#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 0.00 -3.14 1.61 7.64 -1.26 -5.07 113.62 113.41 1ssl n SER 2 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1ssl n SER 2 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1ssl n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ssl n ALA 3 N -3.00 -2.41 0.24 -0.43 0.00 -1.26 -4.80 120.51 108.84 1ssl n ALA 3 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 53.44 53.71 1ssl n ALA 3 Cb 0.00 -1.12 0.19 0.00 0.00 0.00 0.00 19.45 18.52 1ssl n ALA 3 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ssl n MET 4 N 0.81 2.70 0.00 0.00 2.81 -1.26 -4.92 117.12 117.25 1ssl n MET 4 Ca -0.01 -1.52 0.00 0.00 -1.81 0.00 0.00 57.70 54.36 1ssl n MET 4 Cb 0.43 -1.74 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1ssl n MET 4 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ssl n GLY 5 N 0.50 4.21 0.49 3.03 0.00 -1.26 -4.75 105.19 107.41 1ssl n GLY 5 Ca 0.14 -1.05 0.27 0.00 0.00 0.00 0.00 46.02 45.38 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 0.00 0.00 -0.01 0.00 3.08 -1.89 -2.51 114.38 113.05 1ssl h ARG 7 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1ssl h ARG 7 Cb 2.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.34 1ssl h ARG 7 CO -0.00 0.00 -0.59 1.58 -1.07 0.00 0.00 179.97 179.88 1ssl n HIS 8 N -2.47 0.00 -1.94 3.04 -0.00 0.71 -4.97 115.22 109.60 1ssl n HIS 8 Ca 0.02 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.32 1ssl n HIS 8 Cb 0.25 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.22 1ssl n HIS 8 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1ssl s PHE 9 N -2.39 2.88 0.00 1.57 0.40 -0.95 -4.94 117.98 114.55 1ssl s PHE 9 Ca 0.12 1.08 0.00 0.00 -0.60 0.00 0.00 56.93 57.53 1ssl s PHE 9 Cb 0.15 -3.89 0.00 0.00 0.51 0.00 0.00 43.02 39.79 1ssl s PHE 9 CO 0.59 -2.77 0.06 1.04 0.70 0.00 0.00 175.22 174.84 1ssl n GLN 10 N 1.62 0.00 0.00 0.44 1.13 -1.26 -4.92 117.38 114.39 1ssl n GLN 10 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 1ssl n GLN 10 Cb 0.40 -0.36 0.00 0.00 0.11 0.00 0.00 30.24 30.39 1ssl n GLN 10 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1ssl n SER 11 N -0.13 -0.21 -0.50 1.08 2.88 -1.26 -4.90 113.62 110.58 1ssl n SER 11 Ca 0.00 -0.17 0.12 0.00 -1.33 0.00 0.00 58.87 57.49 1ssl n SER 11 Cb 0.00 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 63.57 1ssl n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ssl h SER 13 N 2.48 -1.32 -0.02 0.00 0.87 -1.87 -2.34 113.55 111.35 1ssl h SER 13 Ca 0.00 0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.57 1ssl h SER 13 Cb 0.73 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 63.08 1ssl h SER 13 CO 0.00 -0.73 -0.19 -0.61 -0.53 0.00 0.00 176.83 174.77 1ssl h GLN 14 N -1.14 0.38 -1.00 2.24 5.75 -1.88 0.13 115.11 119.59 1ssl h GLN 14 Ca -0.09 -0.12 0.21 0.00 -0.15 0.00 0.00 58.65 58.50 1ssl h GLN 14 Cb 0.94 -0.04 -0.10 0.00 1.07 0.00 0.00 27.48 29.35 1ssl h GLN 14 CO 0.04 0.56 0.62 0.00 -2.65 0.00 0.00 178.83 177.39 1ssl n LEU 16 N -4.72 1.32 0.03 0.00 4.32 -0.92 -4.38 117.00 112.64 1ssl n LEU 16 Ca 0.23 -0.78 0.12 0.00 -0.02 0.00 0.00 56.01 55.56 1ssl n LEU 16 Cb 0.65 0.00 0.16 0.00 -1.62 0.00 0.00 43.42 42.61 1ssl n LEU 16 CO 0.23 0.26 0.29 -1.20 -1.22 0.00 0.00 177.39 175.75 1ssl n SER 17 N -0.18 0.61 -3.10 -1.43 7.64 0.41 -4.41 113.62 113.17 1ssl n SER 17 Ca 0.05 -0.10 -0.16 0.00 1.01 0.00 0.00 58.87 59.66 1ssl n SER 17 Cb 0.23 0.36 -0.01 0.00 -1.01 0.00 0.00 64.21 63.79 1ssl n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ssl n ALA 18 N -1.71 1.44 0.13 -0.43 0.00 -0.64 -4.94 120.51 114.36 1ssl n ALA 18 Ca 0.04 -3.00 -0.00 0.00 0.00 0.00 0.00 53.44 50.48 1ssl n ALA 18 Cb 0.40 -0.97 0.13 0.00 0.00 0.00 0.00 19.45 19.00 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 3.07 0.00 0.00 0.00 0.13 -1.77 -3.25 132.00 130.18 1ssl h PRO 19 Ca 0.06 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.10 1ssl h PRO 19 Cb 0.99 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1ssl h PRO 19 CO 0.42 0.63 -0.39 -1.00 -0.23 0.00 0.00 178.00 177.43 1ssl h PRO 20 N 0.00 0.00 -0.60 1.56 0.13 -1.96 -2.96 132.00 128.17 1ssl h PRO 20 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1ssl h PRO 20 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1ssl h PRO 20 CO 0.08 0.39 0.00 1.19 -0.23 0.00 0.00 178.00 179.44 1ssl n PHE 21 N -3.49 2.00 -4.11 1.56 3.72 -1.23 -4.95 117.46 110.95 1ssl n PHE 21 Ca 0.00 -0.69 -0.15 0.00 -0.05 0.00 0.00 57.45 56.56 1ssl n PHE 21 Cb 0.54 -0.50 -0.04 0.00 -0.94 0.00 0.00 39.48 38.54 1ssl n PHE 21 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1ssl n VAL 22 N 0.60 0.00 -1.95 -4.37 0.24 -1.12 -4.70 118.33 107.03 1ssl n VAL 22 Ca 0.27 -1.86 0.00 0.00 -2.04 0.00 0.00 64.34 60.71 1ssl n VAL 22 Cb 1.16 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 34.58 1ssl n VAL 22 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1ssl n GLN 23 N -0.55 0.03 -4.45 7.34 7.27 -1.26 -4.95 117.38 120.82 1ssl n GLN 23 Ca 0.03 -1.02 -0.23 0.00 0.07 0.00 0.00 57.00 55.84 1ssl n GLN 23 Cb 0.54 -0.52 -0.10 0.00 2.41 0.00 0.00 30.24 32.57 1ssl n GLN 23 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ssl n GLY 25 N -0.55 3.06 3.84 0.00 0.00 -0.00 -4.87 105.19 106.66 1ssl n GLY 25 Ca -0.06 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.72 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 -3.18 3.62 -0.30 1.61 -0.11 0.44 0.29 118.94 121.31 1ssl s TRP 26 Ca 0.34 1.15 -0.03 0.00 1.22 0.00 0.00 56.10 58.78 1ssl s TRP 26 Cb 0.02 -2.44 0.11 0.00 -1.50 0.00 0.00 33.47 29.66 1ssl s TRP 26 CO 0.24 0.40 0.16 0.00 -4.62 0.00 0.00 176.95 173.14 1ssl n HIS 28 N 5.05 0.00 0.00 0.00 8.25 -1.26 -3.23 115.22 124.03 1ssl n HIS 28 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1ssl n HIS 28 Cb 0.42 -0.96 0.00 0.00 1.12 0.00 0.00 29.99 30.57 1ssl n HIS 28 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1ssl n ASP 29 N 0.00 0.00 -4.98 0.41 5.75 -1.26 -5.15 116.55 111.33 1ssl n ASP 29 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 54.79 54.59 1ssl n ASP 29 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 1ssl n ASP 29 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1ssl s LYS 30 N 0.00 3.04 -0.52 0.11 2.20 -1.20 -5.00 119.74 118.36 1ssl s LYS 30 Ca 0.00 -1.08 -0.20 0.00 -0.36 0.00 0.00 55.97 54.34 1ssl s LYS 30 Cb 0.00 -2.77 0.06 0.00 -1.51 0.00 0.00 37.83 33.61 1ssl s LYS 30 CO 0.00 0.03 0.66 0.00 -0.36 0.00 0.00 175.35 175.68 1ssl s VAL 32 N 2.76 0.00 0.37 0.00 -7.23 0.85 -4.71 120.40 112.44 1ssl s VAL 32 Ca 0.16 -1.64 0.08 0.00 -1.81 0.00 0.00 61.98 58.76 1ssl s VAL 32 Cb -0.19 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 1ssl s VAL 32 CO 0.12 0.00 0.16 -0.60 -0.31 0.00 0.00 175.10 174.47 1ssl s ARG 33 N -3.82 2.31 0.16 4.82 3.52 -1.26 -0.82 118.95 123.85 1ssl s ARG 33 Ca 0.30 -1.66 -0.18 0.00 -0.13 0.00 0.00 55.73 54.06 1ssl s ARG 33 Cb 0.02 -2.10 0.10 0.00 -1.56 0.00 0.00 34.95 31.40 1ssl s ARG 33 CO 0.13 0.02 1.21 0.45 -0.81 0.00 0.00 175.30 176.30 1ssl n SER 34 N -1.19 -0.62 0.24 -2.12 2.88 -1.26 0.24 113.62 111.79 1ssl n SER 34 Ca -0.02 1.38 0.14 0.00 -1.33 0.00 0.00 58.87 59.04 1ssl n SER 34 Cb 0.62 -0.27 0.78 0.00 -0.75 0.00 0.00 64.21 64.59 1ssl n SER 34 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1ssl h GLU 35 N 0.00 0.00 -0.00 -1.46 5.08 -1.96 -1.70 114.58 114.53 1ssl h GLU 35 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1ssl h GLU 35 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1ssl h GLU 35 CO -0.76 0.00 -0.07 0.39 -1.00 0.00 0.00 179.01 177.57 1ssl n GLU 36 N -2.56 2.49 -2.36 2.33 1.02 0.67 -5.02 120.64 117.22 1ssl n GLU 36 Ca -0.02 -0.38 -0.39 0.00 -0.02 0.00 0.00 57.16 56.34 1ssl n GLU 36 Cb 0.14 -0.88 -0.03 0.00 -0.02 0.00 0.00 31.44 30.65 1ssl n GLU 36 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ssl h LEU 38 N 3.21 -1.39-10.56 0.00 -0.00 -1.88 -3.44 115.31 101.25 1ssl h LEU 38 Ca -0.48 0.11 -0.46 0.00 -0.00 0.00 0.00 57.88 57.05 1ssl h LEU 38 Cb 1.22 0.45 0.03 0.00 -0.00 0.00 0.00 40.66 42.37 1ssl h LEU 38 CO 0.65 -0.69 -0.14 -0.55 -0.00 0.00 0.00 178.44 177.71 1ssl s SER 39 N -4.33 5.27 -0.70 -0.43 0.15 -1.26 -4.94 113.70 107.45 1ssl s SER 39 Ca -0.18 -0.58 -0.06 0.00 0.70 0.00 0.00 55.95 55.83 1ssl s SER 39 Cb 0.04 -0.19 -0.10 0.00 -1.71 0.00 0.00 66.02 64.06 1ssl s SER 39 CO 0.60 -1.15 2.43 0.61 1.20 0.00 0.00 173.24 176.93 1ssl n GLY 40 N -2.15 3.02 2.93 9.45 0.00 -1.26 -4.79 105.19 112.39 1ssl n GLY 40 Ca 0.12 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 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 2.58 0.13 -0.13 2.61 -1.32 -1.26 -5.15 115.64 113.10 1ssl s THR 41 Ca 0.46 -0.37 -0.08 0.00 -1.21 0.00 0.00 61.69 60.50 1ssl s THR 41 Cb 0.15 -0.17 0.04 0.00 -1.51 0.00 0.00 72.50 71.02 1ssl s THR 41 CO -0.03 -0.15 0.31 0.86 -2.21 0.00 0.00 174.62 173.40 1ssl s TRP 42 N -0.53 -0.40 0.04 9.09 -0.00 -1.26 -4.75 118.94 121.12 1ssl s TRP 42 Ca -0.05 0.93 0.06 0.00 -0.00 0.00 0.00 56.10 57.04 1ssl s TRP 42 Cb -0.04 0.13 -0.02 0.00 -0.00 0.00 0.00 33.47 33.54 1ssl s TRP 42 CO -0.00 -0.24 -0.17 -0.08 -0.00 0.00 0.00 176.95 176.46 1ssl s THR 43 N 0.95 1.34 -0.08 5.86 -1.32 -0.45 -5.01 115.64 116.93 1ssl s THR 43 Ca -0.06 -1.05 0.12 0.00 -1.21 0.00 0.00 61.69 59.48 1ssl s THR 43 Cb -0.07 -1.18 0.18 0.00 -1.51 0.00 0.00 72.50 69.91 1ssl s THR 43 CO -0.07 0.11 1.07 1.67 -2.21 0.00 0.00 174.62 175.19 1ssl n GLN 44 N 1.95 1.24 -3.26 7.08 0.00 -1.26 -0.42 117.38 122.70 1ssl n GLN 44 Ca -0.17 -2.02 -0.05 0.00 -0.00 0.00 0.00 57.00 54.76 1ssl n GLN 44 Cb 0.54 -1.19 -0.05 0.00 0.00 0.00 0.00 30.24 29.55 1ssl n GLN 44 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 1ssl s GLN 45 N -1.91 0.45 0.00 3.69 -0.21 -1.26 -4.80 119.66 115.62 1ssl s GLN 45 Ca 0.19 0.43 0.00 0.00 0.02 0.00 0.00 55.36 56.01 1ssl s GLN 45 Cb 0.17 -0.12 0.00 0.00 1.00 0.00 0.00 33.01 34.06 1ssl s GLN 45 CO 0.02 -0.88 0.00 1.51 -2.12 0.00 0.00 175.29 173.82 1ssl n ILE 46 N 5.38 0.00 -4.20 1.08 3.06 -1.26 -5.14 119.36 118.28 1ssl n ILE 46 Ca 0.00 0.00 -0.12 0.00 -2.50 0.00 0.00 62.75 60.13 1ssl n ILE 46 Cb 0.51 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.59 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05