#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ssl s SER 2 N 0.00 5.89 0.00 1.61 0.01 -1.26 -4.99 113.70 114.96 1ssl s SER 2 Ca 0.00 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1ssl s SER 2 Cb 0.00 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.17 1ssl s SER 2 CO 0.00 0.04 0.00 0.00 0.41 0.00 0.00 173.24 173.69 1ssl n ALA 3 N 4.44 0.06 -2.67 1.44 0.00 -1.26 -5.12 120.51 117.40 1ssl n ALA 3 Ca -0.15 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 1ssl n ALA 3 Cb 0.52 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.01 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 0.00 0.10 0.00 0.00 -0.00 -1.26 -5.01 117.12 110.95 1ssl n MET 4 Ca 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 57.70 56.91 1ssl n MET 4 Cb 0.00 0.11 0.00 0.00 -0.00 0.00 0.00 33.22 33.33 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 2.53 -0.31 0.07 3.17 0.00 -1.26 -4.73 105.19 104.66 1ssl n GLY 5 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 0.35 0.00 -0.01 0.00 9.65 -1.85 -0.86 114.38 121.67 1ssl h ARG 7 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1ssl h ARG 7 Cb 0.51 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1ssl h ARG 7 CO 0.00 0.00 -0.22 -2.39 2.80 0.00 0.00 179.97 180.16 1ssl n HIS 8 N -3.20 0.00 -0.90 2.20 1.44 -1.26 -4.92 115.22 108.59 1ssl n HIS 8 Ca -0.03 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.34 1ssl n HIS 8 Cb 0.14 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.33 1ssl n HIS 8 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1ssl n PHE 9 N -0.12 -3.15 0.00 -1.40 3.01 -0.33 -4.94 117.46 110.53 1ssl n PHE 9 Ca 0.05 0.15 0.00 0.00 1.01 0.00 0.00 57.45 58.66 1ssl n PHE 9 Cb 0.25 -1.56 0.00 0.00 -0.01 0.00 0.00 39.48 38.16 1ssl n PHE 9 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1ssl n GLN 10 N 0.59 0.00 -1.80 -1.08 7.27 -1.26 -4.95 117.38 116.14 1ssl n GLN 10 Ca 0.01 0.50 0.00 0.00 0.07 0.00 0.00 57.00 57.58 1ssl n GLN 10 Cb 0.58 -1.03 0.00 0.00 2.41 0.00 0.00 30.24 32.20 1ssl n GLN 10 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1ssl n SER 11 N -1.99 1.73 0.00 1.69 7.64 -1.26 -4.90 113.62 116.53 1ssl n SER 11 Ca 0.00 -0.97 0.07 0.00 1.01 0.00 0.00 58.87 58.98 1ssl n SER 11 Cb 0.00 0.00 0.36 0.00 -1.01 0.00 0.00 64.21 63.56 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 -1.35 1.68 0.00 0.87 -1.94 -2.57 113.55 110.24 1ssl h SER 13 Ca 0.00 0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.63 1ssl h SER 13 Cb 0.15 0.45 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 1ssl h SER 13 CO 0.00 -0.64 -0.33 -0.61 -0.53 0.00 0.00 176.83 174.73 1ssl h GLN 14 N -0.95 0.00 -0.85 2.24 5.75 -1.95 -1.86 115.11 117.49 1ssl h GLN 14 Ca -0.06 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.56 1ssl h GLN 14 Cb 0.83 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 29.32 1ssl h GLN 14 CO -0.07 0.18 0.55 0.00 -2.65 0.00 0.00 178.83 176.84 1ssl n LEU 16 N -4.53 0.34 -0.10 0.00 4.32 -0.99 -4.36 117.00 111.67 1ssl n LEU 16 Ca 0.15 -0.38 0.13 0.00 -0.02 0.00 0.00 56.01 55.90 1ssl n LEU 16 Cb 0.40 0.00 0.45 0.00 -1.62 0.00 0.00 43.42 42.66 1ssl n LEU 16 CO 0.31 0.08 0.71 -0.24 -1.22 0.00 0.00 177.39 177.04 1ssl n SER 17 N -1.38 0.56 -2.87 -1.43 2.88 -0.70 -4.18 113.62 106.50 1ssl n SER 17 Ca 0.01 -0.42 -0.12 0.00 -1.33 0.00 0.00 58.87 57.01 1ssl n SER 17 Cb 0.17 0.01 0.02 0.00 -0.75 0.00 0.00 64.21 63.67 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 -1.10 2.24 0.14 -1.46 0.00 -0.61 -4.93 120.51 114.80 1ssl n ALA 18 Ca 0.10 -2.86 0.01 0.00 0.00 0.00 0.00 53.44 50.69 1ssl n ALA 18 Cb 0.32 -0.96 0.16 0.00 0.00 0.00 0.00 19.45 18.97 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 2.89 0.00 -0.09 0.00 0.13 -1.76 -3.26 132.00 129.90 1ssl h PRO 19 Ca -0.05 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.91 1ssl h PRO 19 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1ssl h PRO 19 CO 0.40 0.58 -0.67 -1.00 -0.23 0.00 0.00 178.00 177.08 1ssl h PRO 20 N 0.00 0.39 -0.76 1.56 0.13 -1.94 -2.90 132.00 128.48 1ssl h PRO 20 Ca -0.01 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1ssl h PRO 20 Cb 1.18 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1ssl h PRO 20 CO 0.08 0.92 0.00 1.19 -0.23 0.00 0.00 178.00 179.95 1ssl n PHE 21 N -3.86 0.97 -2.64 1.56 3.72 -1.23 -4.90 117.46 111.07 1ssl n PHE 21 Ca -0.04 -0.34 0.00 0.00 -0.05 0.00 0.00 57.45 57.02 1ssl n PHE 21 Cb 0.67 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 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 0.33 0.00 0.00 -4.37 0.24 -1.09 -4.67 118.33 108.76 1ssl n VAL 22 Ca 0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.43 1ssl n VAL 22 Cb 0.68 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.05 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 0.00 0.00 -0.90 7.34 -0.06 -1.26 -4.92 117.38 117.58 1ssl n GLN 23 Ca 0.00 0.00 -0.29 0.00 -2.00 0.00 0.00 57.00 54.71 1ssl n GLN 23 Cb 0.00 -0.25 0.18 0.00 -4.06 0.00 0.00 30.24 26.11 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 -0.26 2.94 3.77 0.00 0.00 -0.29 -4.86 105.19 106.48 1ssl n GLY 25 Ca 0.07 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.95 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 -3.14 3.73 -0.29 1.61 -0.11 0.56 0.32 118.94 121.62 1ssl s TRP 26 Ca 0.27 1.30 -0.02 0.00 1.22 0.00 0.00 56.10 58.87 1ssl s TRP 26 Cb 0.01 -2.65 0.10 0.00 -1.50 0.00 0.00 33.47 29.43 1ssl s TRP 26 CO 0.20 0.39 0.11 0.00 -4.62 0.00 0.00 176.95 173.03 1ssl n HIS 28 N 5.06 -0.84 0.00 0.00 -0.00 -1.26 -3.96 115.22 114.21 1ssl n HIS 28 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.68 1ssl n HIS 28 Cb 0.42 -1.54 0.00 0.00 -0.00 0.00 0.00 29.99 28.87 1ssl n HIS 28 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1ssl n ASP 29 N 0.36 0.00 -4.87 0.26 5.68 -1.26 -5.15 116.55 111.57 1ssl n ASP 29 Ca -0.05 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.04 1ssl n ASP 29 Cb 0.17 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.20 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 0.63 -2.88 0.11 2.85 -1.25 -4.97 118.16 112.64 1ssl n LYS 30 Ca 0.00 -3.14 -0.43 0.00 -1.05 0.00 0.00 58.31 53.69 1ssl n LYS 30 Cb 0.00 -0.11 -0.04 0.00 -0.65 0.00 0.00 35.03 34.23 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 3.78 0.00 0.38 0.00 -7.23 0.95 -4.55 120.40 113.73 1ssl s VAL 32 Ca 0.27 -1.79 0.04 0.00 -1.81 0.00 0.00 61.98 58.69 1ssl s VAL 32 Cb -0.14 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 1ssl s VAL 32 CO 0.17 0.00 0.11 -0.60 -0.31 0.00 0.00 175.10 174.47 1ssl s ARG 33 N -3.59 1.84 0.40 4.82 3.52 -1.26 -1.14 118.95 123.55 1ssl s ARG 33 Ca 0.35 -2.10 0.32 0.00 -0.13 0.00 0.00 55.73 54.17 1ssl s ARG 33 Cb 0.02 -0.68 1.32 0.00 -1.56 0.00 0.00 34.95 34.06 1ssl s ARG 33 CO 0.19 -0.40 1.31 0.45 -0.81 0.00 0.00 175.30 176.04 1ssl n SER 34 N -1.11 0.12 -0.33 -2.12 2.88 -1.26 0.16 113.62 111.95 1ssl n SER 34 Ca -0.05 1.05 0.30 0.00 -1.33 0.00 0.00 58.87 58.84 1ssl n SER 34 Cb 0.65 -0.52 0.64 0.00 -0.75 0.00 0.00 64.21 64.23 1ssl n SER 34 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1ssl h GLU 35 N 0.00 0.18 0.00 -1.46 4.22 -2.00 -2.47 114.58 113.04 1ssl h GLU 35 Ca 0.76 -0.01 -0.07 0.00 0.08 0.00 0.00 59.36 60.12 1ssl h GLU 35 Cb 2.66 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.86 1ssl h GLU 35 CO -0.26 0.12 -1.25 -1.91 -2.18 0.00 0.00 179.01 173.52 1ssl n GLU 36 N -4.42 0.11 -2.07 1.92 2.13 0.42 -4.74 120.64 114.00 1ssl n GLU 36 Ca 0.26 0.03 -0.38 0.00 0.66 0.00 0.00 57.16 57.73 1ssl n GLU 36 Cb 1.09 -1.09 -0.00 0.00 0.27 0.00 0.00 31.44 31.72 1ssl n GLU 36 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ssl n LEU 38 N 0.71 5.97 -0.02 0.00 0.00 -0.94 -3.90 117.00 118.82 1ssl n LEU 38 Ca 0.54 -3.36 0.00 0.00 0.00 0.00 0.00 56.01 53.20 1ssl n LEU 38 Cb 0.31 -1.36 -0.05 0.00 0.00 0.00 0.00 43.42 42.32 1ssl n LEU 38 CO 0.54 1.60 -0.64 -1.20 0.00 0.00 0.00 177.39 177.70 1ssl n SER 39 N 2.98 3.46 0.00 1.96 7.64 -1.26 -5.00 113.62 123.40 1ssl n SER 39 Ca 0.51 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.39 1ssl n SER 39 Cb 0.60 1.01 0.00 0.00 -1.01 0.00 0.00 64.21 64.81 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 2.35 1.88 2.73 0.23 0.00 -1.25 -5.12 105.19 106.01 1ssl n GLY 40 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.00 0.21 -0.14 2.61 -1.32 -1.26 -5.12 115.64 108.61 1ssl s THR 41 Ca 0.00 0.19 -0.06 0.00 -1.21 0.00 0.00 61.69 60.61 1ssl s THR 41 Cb 0.00 -0.43 0.06 0.00 -1.51 0.00 0.00 72.50 70.63 1ssl s THR 41 CO 0.00 0.20 0.31 0.86 -2.21 0.00 0.00 174.62 173.79 1ssl s TRP 42 N 2.04 -0.51 0.04 9.09 -0.00 -1.26 -4.86 118.94 123.48 1ssl s TRP 42 Ca 0.05 1.09 0.08 0.00 -0.00 0.00 0.00 56.10 57.33 1ssl s TRP 42 Cb -0.12 0.10 -0.03 0.00 -0.00 0.00 0.00 33.47 33.42 1ssl s TRP 42 CO -0.05 -0.35 -0.24 -0.08 -0.00 0.00 0.00 176.95 176.23 1ssl s THR 43 N 2.05 2.34 -0.10 5.86 -1.32 0.03 -5.00 115.64 119.50 1ssl s THR 43 Ca -0.03 -1.30 0.14 0.00 -1.21 0.00 0.00 61.69 59.29 1ssl s THR 43 Cb -0.11 -1.93 0.22 0.00 -1.51 0.00 0.00 72.50 69.17 1ssl s THR 43 CO -0.10 0.38 1.11 1.67 -2.21 0.00 0.00 174.62 175.46 1ssl n GLN 44 N 1.77 1.29 -3.45 7.08 7.27 -1.26 -0.32 117.38 129.75 1ssl n GLN 44 Ca -0.17 -2.25 -0.18 0.00 0.07 0.00 0.00 57.00 54.47 1ssl n GLN 44 Cb 0.52 -1.31 -0.12 0.00 2.41 0.00 0.00 30.24 31.74 1ssl n GLN 44 CO 0.00 0.00 0.00 1.14 0.07 0.00 0.00 177.06 178.27 1ssl s GLN 45 N -2.30 0.25 0.00 3.69 -2.07 -1.26 -4.88 119.66 113.10 1ssl s GLN 45 Ca 0.24 -0.00 0.00 0.00 -1.82 0.00 0.00 55.36 53.78 1ssl s GLN 45 Cb 0.21 -0.94 0.00 0.00 -1.09 0.00 0.00 33.01 31.19 1ssl s GLN 45 CO 0.02 -0.85 0.00 1.51 -1.32 0.00 0.00 175.29 174.66 1ssl n ILE 46 N 5.31 0.00 -3.33 3.63 0.13 -1.26 -5.08 119.36 118.77 1ssl n ILE 46 Ca -0.04 0.00 -0.39 0.00 -1.10 0.00 0.00 62.75 61.22 1ssl n ILE 46 Cb 0.47 -0.18 -0.08 0.00 -0.84 0.00 0.00 39.64 39.01 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35