 1cfp h ILE 80 CO 0.01 0.12 1.24 0.74 -0.69 0.00 0.00 178.15 179.57 1cfp h THR 81 N -0.94 0.01 0.00 -0.27 2.02 0.17 2.62 112.91 116.52 1cfp h THR 81 Ca -0.04 -0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.95 1cfp h THR 81 Cb 0.51 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 1cfp h THR 81 CO 0.07 0.00 -1.11 0.71 0.37 0.00 0.00 175.52 175.56 1cfp h THR 82 N 0.00 1.04 -0.31 3.16 1.35 -1.28 -3.20 112.91 113.67 1cfp h THR 82 Ca 0.92 -2.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.14 1cfp h THR 82 Cb 3.46 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 72.34 1cfp h THR 82 CO -0.17 0.59 0.00 0.00 -0.25 0.00 0.00 175.52 175.69 1cfp n ALA 83 N -2.37 2.47 -1.42 6.62 0.00 0.85 -3.74 120.51 122.91 1cfp n ALA 83 Ca -0.05 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1cfp n ALA 83 Cb 0.89 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 0.00 0.00 -4.16 0.00 -0.00 -1.26 -4.98 115.22 104.83 1cfp n HIS 85 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1cfp n HIS 85 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 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 0.00 -0.23 1.57 -0.58 -1.26 -2.62 120.64 117.52 1cfp n GLU 86 Ca 0.00 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.76 1cfp n GLU 86 Cb 0.00 0.00 0.14 0.00 -0.57 0.00 0.00 31.44 31.01 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 0.40 -3.67 -0.32 3.04 -1.98 -3.41 116.94 111.00 1cfp h PHE 87 Ca 0.00 0.03 -0.54 0.00 3.98 0.00 0.00 57.97 61.45 1cfp h PHE 87 Cb 0.00 -0.08 0.10 0.00 2.56 0.00 0.00 35.95 38.53 1cfp h PHE 87 CO 0.00 0.06 0.82 1.19 -2.02 0.00 0.00 178.31 178.36 1cfp n PHE 88 N -5.03 2.95 0.00 0.41 3.72 -1.08 -4.83 117.46 113.60 1cfp n PHE 88 Ca 0.11 0.37 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 1cfp n PHE 88 Cb 0.34 -2.56 0.00 0.00 -0.94 0.00 0.00 39.48 36.32 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 1.13 0.00 -3.17 -1.08 0.00 -1.25 -4.33 120.64 111.95 1cfp n GLU 89 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.23 1cfp n GLU 89 Cb 0.38 -0.34 -0.01 0.00 0.00 0.00 0.00 31.44 31.48 1cfp n GLU 89 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1cfp s HIS 90 N -1.01 -1.79 -1.93 4.31 5.04 -1.26 -4.95 115.29 113.70 1cfp s HIS 90 Ca 0.00 0.99 0.00 0.00 -1.54 0.00 0.00 55.06 54.51 1cfp s HIS 90 Cb 0.00 0.28 0.00 0.00 0.04 0.00 0.00 32.58 32.90 1cfp s HIS 90 CO 0.00 -1.09 0.48 -1.91 -2.34 0.00 0.00 174.74 169.89