#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 0.13 -0.50 6.12 7.64 -1.26 -4.23 113.62 121.52 1cfp n SER 1 Ca 0.00 -1.36 0.38 0.00 1.01 0.00 0.00 58.87 58.90 1cfp n SER 1 Cb 0.00 -0.01 0.60 0.00 -1.01 0.00 0.00 64.21 63.80 1cfp n SER 1 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1cfp n GLU 2 N -0.74 -0.01 0.12 1.43 -0.58 -1.26 0.67 120.64 120.27 1cfp n GLU 2 Ca 0.16 0.87 -0.11 0.00 -0.42 0.00 0.00 57.16 57.66 1cfp n GLU 2 Cb 0.09 -1.92 -0.07 0.00 -0.57 0.00 0.00 31.44 28.97 1cfp n GLU 2 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1cfp h LEU 3 N 0.00 -0.31 -1.46 -4.62 3.38 -1.99 0.77 115.31 111.08 1cfp h LEU 3 Ca 0.71 -0.22 0.10 0.00 0.09 0.00 0.00 57.88 58.56 1cfp h LEU 3 Cb 2.71 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 43.50 1cfp h LEU 3 CO -0.11 0.15 0.47 -0.08 0.09 0.00 0.00 178.44 178.97 1cfp h GLU 4 N -0.88 0.58 -0.15 1.13 4.81 -0.10 1.01 114.58 120.98 1cfp h GLU 4 Ca -0.04 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.03 1cfp h GLU 4 Cb 0.51 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1cfp h GLU 4 CO 0.06 0.39 -0.45 0.87 -0.73 0.00 0.00 179.01 179.15 1cfp h LYS 5 N 0.60 0.36 -0.00 1.92 1.57 -1.16 -1.00 116.57 118.86 1cfp h LYS 5 Ca 0.33 -0.19 -0.20 0.00 -1.87 0.00 0.00 60.65 58.72 1cfp h LYS 5 Cb 0.49 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1cfp h LYS 5 CO -0.11 0.74 -0.87 0.00 -0.57 0.00 0.00 179.45 178.64 1cfp h ALA 6 N 1.23 0.51 -0.45 3.86 0.00 0.20 -2.47 119.26 122.14 1cfp h ALA 6 Ca 0.02 -0.71 0.02 0.00 0.00 0.00 0.00 54.91 54.24 1cfp h ALA 6 Cb 0.91 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1cfp h ALA 6 CO 0.08 0.88 0.27 0.28 0.00 0.00 0.00 179.25 180.75 1cfp h VAL 7 N 0.14 1.05 -0.79 0.00 2.07 0.14 0.10 116.25 118.97 1cfp h VAL 7 Ca -0.05 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1cfp h VAL 7 Cb 1.49 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1cfp h VAL 7 CO 0.14 0.10 0.47 0.58 0.02 0.00 0.00 177.57 178.87 1cfp h VAL 8 N 0.54 1.22 -0.41 2.57 2.07 -1.08 -0.56 116.25 120.60 1cfp h VAL 8 Ca 0.18 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 1cfp h VAL 8 Cb 0.01 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 1cfp h VAL 8 CO -0.08 0.23 0.13 0.00 0.02 0.00 0.00 177.57 177.87 1cfp h ALA 9 N 1.43 1.46 -0.16 1.67 0.00 -0.58 -2.32 119.26 120.77 1cfp h ALA 9 Ca 0.28 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1cfp h ALA 9 Cb -0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1cfp h ALA 9 CO -0.05 0.41 -0.04 -0.07 0.00 0.00 0.00 179.25 179.49 1cfp h LEU 10 N 0.59 0.31 -1.88 0.00 3.38 0.63 -0.22 115.31 118.11 1cfp h LEU 10 Ca 0.14 -0.37 0.26 0.00 0.09 0.00 0.00 57.88 58.00 1cfp h LEU 10 Cb 0.18 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1cfp h LEU 10 CO -0.01 0.61 0.75 0.16 0.09 0.00 0.00 178.44 180.04 1cfp h ILE 11 N 0.01 0.37 0.09 1.22 -0.00 -0.73 2.68 117.51 121.15 1cfp h ILE 11 Ca 0.04 0.00 -0.28 0.00 -0.00 0.00 0.00 64.86 64.62 1cfp h ILE 11 Cb 0.47 0.45 -0.01 0.00 -0.00 0.00 0.00 36.82 37.73 1cfp h ILE 11 CO 0.02 0.00 -1.35 -0.78 -0.00 0.00 0.00 178.15 176.04 1cfp h ASP 12 N 0.00 0.31 0.29 2.16 1.82 -1.08 -2.41 116.42 117.51 1cfp h ASP 12 Ca 0.43 -0.38 -0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1cfp h ASP 12 Cb 1.92 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 41.83 1cfp h ASP 12 CO -0.00 1.31 -0.14 0.58 -1.61 0.00 0.00 179.24 179.38 1cfp h VAL 13 N 0.05 0.00 -0.83 2.25 2.07 0.60 -2.73 116.25 117.67 1cfp h VAL 13 Ca -0.17 -0.38 0.12 0.00 0.82 0.00 0.00 66.70 67.09 1cfp h VAL 13 Cb 1.96 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1cfp h VAL 13 CO 0.17 0.00 0.54 0.15 0.02 0.00 0.00 177.57 178.44 1cfp h PHE 14 N -0.77 0.76 -0.69 1.57 3.57 0.31 0.22 116.94 121.91 1cfp h PHE 14 Ca -0.04 0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.62 1cfp h PHE 14 Cb 0.30 -0.24 -0.13 0.00 2.79 0.00 0.00 35.95 38.66 1cfp h PHE 14 CO 0.03 0.32 -0.17 1.25 -2.23 0.00 0.00 178.31 177.51 1cfp h HIS 15 N 0.68 -0.36 0.02 0.41 -0.00 -1.41 0.35 115.15 114.84 1cfp h HIS 15 Ca 0.40 0.06 -0.00 0.00 -0.00 0.00 0.00 60.37 60.83 1cfp h HIS 15 Cb 0.60 0.27 0.00 0.00 -0.00 0.00 0.00 27.41 28.28 1cfp h HIS 15 CO -0.00 -0.29 -0.01 1.96 -0.00 0.00 0.00 177.93 179.58 1cfp h GLN 16 N 0.00 -0.03 0.00 5.26 4.20 -0.51 -2.08 115.11 121.95 1cfp h GLN 16 Ca 0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.04 1cfp h GLN 16 Cb 0.50 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1cfp h GLN 16 CO -0.71 -0.02 0.00 0.66 -0.67 0.00 0.00 178.83 178.09 1cfp n TYR 17 N -2.31 0.00 0.70 2.96 4.01 0.51 0.28 117.16 123.31 1cfp n TYR 17 Ca -0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.80 1cfp n TYR 17 Cb 0.01 -0.32 0.34 0.00 -0.31 0.00 0.00 39.34 39.06 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 -2.29 0.00 -2.72 7.72 3.41 0.12 -3.39 113.62 116.47 1cfp n SER 18 Ca 0.00 -0.24 -0.09 0.00 -0.26 0.00 0.00 58.87 58.28 1cfp n SER 18 Cb 0.00 -0.08 0.07 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.26 1.53 0.01 5.00 0.00 0.20 -3.31 105.19 108.36 1cfp n GLY 19 Ca 0.08 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.23 1.82 0.00 1.61 1.85 0.81 -4.40 116.66 118.13 1cfp n ARG 20 Ca 0.05 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.91 1cfp n ARG 20 Cb 0.81 -1.05 0.00 0.00 -1.05 0.00 0.00 32.46 31.17 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 -2.33 0.00 0.00 2.89 0.00 -1.26 -5.07 120.64 114.86 1cfp n GLU 21 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.12 1cfp n GLU 21 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.00 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 3.32 5.24 3.53 8.31 0.00 -1.26 -5.09 105.19 119.24 1cfp n GLY 22 Ca 0.00 -1.53 0.03 0.00 0.00 0.00 0.00 46.02 44.53 1cfp n GLY 22 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cfp n ASP 23 N 0.00 -2.36 0.04 1.61 -0.08 -1.26 -4.53 116.55 109.97 1cfp n ASP 23 Ca 0.00 0.27 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 1cfp n ASP 23 Cb 0.00 -0.93 0.00 0.00 2.34 0.00 0.00 41.12 42.53 1cfp n ASP 23 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1cfp n LYS 24 N -1.20 0.00 -3.00 -0.67 4.81 -1.21 -4.81 118.16 112.09 1cfp n LYS 24 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 58.31 57.25 1cfp n LYS 24 Cb 0.11 -0.10 -0.02 0.00 0.02 0.00 0.00 35.03 35.04 1cfp n LYS 24 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1cfp n HIS 25 N -2.88 1.41 -4.01 5.64 8.25 -1.22 -3.91 115.22 118.50 1cfp n HIS 25 Ca 0.00 -3.63 -0.10 0.00 -0.26 0.00 0.00 57.72 53.72 1cfp n HIS 25 Cb 0.00 -0.40 -0.04 0.00 1.12 0.00 0.00 29.99 30.66 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 -2.85 1.70 -0.11 -0.41 3.01 -1.26 -4.13 119.74 115.68 1cfp s LYS 26 Ca 0.40 -1.40 -0.01 0.00 -1.01 0.00 0.00 55.97 53.95 1cfp s LYS 26 Cb 0.36 0.47 0.03 0.00 -1.01 0.00 0.00 37.83 37.68 1cfp s LYS 26 CO -0.08 -0.71 -0.04 -1.17 0.51 0.00 0.00 175.35 173.85 1cfp s LEU 27 N -3.08 1.05 0.55 3.17 1.98 0.62 -3.63 118.68 119.34 1cfp s LEU 27 Ca 0.24 -0.30 0.03 0.00 -2.89 0.00 0.00 54.13 51.21 1cfp s LEU 27 Cb -0.01 -0.71 0.05 0.00 0.66 0.00 0.00 46.19 46.18 1cfp s LEU 27 CO 0.12 -0.16 0.77 -0.75 -1.89 0.00 0.00 176.35 174.44 1cfp s LYS 28 N 1.79 2.45 0.10 1.98 2.20 -1.26 -0.85 119.74 126.16 1cfp s LYS 28 Ca 0.04 -1.00 -0.29 0.00 -0.36 0.00 0.00 55.97 54.37 1cfp s LYS 28 Cb -0.13 -2.53 -0.11 0.00 -1.51 0.00 0.00 37.83 33.55 1cfp s LYS 28 CO -0.07 -0.74 1.47 0.87 -0.36 0.00 0.00 175.35 176.51 1cfp h LYS 29 N 0.11 -0.43 -0.78 4.03 1.57 -1.76 1.17 116.57 120.48 1cfp h LYS 29 Ca -0.40 0.03 0.18 0.00 -1.87 0.00 0.00 60.65 58.59 1cfp h LYS 29 Cb 1.29 0.10 -0.14 0.00 0.08 0.00 0.00 32.23 33.56 1cfp h LYS 29 CO 0.48 -0.29 0.01 0.77 -0.57 0.00 0.00 179.45 179.85 1cfp h SER 30 N -0.45 -0.35 0.01 0.86 0.02 -1.95 0.11 113.55 111.80 1cfp h SER 30 Ca 0.04 0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1cfp h SER 30 Cb 0.56 0.35 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1cfp h SER 30 CO -0.42 -0.19 -0.01 -0.33 -1.14 0.00 0.00 176.83 174.74 1cfp h GLU 31 N 0.10 -0.02 -0.61 3.45 5.08 -1.41 -2.84 114.58 118.33 1cfp h GLU 31 Ca 0.43 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.91 1cfp h GLU 31 Cb 0.77 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.90 1cfp h GLU 31 CO -0.68 0.31 -0.24 1.25 -1.00 0.00 0.00 179.01 178.65 1cfp h LEU 32 N -0.35 -0.84 -0.42 1.33 5.85 0.33 0.21 115.31 121.42 1cfp h LEU 32 Ca -0.00 0.21 0.09 0.00 0.84 0.00 0.00 57.88 59.01 1cfp h LEU 32 Cb 0.34 0.47 -0.09 0.00 0.37 0.00 0.00 40.66 41.75 1cfp h LEU 32 CO 0.00 -0.26 -0.18 0.50 -0.34 0.00 0.00 178.44 178.16 1cfp h LYS 33 N -0.08 -0.09 -0.73 1.25 1.63 -0.79 0.78 116.57 118.54 1cfp h LYS 33 Ca 0.28 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.13 1cfp h LYS 33 Cb 0.51 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.11 1cfp h LYS 33 CO -0.67 -0.06 0.44 1.49 -3.45 0.00 0.00 179.45 177.20 1cfp h GLU 34 N -0.10 0.80 -0.79 1.90 4.81 -0.48 0.47 114.58 121.19 1cfp h GLU 34 Ca 0.21 -0.05 0.12 0.00 -0.13 0.00 0.00 59.36 59.51 1cfp h GLU 34 Cb 0.41 -0.18 -0.06 0.00 0.63 0.00 0.00 28.75 29.56 1cfp h GLU 34 CO -0.49 0.53 0.52 1.25 -0.73 0.00 0.00 179.01 180.09 1cfp h LEU 35 N 0.82 0.57 0.04 1.64 6.46 0.16 1.35 115.31 126.35 1cfp h LEU 35 Ca 0.31 0.02 -0.29 0.00 -0.12 0.00 0.00 57.88 57.81 1cfp h LEU 35 Cb 0.13 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 39.93 1cfp h LEU 35 CO -0.16 0.31 -1.59 0.40 -0.62 0.00 0.00 178.44 176.78 1cfp h ILE 36 N 0.62 1.02 0.01 4.05 5.03 -0.14 -3.21 117.51 124.88 1cfp h ILE 36 Ca 0.38 -2.79 -0.20 0.00 -0.12 0.00 0.00 64.86 62.13 1cfp h ILE 36 Cb 0.63 2.56 -0.02 0.00 -3.03 0.00 0.00 36.82 36.96 1cfp h ILE 36 CO -0.15 0.68 -0.90 0.78 -0.68 0.00 0.00 178.15 177.88 1cfp h ASN 37 N 0.02 0.15 1.10 1.72 4.21 0.95 1.15 115.58 124.89 1cfp h ASN 37 Ca -0.25 -0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.13 1cfp h ASN 37 Cb 1.98 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 39.13 1cfp h ASN 37 CO 0.10 0.97 0.00 0.59 -1.29 0.00 0.00 177.43 177.81 1cfp n ASN 38 N -3.58 0.33 -0.03 5.81 4.13 0.46 -3.30 115.26 119.06 1cfp n ASN 38 Ca -0.03 0.54 -0.05 0.00 1.68 0.00 0.00 54.58 56.72 1cfp n ASN 38 Cb 0.83 -0.62 -0.03 0.00 -1.54 0.00 0.00 39.78 38.42 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 -1.81 0.16 -3.26 3.52 0.28 -1.14 -4.83 120.64 113.56 1cfp n GLU 39 Ca 0.06 0.05 -0.30 0.00 -0.16 0.00 0.00 57.16 56.81 1cfp n GLU 39 Cb 0.35 -1.02 -0.06 0.00 1.43 0.00 0.00 31.44 32.14 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 -2.88 4.38 -0.30 -1.84 4.77 0.40 -4.92 117.00 116.61 1cfp n LEU 40 Ca -0.12 -5.46 0.01 0.00 -0.03 0.00 0.00 56.01 50.41 1cfp n LEU 40 Cb 0.62 -0.75 0.08 0.00 -2.33 0.00 0.00 43.42 41.04 1cfp n LEU 40 CO 0.05 2.06 0.66 -1.28 -1.33 0.00 0.00 177.39 177.55 1cfp h SER 41 N 4.14 -0.97 -0.89 -1.43 0.87 -1.69 0.52 113.55 114.09 1cfp h SER 41 Ca 0.20 0.26 0.24 0.00 -1.23 0.00 0.00 61.79 61.26 1cfp h SER 41 Cb 0.61 0.58 -0.15 0.00 -0.44 0.00 0.00 62.40 63.00 1cfp h SER 41 CO 0.92 -0.29 0.14 0.45 -0.53 0.00 0.00 176.83 177.52 1cfp h HIS 42 N -0.03 0.17 0.00 2.24 3.86 -1.91 2.08 115.15 121.57 1cfp h HIS 42 Ca 0.37 0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.63 1cfp h HIS 42 Cb 0.60 0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.14 1cfp h HIS 42 CO -0.70 -0.30 -0.01 0.74 0.86 0.00 0.00 177.93 178.52 1cfp h PHE 43 N 0.12 0.00 -1.24 2.45 0.04 -0.28 -1.85 116.94 116.18 1cfp h PHE 43 Ca 0.55 0.00 0.36 0.00 2.80 0.00 0.00 57.97 61.68 1cfp h PHE 43 Cb 1.13 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.23 1cfp h PHE 43 CO -0.36 0.01 0.98 1.25 -0.60 0.00 0.00 178.31 179.60 1cfp h LEU 44 N 0.00 0.00 0.01 1.54 5.85 0.36 1.70 115.31 124.76 1cfp h LEU 44 Ca -0.00 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.42 1cfp h LEU 44 Cb 0.12 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1cfp h LEU 44 CO 0.00 0.00 -1.74 -0.62 -0.34 0.00 0.00 178.44 175.74 1cfp n GLU 45 N -3.92 0.64 0.00 1.25 1.02 -0.70 -4.93 120.64 114.00 1cfp n GLU 45 Ca 0.27 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1cfp n GLU 45 Cb 1.38 -1.78 0.00 0.00 -0.02 0.00 0.00 31.44 31.02 1cfp n GLU 45 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1cfp n GLU 46 N -3.06 0.00 -0.67 3.49 4.07 0.58 -4.41 120.64 120.64 1cfp n GLU 46 Ca -0.18 0.00 0.50 0.00 -0.06 0.00 0.00 57.16 57.42 1cfp n GLU 46 Cb 1.05 0.00 0.77 0.00 -0.06 0.00 0.00 31.44 33.20 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 0.00 -0.00 -0.31 6.31 0.00 -1.26 0.80 119.36 124.90 1cfp n ILE 47 Ca 0.00 1.39 0.32 0.00 0.00 0.00 0.00 62.75 64.46 1cfp n ILE 47 Cb 0.00 -2.32 0.49 0.00 0.00 0.00 0.00 39.64 37.82 1cfp n ILE 47 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1cfp n LYS 48 N -3.79 0.01 -3.30 9.51 4.01 -1.26 -3.21 118.16 120.13 1cfp n LYS 48 Ca 0.42 0.99 -0.09 0.00 -0.51 0.00 0.00 58.31 59.12 1cfp n LYS 48 Cb 1.89 -2.44 -0.05 0.00 -0.51 0.00 0.00 35.03 33.92 1cfp n LYS 48 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1cfp s GLU 49 N -4.44 0.55 0.00 1.97 1.03 0.24 -5.07 118.70 112.98 1cfp s GLU 49 Ca -0.03 -0.18 0.00 0.00 0.03 0.00 0.00 54.97 54.79 1cfp s GLU 49 Cb 0.16 -0.33 0.00 0.00 -0.80 0.00 0.00 34.13 33.16 1cfp s GLU 49 CO 0.54 -1.10 0.81 1.04 -1.33 0.00 0.00 175.26 175.21 1cfp n GLN 50 N 4.91 0.00 -0.48 -4.83 1.13 -1.20 0.55 117.38 117.46 1cfp n GLN 50 Ca 0.05 0.57 0.41 0.00 -1.94 0.00 0.00 57.00 56.09 1cfp n GLN 50 Cb 0.50 -1.31 0.69 0.00 0.11 0.00 0.00 30.24 30.22 1cfp n GLN 50 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1cfp h GLU 51 N 0.00 0.01 -0.02 -1.09 4.81 -1.95 0.84 114.58 117.18 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 -0.61 0.28 -0.73 0.00 0.00 179.01 177.96 1cfp h VAL 52 N 0.01 1.41 -1.15 0.32 2.07 -1.54 -2.32 116.25 115.05 1cfp h VAL 52 Ca 0.89 -2.05 0.33 0.00 0.82 0.00 0.00 66.70 66.69 1cfp h VAL 52 Cb 2.87 2.53 -0.05 0.00 -1.52 0.00 0.00 31.29 35.12 1cfp h VAL 52 CO -0.46 0.60 0.90 0.58 0.02 0.00 0.00 177.57 179.21 1cfp h VAL 53 N -0.05 0.32 0.09 2.57 2.07 0.61 2.46 116.25 124.32 1cfp h VAL 53 Ca -0.07 0.00 -0.23 0.00 0.82 0.00 0.00 66.70 67.22 1cfp h VAL 53 Cb 1.31 0.36 0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1cfp h VAL 53 CO 0.12 0.00 -0.96 -0.78 0.02 0.00 0.00 177.57 175.97 1cfp h ASP 54 N 0.00 0.69 0.30 0.57 3.58 -1.11 -2.36 116.42 118.08 1cfp h ASP 54 Ca 0.55 -0.84 -0.01 0.00 0.42 0.00 0.00 57.03 57.14 1cfp h ASP 54 Cb 2.33 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 43.17 1cfp h ASP 54 CO -0.01 1.45 -0.14 0.11 -2.88 0.00 0.00 179.24 177.78 1cfp h LYS 55 N 0.01 -0.38 -0.72 0.28 6.56 0.41 0.72 116.57 123.45 1cfp h LYS 55 Ca -0.15 0.03 0.09 0.00 -1.06 0.00 0.00 60.65 59.56 1cfp h LYS 55 Cb 1.68 0.09 -0.11 0.00 -0.57 0.00 0.00 32.23 33.32 1cfp h LYS 55 CO 0.18 -0.26 -0.49 0.28 -2.06 0.00 0.00 179.45 177.11 1cfp h VAL 56 N -0.77 0.03 0.00 0.50 2.07 0.14 0.84 116.25 119.06 1cfp h VAL 56 Ca -0.04 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 1cfp h VAL 56 Cb 0.30 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1cfp h VAL 56 CO 0.07 0.00 -0.27 0.24 0.02 0.00 0.00 177.57 177.63 1cfp h MET 57 N -0.17 0.00 -0.13 1.57 2.86 -1.51 -2.85 114.93 114.71 1cfp h MET 57 Ca 0.18 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.85 1cfp h MET 57 Cb 0.53 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.16 1cfp h MET 57 CO -0.78 0.27 -0.06 1.49 1.06 0.00 0.00 176.91 178.88 1cfp h GLU 58 N 0.00 -0.05 -0.69 1.72 4.57 0.72 0.36 114.58 121.21 1cfp h GLU 58 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1cfp h GLU 58 Cb 0.48 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.04 1cfp h GLU 58 CO 0.03 -0.03 0.45 1.15 -1.18 0.00 0.00 179.01 179.43 1cfp h THR 59 N -0.05 1.18 -0.82 0.32 2.02 -0.99 1.98 112.91 116.55 1cfp h THR 59 Ca 0.07 -0.34 0.03 0.00 0.77 0.00 0.00 66.41 66.94 1cfp h THR 59 Cb 0.15 0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 66.70 1cfp h THR 59 CO -0.16 0.18 0.53 -0.07 0.37 0.00 0.00 175.52 176.36 1cfp h LEU 60 N 0.93 0.89 -1.58 2.58 3.38 -1.13 -0.24 115.31 120.14 1cfp h LEU 60 Ca 0.25 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1cfp h LEU 60 Cb -0.09 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1cfp h LEU 60 CO -0.05 0.62 0.00 -0.67 0.09 0.00 0.00 178.44 178.43 1cfp n ASP 61 N -4.56 2.35 0.00 -0.43 2.03 0.12 -4.11 116.55 111.95 1cfp n ASP 61 Ca 0.10 -1.87 0.06 0.00 0.52 0.00 0.00 54.79 53.59 1cfp n ASP 61 Cb 0.07 -0.21 0.35 0.00 -0.72 0.00 0.00 41.12 40.61 1cfp n ASP 61 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1cfp n SER 62 N 0.77 0.00 0.00 1.67 2.88 0.66 -4.85 113.62 114.75 1cfp n SER 62 Ca 0.17 -1.23 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 1cfp n SER 62 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 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 -0.73 0.00 0.00 -3.46 2.03 -1.26 -4.69 116.55 108.45 1cfp n ASP 63 Ca 0.09 0.00 0.11 0.00 0.52 0.00 0.00 54.79 55.51 1cfp n ASP 63 Cb 0.04 0.00 0.67 0.00 -0.72 0.00 0.00 41.12 41.11 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 0.00 -0.76 0.11 0.27 0.00 -1.26 -3.53 105.19 100.01 1cfp n GLY 64 Ca 0.00 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.96 1.87 -0.34 1.61 2.03 -1.25 -3.43 116.55 116.09 1cfp n ASP 65 Ca 0.17 0.43 0.30 0.00 0.52 0.00 0.00 54.79 56.21 1cfp n ASP 65 Cb 0.08 -0.91 0.56 0.00 -0.72 0.00 0.00 41.12 40.12 1cfp n ASP 65 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1cfp h GLY 66 N -1.00 2.12 -5.75 0.27 0.00 -1.75 0.61 103.07 97.57 1cfp h GLY 66 Ca -0.36 -0.17 -0.68 0.00 0.00 0.00 0.00 47.33 46.11 1cfp h GLY 66 CO -0.22 -0.67 0.07 -1.84 0.00 0.00 0.00 176.54 173.88 1cfp n GLU 67 N -5.14 4.14 -2.85 4.80 0.28 -1.26 -4.36 120.64 116.25 1cfp n GLU 67 Ca 0.36 -4.77 -0.43 0.00 -0.16 0.00 0.00 57.16 52.15 1cfp n GLU 67 Cb 1.21 -2.34 -0.02 0.00 1.43 0.00 0.00 31.44 31.73 1cfp n GLU 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1cfp s ASP 69 N 3.62 4.85 0.00 0.00 2.15 -1.26 0.23 116.67 126.25 1cfp s ASP 69 Ca 0.39 0.22 0.00 0.00 0.43 0.00 0.00 52.55 53.60 1cfp s ASP 69 Cb -0.03 -0.90 0.00 0.00 -0.30 0.00 0.00 42.92 41.69 1cfp s ASP 69 CO -0.05 -1.53 0.00 0.49 -0.17 0.00 0.00 175.17 173.91 1cfp n PHE 70 N -2.77 0.00 0.15 -5.34 3.72 -1.26 0.27 117.46 112.24 1cfp n PHE 70 Ca 0.09 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.52 1cfp n PHE 70 Cb 0.60 -0.05 0.12 0.00 -0.94 0.00 0.00 39.48 39.21 1cfp n PHE 70 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1cfp h GLN 71 N 0.00 0.00 -0.42 -1.08 -0.00 -1.97 -3.24 115.11 108.40 1cfp h GLN 71 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.57 1cfp h GLN 71 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.46 1cfp h GLN 71 CO 0.00 0.51 -0.06 0.93 -0.00 0.00 0.00 178.83 180.21 1cfp h GLU 72 N 0.00 0.71 0.59 0.06 5.08 0.36 0.01 114.58 121.38 1cfp h GLU 72 Ca -0.01 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.12 1cfp h GLU 72 Cb 1.25 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.43 1cfp h GLU 72 CO 0.07 0.76 -0.28 0.35 -1.00 0.00 0.00 179.01 178.91 1cfp h PHE 73 N 0.65 -0.73 -0.75 4.33 3.57 -1.55 0.47 116.94 122.94 1cfp h PHE 73 Ca 0.12 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.80 1cfp h PHE 73 Cb 0.49 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 1cfp h PHE 73 CO 0.02 -0.40 0.52 0.52 -2.23 0.00 0.00 178.31 176.75 1cfp h MET 74 N -1.05 0.13 0.50 1.11 2.86 -1.60 0.44 114.93 117.33 1cfp h MET 74 Ca -0.08 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1cfp h MET 74 Cb 0.66 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1cfp h MET 74 CO 0.13 0.09 -0.24 0.00 1.06 0.00 0.00 176.91 177.95 1cfp h ALA 75 N 1.64 -0.85 -0.30 6.32 0.00 -0.43 -2.49 119.26 123.14 1cfp h ALA 75 Ca 0.36 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1cfp h ALA 75 Cb 1.24 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1cfp h ALA 75 CO -0.05 -0.81 0.08 0.35 0.00 0.00 0.00 179.25 178.82 1cfp h PHE 76 N -0.91 0.50 -1.01 0.00 3.57 -0.36 -0.07 116.94 118.65 1cfp h PHE 76 Ca -0.07 -0.06 0.24 0.00 3.53 0.00 0.00 57.97 61.62 1cfp h PHE 76 Cb 0.52 -0.14 -0.12 0.00 2.79 0.00 0.00 35.95 39.00 1cfp h PHE 76 CO 0.04 0.53 0.61 -0.24 -2.23 0.00 0.00 178.31 177.02 1cfp h VAL 77 N 0.32 0.55 -0.17 1.41 3.04 -0.23 0.63 116.25 121.81 1cfp h VAL 77 Ca 0.10 -0.20 -0.07 0.00 -1.01 0.00 0.00 66.70 65.52 1cfp h VAL 77 Cb 0.28 -0.08 -0.00 0.00 -2.01 0.00 0.00 31.29 29.48 1cfp h VAL 77 CO 0.00 0.11 -0.16 0.00 -1.01 0.00 0.00 177.57 176.50 1cfp h ALA 78 N 1.71 0.24 -0.98 3.17 0.00 -0.91 -2.71 119.26 119.79 1cfp h ALA 78 Ca 0.63 -0.33 0.16 0.00 0.00 0.00 0.00 54.91 55.36 1cfp h ALA 78 Cb 1.23 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 1cfp h ALA 78 CO -0.45 0.14 0.59 1.98 0.00 0.00 0.00 179.25 181.51 1cfp h MET 79 N 0.05 0.80 0.05 0.00 -1.53 0.19 0.21 114.93 114.71 1cfp h MET 79 Ca 0.03 -0.05 -0.00 0.00 -3.44 0.00 0.00 59.70 56.24 1cfp h MET 79 Cb 0.70 -0.18 -0.00 0.00 -0.55 0.00 0.00 31.60 31.57 1cfp h MET 79 CO 0.04 0.53 -0.03 0.82 0.14 0.00 0.00 176.91 178.41 1cfp h ILE 80 N 0.83 0.00 -1.08 1.77 1.08 -0.16 0.43 117.51 120.38 1cfp h ILE 80 Ca 0.53 0.00 0.30 0.00 -0.39 0.00 0.00 64.86 65.30 1cfp h ILE 80 Cb 0.70 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.33 1cfp h ILE 80 CO -0.33 0.00 0.68 0.74 -0.69 0.00 0.00 178.15 178.55 1cfp h THR 81 N -0.08 0.41 -0.12 -0.27 2.02 -1.15 0.67 112.91 114.40 1cfp h THR 81 Ca -0.01 -0.12 -0.17 0.00 0.77 0.00 0.00 66.41 66.88 1cfp h THR 81 Cb 0.06 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 1cfp h THR 81 CO 0.01 0.06 -0.64 0.71 0.37 0.00 0.00 175.52 176.03 1cfp h THR 82 N 0.35 1.35 -0.09 3.16 1.35 -0.26 -2.56 112.91 116.21 1cfp h THR 82 Ca 0.67 -1.97 -0.23 0.00 -0.55 0.00 0.00 66.41 64.33 1cfp h THR 82 Cb 1.70 1.95 0.01 0.00 -1.73 0.00 0.00 68.15 70.08 1cfp h THR 82 CO -0.39 0.60 -0.84 0.00 -0.25 0.00 0.00 175.52 174.64 1cfp h ALA 83 N 0.97 0.34 -1.46 6.62 0.00 0.48 -2.90 119.26 123.30 1cfp h ALA 83 Ca -0.01 -0.63 0.42 0.00 0.00 0.00 0.00 54.91 54.69 1cfp h ALA 83 Cb 1.19 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1cfp h ALA 83 CO 0.11 0.71 1.20 0.00 0.00 0.00 0.00 179.25 181.28 1cfp n HIS 85 N -3.77 0.00 -2.62 0.00 -0.00 -1.16 -5.02 115.22 102.66 1cfp n HIS 85 Ca 0.32 0.00 -0.02 0.00 0.46 0.00 0.00 57.72 58.48 1cfp n HIS 85 Cb 1.65 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 31.49 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 0.00 0.02 0.00 1.57 4.07 -1.10 -5.00 120.64 120.19 1cfp n GLU 86 Ca 0.00 -0.41 0.00 0.00 -0.06 0.00 0.00 57.16 56.69 1cfp n GLU 86 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1cfp n GLU 86 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1cfp n PHE 87 N -0.40 0.00 -0.67 4.31 -0.00 -0.97 -4.73 117.46 115.00 1cfp n PHE 87 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.20 1cfp n PHE 87 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.07 1cfp n PHE 87 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1cfp n PHE 88 N 0.00 0.00 -0.00 -5.13 3.72 -1.26 -4.84 117.46 109.94 1cfp n PHE 88 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1cfp n PHE 88 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 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 1.02 -3.28 -1.08 2.13 -1.26 -4.90 120.64 113.27 1cfp n GLU 89 Ca 0.00 -0.37 -0.06 0.00 0.66 0.00 0.00 57.16 57.39 1cfp n GLU 89 Cb 0.00 -0.87 -0.05 0.00 0.27 0.00 0.00 31.44 30.79 1cfp n GLU 89 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 1cfp s HIS 90 N -0.25 -1.13 -1.08 4.31 -3.43 -1.26 -5.10 115.29 107.35 1cfp s HIS 90 Ca 0.00 0.76 0.09 0.00 -0.80 0.00 0.00 55.06 55.11 1cfp s HIS 90 Cb 0.00 0.05 0.07 0.00 -1.43 0.00 0.00 32.58 31.27 1cfp s HIS 90 CO 0.00 -0.90 0.77 -0.85 -2.00 0.00 0.00 174.74 171.77