#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abm s TYR 3 N 0.00 3.42 0.49 1.57 2.02 -1.26 -5.07 117.35 118.53 3abm s TYR 3 Ca 0.00 0.02 -0.23 0.00 -0.37 0.00 0.00 57.07 56.49 3abm s TYR 3 Cb 0.00 -1.59 -0.07 0.00 -0.40 0.00 0.00 41.96 39.91 3abm s TYR 3 CO 0.00 0.48 1.36 -1.21 -1.57 0.00 0.00 175.55 174.61 3abm s GLU 4 N -3.66 3.45 0.13 -0.62 0.41 -1.26 -5.04 118.70 112.11 3abm s GLU 4 Ca 0.34 2.26 0.08 0.00 -0.41 0.00 0.00 54.97 57.24 3abm s GLU 4 Cb -0.10 -2.45 -0.04 0.00 -1.78 0.00 0.00 34.13 29.76 3abm s GLU 4 CO 0.28 -0.95 -0.19 -1.21 -0.49 0.00 0.00 175.26 172.70 3abm s GLU 5 N -2.67 1.19 0.00 1.61 2.02 -1.26 -4.62 118.70 114.96 3abm s GLU 5 Ca 0.66 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 54.37 3abm s GLU 5 Cb -0.40 -1.33 0.00 0.00 0.10 0.00 0.00 34.13 32.49 3abm s GLU 5 CO 0.50 0.29 0.00 0.41 0.02 0.00 0.00 175.26 176.48 3abm n GLY 6 N 0.68 1.92 3.59 -1.39 0.00 -1.26 -4.77 105.19 103.95 3abm n GLY 6 Ca -0.16 -2.04 -0.46 0.00 0.00 0.00 0.00 46.02 43.35 3abm n GLY 6 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3abm n PRO 7 N 0.82 1.31 -0.50 1.61 -0.02 -1.26 -0.46 135.00 136.49 3abm n PRO 7 Ca 0.00 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3abm n PRO 7 Cb 0.00 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3abm n PRO 7 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3abm n GLY 8 N 1.63 1.91 0.00 -1.23 0.00 -1.26 -4.77 105.19 101.46 3abm n GLY 8 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3abm n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3abm n LYS 9 N -2.00 5.89 -1.22 1.61 4.76 0.39 -4.60 118.16 122.99 3abm n LYS 9 Ca 0.00 -0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.13 3abm n LYS 9 Cb 0.00 -0.60 0.07 0.00 -1.84 0.00 0.00 35.03 32.66 3abm n LYS 9 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 3abm n ASN 10 N -1.08 7.36 -3.83 4.39 6.94 -1.20 -4.72 115.26 123.13 3abm n ASN 10 Ca 0.00 -3.61 -0.12 0.00 -0.02 0.00 0.00 54.58 50.83 3abm n ASN 10 Cb 0.02 -1.00 -0.09 0.00 -2.36 0.00 0.00 39.78 36.35 3abm n ASN 10 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3abm s ILE 11 N -4.20 0.08 -2.13 1.53 -4.36 -1.26 -5.05 121.20 105.80 3abm s ILE 11 Ca 0.57 -0.65 0.23 0.00 -0.26 0.00 0.00 60.65 60.53 3abm s ILE 11 Cb 0.45 -0.58 0.58 0.00 1.25 0.00 0.00 42.46 44.15 3abm s ILE 11 CO -0.01 -0.36 1.77 -0.81 0.24 0.00 0.00 174.94 175.77 3abm n PRO 12 N 1.24 1.27 -4.35 0.37 -0.04 -1.26 -4.85 135.00 127.39 3abm n PRO 12 Ca -0.22 -0.41 -0.23 0.00 -0.04 0.00 0.00 63.50 62.61 3abm n PRO 12 Cb 0.56 -1.38 -0.11 0.00 -0.04 0.00 0.00 33.50 32.53 3abm n PRO 12 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3abm s PHE 13 N -1.94 1.91 0.13 0.54 -0.12 -1.26 -5.12 117.98 112.11 3abm s PHE 13 Ca 0.34 -0.45 -0.26 0.00 -0.05 0.00 0.00 56.93 56.51 3abm s PHE 13 Cb 0.17 -0.95 -0.07 0.00 -0.63 0.00 0.00 43.02 41.53 3abm s PHE 13 CO 0.27 0.36 0.81 0.45 -0.05 0.00 0.00 175.22 177.06 3abm s SER 14 N -2.64 7.37 -0.17 1.98 0.15 -1.26 -4.94 113.70 114.19 3abm s SER 14 Ca 0.16 1.63 0.17 0.00 0.70 0.00 0.00 55.95 58.61 3abm s SER 14 Cb -0.06 -2.51 0.42 0.00 -1.71 0.00 0.00 66.02 62.16 3abm s SER 14 CO 0.07 0.12 1.30 1.33 1.20 0.00 0.00 173.24 177.26 3abm n VAL 15 N 2.09 2.14 -0.24 4.45 0.24 -1.26 -4.64 118.33 121.11 3abm n VAL 15 Ca -0.03 -2.22 -0.06 0.00 -2.04 0.00 0.00 64.34 59.99 3abm n VAL 15 Cb 0.49 -0.26 0.09 0.00 -1.47 0.00 0.00 33.84 32.69 3abm n VAL 15 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3abm h GLU 16 N 0.91 1.09 -4.92 7.34 4.57 -1.92 -3.40 114.58 118.25 3abm h GLU 16 Ca 0.02 -0.23 -0.62 0.00 -1.18 0.00 0.00 59.36 57.35 3abm h GLU 16 Cb 1.25 -0.16 -0.34 0.00 -0.16 0.00 0.00 28.75 29.34 3abm h GLU 16 CO 0.13 0.94 -0.85 1.21 -1.18 0.00 0.00 179.01 179.26 3abm s ASN 17 N -6.45 2.70 0.39 1.04 3.84 -1.26 -5.03 114.94 110.17 3abm s ASN 17 Ca -0.12 -0.50 0.28 0.00 0.21 0.00 0.00 52.86 52.74 3abm s ASN 17 Cb 0.15 -1.23 1.24 0.00 -0.55 0.00 0.00 41.25 40.87 3abm s ASN 17 CO 0.84 0.04 1.84 0.07 -2.79 0.00 0.00 177.10 177.10 3abm h LYS 18 N 7.37 0.00 0.06 0.43 2.10 -1.96 -0.19 116.57 124.39 3abm h LYS 18 Ca -0.31 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 57.97 3abm h LYS 18 Cb 1.18 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.47 3abm h LYS 18 CO 0.51 0.00 -2.09 0.91 -2.00 0.00 0.00 179.45 176.78 3abm n TRP 19 N -2.58 0.76 -0.26 0.07 7.02 -1.26 -1.51 117.44 119.68 3abm n TRP 19 Ca 0.01 0.19 0.02 0.00 -1.02 0.00 0.00 57.50 56.69 3abm n TRP 19 Cb 0.22 -1.09 0.14 0.00 -2.42 0.00 0.00 31.31 28.16 3abm n TRP 19 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 3abm h ARG 20 N -0.18 0.65 -0.42 -0.99 2.43 -1.95 -1.49 114.38 112.43 3abm h ARG 20 Ca -0.48 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 58.69 3abm h ARG 20 Cb 1.87 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 31.23 3abm h ARG 20 CO -0.05 0.43 0.18 1.25 -1.51 0.00 0.00 179.97 180.27 3abm h LEU 21 N 0.67 0.23 -0.20 3.80 5.85 -1.07 -1.29 115.31 123.29 3abm h LEU 21 Ca 0.36 0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.17 3abm h LEU 21 Cb 0.35 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.31 3abm h LEU 21 CO -0.25 0.17 -0.27 0.25 -0.34 0.00 0.00 178.44 177.99 3abm h LEU 22 N 0.36 -0.86 -1.07 2.25 5.85 -1.01 0.10 115.31 120.94 3abm h LEU 22 Ca 0.19 0.14 0.08 0.00 0.84 0.00 0.00 57.88 59.13 3abm h LEU 22 Cb 0.14 0.39 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 3abm h LEU 22 CO -0.16 -0.31 0.62 0.00 -0.34 0.00 0.00 178.44 178.25 3abm h ALA 23 N 0.65 1.49 -0.02 1.25 0.00 -0.90 -1.21 119.26 120.52 3abm h ALA 23 Ca 0.12 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 3abm h ALA 23 Cb 0.49 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 18.04 3abm h ALA 23 CO -0.38 0.34 -1.01 0.52 0.00 0.00 0.00 179.25 178.73 3abm h MET 24 N 1.07 0.69 -0.86 0.00 2.86 -0.01 -2.45 114.93 116.23 3abm h MET 24 Ca 0.43 -0.72 -0.03 0.00 -2.06 0.00 0.00 59.70 57.33 3abm h MET 24 Cb 0.27 0.20 -0.04 0.00 0.06 0.00 0.00 31.60 32.09 3abm h MET 24 CO -0.19 1.30 0.44 0.52 1.06 0.00 0.00 176.91 180.04 3abm h MET 25 N 0.40 1.21 -0.08 1.72 2.07 -0.66 -1.16 114.93 118.44 3abm h MET 25 Ca -0.12 -0.16 0.00 0.00 -2.07 0.00 0.00 59.70 57.35 3abm h MET 25 Cb 1.66 -0.23 -0.00 0.00 -1.87 0.00 0.00 31.60 31.15 3abm h MET 25 CO 0.20 0.91 0.04 1.15 1.07 0.00 0.00 176.91 180.28 3abm h THR 26 N 1.21 1.01 -0.65 2.22 2.02 -1.20 0.01 112.91 117.53 3abm h THR 26 Ca 0.30 -0.03 -0.06 0.00 0.77 0.00 0.00 66.41 67.39 3abm h THR 26 Cb 0.08 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 3abm h THR 26 CO -0.04 0.02 0.18 -0.07 0.37 0.00 0.00 175.52 175.98 3abm h LEU 27 N 0.09 0.94 0.27 2.58 3.38 -1.36 0.24 115.31 121.46 3abm h LEU 27 Ca 0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3abm h LEU 27 Cb -0.00 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3abm h LEU 27 CO -0.01 0.89 -0.13 0.15 0.09 0.00 0.00 178.44 179.42 3abm h PHE 28 N 0.96 -0.34 -0.65 1.13 3.57 -1.05 -0.42 116.94 120.15 3abm h PHE 28 Ca 0.21 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.62 3abm h PHE 28 Cb 0.30 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3abm h PHE 28 CO 0.02 -0.21 0.08 0.74 -2.23 0.00 0.00 178.31 176.71 3abm h PHE 29 N -0.44 1.15 -0.71 0.41 -1.00 -1.13 -3.06 116.94 112.16 3abm h PHE 29 Ca -0.04 -0.16 0.10 0.00 2.81 0.00 0.00 57.97 60.68 3abm h PHE 29 Cb 0.28 -0.31 -0.07 0.00 3.61 0.00 0.00 35.95 39.45 3abm h PHE 29 CO 0.12 0.98 0.34 0.78 -1.61 0.00 0.00 178.31 178.92 3abm h GLY 30 N 1.04 1.06 1.18 -1.45 0.00 -1.05 -1.33 103.07 102.52 3abm h GLY 30 Ca 0.19 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 3abm h GLY 30 CO 0.02 0.04 0.02 1.48 0.00 0.00 0.00 176.54 178.09 3abm h SER 31 N 0.57 0.96 -0.20 0.19 4.64 -1.00 -1.03 113.55 117.69 3abm h SER 31 Ca 0.35 -0.26 -0.02 0.00 -0.47 0.00 0.00 61.79 61.40 3abm h SER 31 Cb 0.40 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3abm h SER 31 CO -0.29 1.01 0.05 1.23 -0.87 0.00 0.00 176.83 177.97 3abm h GLY 32 N 1.00 0.34 1.53 -0.77 0.00 -1.39 -1.04 103.07 102.74 3abm h GLY 32 Ca 0.17 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 3abm h GLY 32 CO 0.02 0.19 -0.02 -2.75 0.00 0.00 0.00 176.54 173.99 3abm h PHE 33 N 0.14 0.61 0.03 5.60 3.57 -1.15 -2.95 116.94 122.79 3abm h PHE 33 Ca 0.06 -0.07 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 3abm h PHE 33 Cb 0.25 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 3abm h PHE 33 CO 0.01 0.60 -1.00 0.00 -2.23 0.00 0.00 178.31 175.68 3abm h ALA 34 N 1.44 0.37 -0.35 2.41 0.00 -0.88 -3.36 119.26 118.89 3abm h ALA 34 Ca 0.11 -0.84 0.07 0.00 0.00 0.00 0.00 54.91 54.25 3abm h ALA 34 Cb 0.38 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 3abm h ALA 34 CO 0.01 1.08 -0.04 0.00 0.00 0.00 0.00 179.25 180.30 3abm h ALA 35 N 0.92 0.28 -0.52 0.00 0.00 -1.01 -1.67 119.26 117.26 3abm h ALA 35 Ca -0.05 0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3abm h ALA 35 Cb 1.71 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 3abm h ALA 35 CO 0.14 -0.43 0.35 -1.35 0.00 0.00 0.00 179.25 177.96 3abm h PRO 36 N 0.05 0.50 -0.73 0.00 0.11 -1.74 -1.00 132.00 129.19 3abm h PRO 36 Ca 0.17 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3abm h PRO 36 Cb 0.25 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.21 3abm h PRO 36 CO -0.32 0.33 0.47 0.74 -0.21 0.00 0.00 178.00 179.01 3abm h PHE 37 N 0.52 0.93 0.00 0.65 -1.00 -1.54 -0.51 116.94 115.99 3abm h PHE 37 Ca 0.22 0.02 -0.16 0.00 2.81 0.00 0.00 57.97 60.86 3abm h PHE 37 Cb 0.22 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.45 3abm h PHE 37 CO -0.00 0.60 -0.83 0.74 -1.61 0.00 0.00 178.31 177.21 3abm h PHE 38 N 0.99 0.00 -0.22 -0.55 -1.00 -0.92 -1.93 116.94 113.32 3abm h PHE 38 Ca 0.27 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.86 3abm h PHE 38 Cb -0.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.47 3abm h PHE 38 CO 0.00 0.71 -0.58 0.82 -1.61 0.00 0.00 178.31 177.64 3abm h ILE 39 N 0.00 1.29 -0.43 -0.55 2.04 -0.93 0.28 117.51 119.21 3abm h ILE 39 Ca -0.04 -1.79 0.04 0.00 1.00 0.00 0.00 64.86 64.07 3abm h ILE 39 Cb 1.57 1.82 -0.04 0.00 -0.74 0.00 0.00 36.82 39.44 3abm h ILE 39 CO 0.09 0.57 0.21 0.58 0.00 0.00 0.00 178.15 179.60 3abm h VAL 40 N 0.52 0.97 -0.54 1.67 2.07 -1.07 -0.51 116.25 119.36 3abm h VAL 40 Ca -0.01 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3abm h VAL 40 Cb 1.20 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3abm h VAL 40 CO 0.13 0.08 0.34 -0.09 0.02 0.00 0.00 177.57 178.05 3abm h ARG 41 N 0.43 0.72 -0.47 1.57 2.43 -1.28 0.88 114.38 118.67 3abm h ARG 41 Ca 0.19 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 3abm h ARG 41 Cb 0.10 -0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 29.42 3abm h ARG 41 CO -0.13 0.50 0.09 1.25 -1.51 0.00 0.00 179.97 180.17 3abm h HIS 42 N 0.73 0.15 -0.29 2.20 2.76 -0.54 0.30 115.15 120.45 3abm h HIS 42 Ca 0.20 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.35 3abm h HIS 42 Cb -0.05 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 3abm h HIS 42 CO -0.03 -0.00 -0.00 1.96 -1.30 0.00 0.00 177.93 178.56 3abm h GLN 43 N 0.23 0.52 -0.97 5.26 1.08 -0.48 -3.07 115.11 117.68 3abm h GLN 43 Ca 0.23 -0.17 0.01 0.00 -1.45 0.00 0.00 58.65 57.27 3abm h GLN 43 Cb 0.30 -0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.63 3abm h GLN 43 CO -0.30 0.67 0.64 -0.07 -0.95 0.00 0.00 178.83 178.81 3abm h LEU 44 N 0.31 1.11 -0.28 1.46 3.38 -0.38 -2.13 115.31 118.78 3abm h LEU 44 Ca 0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3abm h LEU 44 Cb 0.43 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3abm h LEU 44 CO 0.02 0.81 0.00 0.18 0.09 0.00 0.00 178.44 179.53 3abm n LEU 45 N -4.41 0.27 -0.08 1.67 4.77 0.10 -3.94 117.00 115.38 3abm n LEU 45 Ca 0.11 -0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.78 3abm n LEU 45 Cb 0.01 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 40.91 3abm n LEU 45 CO 0.37 0.07 -1.07 1.17 -1.33 0.00 0.00 177.39 176.60 3abm n LYS 46 N -0.35 0.35 0.00 3.23 4.81 -0.80 -5.04 118.16 120.35 3abm n LYS 46 Ca 0.00 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 3abm n LYS 46 Cb 0.07 -1.08 0.00 0.00 0.02 0.00 0.00 35.03 34.03 3abm n LYS 46 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74