#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 0.38 -4.42 1.61 7.64 -1.26 -5.00 113.62 112.58 1ssl n SER 2 Ca 0.00 0.08 -0.59 0.00 1.01 0.00 0.00 58.87 59.38 1ssl n SER 2 Cb 0.00 -0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 63.01 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 -3.16 0.17 -2.58 -0.43 0.00 -1.26 -4.82 120.51 108.43 1ssl n ALA 3 Ca 0.00 0.19 -0.30 0.00 0.00 0.00 0.00 53.44 53.33 1ssl n ALA 3 Cb 0.25 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.51 1ssl n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ssl n MET 4 N 6.96 3.51 -0.07 0.00 -0.00 -1.26 -4.74 117.12 121.51 1ssl n MET 4 Ca 0.45 -4.51 -0.10 0.00 -0.00 0.00 0.00 57.70 53.54 1ssl n MET 4 Cb 0.04 -2.27 -0.03 0.00 -0.00 0.00 0.00 33.22 30.95 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 -0.36 -0.45 0.08 3.17 0.00 -1.26 -3.74 105.19 102.62 1ssl n GLY 5 Ca 0.39 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 1ssl n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ssl n ARG 7 N -5.15 0.15 0.05 0.00 3.00 -1.26 -2.06 116.66 111.39 1ssl n ARG 7 Ca -0.05 0.40 0.11 0.00 -0.01 0.00 0.00 57.85 58.30 1ssl n ARG 7 Cb 0.08 -1.79 -0.06 0.00 0.00 0.00 0.00 32.46 30.69 1ssl n ARG 7 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 1ssl n HIS 8 N -2.07 0.52 -1.84 -1.55 -0.00 -0.06 -4.93 115.22 105.28 1ssl n HIS 8 Ca 0.02 0.15 -0.34 0.00 0.46 0.00 0.00 57.72 58.01 1ssl n HIS 8 Cb 0.20 -0.71 0.04 0.00 -0.12 0.00 0.00 29.99 29.40 1ssl n HIS 8 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 1ssl s PHE 9 N -3.39 2.50 0.00 1.57 0.08 0.83 -5.00 117.98 114.57 1ssl s PHE 9 Ca -0.02 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.58 1ssl s PHE 9 Cb 0.12 -3.29 0.00 0.00 -0.57 0.00 0.00 43.02 39.28 1ssl s PHE 9 CO 0.83 -1.89 0.30 1.04 -0.10 0.00 0.00 175.22 175.41 1ssl n GLN 10 N -2.12 0.00 0.00 0.44 1.13 -1.26 -4.96 117.38 110.61 1ssl n GLN 10 Ca 0.12 0.18 0.00 0.00 -1.94 0.00 0.00 57.00 55.35 1ssl n GLN 10 Cb 0.51 -0.90 0.00 0.00 0.11 0.00 0.00 30.24 29.96 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 -1.03 0.00 0.00 1.08 2.88 -1.26 -4.86 113.62 110.44 1ssl n SER 11 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1ssl n SER 11 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 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 0.00 -1.67 0.73 0.00 4.64 -1.91 -0.80 113.55 114.55 1ssl h SER 13 Ca 0.00 0.19 -0.22 0.00 -0.47 0.00 0.00 61.79 61.30 1ssl h SER 13 Cb 0.55 0.65 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1ssl h SER 13 CO 0.00 -0.49 -0.99 -0.61 -0.87 0.00 0.00 176.83 173.87 1ssl h GLN 14 N -0.61 0.14 -0.29 4.77 4.15 -1.85 0.23 115.11 121.66 1ssl h GLN 14 Ca 0.02 -0.19 0.08 0.00 0.77 0.00 0.00 58.65 59.33 1ssl h GLN 14 Cb 0.68 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.43 1ssl h GLN 14 CO -0.40 1.02 0.21 0.00 -1.93 0.00 0.00 178.83 177.72 1ssl n LEU 16 N -4.46 0.37 0.02 0.00 4.32 -0.34 -4.35 117.00 112.57 1ssl n LEU 16 Ca 0.04 -0.40 0.12 0.00 -0.02 0.00 0.00 56.01 55.75 1ssl n LEU 16 Cb 0.35 0.00 0.23 0.00 -1.62 0.00 0.00 43.42 42.38 1ssl n LEU 16 CO 0.35 0.09 0.41 -1.20 -1.22 0.00 0.00 177.39 175.83 1ssl n SER 17 N -1.35 0.55 -3.11 -1.43 7.64 0.07 -4.35 113.62 111.63 1ssl n SER 17 Ca 0.01 -0.08 -0.17 0.00 1.01 0.00 0.00 58.87 59.64 1ssl n SER 17 Cb 0.17 0.21 -0.02 0.00 -1.01 0.00 0.00 64.21 63.57 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 -1.64 1.56 0.14 -0.43 0.00 -0.46 -4.93 120.51 114.76 1ssl n ALA 18 Ca 0.05 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.42 1ssl n ALA 18 Cb 0.38 -0.96 0.15 0.00 0.00 0.00 0.00 19.45 19.02 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 3.15 0.00 0.00 0.00 0.13 -1.76 -3.08 132.00 130.44 1ssl h PRO 19 Ca 0.06 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.09 1ssl h PRO 19 Cb 0.98 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.09 1ssl h PRO 19 CO 0.44 0.60 -0.50 -1.00 -0.23 0.00 0.00 178.00 177.30 1ssl h PRO 20 N 0.00 0.00 -0.13 1.56 0.13 -1.95 -2.79 132.00 128.82 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 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1ssl h PRO 20 CO 0.08 0.50 0.00 1.19 -0.23 0.00 0.00 178.00 179.54 1ssl n PHE 21 N -3.57 0.16 -4.20 1.56 3.72 -1.21 -4.93 117.46 108.99 1ssl n PHE 21 Ca -0.00 -0.08 -0.14 0.00 -0.05 0.00 0.00 57.45 57.18 1ssl n PHE 21 Cb 0.59 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.08 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 0.57 0.00 -1.15 -4.37 0.24 -1.05 -4.67 118.33 107.90 1ssl n VAL 22 Ca 0.17 -1.67 0.00 0.00 -2.04 0.00 0.00 64.34 60.81 1ssl n VAL 22 Cb 0.41 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 33.60 1ssl n VAL 22 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ssl n GLN 23 N -0.45 0.00 -2.69 7.34 10.64 -1.26 -4.83 117.38 126.12 1ssl n GLN 23 Ca 0.05 -0.09 -0.22 0.00 -1.83 0.00 0.00 57.00 54.91 1ssl n GLN 23 Cb 0.41 -0.43 0.07 0.00 -0.86 0.00 0.00 30.24 29.44 1ssl n GLN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ssl n GLY 25 N -2.53 2.27 3.77 0.00 0.00 0.54 -4.90 105.19 104.34 1ssl n GLY 25 Ca 0.12 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 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 -3.28 3.71 -0.31 1.61 -0.11 0.70 0.22 118.94 121.47 1ssl s TRP 26 Ca 0.24 1.24 -0.01 0.00 1.22 0.00 0.00 56.10 58.78 1ssl s TRP 26 Cb -0.01 -2.61 0.10 0.00 -1.50 0.00 0.00 33.47 29.46 1ssl s TRP 26 CO 0.17 0.39 0.12 0.00 -4.62 0.00 0.00 176.95 173.02 1ssl n HIS 28 N 4.84 0.00 0.00 0.00 8.25 -1.26 -3.32 115.22 123.73 1ssl n HIS 28 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1ssl n HIS 28 Cb 0.41 -0.97 0.00 0.00 1.12 0.00 0.00 29.99 30.55 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 -4.59 0.41 5.68 -1.26 -5.16 116.55 111.64 1ssl n ASP 29 Ca 0.00 0.00 -0.24 0.00 -0.50 0.00 0.00 54.79 54.05 1ssl n ASP 29 Cb 0.00 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 39.89 1ssl n ASP 29 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1ssl s LYS 30 N 0.00 2.02 -0.63 0.11 2.36 -1.21 -5.06 119.74 117.33 1ssl s LYS 30 Ca 0.00 -1.66 -0.28 0.00 -2.55 0.00 0.00 55.97 51.49 1ssl s LYS 30 Cb 0.00 -1.95 0.03 0.00 -1.05 0.00 0.00 37.83 34.86 1ssl s LYS 30 CO 0.00 0.27 1.20 0.00 1.55 0.00 0.00 175.35 178.37 1ssl s VAL 32 N 5.14 0.00 0.44 0.00 -7.23 0.59 -4.56 120.40 114.78 1ssl s VAL 32 Ca 0.39 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 59.21 1ssl s VAL 32 Cb -0.08 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 1ssl s VAL 32 CO 0.22 0.00 0.04 -0.60 -0.31 0.00 0.00 175.10 174.45 1ssl s ARG 33 N -3.28 2.00 0.46 4.82 3.52 -1.26 -0.34 118.95 124.87 1ssl s ARG 33 Ca 0.24 -2.21 0.31 0.00 -0.13 0.00 0.00 55.73 53.93 1ssl s ARG 33 Cb -0.02 -1.22 1.41 0.00 -1.56 0.00 0.00 34.95 33.56 1ssl s ARG 33 CO 0.14 -0.30 1.68 0.77 -0.81 0.00 0.00 175.30 176.78 1ssl h SER 34 N 1.66 0.22 -0.79 -2.12 0.02 -1.90 0.29 113.55 110.94 1ssl h SER 34 Ca -0.41 0.09 0.19 0.00 -0.84 0.00 0.00 61.79 60.81 1ssl h SER 34 Cb 1.28 0.06 -0.13 0.00 0.14 0.00 0.00 62.40 63.76 1ssl h SER 34 CO 0.71 -0.07 0.14 -0.08 -1.14 0.00 0.00 176.83 176.39 1ssl h GLU 35 N 0.14 0.19 0.12 3.45 4.81 -1.99 -2.44 114.58 118.86 1ssl h GLU 35 Ca 0.74 -0.01 -0.35 0.00 -0.13 0.00 0.00 59.36 59.61 1ssl h GLU 35 Cb 2.41 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.73 1ssl h GLU 35 CO -0.28 0.13 -1.89 1.49 -0.73 0.00 0.00 179.01 177.74 1ssl h GLU 36 N 0.20 0.26 -5.99 1.92 4.57 -0.85 -3.45 114.58 111.24 1ssl h GLU 36 Ca 0.46 -0.45 -0.58 0.00 -1.18 0.00 0.00 59.36 57.61 1ssl h GLU 36 Cb 0.84 0.17 -0.07 0.00 -0.16 0.00 0.00 28.75 29.53 1ssl h GLU 36 CO -0.60 1.21 0.47 0.00 -1.18 0.00 0.00 179.01 178.91 1ssl n LEU 38 N 5.40 2.65 -1.16 0.00 7.99 -1.26 -4.29 117.00 126.33 1ssl n LEU 38 Ca 0.06 -0.92 -0.02 0.00 -0.01 0.00 0.00 56.01 55.12 1ssl n LEU 38 Cb 0.48 0.00 0.10 0.00 -0.11 0.00 0.00 43.42 43.89 1ssl n LEU 38 CO 0.49 0.46 0.59 -1.20 -1.51 0.00 0.00 177.39 176.22 1ssl n SER 39 N 0.86 2.86 -1.99 -1.43 7.64 -1.26 -4.81 113.62 115.49 1ssl n SER 39 Ca 0.12 -2.40 -0.05 0.00 1.01 0.00 0.00 58.87 57.55 1ssl n SER 39 Cb 0.55 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 63.16 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 0.10 -0.14 3.33 0.23 0.00 -1.26 -4.85 105.19 102.60 1ssl n GLY 40 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1ssl n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ssl s THR 41 N -1.95 4.10 -0.10 2.61 2.01 -1.26 -5.06 115.64 115.99 1ssl s THR 41 Ca 0.00 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.10 1ssl s THR 41 Cb 0.00 -3.23 0.05 0.00 0.01 0.00 0.00 72.50 69.33 1ssl s THR 41 CO 0.00 -0.09 0.13 0.86 -0.69 0.00 0.00 174.62 174.83 1ssl s TRP 42 N 1.49 -0.08 -0.10 4.92 -0.00 -1.26 -4.82 118.94 119.09 1ssl s TRP 42 Ca 0.01 0.35 0.02 0.00 -0.00 0.00 0.00 56.10 56.48 1ssl s TRP 42 Cb -0.18 -0.39 -0.01 0.00 -0.00 0.00 0.00 33.47 32.88 1ssl s TRP 42 CO 0.04 -0.32 -0.16 -0.08 -0.00 0.00 0.00 176.95 176.42 1ssl s THR 43 N 2.24 2.81 -0.23 5.86 -1.32 -0.08 -4.98 115.64 119.95 1ssl s THR 43 Ca 0.04 -0.77 0.13 0.00 -1.21 0.00 0.00 61.69 59.88 1ssl s THR 43 Cb -0.13 -2.14 0.45 0.00 -1.51 0.00 0.00 72.50 69.18 1ssl s THR 43 CO -0.06 0.55 1.18 0.00 -2.21 0.00 0.00 174.62 174.08 1ssl n GLN 44 N 3.19 2.32 -3.21 7.08 10.64 -1.26 -0.22 117.38 135.92 1ssl n GLN 44 Ca -0.18 -3.57 -0.00 0.00 -1.83 0.00 0.00 57.00 51.42 1ssl n GLN 44 Cb 0.53 -1.72 -0.03 0.00 -0.86 0.00 0.00 30.24 28.16 1ssl n GLN 44 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.06 174.09 1ssl s GLN 45 N -3.13 0.51 0.28 2.61 -0.44 -1.26 -4.87 119.66 113.35 1ssl s GLN 45 Ca 0.41 0.64 0.00 0.00 -2.50 0.00 0.00 55.36 53.91 1ssl s GLN 45 Cb 0.38 0.16 0.00 0.00 -1.64 0.00 0.00 33.01 31.91 1ssl s GLN 45 CO -0.03 -0.84 0.00 -0.89 0.50 0.00 0.00 175.29 174.03 1ssl n ILE 46 N 5.40 0.00 -3.81 -2.34 5.41 -1.26 -5.14 119.36 117.62 1ssl n ILE 46 Ca 0.01 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.53 1ssl n ILE 46 Cb 0.52 -0.25 -0.04 0.00 -0.71 0.00 0.00 39.64 39.16 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55