#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3e s SER 2 N 0.00 4.32 -0.71 1.61 0.01 -1.26 -4.79 113.70 112.89 1l3e s SER 2 Ca 0.00 -0.27 0.03 0.00 1.31 0.00 0.00 55.95 57.01 1l3e s SER 2 Cb 0.00 -2.56 0.35 0.00 0.21 0.00 0.00 66.02 64.02 1l3e s SER 2 CO 0.00 -3.51 1.32 0.23 0.41 0.00 0.00 173.24 171.69 1l3e n MET 3 N 8.80 3.84 -1.63 12.44 0.00 -1.26 -5.06 117.12 134.26 1l3e n MET 3 Ca 0.44 -4.63 -0.45 0.00 0.00 0.00 0.00 57.70 53.06 1l3e n MET 3 Cb 0.45 -2.31 -0.02 0.00 0.00 0.00 0.00 33.22 31.34 1l3e n MET 3 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1l3e n ASP 4 N -0.26 1.97 -4.92 7.83 8.00 -1.26 -4.98 116.55 122.92 1l3e n ASP 4 Ca 0.39 1.17 -0.31 0.00 0.71 0.00 0.00 54.79 56.75 1l3e n ASP 4 Cb 0.38 -1.35 -0.04 0.00 -0.02 0.00 0.00 41.12 40.10 1l3e n ASP 4 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1l3e s GLU 5 N -1.03 3.44 -0.28 -1.24 -6.30 -1.26 -5.11 118.70 106.92 1l3e s GLU 5 Ca 0.64 -0.44 -0.24 0.00 -2.50 0.00 0.00 54.97 52.42 1l3e s GLU 5 Cb -0.70 -3.03 0.11 0.00 0.00 0.00 0.00 34.13 30.51 1l3e s GLU 5 CO 0.56 0.60 0.94 -1.54 0.02 0.00 0.00 175.26 175.84 1l3e s SER 6 N -2.55 -0.54 -0.16 -1.70 1.04 -1.26 -5.07 113.70 103.45 1l3e s SER 6 Ca 0.35 1.03 -0.08 0.00 0.48 0.00 0.00 55.95 57.73 1l3e s SER 6 Cb -0.13 1.06 -0.23 0.00 0.10 0.00 0.00 66.02 66.82 1l3e s SER 6 CO 0.28 -0.18 0.21 0.61 0.98 0.00 0.00 173.24 175.15 1l3e n GLY 7 N 2.48 -0.57 3.69 7.32 0.00 -1.26 -4.89 105.19 111.96 1l3e n GLY 7 Ca -0.13 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1l3e n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l3e s LEU 8 N -7.13 4.37 -0.54 0.99 0.20 -1.26 -4.86 118.68 110.45 1l3e s LEU 8 Ca -0.26 2.50 -0.32 0.00 0.69 0.00 0.00 54.13 56.74 1l3e s LEU 8 Cb 0.07 -3.57 -0.13 0.00 -0.43 0.00 0.00 46.19 42.14 1l3e s LEU 8 CO 0.70 -0.88 2.37 -2.65 -0.29 0.00 0.00 176.35 175.60 1l3e n PRO 9 N 5.40 0.80 -3.07 0.98 -0.02 -1.26 -4.92 135.00 132.91 1l3e n PRO 9 Ca 0.16 0.14 -0.25 0.00 -2.02 0.00 0.00 63.50 61.52 1l3e n PRO 9 Cb 0.40 -2.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.38 1l3e n PRO 9 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1l3e s GLN 10 N 7.43 3.51 0.13 -0.52 1.03 -1.26 -5.11 119.66 124.87 1l3e s GLN 10 Ca 1.13 -0.11 0.07 0.00 0.04 0.00 0.00 55.36 56.49 1l3e s GLN 10 Cb -0.77 -2.54 -0.04 0.00 0.03 0.00 0.00 33.01 29.69 1l3e s GLN 10 CO 0.43 0.00 -0.16 -0.51 -2.54 0.00 0.00 175.29 172.51 1l3e s LEU 11 N -4.48 2.40 0.28 2.60 1.43 -1.26 -5.15 118.68 114.50 1l3e s LEU 11 Ca 0.43 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 1l3e s LEU 11 Cb -0.10 -0.68 -0.08 0.00 0.03 0.00 0.00 46.19 45.36 1l3e s LEU 11 CO 0.40 -0.08 0.65 -0.89 0.23 0.00 0.00 176.35 176.65 1l3e s THR 12 N -1.95 4.80 0.61 5.49 2.01 -1.26 -4.93 115.64 120.41 1l3e s THR 12 Ca 0.10 0.72 0.26 0.00 0.31 0.00 0.00 61.69 63.08 1l3e s THR 12 Cb -0.06 -3.61 0.34 0.00 0.01 0.00 0.00 72.50 69.17 1l3e s THR 12 CO 0.04 -0.13 1.63 0.77 -0.69 0.00 0.00 174.62 176.24 1l3e h SER 13 N 2.39 0.00 0.08 3.53 4.64 -2.01 0.19 113.55 122.37 1l3e h SER 13 Ca -0.47 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.64 1l3e h SER 13 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1l3e h SER 13 CO 0.67 0.00 -1.07 0.22 -0.87 0.00 0.00 176.83 175.78 1l3e h TYR 14 N 0.00 0.29 -0.27 4.77 3.20 -1.98 -2.53 116.97 120.45 1l3e h TYR 14 Ca 0.25 -0.21 0.08 0.00 3.14 0.00 0.00 58.73 61.99 1l3e h TYR 14 Cb 1.74 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.99 1l3e h TYR 14 CO 0.00 1.42 0.31 0.22 -1.64 0.00 0.00 178.16 178.47 1l3e h ASP 15 N -0.57 0.00 0.04 -2.11 3.58 -1.01 0.38 116.42 116.72 1l3e h ASP 15 Ca -0.24 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 56.96 1l3e h ASP 15 Cb 1.52 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.55 1l3e h ASP 15 CO 0.01 0.00 -1.35 0.00 -2.88 0.00 0.00 179.24 175.02 1l3e h GLU 17 N -0.72 0.97 -0.13 0.00 4.81 -0.88 1.01 114.58 119.64 1l3e h GLU 17 Ca -0.34 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 1l3e h GLU 17 Cb 1.48 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 1l3e h GLU 17 CO -0.11 0.64 0.00 0.28 -0.73 0.00 0.00 179.01 179.09 1l3e h VAL 18 N 1.00 1.25 0.00 0.32 2.07 -0.46 0.40 116.25 120.83 1l3e h VAL 18 Ca 0.28 -0.82 -0.14 0.00 0.82 0.00 0.00 66.70 66.84 1l3e h VAL 18 Cb -0.10 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1l3e h VAL 18 CO -0.07 0.24 -0.66 -1.13 0.02 0.00 0.00 177.57 175.97 1l3e h ASN 19 N -0.04 0.00 -0.78 0.57 -0.00 -1.44 -3.42 115.58 110.48 1l3e h ASN 19 Ca 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 56.30 56.34 1l3e h ASN 19 Cb 0.36 0.00 -0.19 0.00 -0.00 0.00 0.00 38.32 38.49 1l3e h ASN 19 CO 0.01 0.66 -0.34 0.00 -0.00 0.00 0.00 177.43 177.75 1l3e s ALA 20 N -3.51 -2.95 0.64 1.57 0.00 0.35 -5.07 121.76 112.79 1l3e s ALA 20 Ca -0.01 0.61 -0.06 0.00 0.00 0.00 0.00 51.96 52.50 1l3e s ALA 20 Cb 0.12 -2.79 0.03 0.00 0.00 0.00 0.00 23.12 20.48 1l3e s ALA 20 CO 0.77 -2.24 0.95 -1.25 0.00 0.00 0.00 175.76 173.99 1l3e s PRO 21 N 2.02 2.65 0.01 0.00 0.04 0.12 -4.09 135.00 135.76 1l3e s PRO 21 Ca 0.16 -0.08 0.23 0.00 0.04 0.00 0.00 61.00 61.35 1l3e s PRO 21 Cb -0.03 -2.22 0.18 0.00 0.04 0.00 0.00 34.50 32.46 1l3e s PRO 21 CO -0.11 -0.91 1.17 -0.89 0.04 0.00 0.00 177.00 176.30 1l3e n ILE 22 N -2.73 0.02 -2.26 0.56 5.41 -1.26 -4.98 119.36 114.13 1l3e n ILE 22 Ca 0.06 -0.03 -0.02 0.00 1.00 0.00 0.00 62.75 63.76 1l3e n ILE 22 Cb 0.59 0.52 0.01 0.00 -0.71 0.00 0.00 39.64 40.04 1l3e n ILE 22 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1l3e n GLN 23 N -1.56 -0.60 -1.22 0.38 7.27 -1.26 -4.88 117.38 115.51 1l3e n GLN 23 Ca 0.04 0.07 0.15 0.00 0.07 0.00 0.00 57.00 57.33 1l3e n GLN 23 Cb 0.35 -2.79 -0.08 0.00 2.41 0.00 0.00 30.24 30.13 1l3e n GLN 23 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l3e n GLY 24 N -0.90 -3.23 2.37 1.69 0.00 -1.26 -5.01 105.19 98.85 1l3e n GLY 24 Ca -0.02 -1.11 -0.04 0.00 0.00 0.00 0.00 46.02 44.85 1l3e n GLY 24 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l3e n SER 25 N -3.98 -0.89 -3.96 1.61 3.41 -1.26 -4.88 113.62 103.66 1l3e n SER 25 Ca -0.08 1.08 -0.36 0.00 -0.26 0.00 0.00 58.87 59.24 1l3e n SER 25 Cb 0.58 -4.41 0.01 0.00 -0.26 0.00 0.00 64.21 60.13 1l3e n SER 25 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1l3e n ARG 26 N 1.32 0.00 -1.36 4.33 1.74 -1.26 -4.92 116.66 116.52 1l3e n ARG 26 Ca -0.33 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.46 1l3e n ARG 26 Cb 0.51 -0.93 0.14 0.00 -1.02 0.00 0.00 32.46 31.15 1l3e n ARG 26 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l3e s ASN 27 N -0.93 3.46 -0.08 0.55 3.84 -1.26 -5.01 114.94 115.51 1l3e s ASN 27 Ca 0.53 1.23 -0.26 0.00 0.21 0.00 0.00 52.86 54.57 1l3e s ASN 27 Cb -0.47 -1.89 -0.22 0.00 -0.55 0.00 0.00 41.25 38.12 1l3e s ASN 27 CO 0.61 -2.61 0.93 -0.07 -2.79 0.00 0.00 177.10 173.18 1l3e h LEU 28 N -1.53 -0.03 -9.64 3.21 3.38 -2.01 -3.45 115.31 105.25 1l3e h LEU 28 Ca -0.51 -0.69 -0.52 0.00 0.09 0.00 0.00 57.88 56.26 1l3e h LEU 28 Cb 1.31 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1l3e h LEU 28 CO 0.58 0.71 0.46 -1.48 0.09 0.00 0.00 178.44 178.80 1l3e s LEU 29 N -8.70 4.49 0.00 1.67 2.34 -1.26 -4.89 118.68 112.32 1l3e s LEU 29 Ca -0.16 2.04 0.00 0.00 0.06 0.00 0.00 54.13 56.06 1l3e s LEU 29 Cb -0.01 -3.60 0.00 0.00 -0.56 0.00 0.00 46.19 42.02 1l3e s LEU 29 CO 0.63 -0.20 0.00 1.67 -1.06 0.00 0.00 176.35 177.39 1l3e n GLN 30 N 2.48 0.00 0.00 1.48 7.27 -1.26 -4.72 117.38 122.63 1l3e n GLN 30 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.10 1l3e n GLN 30 Cb 0.47 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.12 1l3e n GLN 30 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l3e n GLY 31 N 0.92 0.51 0.19 1.69 0.00 -1.26 -4.39 105.19 102.86 1l3e n GLY 31 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1l3e n GLY 31 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1l3e h GLU 32 N 0.00 0.00 0.00 1.61 -0.00 -1.99 -2.81 114.58 111.39 1l3e h GLU 32 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 59.36 59.31 1l3e h GLU 32 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.74 1l3e h GLU 32 CO 0.00 0.36 -0.26 0.93 -0.00 0.00 0.00 179.01 180.04 1l3e h GLU 33 N 0.00 0.00 -0.43 1.06 5.08 -1.92 -2.30 114.58 116.07 1l3e h GLU 33 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1l3e h GLU 33 Cb 0.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 1l3e h GLU 33 CO 0.05 0.26 0.01 -0.07 -1.00 0.00 0.00 179.01 178.26 1l3e h LEU 34 N 0.00 0.65 0.19 1.33 3.38 -1.70 0.97 115.31 120.13 1l3e h LEU 34 Ca -0.00 -0.14 -0.31 0.00 0.09 0.00 0.00 57.88 57.52 1l3e h LEU 34 Cb 0.69 -0.17 0.03 0.00 0.09 0.00 0.00 40.66 41.30 1l3e h LEU 34 CO 0.03 0.72 -1.37 -0.07 0.09 0.00 0.00 178.44 177.84 1l3e h LEU 35 N 0.65 0.72 -0.75 1.67 3.38 -1.58 0.31 115.31 119.70 1l3e h LEU 35 Ca 0.13 -0.75 -0.13 0.00 0.09 0.00 0.00 57.88 57.22 1l3e h LEU 35 Cb 0.39 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1l3e h LEU 35 CO 0.01 1.58 -0.57 0.03 0.09 0.00 0.00 178.44 179.58 1l3e h ARG 36 N 0.14 0.15 0.00 1.13 2.47 -1.16 -2.95 114.38 114.16 1l3e h ARG 36 Ca -0.21 -0.10 -0.04 0.00 -1.26 0.00 0.00 59.98 58.38 1l3e h ARG 36 Cb 2.07 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 30.39 1l3e h ARG 36 CO 0.25 0.68 -0.21 0.00 0.56 0.00 0.00 179.97 181.25 1l3e h ALA 37 N 1.30 0.04 -0.66 0.04 0.00 0.94 -3.31 119.26 117.62 1l3e h ALA 37 Ca -0.00 -0.54 0.19 0.00 0.00 0.00 0.00 54.91 54.56 1l3e h ALA 37 Cb 1.04 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1l3e h ALA 37 CO 0.08 0.13 0.70 -0.07 0.00 0.00 0.00 179.25 180.09 1l3e h LEU 38 N -1.00 0.00 -4.11 0.00 3.38 -0.45 0.71 115.31 113.85 1l3e h LEU 38 Ca -0.05 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.42 1l3e h LEU 38 Cb 0.88 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.44 1l3e h LEU 38 CO -0.03 0.00 0.56 -0.67 0.09 0.00 0.00 178.44 178.38 1l3e n ASP 39 N -3.62 6.80 -2.46 -0.43 -0.08 -1.12 -4.42 116.55 111.22 1l3e n ASP 39 Ca 0.13 -3.32 -0.21 0.00 -1.51 0.00 0.00 54.79 49.88 1l3e n ASP 39 Cb 0.93 -1.11 0.01 0.00 2.34 0.00 0.00 41.12 43.30 1l3e n ASP 39 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 1l3e n GLN 40 N 0.23 2.87 -1.61 -0.67 -0.06 0.24 -5.02 117.38 113.36 1l3e n GLN 40 Ca 0.45 -4.12 -0.43 0.00 -2.00 0.00 0.00 57.00 50.90 1l3e n GLN 40 Cb 0.54 -2.00 -0.03 0.00 -4.06 0.00 0.00 30.24 24.69 1l3e n GLN 40 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1l3e n VAL 41 N -0.44 0.46 -0.51 1.69 0.31 -1.26 -5.14 118.33 113.44 1l3e n VAL 41 Ca 0.31 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1l3e n VAL 41 Cb 0.76 -2.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.24 1l3e n VAL 41 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10