#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 -0.01 1.61 7.64 -1.26 -4.89 113.62 116.71 1ssl n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ssl n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 -2.09 0.00 -3.91 -0.43 0.00 -1.26 -4.63 120.51 108.19 1ssl n ALA 3 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1ssl n ALA 3 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1ssl n ALA 3 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1ssl s MET 4 N 0.00 1.37 0.01 0.00 1.00 -1.26 -4.97 119.30 115.45 1ssl s MET 4 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 55.69 54.48 1ssl s MET 4 Cb 0.00 -2.59 0.00 0.00 0.00 0.00 0.00 34.83 32.24 1ssl s MET 4 CO 0.00 -0.77 0.00 0.41 0.00 0.00 0.00 175.02 174.66 1ssl n GLY 5 N 4.62 0.03 0.16 -0.03 0.00 -1.26 -4.47 105.19 104.23 1ssl n GLY 5 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 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 0.24 0.00 0.00 0.00 3.08 -1.88 -0.73 114.38 115.08 1ssl h ARG 7 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1ssl h ARG 7 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1ssl h ARG 7 CO -0.20 0.00 -0.41 1.58 -1.07 0.00 0.00 179.97 179.87 1ssl n HIS 8 N -2.80 0.35 -1.57 3.04 -0.00 0.93 -4.88 115.22 110.29 1ssl n HIS 8 Ca -0.00 0.10 -0.29 0.00 0.46 0.00 0.00 57.72 57.99 1ssl n HIS 8 Cb 0.19 -0.55 0.16 0.00 -0.12 0.00 0.00 29.99 29.68 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 -3.08 1.94 0.00 1.57 0.08 -0.28 -5.02 117.98 113.18 1ssl s PHE 9 Ca 0.09 0.65 0.00 0.00 0.12 0.00 0.00 56.93 57.79 1ssl s PHE 9 Cb 0.15 -3.58 0.00 0.00 -0.57 0.00 0.00 43.02 39.02 1ssl s PHE 9 CO 0.67 -2.68 0.00 0.00 -0.10 0.00 0.00 175.22 173.10 1ssl n GLN 10 N -3.93 2.07 -1.24 0.44 10.64 -1.26 -4.98 117.38 119.13 1ssl n GLN 10 Ca 0.10 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.27 1ssl n GLN 10 Cb 0.59 -0.95 0.00 0.00 -0.86 0.00 0.00 30.24 29.02 1ssl n GLN 10 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1ssl n SER 11 N -2.09 1.40 0.07 2.61 7.64 -1.26 -4.75 113.62 117.24 1ssl n SER 11 Ca 0.00 -0.73 0.12 0.00 1.01 0.00 0.00 58.87 59.27 1ssl n SER 11 Cb 0.45 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.74 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 -1.58 0.55 0.00 0.02 -1.96 -1.86 113.55 108.72 1ssl h SER 13 Ca 0.00 0.17 -0.22 0.00 -0.84 0.00 0.00 61.79 60.90 1ssl h SER 13 Cb 0.83 0.59 -0.00 0.00 0.14 0.00 0.00 62.40 63.96 1ssl h SER 13 CO 0.00 -0.52 -0.99 -0.61 -1.14 0.00 0.00 176.83 173.57 1ssl h GLN 14 N -0.69 0.26 -1.10 3.45 5.75 -1.95 0.32 115.11 121.15 1ssl h GLN 14 Ca 0.00 -0.33 0.30 0.00 -0.15 0.00 0.00 58.65 58.48 1ssl h GLN 14 Cb 0.72 0.10 -0.10 0.00 1.07 0.00 0.00 27.48 29.27 1ssl h GLN 14 CO -0.31 1.06 0.72 0.00 -2.65 0.00 0.00 178.83 177.65 1ssl n LEU 16 N -4.60 0.26 -0.16 0.00 4.32 -0.73 -4.51 117.00 111.59 1ssl n LEU 16 Ca 0.27 -0.32 0.14 0.00 -0.02 0.00 0.00 56.01 56.08 1ssl n LEU 16 Cb 1.01 0.00 0.59 0.00 -1.62 0.00 0.00 43.42 43.40 1ssl n LEU 16 CO 0.26 0.07 0.85 -0.24 -1.22 0.00 0.00 177.39 177.11 1ssl n SER 17 N -1.42 0.61 -3.11 -1.43 2.88 0.10 -4.23 113.62 107.02 1ssl n SER 17 Ca 0.00 -0.73 -0.16 0.00 -1.33 0.00 0.00 58.87 56.65 1ssl n SER 17 Cb 0.17 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.59 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 -0.81 1.54 0.13 -1.46 0.00 -0.74 -4.93 120.51 114.24 1ssl n ALA 18 Ca 0.15 -3.08 -0.01 0.00 0.00 0.00 0.00 53.44 50.50 1ssl n ALA 18 Cb 0.28 -0.97 0.14 0.00 0.00 0.00 0.00 19.45 18.90 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 3.00 0.00 0.00 0.00 0.13 -1.81 -3.10 132.00 130.22 1ssl h PRO 19 Ca 0.07 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.16 1ssl h PRO 19 Cb 0.99 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1ssl h PRO 19 CO 0.44 0.64 -0.18 -1.00 -0.23 0.00 0.00 178.00 177.68 1ssl h PRO 20 N 0.00 0.00 -0.51 1.56 0.13 -1.95 -3.04 132.00 128.19 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 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ssl h PRO 20 CO 0.08 0.18 0.00 1.19 -0.23 0.00 0.00 178.00 179.22 1ssl n PHE 21 N -3.21 0.67 -3.75 1.56 3.72 -1.20 -4.99 117.46 110.26 1ssl n PHE 21 Ca 0.02 -0.34 -0.04 0.00 -0.05 0.00 0.00 57.45 57.04 1ssl n PHE 21 Cb 0.50 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.03 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 1.57 0.00 0.00 -4.37 0.24 -1.15 -4.60 118.33 110.03 1ssl n VAL 22 Ca 0.21 -0.55 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1ssl n VAL 22 Cb 0.62 0.33 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 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 -0.17 1.67 -0.77 7.34 7.27 -1.26 -4.85 117.38 126.60 1ssl n GLN 23 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 56.79 1ssl n GLN 23 Cb 0.17 -0.53 0.23 0.00 2.41 0.00 0.00 30.24 32.53 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 0.12 2.64 3.82 0.00 0.00 -0.27 -4.84 105.19 106.66 1ssl n GLY 25 Ca 0.04 -1.64 -0.37 0.00 0.00 0.00 0.00 46.02 44.05 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 -3.31 3.74 -0.32 1.61 -0.11 0.11 0.31 118.94 120.96 1ssl s TRP 26 Ca 0.24 1.27 -0.01 0.00 1.22 0.00 0.00 56.10 58.82 1ssl s TRP 26 Cb -0.00 -2.51 0.10 0.00 -1.50 0.00 0.00 33.47 29.57 1ssl s TRP 26 CO 0.17 0.50 0.12 0.00 -4.62 0.00 0.00 176.95 173.12 1ssl n HIS 28 N 4.75 -0.92 0.00 0.00 8.25 -1.26 -3.22 115.22 122.82 1ssl n HIS 28 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1ssl n HIS 28 Cb 0.41 -0.72 0.00 0.00 1.12 0.00 0.00 29.99 30.80 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 0.23 0.00 -5.01 0.41 5.68 -1.26 -5.15 116.55 111.46 1ssl n ASP 29 Ca 0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 54.79 54.11 1ssl n ASP 29 Cb 0.10 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.11 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 2.64 -0.52 0.11 2.20 -1.20 -5.01 119.74 117.97 1ssl s LYS 30 Ca 0.00 -1.31 -0.18 0.00 -0.36 0.00 0.00 55.97 54.11 1ssl s LYS 30 Cb 0.00 -2.70 0.07 0.00 -1.51 0.00 0.00 37.83 33.69 1ssl s LYS 30 CO 0.00 -0.48 0.60 0.00 -0.36 0.00 0.00 175.35 175.11 1ssl s VAL 32 N 2.45 0.00 0.35 0.00 -7.23 0.90 -4.66 120.40 112.20 1ssl s VAL 32 Ca 0.12 -1.26 0.08 0.00 -1.81 0.00 0.00 61.98 59.11 1ssl s VAL 32 Cb -0.21 -2.58 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 1ssl s VAL 32 CO 0.10 0.00 0.19 -0.60 -0.31 0.00 0.00 175.10 174.48 1ssl s ARG 33 N -3.04 2.44 0.32 4.82 3.52 -1.26 -1.11 118.95 124.64 1ssl s ARG 33 Ca 0.21 -1.52 0.06 0.00 -0.13 0.00 0.00 55.73 54.35 1ssl s ARG 33 Cb -0.03 -2.23 0.87 0.00 -1.56 0.00 0.00 34.95 31.99 1ssl s ARG 33 CO 0.13 0.07 1.54 0.45 -0.81 0.00 0.00 175.30 176.68 1ssl n SER 34 N -1.23 -0.02 0.19 -2.12 2.88 -1.26 0.27 113.62 112.33 1ssl n SER 34 Ca -0.02 1.66 0.12 0.00 -1.33 0.00 0.00 58.87 59.29 1ssl n SER 34 Cb 0.61 -0.64 0.62 0.00 -0.75 0.00 0.00 64.21 64.05 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 0.00 0.00 -1.46 4.81 -1.96 -1.71 114.58 114.26 1ssl h GLU 35 Ca 0.64 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.87 1ssl h GLU 35 Cb 1.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.80 1ssl h GLU 35 CO -0.89 0.00 -0.62 -1.91 -0.73 0.00 0.00 179.01 174.86 1ssl n GLU 36 N -2.33 3.09 -2.33 1.92 4.07 0.75 -5.02 120.64 120.78 1ssl n GLU 36 Ca -0.02 -0.01 -0.38 0.00 -0.06 0.00 0.00 57.16 56.69 1ssl n GLU 36 Cb 0.12 -0.84 -0.02 0.00 -0.06 0.00 0.00 31.44 30.63 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 2.72 -0.60 0.00 0.00 3.38 -1.92 -3.46 115.31 115.44 1ssl h LEU 38 Ca -0.49 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.43 1ssl h LEU 38 Cb 1.23 0.15 0.01 0.00 0.09 0.00 0.00 40.66 42.14 1ssl h LEU 38 CO 0.63 -0.20 0.02 -1.20 0.09 0.00 0.00 178.44 177.78 1ssl n SER 39 N -5.26 -0.02 -2.55 -0.43 7.64 -1.26 -4.95 113.62 106.79 1ssl n SER 39 Ca -0.10 -1.01 -0.37 0.00 1.01 0.00 0.00 58.87 58.41 1ssl n SER 39 Cb 0.31 -0.04 0.06 0.00 -1.01 0.00 0.00 64.21 63.53 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 4.62 5.75 3.10 0.23 0.00 -1.26 -4.93 105.19 112.70 1ssl n GLY 40 Ca 0.01 -2.39 -0.23 0.00 0.00 0.00 0.00 46.02 43.41 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 -4.93 1.12 -0.02 2.61 -1.32 -1.26 -5.13 115.64 106.71 1ssl s THR 41 Ca 0.60 -0.58 -0.00 0.00 -1.21 0.00 0.00 61.69 60.49 1ssl s THR 41 Cb 0.48 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 70.54 1ssl s THR 41 CO -0.17 0.32 0.03 0.86 -2.21 0.00 0.00 174.62 173.45 1ssl s TRP 42 N -0.16 0.02 0.12 9.09 -0.00 -1.26 -4.83 118.94 121.92 1ssl s TRP 42 Ca 0.02 0.11 0.08 0.00 -0.00 0.00 0.00 56.10 56.32 1ssl s TRP 42 Cb -0.07 -0.19 -0.04 0.00 -0.00 0.00 0.00 33.47 33.17 1ssl s TRP 42 CO 0.00 -0.07 -0.20 -0.08 -0.00 0.00 0.00 176.95 176.59 1ssl s THR 43 N 0.86 1.78 -0.04 5.86 -1.32 0.11 -5.02 115.64 117.86 1ssl s THR 43 Ca -0.07 -1.66 0.10 0.00 -1.21 0.00 0.00 61.69 58.85 1ssl s THR 43 Cb -0.10 -1.66 0.19 0.00 -1.51 0.00 0.00 72.50 69.41 1ssl s THR 43 CO -0.02 -0.12 1.08 0.00 -2.21 0.00 0.00 174.62 173.34 1ssl n GLN 44 N 0.85 0.36 -3.42 7.08 -0.00 -1.26 0.04 117.38 121.02 1ssl n GLN 44 Ca -0.18 -1.70 -0.16 0.00 -0.00 0.00 0.00 57.00 54.96 1ssl n GLN 44 Cb 0.54 -0.65 -0.10 0.00 -0.00 0.00 0.00 30.24 30.03 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 -0.77 0.29 0.17 2.61 2.00 -1.26 -4.88 119.66 117.82 1ssl s GLN 45 Ca 0.17 0.07 0.00 0.00 -2.00 0.00 0.00 55.36 53.59 1ssl s GLN 45 Cb 0.17 -0.80 0.00 0.00 0.80 0.00 0.00 33.01 33.18 1ssl s GLN 45 CO -0.04 -0.86 0.00 1.51 -0.50 0.00 0.00 175.29 175.40 1ssl n ILE 46 N 5.32 0.00 -2.71 -2.34 3.06 -1.26 -5.12 119.36 116.31 1ssl n ILE 46 Ca -0.03 0.00 -0.30 0.00 -2.50 0.00 0.00 62.75 59.92 1ssl n ILE 46 Cb 0.48 -0.24 -0.03 0.00 0.54 0.00 0.00 39.64 40.39 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05