#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 0.00 1.61 2.88 -1.26 -5.12 113.62 111.73 1ssl n SER 2 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ssl n SER 2 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1ssl n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ssl n ALA 3 N -3.00 0.00 -2.98 -1.46 0.00 -1.26 -5.00 120.51 106.81 1ssl n ALA 3 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1ssl n ALA 3 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 3.08 0.00 0.00 -0.00 -1.26 -4.81 117.12 114.13 1ssl n MET 4 Ca 0.00 -4.77 0.00 0.00 -0.00 0.00 0.00 57.70 52.93 1ssl n MET 4 Cb 0.00 -2.21 0.00 0.00 -0.00 0.00 0.00 33.22 31.01 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 -0.17 0.56 0.09 3.17 0.00 -1.26 -4.50 105.19 103.08 1ssl n GLY 5 Ca 0.31 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.44 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 -2.34 0.05 -0.01 0.00 3.00 -1.26 -1.32 116.66 114.78 1ssl n ARG 7 Ca 0.03 0.42 0.09 0.00 -0.00 0.00 0.00 57.85 58.39 1ssl n ARG 7 Cb 0.47 -1.63 -0.14 0.00 0.00 0.00 0.00 32.46 31.17 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 -1.73 0.00 0.00 -0.14 -0.00 -1.23 -4.98 115.22 107.13 1ssl n HIS 8 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1ssl n HIS 8 Cb 0.10 -0.34 0.00 0.00 -0.00 0.00 0.00 29.99 29.76 1ssl n HIS 8 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1ssl n PHE 9 N -2.00 -1.22 0.00 1.57 3.72 -0.43 -5.02 117.46 114.07 1ssl n PHE 9 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1ssl n PHE 9 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 1ssl n PHE 9 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1ssl n GLN 10 N -1.16 0.00 -2.73 -1.08 6.02 -1.26 -5.07 117.38 112.09 1ssl n GLN 10 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 1ssl n GLN 10 Cb 0.00 -0.08 0.04 0.00 1.02 0.00 0.00 30.24 31.22 1ssl n GLN 10 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1ssl n SER 11 N -2.13 1.83 0.00 1.08 7.64 -1.26 -4.93 113.62 115.84 1ssl n SER 11 Ca 0.00 -2.26 0.07 0.00 1.01 0.00 0.00 58.87 57.69 1ssl n SER 11 Cb 0.00 -0.25 0.37 0.00 -1.01 0.00 0.00 64.21 63.32 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 -1.15 0.58 0.00 0.02 -1.93 -2.19 113.55 108.89 1ssl h SER 13 Ca 0.00 0.05 -0.21 0.00 -0.84 0.00 0.00 61.79 60.79 1ssl h SER 13 Cb 0.12 0.31 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1ssl h SER 13 CO 0.00 -0.77 -0.92 -0.61 -1.14 0.00 0.00 176.83 173.39 1ssl h GLN 14 N -1.25 0.21 -0.57 3.45 5.75 -1.94 0.11 115.11 120.88 1ssl h GLN 14 Ca -0.12 -0.25 0.14 0.00 -0.15 0.00 0.00 58.65 58.27 1ssl h GLN 14 Cb 0.98 0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.57 1ssl h GLN 14 CO 0.17 0.99 0.40 0.00 -2.65 0.00 0.00 178.83 177.74 1ssl n LEU 16 N -4.42 0.18 -0.17 0.00 4.32 -0.83 -4.25 117.00 111.84 1ssl n LEU 16 Ca 0.10 -0.18 0.14 0.00 -0.02 0.00 0.00 56.01 56.05 1ssl n LEU 16 Cb 0.54 0.00 0.51 0.00 -1.62 0.00 0.00 43.42 42.85 1ssl n LEU 16 CO 0.36 0.05 0.78 -0.24 -1.22 0.00 0.00 177.39 177.11 1ssl n SER 17 N -1.67 0.70 -2.86 -1.43 2.88 0.38 -4.12 113.62 107.50 1ssl n SER 17 Ca -0.01 -0.69 -0.12 0.00 -1.33 0.00 0.00 58.87 56.72 1ssl n SER 17 Cb 0.25 0.01 0.02 0.00 -0.75 0.00 0.00 64.21 63.74 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 -0.83 2.33 0.15 -1.46 0.00 0.08 -4.93 120.51 115.84 1ssl n ALA 18 Ca 0.13 -2.90 0.02 0.00 0.00 0.00 0.00 53.44 50.69 1ssl n ALA 18 Cb 0.31 -0.96 0.18 0.00 0.00 0.00 0.00 19.45 18.98 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 2.90 0.00 0.00 0.00 0.13 -1.74 -3.25 132.00 130.04 1ssl h PRO 19 Ca -0.05 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.97 1ssl h PRO 19 Cb 1.11 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1ssl h PRO 19 CO 0.41 0.53 -0.55 -1.00 -0.23 0.00 0.00 178.00 177.16 1ssl h PRO 20 N 0.00 0.00 -0.79 1.56 0.13 -1.94 -3.02 132.00 127.95 1ssl h PRO 20 Ca -0.01 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.79 1ssl h PRO 20 Cb 1.14 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.07 1ssl h PRO 20 CO 0.07 0.55 0.39 1.19 -0.23 0.00 0.00 178.00 179.97 1ssl n PHE 21 N -3.76 2.50 -3.94 1.56 3.72 -1.23 -4.96 117.46 111.35 1ssl n PHE 21 Ca -0.01 -1.52 -0.09 0.00 -0.05 0.00 0.00 57.45 55.78 1ssl n PHE 21 Cb 0.58 -0.76 -0.05 0.00 -0.94 0.00 0.00 39.48 38.31 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 -3.16 0.01 0.00 -4.37 -7.23 -1.14 -4.59 120.40 99.92 1ssl s VAL 22 Ca 0.54 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.45 1ssl s VAL 22 Cb 0.45 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 35.33 1ssl s VAL 22 CO 0.11 -0.04 0.00 1.67 -0.31 0.00 0.00 175.10 176.53 1ssl n GLN 23 N -0.38 1.31 -1.03 4.82 7.27 -1.26 -4.88 117.38 123.24 1ssl n GLN 23 Ca -0.03 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.72 1ssl n GLN 23 Cb 0.62 -0.90 0.13 0.00 2.41 0.00 0.00 30.24 32.49 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 -0.36 3.18 3.81 0.00 0.00 -0.27 -4.83 105.19 106.72 1ssl n GLY 25 Ca 0.11 -1.87 -0.38 0.00 0.00 0.00 0.00 46.02 43.88 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 -3.03 3.79 -0.31 1.61 -0.11 0.11 0.30 118.94 121.30 1ssl s TRP 26 Ca 0.30 1.34 -0.02 0.00 1.22 0.00 0.00 56.10 58.94 1ssl s TRP 26 Cb 0.01 -2.55 0.10 0.00 -1.50 0.00 0.00 33.47 29.53 1ssl s TRP 26 CO 0.21 0.53 0.11 0.00 -4.62 0.00 0.00 176.95 173.18 1ssl n HIS 28 N 4.91 -1.06 0.00 0.00 8.25 -1.26 -3.75 115.22 122.31 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 -1.04 0.00 0.00 1.12 0.00 0.00 29.99 30.48 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 0.76 0.00 -4.74 0.41 5.68 -1.26 -5.15 116.55 112.25 1ssl n ASP 29 Ca -0.00 0.00 -0.23 0.00 -0.50 0.00 0.00 54.79 54.05 1ssl n ASP 29 Cb 0.05 0.00 0.09 0.00 -1.14 0.00 0.00 41.12 40.13 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 1.85 -0.55 0.11 2.20 -1.25 -5.02 119.74 117.08 1ssl s LYS 30 Ca 0.00 -0.99 -0.22 0.00 -0.36 0.00 0.00 55.97 54.40 1ssl s LYS 30 Cb 0.00 -2.34 0.05 0.00 -1.51 0.00 0.00 37.83 34.03 1ssl s LYS 30 CO 0.00 -1.32 0.82 0.00 -0.36 0.00 0.00 175.35 174.49 1ssl s VAL 32 N 3.44 0.00 0.44 0.00 -7.23 0.87 -4.76 120.40 113.16 1ssl s VAL 32 Ca 0.23 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.91 1ssl s VAL 32 Cb -0.16 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 1ssl s VAL 32 CO 0.15 0.00 0.05 -0.60 -0.31 0.00 0.00 175.10 174.39 1ssl s ARG 33 N -3.34 2.00 0.52 4.82 3.52 -1.26 -1.12 118.95 124.09 1ssl s ARG 33 Ca 0.28 -2.22 0.46 0.00 -0.13 0.00 0.00 55.73 54.12 1ssl s ARG 33 Cb -0.00 -1.18 1.64 0.00 -1.56 0.00 0.00 34.95 33.85 1ssl s ARG 33 CO 0.16 -0.32 1.50 0.43 -0.81 0.00 0.00 175.30 176.26 1ssl n SER 34 N -1.15 0.03 -0.35 -2.12 7.64 -1.26 0.17 113.62 116.58 1ssl n SER 34 Ca -0.11 1.01 -0.00 0.00 1.01 0.00 0.00 58.87 60.78 1ssl n SER 34 Cb 0.66 -0.50 0.13 0.00 -1.01 0.00 0.00 64.21 63.49 1ssl n SER 34 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1ssl h GLU 35 N 0.00 1.14 0.00 1.43 4.39 -1.99 -2.51 114.58 117.04 1ssl h GLU 35 Ca 0.90 -0.07 -0.35 0.00 0.34 0.00 0.00 59.36 60.18 1ssl h GLU 35 Cb 3.53 -0.26 -0.05 0.00 -0.10 0.00 0.00 28.75 31.87 1ssl h GLU 35 CO -0.07 0.75 -1.92 0.39 -1.16 0.00 0.00 179.01 177.00 1ssl n GLU 36 N -4.50 0.58 -3.39 2.33 -0.58 0.45 -4.66 120.64 110.87 1ssl n GLU 36 Ca 0.13 0.41 -0.38 0.00 -0.42 0.00 0.00 57.16 56.90 1ssl n GLU 36 Cb 0.11 -1.62 -0.04 0.00 -0.57 0.00 0.00 31.44 29.32 1ssl n GLU 36 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ssl n LEU 38 N 1.86 3.84 0.00 0.00 -0.00 -0.94 -4.21 117.00 117.54 1ssl n LEU 38 Ca 0.25 -1.98 0.09 0.00 -0.00 0.00 0.00 56.01 54.36 1ssl n LEU 38 Cb 0.37 -0.59 0.47 0.00 -0.00 0.00 0.00 43.42 43.67 1ssl n LEU 38 CO 0.48 0.61 0.74 -0.24 -0.00 0.00 0.00 177.39 178.99 1ssl n SER 39 N 0.04 0.00 0.00 1.45 2.88 -1.26 -4.79 113.62 111.94 1ssl n SER 39 Ca 0.16 -0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1ssl n SER 39 Cb 0.80 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 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 0.15 0.89 2.65 0.46 0.00 -1.26 -5.06 105.19 103.01 1ssl n GLY 40 Ca 0.10 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 0.01 -0.03 2.61 -1.32 -1.26 -5.13 115.64 108.52 1ssl s THR 41 Ca 0.00 -0.09 0.02 0.00 -1.21 0.00 0.00 61.69 60.41 1ssl s THR 41 Cb 0.00 -0.55 0.01 0.00 -1.51 0.00 0.00 72.50 70.45 1ssl s THR 41 CO 0.00 -0.15 -0.08 0.86 -2.21 0.00 0.00 174.62 173.04 1ssl s TRP 42 N 2.10 0.90 0.10 9.09 -0.00 -1.26 -4.77 118.94 125.11 1ssl s TRP 42 Ca 0.02 -0.24 0.06 0.00 -0.00 0.00 0.00 56.10 55.94 1ssl s TRP 42 Cb -0.15 -0.68 -0.03 0.00 -0.00 0.00 0.00 33.47 32.60 1ssl s TRP 42 CO -0.08 -0.13 -0.14 -0.08 -0.00 0.00 0.00 176.95 176.52 1ssl s THR 43 N 0.41 1.24 -0.04 5.86 -1.32 -0.19 -5.02 115.64 116.57 1ssl s THR 43 Ca -0.06 -1.53 0.08 0.00 -1.21 0.00 0.00 61.69 58.96 1ssl s THR 43 Cb -0.10 -1.33 0.13 0.00 -1.51 0.00 0.00 72.50 69.68 1ssl s THR 43 CO 0.01 -0.32 1.06 0.00 -2.21 0.00 0.00 174.62 173.16 1ssl n GLN 44 N 0.88 0.39 -3.29 7.08 -0.00 -1.26 0.07 117.38 121.25 1ssl n GLN 44 Ca -0.18 -1.59 -0.06 0.00 -0.00 0.00 0.00 57.00 55.17 1ssl n GLN 44 Cb 0.56 -0.76 -0.05 0.00 -0.00 0.00 0.00 30.24 29.98 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 -0.87 0.42 0.00 2.61 0.74 -1.26 -4.77 119.66 116.53 1ssl s GLN 45 Ca 0.13 0.43 0.00 0.00 0.05 0.00 0.00 55.36 55.97 1ssl s GLN 45 Cb 0.12 -0.20 0.00 0.00 1.10 0.00 0.00 33.01 34.03 1ssl s GLN 45 CO -0.01 -0.84 0.00 1.51 -0.55 0.00 0.00 175.29 175.40 1ssl n ILE 46 N 5.37 0.00 -5.16 -2.34 3.06 -1.26 -5.10 119.36 113.94 1ssl n ILE 46 Ca -0.01 0.00 -0.32 0.00 -2.50 0.00 0.00 62.75 59.93 1ssl n ILE 46 Cb 0.50 0.00 -0.15 0.00 0.54 0.00 0.00 39.64 40.53 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05