#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6e n MET 2 N 0.00 -1.06 0.00 -0.41 1.56 -1.26 -4.62 117.12 111.33 1l6e n MET 2 Ca 0.00 0.44 0.00 0.00 -0.27 0.00 0.00 57.70 57.87 1l6e n MET 2 Cb 0.00 -3.81 0.00 0.00 2.15 0.00 0.00 33.22 31.56 1l6e n MET 2 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1l6e n GLY 3 N -1.75 0.18 3.71 -5.12 0.00 -1.26 -5.15 105.19 95.80 1l6e n GLY 3 Ca -0.10 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 1l6e n GLY 3 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1l6e s HIS 4 N 0.00 -0.15 -0.13 1.61 0.00 -1.26 -5.15 115.29 110.20 1l6e s HIS 4 Ca 0.00 -0.25 -0.01 0.00 -3.00 0.00 0.00 55.06 51.81 1l6e s HIS 4 Cb 0.00 0.57 0.03 0.00 -4.00 0.00 0.00 32.58 29.19 1l6e s HIS 4 CO 0.00 -1.10 -0.04 0.42 -1.00 0.00 0.00 174.74 173.01 1l6e s ILE 5 N -3.90 0.91 -0.32 -5.38 -1.09 -1.26 -4.87 121.20 105.29 1l6e s ILE 5 Ca 0.11 -0.38 0.17 0.00 -2.23 0.00 0.00 60.65 58.32 1l6e s ILE 5 Cb -0.04 -1.05 0.45 0.00 -1.58 0.00 0.00 42.46 40.24 1l6e s ILE 5 CO 0.03 0.21 1.24 0.00 -1.23 0.00 0.00 174.94 175.19 1l6e n GLN 6 N 4.96 1.43 -3.92 2.79 10.64 -1.26 -5.07 117.38 126.95 1l6e n GLN 6 Ca -0.11 -2.55 -0.35 0.00 -1.83 0.00 0.00 57.00 52.16 1l6e n GLN 6 Cb 0.49 -0.72 -0.14 0.00 -0.86 0.00 0.00 30.24 29.01 1l6e n GLN 6 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1l6e s ILE 7 N -1.95 3.00 0.11 -0.39 -1.09 -1.26 -5.08 121.20 114.54 1l6e s ILE 7 Ca 0.21 -1.21 -0.31 0.00 -2.23 0.00 0.00 60.65 57.11 1l6e s ILE 7 Cb 0.40 -2.64 -0.07 0.00 -1.58 0.00 0.00 42.46 38.56 1l6e s ILE 7 CO -0.06 0.02 1.31 -2.16 -1.23 0.00 0.00 174.94 172.82 1l6e s PRO 8 N 1.29 4.37 0.14 2.79 0.04 -1.26 -5.02 135.00 137.35 1l6e s PRO 8 Ca -0.03 1.96 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 1l6e s PRO 8 Cb -0.18 -3.27 0.03 0.00 0.04 0.00 0.00 34.50 31.12 1l6e s PRO 8 CO -0.02 -0.34 0.14 -0.35 0.04 0.00 0.00 177.00 176.47 1l6e n PRO 9 N 3.73 -0.94 0.00 0.56 -0.04 -1.26 -4.35 135.00 132.70 1l6e n PRO 9 Ca 0.10 -0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1l6e n PRO 9 Cb 0.44 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 1l6e n PRO 9 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1l6e n GLY 10 N 2.28 2.66 0.00 0.55 0.00 -1.26 -4.77 105.19 104.65 1l6e n GLY 10 Ca 0.02 -0.49 0.11 0.00 0.00 0.00 0.00 46.02 45.67 1l6e n GLY 10 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1l6e n LEU 11 N 0.00 0.00 0.30 0.99 7.94 -1.26 -3.86 117.00 121.11 1l6e n LEU 11 Ca 0.00 0.49 -0.12 0.00 -1.11 0.00 0.00 56.01 55.27 1l6e n LEU 11 Cb 0.00 -0.49 -0.06 0.00 0.53 0.00 0.00 43.42 43.41 1l6e n LEU 11 CO 0.00 -0.10 0.49 0.74 -1.11 0.00 0.00 177.39 177.41 1l6e h THR 12 N 0.00 0.00 -0.95 1.96 2.02 -1.90 -2.94 112.91 111.10 1l6e h THR 12 Ca 0.00 -0.04 0.13 0.00 0.77 0.00 0.00 66.41 67.27 1l6e h THR 12 Cb 0.39 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.65 1l6e h THR 12 CO 0.00 0.00 -0.43 1.21 0.37 0.00 0.00 175.52 176.67 1l6e n GLU 13 N -4.17 -0.28 -0.02 6.66 4.07 -1.25 0.71 120.64 126.36 1l6e n GLU 13 Ca -0.10 1.46 -0.02 0.00 -0.06 0.00 0.00 57.16 58.45 1l6e n GLU 13 Cb 0.30 -2.16 -0.01 0.00 -0.06 0.00 0.00 31.44 29.51 1l6e n GLU 13 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1l6e h LEU 14 N 0.00 -0.28 0.50 4.31 4.07 -1.74 0.21 115.31 122.38 1l6e h LEU 14 Ca 0.28 0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.26 1l6e h LEU 14 Cb 0.52 0.12 -0.00 0.00 1.08 0.00 0.00 40.66 42.37 1l6e h LEU 14 CO -0.93 -0.06 -0.28 -0.07 -1.08 0.00 0.00 178.44 176.02 1l6e h LEU 15 N -0.06 -0.68 -0.94 1.67 4.07 -1.08 -2.92 115.31 115.37 1l6e h LEU 15 Ca 0.01 0.03 0.13 0.00 0.08 0.00 0.00 57.88 58.14 1l6e h LEU 15 Cb 0.09 0.19 -0.15 0.00 1.08 0.00 0.00 40.66 41.88 1l6e h LEU 15 CO -0.09 -0.45 -0.43 -0.61 -1.08 0.00 0.00 178.44 175.78 1l6e h GLN 16 N -0.73 -0.03 -0.61 1.13 4.15 0.54 0.40 115.11 119.96 1l6e h GLN 16 Ca -0.06 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.47 1l6e h GLN 16 Cb 0.58 0.01 -0.12 0.00 0.21 0.00 0.00 27.48 28.16 1l6e h GLN 16 CO 0.08 -0.02 -0.32 0.78 -1.93 0.00 0.00 178.83 177.42 1l6e h GLY 17 N -0.03 -0.04 -0.76 2.39 0.00 -0.39 -1.21 103.07 103.02 1l6e h GLY 17 Ca 0.29 0.42 0.07 0.00 0.00 0.00 0.00 47.33 48.11 1l6e h GLY 17 CO -0.94 -0.21 -0.45 2.98 0.00 0.00 0.00 176.54 177.92 1l6e n TYR 18 N -5.44 -0.34 -0.27 5.60 9.36 0.14 0.20 117.16 126.42 1l6e n TYR 18 Ca 0.05 0.96 0.28 0.00 3.32 0.00 0.00 57.90 62.51 1l6e n TYR 18 Cb 0.36 -0.56 0.65 0.00 -0.63 0.00 0.00 39.34 39.16 1l6e n TYR 18 CO 0.00 0.00 0.00 1.15 0.22 0.00 0.00 176.86 178.23 1l6e h THR 19 N 0.00 0.51 0.00 2.97 2.02 -1.07 1.03 112.91 118.37 1l6e h THR 19 Ca 0.12 -0.05 -0.05 0.00 0.77 0.00 0.00 66.41 67.21 1l6e h THR 19 Cb 0.31 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1l6e h THR 19 CO -0.72 0.03 -0.22 0.58 0.37 0.00 0.00 175.52 175.55 1l6e h VAL 20 N 0.15 0.43 0.00 3.16 2.07 0.27 -2.84 116.25 119.48 1l6e h VAL 20 Ca 0.52 -1.39 -0.19 0.00 0.82 0.00 0.00 66.70 66.46 1l6e h VAL 20 Cb 1.78 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 33.56 1l6e h VAL 20 CO -0.10 0.22 -1.37 -0.62 0.02 0.00 0.00 177.57 175.72 1l6e n GLU 21 N -3.21 0.54 -0.02 1.57 1.02 0.31 -2.62 120.64 118.23 1l6e n GLU 21 Ca 0.02 0.39 0.22 0.00 -0.02 0.00 0.00 57.16 57.77 1l6e n GLU 21 Cb 0.55 -1.59 0.70 0.00 -0.02 0.00 0.00 31.44 31.09 1l6e n GLU 21 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1l6e h VAL 22 N -1.00 0.66 0.10 2.62 2.07 -0.43 -1.60 116.25 118.67 1l6e h VAL 22 Ca -0.28 0.00 -0.35 0.00 0.82 0.00 0.00 66.70 66.89 1l6e h VAL 22 Cb 1.13 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 1l6e h VAL 22 CO -0.17 0.00 -1.92 0.18 0.02 0.00 0.00 177.57 175.69 1l6e n LEU 23 N -4.29 2.20 -1.58 2.57 4.77 -1.07 -0.67 117.00 118.93 1l6e n LEU 23 Ca 0.11 0.27 -0.06 0.00 -0.03 0.00 0.00 56.01 56.29 1l6e n LEU 23 Cb 0.67 -0.81 0.02 0.00 -2.33 0.00 0.00 43.42 40.97 1l6e n LEU 23 CO 0.36 0.74 1.01 0.54 -1.33 0.00 0.00 177.39 178.71 1l6e n ARG 24 N -3.38 1.31 0.00 3.23 1.74 -0.62 -3.92 116.66 115.02 1l6e n ARG 24 Ca -0.28 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.18 1l6e n ARG 24 Cb 1.05 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 31.24 1l6e n ARG 24 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1l6e n GLN 25 N 0.88 0.00 -3.29 5.56 -0.00 -1.09 -4.93 117.38 114.51 1l6e n GLN 25 Ca 0.12 0.00 -0.12 0.00 -0.00 0.00 0.00 57.00 57.00 1l6e n GLN 25 Cb 0.57 0.00 0.01 0.00 -0.00 0.00 0.00 30.24 30.82 1l6e n GLN 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1l6e n GLN 26 N 0.00 -0.80 -1.33 2.61 1.13 0.16 -4.90 117.38 114.25 1l6e n GLN 26 Ca 0.00 0.99 -0.30 0.00 -1.94 0.00 0.00 57.00 55.75 1l6e n GLN 26 Cb 0.00 -1.34 0.12 0.00 0.11 0.00 0.00 30.24 29.14 1l6e n GLN 26 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1l6e s PRO 27 N -1.46 1.49 0.50 -1.09 0.04 -1.26 -4.93 135.00 128.29 1l6e s PRO 27 Ca 0.12 0.74 0.29 0.00 0.04 0.00 0.00 61.00 62.19 1l6e s PRO 27 Cb -0.01 -1.84 1.26 0.00 0.04 0.00 0.00 34.50 33.94 1l6e s PRO 27 CO 0.28 -2.06 1.96 -1.00 0.04 0.00 0.00 177.00 176.22 1l6e h PRO 28 N -1.41 0.00 -2.47 0.56 0.13 -2.00 -3.41 132.00 123.40 1l6e h PRO 28 Ca -0.49 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.52 1l6e h PRO 28 Cb 1.28 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.12 1l6e h PRO 28 CO 0.56 0.12 -0.42 -0.51 -0.23 0.00 0.00 178.00 177.53 1l6e s ASP 29 N -5.98 -0.06 0.01 1.44 1.01 -1.26 -5.07 116.67 106.76 1l6e s ASP 29 Ca -0.00 0.79 -0.22 0.00 0.71 0.00 0.00 52.55 53.83 1l6e s ASP 29 Cb 0.11 1.20 -0.12 0.00 1.01 0.00 0.00 42.92 45.11 1l6e s ASP 29 CO 0.58 -0.24 1.07 0.25 0.21 0.00 0.00 175.17 177.04 1l6e h LEU 30 N 8.19 -0.68 -0.19 1.23 6.46 -1.98 -2.14 115.31 126.21 1l6e h LEU 30 Ca -0.16 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.64 1l6e h LEU 30 Cb 1.12 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 41.20 1l6e h LEU 30 CO 0.15 -0.38 -0.11 0.52 -0.62 0.00 0.00 178.44 178.00 1l6e n VAL 31 N -4.73 -0.13 -0.26 1.05 0.31 -1.26 0.25 118.33 113.56 1l6e n VAL 31 Ca -0.10 1.17 0.14 0.00 -0.01 0.00 0.00 64.34 65.54 1l6e n VAL 31 Cb 0.31 -1.52 0.41 0.00 -0.91 0.00 0.00 33.84 32.14 1l6e n VAL 31 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 1l6e h ASP 32 N 0.00 0.59 -0.20 4.52 2.03 -2.01 0.15 116.42 121.50 1l6e h ASP 32 Ca 0.03 0.04 -0.09 0.00 -0.73 0.00 0.00 57.03 56.28 1l6e h ASP 32 Cb 0.08 -0.07 -0.02 0.00 -0.83 0.00 0.00 39.33 38.49 1l6e h ASP 32 CO -0.18 0.28 -0.18 0.15 -1.03 0.00 0.00 179.24 178.28 1l6e h PHE 33 N 0.61 0.70 -0.28 4.15 3.57 0.40 -1.58 116.94 124.51 1l6e h PHE 33 Ca 0.46 -0.14 -0.05 0.00 3.53 0.00 0.00 57.97 61.78 1l6e h PHE 33 Cb 0.85 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 1l6e h PHE 33 CO -0.00 0.77 -0.03 0.00 -2.23 0.00 0.00 178.31 176.82 1l6e h ALA 34 N 1.24 1.43 0.03 2.41 0.00 0.31 -0.67 119.26 124.02 1l6e h ALA 34 Ca 0.09 -0.19 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 1l6e h ALA 34 Cb 0.63 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.31 1l6e h ALA 34 CO 0.04 0.40 -0.83 0.28 0.00 0.00 0.00 179.25 179.14 1l6e h VAL 35 N 0.42 1.38 -0.57 0.00 2.07 -1.05 -3.03 116.25 115.48 1l6e h VAL 35 Ca 0.09 -2.23 -0.07 0.00 0.82 0.00 0.00 66.70 65.32 1l6e h VAL 35 Cb 0.32 2.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.70 1l6e h VAL 35 CO 0.01 0.66 0.09 -0.33 0.02 0.00 0.00 177.57 178.02 1l6e h GLU 36 N 0.04 0.91 0.67 1.57 5.08 -1.05 -0.13 114.58 121.67 1l6e h GLU 36 Ca -0.11 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 57.99 1l6e h GLU 36 Cb 1.54 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 30.67 1l6e h GLU 36 CO 0.16 0.85 -0.32 -0.92 -1.00 0.00 0.00 179.01 177.78 1l6e h TYR 37 N 0.86 -0.84 0.63 4.33 3.20 -1.18 -2.70 116.97 121.28 1l6e h TYR 37 Ca 0.18 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1l6e h TYR 37 Cb 0.38 0.28 0.01 0.00 1.54 0.00 0.00 36.73 38.94 1l6e h TYR 37 CO 0.02 -0.52 -0.30 0.74 -1.64 0.00 0.00 178.16 176.46 1l6e h PHE 38 N -1.15 -0.79 -0.99 -3.82 0.04 -1.57 -2.03 116.94 106.63 1l6e h PHE 38 Ca -0.09 -0.02 0.38 0.00 2.80 0.00 0.00 57.97 61.03 1l6e h PHE 38 Cb 0.69 0.26 -0.18 0.00 2.20 0.00 0.00 35.95 38.93 1l6e h PHE 38 CO 0.02 -0.45 0.44 1.15 -0.60 0.00 0.00 178.31 178.87 1l6e h THR 39 N -1.11 0.05 -0.25 -1.55 2.02 -1.15 0.82 112.91 111.73 1l6e h THR 39 Ca -0.09 -0.02 -0.11 0.00 0.77 0.00 0.00 66.41 66.96 1l6e h THR 39 Cb 0.69 -0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1l6e h THR 39 CO 0.14 0.01 -0.28 0.03 0.37 0.00 0.00 175.52 175.79 1l6e h ARG 40 N 0.05 0.64 -1.08 6.66 3.08 -1.34 -3.02 114.38 119.36 1l6e h ARG 40 Ca 0.78 -0.35 0.34 0.00 0.07 0.00 0.00 59.98 60.83 1l6e h ARG 40 Cb 1.96 0.02 -0.14 0.00 0.08 0.00 0.00 29.97 31.89 1l6e h ARG 40 CO -0.77 0.95 0.65 -0.07 -1.07 0.00 0.00 179.97 179.66 1l6e h LEU 41 N 0.35 0.43 -1.76 3.04 3.38 0.14 1.63 115.31 122.53 1l6e h LEU 41 Ca 0.04 0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1l6e h LEU 41 Cb 0.85 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1l6e h LEU 41 CO 0.07 -0.12 0.18 0.03 0.09 0.00 0.00 178.44 178.69 1l6e h ARG 42 N 0.27 0.32 -0.59 1.13 -0.00 -1.35 -0.03 114.38 114.12 1l6e h ARG 42 Ca 0.74 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 60.20 1l6e h ARG 42 Cb 1.88 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 31.78 1l6e h ARG 42 CO -0.52 0.21 0.00 0.39 0.00 0.00 0.00 179.97 180.06 1l6e n GLU 43 N -4.50 2.49 0.00 0.04 1.02 0.55 -4.67 120.64 115.57 1l6e n GLU 43 Ca 0.01 -2.30 0.00 0.00 -0.02 0.00 0.00 57.16 54.85 1l6e n GLU 43 Cb 0.10 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1l6e n GLU 43 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1l6e n ALA 44 N 1.39 0.00 0.00 0.62 0.00 -0.03 -4.70 120.51 117.80 1l6e n ALA 44 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1l6e n ALA 44 Cb 0.55 0.35 0.00 0.00 0.00 0.00 0.00 19.45 20.36 1l6e n ALA 44 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1l6e n ARG 45 N -2.21 0.00 -0.16 0.00 3.00 -1.26 -5.09 116.66 110.95 1l6e n ARG 45 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1l6e n ARG 45 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1l6e n ARG 45 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50