#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r7d s GLY 2 N 0.00 2.12 0.16 0.23 0.00 -1.26 -5.08 107.32 103.49 1r7d s GLY 2 Ca 0.00 -0.83 -0.30 0.00 0.00 0.00 0.00 44.72 43.59 1r7d s GLY 2 CO 0.00 -0.73 0.96 -0.45 0.00 0.00 0.00 173.10 172.88 1r7d s SER 3 N -1.99 7.55 -0.16 1.64 0.15 -1.26 -4.96 113.70 114.68 1r7d s SER 3 Ca 0.27 1.86 -0.01 0.00 0.70 0.00 0.00 55.95 58.77 1r7d s SER 3 Cb -0.12 -2.60 -0.09 0.00 -1.71 0.00 0.00 66.02 61.50 1r7d s SER 3 CO 0.19 0.02 -0.16 1.87 1.20 0.00 0.00 173.24 176.36 1r7d n TRP 4 N 2.27 0.00 -0.07 3.44 -0.00 -1.26 -4.27 117.44 117.55 1r7d n TRP 4 Ca 0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.44 1r7d n TRP 4 Cb 0.48 -0.58 -0.01 0.00 -0.00 0.00 0.00 31.31 31.20 1r7d n TRP 4 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1r7d h LEU 5 N -0.17 -0.23 -1.13 5.87 6.46 -2.00 -1.37 115.31 122.75 1r7d h LEU 5 Ca -0.36 0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.47 1r7d h LEU 5 Cb 1.48 0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 41.53 1r7d h LEU 5 CO -0.11 -0.08 0.40 -0.09 -0.62 0.00 0.00 178.44 177.94 1r7d h ARG 6 N 0.02 1.00 -0.95 1.25 2.43 -2.00 -0.01 114.38 116.12 1r7d h ARG 6 Ca 0.13 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1r7d h ARG 6 Cb 0.20 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 29.50 1r7d h ARG 6 CO -0.27 0.73 0.63 0.22 -1.51 0.00 0.00 179.97 179.77 1r7d h ASP 7 N 1.01 1.08 0.92 -3.80 3.58 -1.46 -2.39 116.42 115.35 1r7d h ASP 7 Ca 0.26 -0.02 -0.22 0.00 0.42 0.00 0.00 57.03 57.46 1r7d h ASP 7 Cb 0.02 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 40.78 1r7d h ASP 7 CO -0.04 0.77 -1.08 0.40 -2.88 0.00 0.00 179.24 176.41 1r7d h ILE 8 N 1.27 1.64 -0.37 2.25 2.04 -0.75 -3.29 117.51 120.29 1r7d h ILE 8 Ca 0.35 -3.34 0.04 0.00 1.00 0.00 0.00 64.86 62.92 1r7d h ILE 8 Cb -0.11 2.84 -0.04 0.00 -0.74 0.00 0.00 36.82 38.76 1r7d h ILE 8 CO -0.08 0.94 0.12 -0.25 0.00 0.00 0.00 178.15 178.88 1r7d h TRP 9 N 0.01 0.21 -0.89 1.37 2.91 -0.50 0.24 115.95 119.30 1r7d h TRP 9 Ca -0.04 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 59.97 1r7d h TRP 9 Cb 1.81 -0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 30.38 1r7d h TRP 9 CO 0.01 0.08 0.47 0.22 -1.03 0.00 0.00 178.44 178.19 1r7d h ASP 10 N 0.27 1.12 -0.70 2.65 3.58 -1.61 -2.26 116.42 119.46 1r7d h ASP 10 Ca 0.17 -0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.46 1r7d h ASP 10 Cb 0.15 -0.29 -0.03 0.00 1.72 0.00 0.00 39.33 40.89 1r7d h ASP 10 CO -0.18 0.91 0.23 -0.25 -2.88 0.00 0.00 179.24 177.06 1r7d h TRP 11 N 1.25 1.12 -0.74 0.28 7.01 -1.43 -1.55 115.95 121.90 1r7d h TRP 11 Ca 0.31 -0.11 0.00 0.00 2.11 0.00 0.00 58.89 61.20 1r7d h TRP 11 Cb 0.04 -0.33 -0.04 0.00 -2.10 0.00 0.00 29.16 26.74 1r7d h TRP 11 CO 0.01 0.89 0.47 0.82 -2.79 0.00 0.00 178.44 177.84 1r7d h ILE 12 N 1.03 1.20 -0.18 2.65 2.04 -0.46 -0.91 117.51 122.87 1r7d h ILE 12 Ca 0.23 -0.39 -0.15 0.00 1.00 0.00 0.00 64.86 65.54 1r7d h ILE 12 Cb 0.29 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1r7d h ILE 12 CO -0.01 0.20 -0.51 0.00 0.00 0.00 0.00 178.15 177.83 1r7d h GLU 14 N 0.39 0.65 -0.60 0.00 4.81 -0.50 -2.64 114.58 116.68 1r7d h GLU 14 Ca 0.02 -0.31 -0.04 0.00 -0.13 0.00 0.00 59.36 58.89 1r7d h GLU 14 Cb 1.03 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 1r7d h GLU 14 CO 0.09 0.90 0.20 0.28 -0.73 0.00 0.00 179.01 179.75 1r7d h VAL 15 N 0.40 1.23 -0.05 0.32 2.07 -1.18 0.12 116.25 119.15 1r7d h VAL 15 Ca 0.06 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1r7d h VAL 15 Cb 0.74 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1r7d h VAL 15 CO 0.05 0.30 0.03 0.25 0.02 0.00 0.00 177.57 178.22 1r7d h LEU 16 N 0.88 0.07 -0.83 2.57 6.46 -1.35 0.38 115.31 123.49 1r7d h LEU 16 Ca 0.20 -0.08 -0.08 0.00 -0.12 0.00 0.00 57.88 57.80 1r7d h LEU 16 Cb 0.24 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1r7d h LEU 16 CO -0.01 0.13 -0.01 0.28 -0.62 0.00 0.00 178.44 178.21 1r7d h SER 17 N -0.00 0.84 -0.61 1.25 0.02 -1.22 -2.72 113.55 111.11 1r7d h SER 17 Ca 0.02 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.68 1r7d h SER 17 Cb 0.08 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1r7d h SER 17 CO -0.00 0.91 0.10 -0.78 -1.14 0.00 0.00 176.83 175.91 1r7d h ASP 18 N 0.80 0.98 -0.76 3.07 1.82 -0.36 -2.76 116.42 119.21 1r7d h ASP 18 Ca 0.15 -0.26 0.15 0.00 -0.39 0.00 0.00 57.03 56.68 1r7d h ASP 18 Cb 0.49 -0.26 -0.10 0.00 0.68 0.00 0.00 39.33 40.15 1r7d h ASP 18 CO 0.02 0.99 0.30 0.15 -1.61 0.00 0.00 179.24 179.09 1r7d h PHE 19 N 0.92 0.51 -0.62 0.28 3.04 0.08 1.33 116.94 122.48 1r7d h PHE 19 Ca 0.19 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.11 1r7d h PHE 19 Cb 0.43 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.80 1r7d h PHE 19 CO 0.03 0.05 0.16 -0.22 -2.02 0.00 0.00 178.31 176.32 1r7d h LYS 20 N 0.43 0.99 -0.06 1.11 3.11 -1.43 -2.61 116.57 118.11 1r7d h LYS 20 Ca 0.42 -0.23 -0.22 0.00 -2.81 0.00 0.00 60.65 57.81 1r7d h LYS 20 Cb 0.65 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.75 1r7d h LYS 20 CO -0.41 0.89 -0.85 1.15 -2.81 0.00 0.00 179.45 177.42 1r7d h THR 21 N 0.91 1.35 -0.27 1.00 2.02 -0.71 -2.54 112.91 114.67 1r7d h THR 21 Ca 0.20 -2.22 0.05 0.00 0.77 0.00 0.00 66.41 65.21 1r7d h THR 21 Cb 0.34 2.21 -0.05 0.00 -1.74 0.00 0.00 68.15 68.92 1r7d h THR 21 CO 0.00 0.67 -0.05 -0.25 0.37 0.00 0.00 175.52 176.27 1r7d h TRP 22 N 0.33 -0.11 -0.35 3.16 7.01 0.18 0.38 115.95 126.55 1r7d h TRP 22 Ca -0.06 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 60.84 1r7d h TRP 22 Cb 1.46 0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 28.60 1r7d h TRP 22 CO 0.06 -0.10 -0.28 -0.07 -2.79 0.00 0.00 178.44 175.27 1r7d h LEU 23 N 0.02 0.76 -0.50 0.65 4.07 -1.51 -1.84 115.31 116.96 1r7d h LEU 23 Ca 0.13 -0.29 -0.06 0.00 0.08 0.00 0.00 57.88 57.74 1r7d h LEU 23 Cb 0.19 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.70 1r7d h LEU 23 CO -0.26 0.99 0.06 0.50 -1.08 0.00 0.00 178.44 178.65 1r7d h LYS 24 N 0.63 0.83 0.00 1.13 3.64 -0.91 0.11 116.57 122.01 1r7d h LYS 24 Ca 0.08 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1r7d h LYS 24 Cb 0.79 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1r7d h LYS 24 CO 0.07 0.84 0.00 0.00 -2.27 0.00 0.00 179.45 178.08 1r7d n ALA 25 N -2.41 2.06 -0.12 5.00 0.00 0.13 -3.89 120.51 121.27 1r7d n ALA 25 Ca 0.01 -0.07 -0.24 0.00 0.00 0.00 0.00 53.44 53.14 1r7d n ALA 25 Cb 0.27 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 18.26 1r7d n ALA 25 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1r7d n LYS 26 N -1.55 0.57 -4.91 0.00 3.00 -0.70 -4.97 118.16 109.61 1r7d n LYS 26 Ca 0.05 0.27 -0.28 0.00 -0.00 0.00 0.00 58.31 58.35 1r7d n LYS 26 Cb 0.28 -1.49 -0.17 0.00 0.00 0.00 0.00 35.03 33.65 1r7d n LYS 26 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1r7d s LEU 27 N -7.64 1.88 0.37 3.14 1.98 0.34 -4.97 118.68 113.79 1r7d s LEU 27 Ca -0.36 -0.42 0.00 0.00 -2.89 0.00 0.00 54.13 50.46 1r7d s LEU 27 Cb 0.12 -1.10 0.00 0.00 0.66 0.00 0.00 46.19 45.86 1r7d s LEU 27 CO 0.47 0.11 0.00 0.80 -1.89 0.00 0.00 176.35 175.85 1r7d n MET 28 N 3.56 0.00 -0.73 1.98 0.00 -1.26 -4.39 117.12 116.27 1r7d n MET 28 Ca -0.20 0.00 -0.16 0.00 -0.00 0.00 0.00 57.70 57.34 1r7d n MET 28 Cb 0.52 0.00 0.12 0.00 0.00 0.00 0.00 33.22 33.87 1r7d n MET 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1r7d n PRO 29 N -3.26 -1.57 0.00 2.12 -0.04 -1.26 -4.90 135.00 126.08 1r7d n PRO 29 Ca 0.00 -0.99 0.00 0.00 -0.04 0.00 0.00 63.50 62.47 1r7d n PRO 29 Cb 0.00 -0.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 1r7d n PRO 29 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1r7d n GLN 30 N -2.97 0.00 0.00 0.54 3.00 -1.26 -5.24 117.38 111.46 1r7d n GLN 30 Ca 0.08 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.15 1r7d n GLN 30 Cb 0.31 0.00 0.06 0.00 0.00 0.00 0.00 30.24 30.61 1r7d n GLN 30 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34