#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ssl n SER 2 N 0.00 -2.32 -3.96 1.61 3.41 -1.26 -4.90 113.62 106.20 1ssl n SER 2 Ca 0.00 -1.12 0.00 0.00 -0.26 0.00 0.00 58.87 57.49 1ssl n SER 2 Cb 0.00 -2.25 0.00 0.00 -0.26 0.00 0.00 64.21 61.70 1ssl n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ssl n ALA 3 N -4.27 0.00 -0.05 7.33 0.00 -1.26 -4.13 120.51 118.13 1ssl n ALA 3 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1ssl n ALA 3 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1ssl n ALA 3 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1ssl n MET 4 N 0.00 0.00 0.00 0.00 0.00 -1.26 -4.87 117.12 110.99 1ssl n MET 4 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1ssl n MET 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1ssl n MET 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ssl n GLY 5 N 0.00 0.03 0.20 -5.12 0.00 -1.26 -4.68 105.19 94.36 1ssl n GLY 5 Ca 0.00 -2.29 0.15 0.00 0.00 0.00 0.00 46.02 43.88 1ssl n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ssl h ARG 7 N 0.99 0.00 0.00 0.00 3.08 -1.83 0.14 114.38 116.76 1ssl h ARG 7 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 1ssl h ARG 7 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1ssl h ARG 7 CO 0.00 0.00 -0.35 1.25 -1.07 0.00 0.00 179.97 179.80 1ssl h HIS 8 N 0.00 0.00 -3.29 3.04 -0.00 -1.90 -3.46 115.15 109.53 1ssl h HIS 8 Ca 0.03 0.00 -0.55 0.00 -0.00 0.00 0.00 60.37 59.85 1ssl h HIS 8 Cb 0.14 0.00 0.20 0.00 -0.00 0.00 0.00 27.41 27.75 1ssl h HIS 8 CO 0.00 0.35 -0.48 1.19 -0.00 0.00 0.00 177.93 178.99 1ssl n PHE 9 N -3.24 -1.11 0.00 5.26 3.01 0.49 -4.97 117.46 116.91 1ssl n PHE 9 Ca 0.02 0.30 0.00 0.00 1.01 0.00 0.00 57.45 58.77 1ssl n PHE 9 Cb 0.63 -1.86 0.00 0.00 -0.01 0.00 0.00 39.48 38.24 1ssl n PHE 9 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1ssl n GLN 10 N -1.11 0.00 -1.19 -1.08 1.13 -1.26 -4.99 117.38 108.87 1ssl n GLN 10 Ca 0.08 0.26 -0.01 0.00 -1.94 0.00 0.00 57.00 55.40 1ssl n GLN 10 Cb 0.52 -0.76 0.00 0.00 0.11 0.00 0.00 30.24 30.11 1ssl n GLN 10 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1ssl n SER 11 N -1.34 0.27 0.04 1.08 7.64 -1.26 -4.90 113.62 115.15 1ssl n SER 11 Ca 0.00 -1.09 0.10 0.00 1.01 0.00 0.00 58.87 58.89 1ssl n SER 11 Cb 0.00 -0.02 0.43 0.00 -1.01 0.00 0.00 64.21 63.61 1ssl n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ssl h SER 13 N 0.00 -1.56 0.73 0.00 0.87 -1.93 -2.42 113.55 109.24 1ssl h SER 13 Ca 0.00 0.18 -0.19 0.00 -1.23 0.00 0.00 61.79 60.55 1ssl h SER 13 Cb 0.39 0.60 -0.02 0.00 -0.44 0.00 0.00 62.40 62.94 1ssl h SER 13 CO 0.00 -0.45 -0.89 -0.61 -0.53 0.00 0.00 176.83 174.34 1ssl h GLN 14 N -0.56 0.10 -1.10 2.24 5.75 -1.97 -2.14 115.11 117.43 1ssl h GLN 14 Ca 0.02 -0.12 0.30 0.00 -0.15 0.00 0.00 58.65 58.71 1ssl h GLN 14 Cb 0.63 0.04 -0.09 0.00 1.07 0.00 0.00 27.48 29.13 1ssl h GLN 14 CO -0.38 0.92 0.72 0.00 -2.65 0.00 0.00 178.83 177.45 1ssl n LEU 16 N -4.57 0.31 0.06 0.00 4.32 -0.97 -4.48 117.00 111.67 1ssl n LEU 16 Ca 0.27 -0.35 0.13 0.00 -0.02 0.00 0.00 56.01 56.04 1ssl n LEU 16 Cb 1.01 0.00 0.49 0.00 -1.62 0.00 0.00 43.42 43.30 1ssl n LEU 16 CO 0.27 0.08 0.91 -0.24 -1.22 0.00 0.00 177.39 177.18 1ssl n SER 17 N -1.41 0.48 -3.12 -1.43 2.88 -0.55 -4.16 113.62 106.31 1ssl n SER 17 Ca 0.01 0.55 -0.19 0.00 -1.33 0.00 0.00 58.87 57.90 1ssl n SER 17 Cb 0.18 -0.68 -0.03 0.00 -0.75 0.00 0.00 64.21 62.93 1ssl n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ssl n ALA 18 N -1.67 1.72 0.13 -1.46 0.00 -0.93 -4.94 120.51 113.36 1ssl n ALA 18 Ca 0.06 -3.09 -0.01 0.00 0.00 0.00 0.00 53.44 50.40 1ssl n ALA 18 Cb 0.38 -0.92 0.13 0.00 0.00 0.00 0.00 19.45 19.04 1ssl n ALA 18 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ssl h PRO 19 N 3.58 0.00 0.00 0.00 0.13 -1.79 -3.15 132.00 130.77 1ssl h PRO 19 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1ssl h PRO 19 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1ssl h PRO 19 CO 0.44 0.63 0.00 -0.35 -0.23 0.00 0.00 178.00 178.50 1ssl n PRO 20 N -3.59 0.09 -0.18 1.56 -0.04 -1.26 -2.73 135.00 128.84 1ssl n PRO 20 Ca -0.00 0.22 0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1ssl n PRO 20 Cb 0.67 -1.63 0.14 0.00 -0.04 0.00 0.00 33.50 32.64 1ssl n PRO 20 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1ssl n PHE 21 N -1.79 0.38 -4.14 0.54 3.72 -1.19 -5.03 117.46 109.96 1ssl n PHE 21 Ca 0.04 -0.68 -0.12 0.00 -0.05 0.00 0.00 57.45 56.64 1ssl n PHE 21 Cb 0.27 -0.13 -0.08 0.00 -0.94 0.00 0.00 39.48 38.60 1ssl n PHE 21 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1ssl s VAL 22 N -1.79 0.00 0.00 -4.37 -7.23 -1.11 -4.58 120.40 101.32 1ssl s VAL 22 Ca 0.24 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 1ssl s VAL 22 Cb 0.17 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.69 1ssl s VAL 22 CO 0.08 0.00 0.00 1.67 -0.31 0.00 0.00 175.10 176.54 1ssl n GLN 23 N -0.35 2.06 -1.55 4.82 -0.06 -1.26 -4.87 117.38 116.17 1ssl n GLN 23 Ca 0.01 0.00 -0.29 0.00 -2.00 0.00 0.00 57.00 54.72 1ssl n GLN 23 Cb 0.64 -0.83 0.15 0.00 -4.06 0.00 0.00 30.24 26.14 1ssl n GLN 23 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1ssl n GLY 25 N -2.30 1.99 3.80 0.00 0.00 0.11 -4.75 105.19 104.03 1ssl n GLY 25 Ca 0.08 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 1ssl n GLY 25 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1ssl s TRP 26 N -3.21 3.80 -0.30 1.61 -0.11 0.87 0.27 118.94 121.87 1ssl s TRP 26 Ca 0.22 1.30 -0.02 0.00 1.22 0.00 0.00 56.10 58.82 1ssl s TRP 26 Cb -0.02 -2.53 0.10 0.00 -1.50 0.00 0.00 33.47 29.53 1ssl s TRP 26 CO 0.16 0.56 0.12 0.00 -4.62 0.00 0.00 176.95 173.17 1ssl n HIS 28 N 5.01 -0.87 0.00 0.00 -0.00 -1.26 -3.95 115.22 114.15 1ssl n HIS 28 Ca -0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.15 1ssl n HIS 28 Cb 0.42 -1.41 0.00 0.00 -0.12 0.00 0.00 29.99 28.88 1ssl n HIS 28 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1ssl n ASP 29 N 0.55 0.00 -4.46 0.26 5.68 -1.26 -5.15 116.55 112.17 1ssl n ASP 29 Ca -0.03 0.00 -0.23 0.00 -0.50 0.00 0.00 54.79 54.02 1ssl n ASP 29 Cb 0.12 0.00 0.12 0.00 -1.14 0.00 0.00 41.12 40.23 1ssl n ASP 29 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1ssl n LYS 30 N 0.00 -0.19 -2.75 0.11 2.85 -1.25 -5.02 118.16 111.91 1ssl n LYS 30 Ca 0.00 -2.63 -0.43 0.00 -1.05 0.00 0.00 58.31 54.20 1ssl n LYS 30 Cb 0.00 -0.70 -0.04 0.00 -0.65 0.00 0.00 35.03 33.64 1ssl n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ssl s VAL 32 N 4.27 0.00 0.44 0.00 -7.23 0.77 -4.60 120.40 114.04 1ssl s VAL 32 Ca 0.35 -1.60 0.06 0.00 -1.81 0.00 0.00 61.98 58.98 1ssl s VAL 32 Cb -0.11 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.29 1ssl s VAL 32 CO 0.22 0.00 0.09 -0.60 -0.31 0.00 0.00 175.10 174.50 1ssl s ARG 33 N -3.50 2.11 0.41 4.82 3.52 -1.26 -0.72 118.95 124.34 1ssl s ARG 33 Ca 0.29 -2.07 0.27 0.00 -0.13 0.00 0.00 55.73 54.09 1ssl s ARG 33 Cb 0.01 -1.76 1.43 0.00 -1.56 0.00 0.00 34.95 33.06 1ssl s ARG 33 CO 0.16 -0.17 1.58 0.77 -0.81 0.00 0.00 175.30 176.83 1ssl h SER 34 N 1.51 0.26 -0.55 -2.12 0.02 -1.92 0.97 113.55 111.71 1ssl h SER 34 Ca -0.43 0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 1ssl h SER 34 Cb 1.26 0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.99 1ssl h SER 34 CO 0.75 -0.35 0.12 -0.08 -1.14 0.00 0.00 176.83 176.13 1ssl h GLU 35 N 0.00 0.93 -0.01 3.45 4.81 -1.98 -2.79 114.58 118.99 1ssl h GLU 35 Ca 0.87 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.89 1ssl h GLU 35 Cb 2.56 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.81 1ssl h GLU 35 CO -0.62 0.84 -0.41 0.39 -0.73 0.00 0.00 179.01 178.49 1ssl n GLU 36 N -4.25 1.07 -2.16 1.92 -0.58 0.30 -4.87 120.64 112.08 1ssl n GLU 36 Ca 0.04 -0.82 -0.43 0.00 -0.42 0.00 0.00 57.16 55.54 1ssl n GLU 36 Cb 0.25 -1.48 -0.02 0.00 -0.57 0.00 0.00 31.44 29.61 1ssl n GLU 36 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ssl h LEU 38 N 12.64 -0.89 0.00 0.00 7.12 -1.89 -3.41 115.31 128.87 1ssl h LEU 38 Ca -0.31 0.15 0.00 0.00 0.13 0.00 0.00 57.88 57.84 1ssl h LEU 38 Cb 1.14 0.40 0.00 0.00 -0.53 0.00 0.00 40.66 41.67 1ssl h LEU 38 CO 1.04 -0.31 0.00 -1.20 -0.13 0.00 0.00 178.44 177.84 1ssl n SER 39 N -5.39 0.00 -0.93 1.25 7.64 -1.26 -4.97 113.62 109.96 1ssl n SER 39 Ca -0.01 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.91 1ssl n SER 39 Cb 0.31 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.66 1ssl n SER 39 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ssl n GLY 40 N 2.77 3.91 3.22 0.23 0.00 -1.26 -5.05 105.19 109.02 1ssl n GLY 40 Ca 0.00 -1.21 -0.16 0.00 0.00 0.00 0.00 46.02 44.65 1ssl n GLY 40 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ssl s THR 41 N -2.32 1.17 -0.08 2.61 -1.32 -1.26 -5.14 115.64 109.29 1ssl s THR 41 Ca 0.37 -1.77 -0.09 0.00 -1.21 0.00 0.00 61.69 59.00 1ssl s THR 41 Cb 0.38 -1.54 0.02 0.00 -1.51 0.00 0.00 72.50 69.85 1ssl s THR 41 CO -0.10 -0.54 0.24 0.86 -2.21 0.00 0.00 174.62 172.87 1ssl s TRP 42 N -2.50 -0.25 0.12 9.09 -0.00 -1.26 -4.83 118.94 119.32 1ssl s TRP 42 Ca 0.09 0.59 0.04 0.00 -0.00 0.00 0.00 56.10 56.83 1ssl s TRP 42 Cb -0.03 0.08 -0.04 0.00 -0.00 0.00 0.00 33.47 33.49 1ssl s TRP 42 CO 0.02 -0.14 -0.10 -0.08 -0.00 0.00 0.00 176.95 176.64 1ssl s THR 43 N 0.01 1.01 -0.15 5.86 -1.32 -0.45 -5.03 115.64 115.57 1ssl s THR 43 Ca -0.01 -1.84 0.24 0.00 -1.21 0.00 0.00 61.69 58.87 1ssl s THR 43 Cb -0.02 -1.59 0.47 0.00 -1.51 0.00 0.00 72.50 69.85 1ssl s THR 43 CO 0.01 -0.67 1.14 0.00 -2.21 0.00 0.00 174.62 172.89 1ssl n GLN 44 N 0.19 1.02 -3.33 7.08 -0.00 -1.26 -0.09 117.38 121.00 1ssl n GLN 44 Ca -0.13 -2.88 -0.08 0.00 -0.00 0.00 0.00 57.00 53.90 1ssl n GLN 44 Cb 0.59 -0.94 -0.07 0.00 -0.00 0.00 0.00 30.24 29.82 1ssl n GLN 44 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 1ssl s GLN 45 N -2.19 0.38 0.00 2.61 0.74 -1.26 -4.90 119.66 115.03 1ssl s GLN 45 Ca 0.30 0.43 0.00 0.00 0.05 0.00 0.00 55.36 56.15 1ssl s GLN 45 Cb 0.35 -0.37 0.00 0.00 1.10 0.00 0.00 33.01 34.09 1ssl s GLN 45 CO -0.09 -0.76 0.00 1.51 -0.55 0.00 0.00 175.29 175.40 1ssl n ILE 46 N 5.36 0.00 -4.83 -2.34 0.13 -1.26 -5.12 119.36 111.31 1ssl n ILE 46 Ca -0.02 0.00 -0.25 0.00 -1.10 0.00 0.00 62.75 61.38 1ssl n ILE 46 Cb 0.50 -0.14 -0.15 0.00 -0.84 0.00 0.00 39.64 39.00 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35