#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 -0.04 0.00 1.61 0.01 -1.26 -5.07 113.70 108.94 1ssl s SER 2 Ca 0.00 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.21 1ssl s SER 2 Cb 0.00 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.49 1ssl s SER 2 CO 0.00 -0.32 0.00 0.00 0.41 0.00 0.00 173.24 173.33 1ssl n ALA 3 N 1.74 0.00 -3.89 1.44 0.00 -1.26 -4.05 120.51 114.49 1ssl n ALA 3 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.93 1ssl n ALA 3 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 1ssl n ALA 3 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ssl n MET 4 N 0.00 -4.70 0.00 0.00 2.81 -1.26 -4.79 117.12 109.19 1ssl n MET 4 Ca 0.00 0.54 0.00 0.00 -1.81 0.00 0.00 57.70 56.43 1ssl n MET 4 Cb 0.00 -5.37 0.00 0.00 -0.71 0.00 0.00 33.22 27.14 1ssl n MET 4 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ssl n GLY 5 N -1.55 0.12 0.05 3.03 0.00 -1.26 -4.87 105.19 100.71 1ssl n GLY 5 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.12 0.18 0.00 0.00 3.00 -1.26 -2.22 116.66 114.24 1ssl n ARG 7 Ca 0.02 0.49 0.03 0.00 -0.00 0.00 0.00 57.85 58.39 1ssl n ARG 7 Cb 0.46 -1.90 0.01 0.00 0.00 0.00 0.00 32.46 31.03 1ssl n ARG 7 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.63 175.24 1ssl n HIS 8 N -2.24 0.00 -0.36 -0.14 1.44 -1.25 -4.98 115.22 107.68 1ssl n HIS 8 Ca 0.01 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.42 1ssl n HIS 8 Cb 0.17 0.00 0.29 0.00 0.12 0.00 0.00 29.99 30.57 1ssl n HIS 8 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1ssl s PHE 9 N -0.89 -0.41 0.00 -1.40 0.08 -0.94 -5.02 117.98 109.39 1ssl s PHE 9 Ca 0.06 0.66 0.00 0.00 0.12 0.00 0.00 56.93 57.77 1ssl s PHE 9 Cb 0.05 -2.90 0.00 0.00 -0.57 0.00 0.00 43.02 39.60 1ssl s PHE 9 CO 0.14 -4.91 0.00 1.04 -0.10 0.00 0.00 175.22 171.39 1ssl n GLN 10 N -5.59 0.00 0.00 0.44 6.02 -1.26 -5.03 117.38 111.95 1ssl n GLN 10 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1ssl n GLN 10 Cb 0.59 -0.07 0.00 0.00 1.02 0.00 0.00 30.24 31.78 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 -0.08 0.00 -0.54 1.08 7.64 -1.26 -4.96 113.62 115.50 1ssl n SER 11 Ca 0.00 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.02 1ssl n SER 11 Cb 0.00 0.00 0.47 0.00 -1.01 0.00 0.00 64.21 63.67 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 2.67 -0.84 0.96 0.00 0.02 -1.94 -2.74 113.55 111.67 1ssl h SER 13 Ca 0.00 0.03 -0.16 0.00 -0.84 0.00 0.00 61.79 60.82 1ssl h SER 13 Cb 0.57 0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.30 1ssl h SER 13 CO 0.00 -0.50 -0.76 -0.61 -1.14 0.00 0.00 176.83 173.82 1ssl h GLN 14 N -1.21 0.00 -0.69 3.45 5.75 -1.95 -0.95 115.11 119.52 1ssl h GLN 14 Ca -0.10 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.47 1ssl h GLN 14 Cb 0.76 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 29.25 1ssl h GLN 14 CO 0.17 0.76 0.37 0.00 -2.65 0.00 0.00 178.83 177.47 1ssl n LEU 16 N -4.82 1.71 0.00 0.00 4.32 -1.04 -4.19 117.00 112.99 1ssl n LEU 16 Ca 0.09 -0.73 0.12 0.00 -0.02 0.00 0.00 56.01 55.47 1ssl n LEU 16 Cb 0.21 0.00 0.23 0.00 -1.62 0.00 0.00 43.42 42.24 1ssl n LEU 16 CO 0.27 0.33 0.43 -0.24 -1.22 0.00 0.00 177.39 176.96 1ssl n SER 17 N -0.22 0.53 -3.11 -1.43 2.88 -0.36 -4.40 113.62 107.51 1ssl n SER 17 Ca 0.07 -0.27 -0.19 0.00 -1.33 0.00 0.00 58.87 57.15 1ssl n SER 17 Cb 0.39 0.28 -0.03 0.00 -0.75 0.00 0.00 64.21 64.10 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 -1.51 1.61 0.14 -1.46 0.00 -0.59 -4.95 120.51 113.75 1ssl n ALA 18 Ca 0.05 -3.04 -0.00 0.00 0.00 0.00 0.00 53.44 50.46 1ssl n ALA 18 Cb 0.34 -0.94 0.16 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 3.53 0.00 0.00 0.00 0.13 -1.77 -3.15 132.00 130.75 1ssl h PRO 19 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1ssl h PRO 19 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1ssl h PRO 19 CO 0.43 0.60 0.00 -1.00 -0.23 0.00 0.00 178.00 177.81 1ssl h PRO 20 N 0.00 0.00 -0.54 1.56 0.13 -1.95 -2.95 132.00 128.25 1ssl h PRO 20 Ca -0.01 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.95 1ssl h PRO 20 Cb 1.17 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 1ssl h PRO 20 CO 0.08 0.00 0.15 1.19 -0.23 0.00 0.00 178.00 179.18 1ssl n PHE 21 N -2.96 1.76 -3.58 1.56 3.72 -1.19 -4.87 117.46 111.91 1ssl n PHE 21 Ca 0.02 -1.28 -0.03 0.00 -0.05 0.00 0.00 57.45 56.11 1ssl n PHE 21 Cb 0.39 -0.56 -0.00 0.00 -0.94 0.00 0.00 39.48 38.36 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 -0.59 0.00 0.00 -4.37 0.24 -1.12 -4.47 118.33 108.02 1ssl n VAL 22 Ca 0.36 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 1ssl n VAL 22 Cb 1.20 0.25 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 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 -0.14 0.00 -0.85 7.34 7.27 -1.26 -4.40 117.38 125.35 1ssl n GLN 23 Ca -0.00 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.77 1ssl n GLN 23 Cb 0.14 -0.34 0.24 0.00 2.41 0.00 0.00 30.24 32.69 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 -0.16 2.84 3.78 0.00 0.00 -0.05 -4.85 105.19 106.75 1ssl n GLY 25 Ca 0.09 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.92 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 -3.18 3.73 -0.32 1.61 -0.11 0.14 0.29 118.94 121.11 1ssl s TRP 26 Ca 0.33 1.26 -0.01 0.00 1.22 0.00 0.00 56.10 58.89 1ssl s TRP 26 Cb 0.01 -2.60 0.10 0.00 -1.50 0.00 0.00 33.47 29.49 1ssl s TRP 26 CO 0.23 0.42 0.11 0.00 -4.62 0.00 0.00 176.95 173.10 1ssl n HIS 28 N 4.81 0.00 0.00 0.00 8.25 -1.26 -3.39 115.22 123.63 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 -0.98 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 1.50 0.00 -5.00 0.41 5.68 -1.26 -5.15 116.55 112.73 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 0.15 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.14 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 2.79 -0.54 0.11 2.20 -1.22 -5.02 119.74 118.06 1ssl s LYS 30 Ca 0.00 -1.17 -0.21 0.00 -0.36 0.00 0.00 55.97 54.23 1ssl s LYS 30 Cb 0.00 -2.72 0.06 0.00 -1.51 0.00 0.00 37.83 33.66 1ssl s LYS 30 CO 0.00 -0.34 0.78 0.00 -0.36 0.00 0.00 175.35 175.43 1ssl s VAL 32 N 3.26 0.00 0.43 0.00 -7.23 0.85 -4.58 120.40 113.13 1ssl s VAL 32 Ca 0.21 -1.64 0.07 0.00 -1.81 0.00 0.00 61.98 58.81 1ssl s VAL 32 Cb -0.17 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 1ssl s VAL 32 CO 0.14 0.00 0.28 -0.60 -0.31 0.00 0.00 175.10 174.61 1ssl s ARG 33 N -4.06 2.34 0.65 4.82 3.52 -1.26 -0.87 118.95 124.10 1ssl s ARG 33 Ca 0.29 -1.76 0.19 0.00 -0.13 0.00 0.00 55.73 54.32 1ssl s ARG 33 Cb 0.02 -2.14 0.98 0.00 -1.56 0.00 0.00 34.95 32.26 1ssl s ARG 33 CO 0.10 -0.21 1.55 1.03 -0.81 0.00 0.00 175.30 176.96 1ssl h SER 34 N 1.20 0.00 0.78 -2.12 0.87 -1.92 1.14 113.55 113.49 1ssl h SER 34 Ca -0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1ssl h SER 34 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1ssl h SER 34 CO 0.64 0.00 -0.68 -0.62 -0.53 0.00 0.00 176.83 175.64 1ssl n GLU 35 N -2.84 0.27 0.00 2.24 1.02 -1.26 -4.15 120.64 115.92 1ssl n GLU 35 Ca 0.01 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1ssl n GLU 35 Cb 0.70 -1.66 -0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1ssl n GLU 35 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ssl n GLU 36 N -2.05 5.74 -2.35 3.49 -0.58 0.36 -5.04 120.64 120.21 1ssl n GLU 36 Ca 0.03 -0.07 -0.29 0.00 -0.42 0.00 0.00 57.16 56.41 1ssl n GLU 36 Cb 0.43 -0.61 0.00 0.00 -0.57 0.00 0.00 31.44 30.70 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 -2.45 0.40 -4.69 0.00 0.00 -1.26 -4.84 117.00 104.16 1ssl n LEU 38 Ca 0.03 0.63 -0.30 0.00 0.00 0.00 0.00 56.01 56.37 1ssl n LEU 38 Cb 0.55 -0.30 0.24 0.00 0.00 0.00 0.00 43.42 43.90 1ssl n LEU 38 CO 0.55 -0.30 0.71 -0.44 0.00 0.00 0.00 177.39 177.91 1ssl s SER 39 N -2.07 1.32 -0.06 1.96 0.01 -1.26 -4.90 113.70 108.70 1ssl s SER 39 Ca 0.00 0.41 0.07 0.00 1.31 0.00 0.00 55.95 57.74 1ssl s SER 39 Cb 0.00 -0.51 0.29 0.00 0.21 0.00 0.00 66.02 66.02 1ssl s SER 39 CO 0.00 -3.86 1.07 0.61 0.41 0.00 0.00 173.24 171.48 1ssl n GLY 40 N -1.86 1.38 3.85 3.44 0.00 -1.26 -4.87 105.19 105.86 1ssl n GLY 40 Ca 0.15 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.66 4.86 -0.16 2.61 -4.23 -1.26 -4.97 115.64 110.84 1ssl s THR 41 Ca 0.20 0.76 -0.08 0.00 -1.18 0.00 0.00 61.69 61.39 1ssl s THR 41 Cb 0.14 -3.71 0.06 0.00 1.34 0.00 0.00 72.50 70.33 1ssl s THR 41 CO 0.09 0.16 0.37 0.86 -0.54 0.00 0.00 174.62 175.56 1ssl s TRP 42 N -1.55 -0.55 0.12 3.99 -0.00 -1.26 -4.77 118.94 114.90 1ssl s TRP 42 Ca 0.40 1.19 0.07 0.00 -0.00 0.00 0.00 56.10 57.76 1ssl s TRP 42 Cb -0.14 0.21 -0.04 0.00 -0.00 0.00 0.00 33.47 33.51 1ssl s TRP 42 CO 0.20 -0.33 -0.16 -0.08 -0.00 0.00 0.00 176.95 176.57 1ssl s THR 43 N 1.50 1.47 -0.23 5.86 -1.32 -0.37 -5.01 115.64 117.54 1ssl s THR 43 Ca -0.09 -1.64 0.18 0.00 -1.21 0.00 0.00 61.69 58.94 1ssl s THR 43 Cb -0.09 -1.51 0.48 0.00 -1.51 0.00 0.00 72.50 69.87 1ssl s THR 43 CO -0.12 -0.28 1.15 0.00 -2.21 0.00 0.00 174.62 173.16 1ssl n GLN 44 N 0.76 2.01 -3.33 7.08 6.02 -1.26 0.23 117.38 128.88 1ssl n GLN 44 Ca -0.17 -3.48 -0.10 0.00 -0.01 0.00 0.00 57.00 53.24 1ssl n GLN 44 Cb 0.56 -1.58 -0.07 0.00 1.02 0.00 0.00 30.24 30.16 1ssl n GLN 44 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1ssl s GLN 45 N -3.21 0.38 0.00 -1.09 0.74 -1.26 -4.93 119.66 110.29 1ssl s GLN 45 Ca 0.35 0.23 0.00 0.00 0.05 0.00 0.00 55.36 55.99 1ssl s GLN 45 Cb 0.36 -0.42 0.00 0.00 1.10 0.00 0.00 33.01 34.04 1ssl s GLN 45 CO -0.04 -0.90 0.00 -0.89 -0.55 0.00 0.00 175.29 172.92 1ssl n ILE 46 N 5.35 0.00 -2.58 -2.34 2.08 -1.26 -5.08 119.36 115.54 1ssl n ILE 46 Ca -0.01 0.00 -0.43 0.00 0.56 0.00 0.00 62.75 62.87 1ssl n ILE 46 Cb 0.49 -0.04 -0.02 0.00 -0.75 0.00 0.00 39.64 39.32 1ssl n ILE 46 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11