#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 -1.17 -4.55 1.61 3.41 -1.26 -4.74 113.62 106.91 1ssl n SER 2 Ca 0.00 0.37 -0.37 0.00 -0.26 0.00 0.00 58.87 58.61 1ssl n SER 2 Cb 0.00 -1.20 -0.03 0.00 -0.26 0.00 0.00 64.21 62.72 1ssl n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ssl s ALA 3 N -1.88 1.92 -0.58 7.33 0.00 -1.26 -4.85 121.76 122.45 1ssl s ALA 3 Ca 0.00 -0.33 0.06 0.00 0.00 0.00 0.00 51.96 51.69 1ssl s ALA 3 Cb 0.00 -4.32 0.31 0.00 0.00 0.00 0.00 23.12 19.10 1ssl s ALA 3 CO 0.00 -4.15 0.85 -0.12 0.00 0.00 0.00 175.76 172.33 1ssl n MET 4 N 9.10 2.73 0.00 0.00 0.00 -1.26 -4.86 117.12 122.84 1ssl n MET 4 Ca 0.28 -4.63 0.00 0.00 -0.00 0.00 0.00 57.70 53.35 1ssl n MET 4 Cb 0.53 -2.16 0.00 0.00 0.00 0.00 0.00 33.22 31.59 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 0.23 2.43 0.07 -5.12 0.00 -1.26 -4.72 105.19 96.82 1ssl n GLY 5 Ca 0.30 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.15 0.03 0.00 0.00 0.11 -1.89 -0.56 114.38 111.92 1ssl h ARG 7 Ca -0.01 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 1ssl h ARG 7 Cb 0.13 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.20 1ssl h ARG 7 CO 0.01 0.17 -0.04 1.25 0.10 0.00 0.00 179.97 181.46 1ssl h HIS 8 N 0.03 0.00 -3.95 4.08 2.76 -1.67 -3.43 115.15 112.97 1ssl h HIS 8 Ca 0.01 0.00 -0.48 0.00 -2.20 0.00 0.00 60.37 57.69 1ssl h HIS 8 Cb 0.27 0.00 0.17 0.00 1.55 0.00 0.00 27.41 29.40 1ssl h HIS 8 CO 0.00 0.04 0.19 -0.06 -1.30 0.00 0.00 177.93 176.81 1ssl s PHE 9 N -4.31 1.95 0.00 5.26 0.08 -0.22 -5.03 117.98 115.71 1ssl s PHE 9 Ca -0.04 1.39 0.00 0.00 0.12 0.00 0.00 56.93 58.40 1ssl s PHE 9 Cb 0.14 -3.18 0.00 0.00 -0.57 0.00 0.00 43.02 39.40 1ssl s PHE 9 CO 0.53 -2.79 0.00 1.04 -0.10 0.00 0.00 175.22 173.90 1ssl n GLN 10 N -4.18 0.00 0.00 0.44 6.02 -1.26 -4.94 117.38 113.46 1ssl n GLN 10 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1ssl n GLN 10 Cb 0.54 -0.04 0.00 0.00 1.02 0.00 0.00 30.24 31.76 1ssl n GLN 10 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1ssl n SER 11 N 0.00 0.00 -0.73 1.08 2.88 -1.26 -4.72 113.62 110.87 1ssl n SER 11 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1ssl n SER 11 Cb 0.00 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 63.67 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 3.60 -1.32 1.30 0.00 4.64 -1.92 -2.77 113.55 117.08 1ssl h SER 13 Ca 0.00 0.10 -0.14 0.00 -0.47 0.00 0.00 61.79 61.28 1ssl h SER 13 Cb 0.81 0.42 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1ssl h SER 13 CO 0.00 -0.67 -0.71 -0.61 -0.87 0.00 0.00 176.83 173.98 1ssl h GLN 14 N -1.02 0.00 -0.73 4.77 5.75 -1.96 -1.95 115.11 119.97 1ssl h GLN 14 Ca -0.07 0.00 0.15 0.00 -0.15 0.00 0.00 58.65 58.57 1ssl h GLN 14 Cb 0.87 0.00 -0.10 0.00 1.07 0.00 0.00 27.48 29.32 1ssl h GLN 14 CO -0.03 0.64 0.25 0.00 -2.65 0.00 0.00 178.83 177.04 1ssl n LEU 16 N -5.06 0.51 0.08 0.00 4.32 -1.06 -4.24 117.00 111.55 1ssl n LEU 16 Ca 0.14 -0.36 0.13 0.00 -0.02 0.00 0.00 56.01 55.90 1ssl n LEU 16 Cb 0.42 0.00 0.46 0.00 -1.62 0.00 0.00 43.42 42.68 1ssl n LEU 16 CO 0.16 0.13 0.90 -1.20 -1.22 0.00 0.00 177.39 176.16 1ssl n SER 17 N -1.55 0.60 -3.11 -1.43 7.64 -0.73 -4.06 113.62 110.97 1ssl n SER 17 Ca 0.01 0.56 -0.16 0.00 1.01 0.00 0.00 58.87 60.29 1ssl n SER 17 Cb 0.28 -0.72 -0.01 0.00 -1.01 0.00 0.00 64.21 62.76 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 1.50 0.13 -0.43 0.00 -0.76 -4.94 120.51 114.30 1ssl n ALA 18 Ca 0.06 -3.05 -0.01 0.00 0.00 0.00 0.00 53.44 50.44 1ssl n ALA 18 Cb 0.40 -0.97 0.14 0.00 0.00 0.00 0.00 19.45 19.01 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 3.01 0.00 0.00 0.00 0.13 -1.74 -3.10 132.00 130.30 1ssl h PRO 19 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1ssl h PRO 19 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1ssl h PRO 19 CO 0.43 0.63 0.00 -0.35 -0.23 0.00 0.00 178.00 178.49 1ssl n PRO 20 N -3.61 0.20 -0.57 1.56 -0.04 -1.26 -2.38 135.00 128.91 1ssl n PRO 20 Ca -0.00 0.36 0.07 0.00 -0.04 0.00 0.00 63.50 63.89 1ssl n PRO 20 Cb 0.67 -1.84 0.29 0.00 -0.04 0.00 0.00 33.50 32.57 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 -2.21 1.22 -3.98 0.54 3.72 -1.17 -5.00 117.46 110.57 1ssl n PHE 21 Ca 0.03 -0.90 -0.13 0.00 -0.05 0.00 0.00 57.45 56.40 1ssl n PHE 21 Cb 0.28 -0.38 -0.01 0.00 -0.94 0.00 0.00 39.48 38.44 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 -2.85 0.00 0.00 -4.37 -7.23 -1.00 -4.02 120.40 100.93 1ssl s VAL 22 Ca 0.45 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 1ssl s VAL 22 Cb 0.36 -2.82 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1ssl s VAL 22 CO 0.10 0.00 0.29 1.67 -0.31 0.00 0.00 175.10 176.85 1ssl n GLN 23 N -0.58 0.04 -2.97 4.82 7.27 -1.26 -4.92 117.38 119.78 1ssl n GLN 23 Ca -0.03 -0.30 -0.18 0.00 0.07 0.00 0.00 57.00 56.56 1ssl n GLN 23 Cb 0.61 -0.51 0.03 0.00 2.41 0.00 0.00 30.24 32.77 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 -2.05 2.17 3.85 0.00 0.00 -0.07 -4.84 105.19 104.25 1ssl n GLY 25 Ca 0.11 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 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 -2.98 3.56 -0.31 1.61 -0.11 0.98 0.26 118.94 121.95 1ssl s TRP 26 Ca 0.29 1.00 -0.02 0.00 1.22 0.00 0.00 56.10 58.59 1ssl s TRP 26 Cb -0.01 -2.33 0.11 0.00 -1.50 0.00 0.00 33.47 29.74 1ssl s TRP 26 CO 0.21 0.39 0.14 0.00 -4.62 0.00 0.00 176.95 173.07 1ssl n HIS 28 N 4.91 -0.33 0.00 0.00 8.25 -1.26 -3.08 115.22 123.72 1ssl n HIS 28 Ca -0.02 0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1ssl n HIS 28 Cb 0.41 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1ssl n HIS 28 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1ssl n ASP 29 N -0.08 0.00 -4.45 0.41 -0.08 -1.26 -5.15 116.55 105.94 1ssl n ASP 29 Ca 0.02 0.00 -0.29 0.00 -1.51 0.00 0.00 54.79 53.01 1ssl n ASP 29 Cb 0.11 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.49 1ssl n ASP 29 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1ssl s LYS 30 N 0.00 2.07 -0.54 -0.67 2.20 -1.18 -5.09 119.74 116.53 1ssl s LYS 30 Ca 0.00 -2.29 -0.20 0.00 -0.36 0.00 0.00 55.97 53.11 1ssl s LYS 30 Cb 0.00 -1.09 0.06 0.00 -1.51 0.00 0.00 37.83 35.29 1ssl s LYS 30 CO 0.00 -0.41 0.73 0.00 -0.36 0.00 0.00 175.35 175.30 1ssl s VAL 32 N 3.02 0.00 0.48 0.00 -7.23 0.71 -4.25 120.40 113.13 1ssl s VAL 32 Ca 0.18 -1.45 0.05 0.00 -1.81 0.00 0.00 61.98 58.95 1ssl s VAL 32 Cb -0.18 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.23 1ssl s VAL 32 CO 0.13 0.00 0.18 -0.60 -0.31 0.00 0.00 175.10 174.49 1ssl s ARG 33 N -3.33 2.21 0.34 4.82 3.52 -1.26 -0.89 118.95 124.36 1ssl s ARG 33 Ca 0.26 -2.09 0.14 0.00 -0.13 0.00 0.00 55.73 53.90 1ssl s ARG 33 Cb -0.01 -1.85 1.11 0.00 -1.56 0.00 0.00 34.95 32.64 1ssl s ARG 33 CO 0.15 -0.34 1.59 0.77 -0.81 0.00 0.00 175.30 176.66 1ssl h SER 34 N 1.23 0.08 -0.08 -2.12 0.02 -1.88 1.85 113.55 112.65 1ssl h SER 34 Ca -0.41 0.26 0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1ssl h SER 34 Cb 1.29 0.32 -0.00 0.00 0.14 0.00 0.00 62.40 64.14 1ssl h SER 34 CO 0.68 -0.37 0.41 -0.08 -1.14 0.00 0.00 176.83 176.34 1ssl h GLU 35 N 0.05 0.00 0.00 3.45 4.81 -1.98 -1.78 114.58 119.13 1ssl h GLU 35 Ca 0.75 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.80 1ssl h GLU 35 Cb 1.82 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.17 1ssl h GLU 35 CO -0.79 0.00 -1.67 -1.91 -0.73 0.00 0.00 179.01 173.90 1ssl n GLU 36 N -2.99 1.92 -2.09 1.92 4.07 0.61 -4.87 120.64 119.21 1ssl n GLU 36 Ca -0.00 0.01 -0.35 0.00 -0.06 0.00 0.00 57.16 56.76 1ssl n GLU 36 Cb 0.48 -1.25 -0.04 0.00 -0.06 0.00 0.00 31.44 30.58 1ssl n GLU 36 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ssl h LEU 38 N 16.58 0.00 0.00 0.00 7.12 -1.90 -1.88 115.31 135.24 1ssl h LEU 38 Ca -0.12 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.89 1ssl h LEU 38 Cb 1.10 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.23 1ssl h LEU 38 CO 1.23 0.11 0.00 -0.24 -0.13 0.00 0.00 178.44 179.41 1ssl n SER 39 N -3.48 0.00 -0.12 1.25 2.88 -1.26 -4.81 113.62 108.08 1ssl n SER 39 Ca -0.01 -0.91 -0.02 0.00 -1.33 0.00 0.00 58.87 56.60 1ssl n SER 39 Cb 0.26 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1ssl n SER 39 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ssl n GLY 40 N 0.43 0.33 3.65 0.46 0.00 -0.70 -4.97 105.19 104.38 1ssl n GLY 40 Ca 0.14 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1ssl n GLY 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ssl s THR 41 N -1.52 3.93 -0.14 2.61 -4.23 -1.26 -5.07 115.64 109.95 1ssl s THR 41 Ca 0.00 -0.74 -0.11 0.00 -1.18 0.00 0.00 61.69 59.66 1ssl s THR 41 Cb 0.00 -2.76 0.04 0.00 1.34 0.00 0.00 72.50 71.13 1ssl s THR 41 CO 0.00 0.34 0.36 0.86 -0.54 0.00 0.00 174.62 175.64 1ssl s TRP 42 N -1.09 -0.44 0.11 3.99 -0.00 -1.26 -4.73 118.94 115.52 1ssl s TRP 42 Ca 0.20 1.03 0.03 0.00 -0.00 0.00 0.00 56.10 57.35 1ssl s TRP 42 Cb -0.11 0.16 -0.04 0.00 -0.00 0.00 0.00 33.47 33.47 1ssl s TRP 42 CO 0.10 -0.23 -0.09 -0.08 -0.00 0.00 0.00 176.95 176.66 1ssl s THR 43 N 0.53 0.90 -0.35 5.86 -1.32 -0.41 -5.02 115.64 115.84 1ssl s THR 43 Ca -0.03 -1.82 0.15 0.00 -1.21 0.00 0.00 61.69 58.78 1ssl s THR 43 Cb -0.04 -1.55 0.43 0.00 -1.51 0.00 0.00 72.50 69.82 1ssl s THR 43 CO -0.03 -0.70 1.01 0.00 -2.21 0.00 0.00 174.62 172.69 1ssl n GLN 44 N 0.21 1.12 -3.17 7.08 -0.00 -1.26 -0.01 117.38 121.35 1ssl n GLN 44 Ca -0.14 -2.94 0.03 0.00 -0.00 0.00 0.00 57.00 53.95 1ssl n GLN 44 Cb 0.59 -1.06 -0.01 0.00 -0.00 0.00 0.00 30.24 29.76 1ssl n GLN 44 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 1ssl s GLN 45 N -2.25 0.55 0.00 2.61 -2.07 -1.26 -4.95 119.66 112.28 1ssl s GLN 45 Ca 0.28 0.81 0.00 0.00 -1.82 0.00 0.00 55.36 54.62 1ssl s GLN 45 Cb 0.43 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.71 1ssl s GLN 45 CO -0.00 -0.77 0.00 -0.89 -1.32 0.00 0.00 175.29 172.31 1ssl n ILE 46 N 5.42 0.00 -4.32 3.63 5.41 -1.26 -5.12 119.36 123.12 1ssl n ILE 46 Ca 0.01 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.41 1ssl n ILE 46 Cb 0.52 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.36 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55