#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b5t s SER 1 N 0.00 6.32 -0.09 8.00 0.15 -1.26 -5.04 113.70 121.78 2b5t s SER 1 Ca 0.00 -0.27 -0.24 0.00 0.70 0.00 0.00 55.95 56.14 2b5t s SER 1 Cb 0.00 -2.30 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 2b5t s SER 1 CO 0.00 -0.68 0.73 -0.70 1.20 0.00 0.00 173.24 173.79 2b5t s GLU 1 N 2.65 4.41 -0.17 5.44 2.56 -1.26 -5.04 118.70 127.30 2b5t s GLU 1 Ca 0.21 0.91 -0.08 0.00 0.00 0.00 0.00 54.97 56.01 2b5t s GLU 1 Cb -0.15 -3.48 0.06 0.00 2.00 0.00 0.00 34.13 32.57 2b5t s GLU 1 CO 0.17 -0.02 0.39 -0.47 -0.56 0.00 0.00 175.26 174.77 2b5t s TYR 1 N 1.10 -0.60 -0.27 5.30 5.04 -1.26 -5.14 117.35 121.52 2b5t s TYR 1 Ca 0.38 1.26 -0.10 0.00 -2.44 0.00 0.00 57.07 56.17 2b5t s TYR 1 Cb -0.18 0.24 -0.04 0.00 0.35 0.00 0.00 41.96 42.34 2b5t s TYR 1 CO 0.17 -0.35 0.15 -1.14 -1.34 0.00 0.00 175.55 173.04 2b5t s GLN 1 N 1.58 3.81 0.83 4.97 2.00 -1.26 -5.04 119.66 126.54 2b5t s GLN 1 Ca -0.08 -0.40 -0.14 0.00 -2.00 0.00 0.00 55.36 52.74 2b5t s GLN 1 Cb -0.09 -3.55 0.21 0.00 0.80 0.00 0.00 33.01 30.38 2b5t s GLN 1 CO -0.12 -0.20 0.61 0.25 -0.50 0.00 0.00 175.29 175.33 2b5t n THR 1 N 5.01 0.00 0.00 -0.34 -2.24 -1.26 -5.10 114.28 110.35 2b5t n THR 1 Ca -0.15 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2b5t n THR 1 Cb 0.52 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 2b5t n THR 1 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2b5t n PHE 1 N -4.32 0.00 -3.39 4.78 3.01 -1.26 -5.17 117.46 111.12 2b5t n PHE 1 Ca 0.09 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.15 2b5t n PHE 1 Cb 0.37 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.75 2b5t n PHE 1 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2b5t s ASN 1 N 0.00 6.21 0.21 4.37 3.84 -1.26 -4.95 114.94 123.36 2b5t s ASN 1 Ca 0.00 -0.07 0.12 0.00 0.21 0.00 0.00 52.86 53.12 2b5t s ASN 1 Cb 0.00 -2.21 0.66 0.00 -0.55 0.00 0.00 41.25 39.16 2b5t s ASN 1 CO 0.00 -0.31 1.32 -0.81 -2.79 0.00 0.00 177.10 174.52 2b5t n PRO 1 N 5.40 0.08 0.14 0.43 -0.04 -1.26 -0.87 135.00 138.88 2b5t n PRO 1 Ca -0.09 0.55 0.02 0.00 -0.04 0.00 0.00 63.50 63.94 2b5t n PRO 1 Cb 0.50 -1.86 0.36 0.00 -0.04 0.00 0.00 33.50 32.46 2b5t n PRO 1 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2b5t h ARG 1 N 0.00 0.16 0.00 0.54 2.43 -1.93 -1.08 114.38 114.50 2b5t h ARG 1 Ca 0.00 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2b5t h ARG 1 Cb 0.19 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2b5t h ARG 1 CO 0.00 0.41 -1.24 0.25 -1.51 0.00 0.00 179.97 177.88 2b5t n THR 1 N -4.19 0.07 0.07 0.20 -2.24 -0.44 -4.64 114.28 103.11 2b5t n THR 1 Ca -0.01 -0.13 0.01 0.00 -2.27 0.00 0.00 64.05 61.65 2b5t n THR 1 Cb 0.34 0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.63 2b5t n THR 1 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2b5t h PHE 1 N 0.00 0.00 0.00 4.78 3.57 -1.06 -3.51 116.94 120.72 2b5t h PHE 1 Ca -0.03 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.47 2b5t h PHE 1 Cb 0.45 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.19 2b5t h PHE 1 CO 0.00 0.52 0.00 0.41 -2.23 0.00 0.00 178.31 177.01 2b5t n GLY 1 N 1.33 -1.78 3.83 2.40 0.00 -0.41 -4.97 105.19 105.59 2b5t n GLY 1 Ca -0.05 -1.71 -0.22 0.00 0.00 0.00 0.00 46.02 44.04 2b5t n GLY 1 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b5t s SER 1 N -4.00 4.88 0.00 1.61 1.04 -1.26 -4.29 113.70 111.68 2b5t s SER 1 Ca 0.00 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.61 2b5t s SER 1 Cb 0.00 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.54 2b5t s SER 1 CO 0.00 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2b5t n GLY 1 N -1.44 2.19 0.32 7.32 0.00 -1.26 -5.00 105.19 107.32 2b5t n GLY 1 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2b5t n GLY 1 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2b5t h GLU 1 N 0.89 1.00 -0.47 1.61 4.81 -1.96 -2.64 114.58 117.81 2b5t h GLU 1 Ca 0.00 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2b5t h GLU 1 Cb 0.00 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 2b5t h GLU 1 CO 0.00 0.82 0.28 0.00 -0.73 0.00 0.00 179.01 179.38 2b5t h ALA 1 N 1.31 1.61 -0.43 2.92 0.00 -1.96 -2.39 119.26 120.32 2b5t h ALA 1 Ca 0.23 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 2b5t h ALA 1 Cb 0.20 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 2b5t h ALA 1 CO -0.02 0.34 0.06 -3.47 0.00 0.00 0.00 179.25 176.17 2b5t n ASP 1 N -4.44 3.58 -4.74 0.00 2.03 -1.15 -4.93 116.55 106.90 2b5t n ASP 1 Ca 0.04 -3.35 -0.36 0.00 0.52 0.00 0.00 54.79 51.64 2b5t n ASP 1 Cb 0.08 -0.63 0.06 0.00 -0.72 0.00 0.00 41.12 39.90 2b5t n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2b5t n GLY 2 N 0.52 0.59 3.22 0.00 0.00 -1.26 -4.99 105.19 103.27 2b5t n GLY 2 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2b5t n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b5t s LEU 3 N 0.00 3.54 -0.09 0.99 1.43 -1.24 -5.03 118.68 118.28 2b5t s LEU 3 Ca 0.00 -0.95 -0.30 0.00 -1.03 0.00 0.00 54.13 51.85 2b5t s LEU 3 Cb 0.00 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 2b5t s LEU 3 CO 0.00 -0.18 1.01 -0.13 0.23 0.00 0.00 176.35 177.28 2b5t s ARG 4 N 1.34 4.44 0.23 1.70 0.52 -1.26 -4.82 118.95 121.10 2b5t s ARG 4 Ca -0.01 1.41 -0.08 0.00 -0.52 0.00 0.00 55.73 56.54 2b5t s ARG 4 Cb -0.18 -3.53 0.38 0.00 0.52 0.00 0.00 34.95 32.14 2b5t s ARG 4 CO -0.02 -0.29 1.68 -1.35 0.02 0.00 0.00 175.30 175.34 2b5t h PRO 5 N 7.08 0.22 -0.16 3.54 0.11 -1.96 -0.58 132.00 140.25 2b5t h PRO 5 Ca -0.32 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2b5t h PRO 5 Cb 1.16 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2b5t h PRO 5 CO 0.84 0.14 0.00 1.28 -0.21 0.00 0.00 178.00 180.06 2b5t n LEU 6 N -5.18 1.17 0.00 2.35 4.77 -1.26 -3.96 117.00 114.89 2b5t n LEU 6 Ca 0.11 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 2b5t n LEU 6 Cb 0.40 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2b5t n LEU 6 CO 0.13 0.26 0.00 0.49 -1.33 0.00 0.00 177.39 176.94 2b5t n PHE 7 N 0.04 0.00 0.03 -1.77 3.72 -0.32 -4.81 117.46 114.35 2b5t n PHE 7 Ca 0.13 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.42 2b5t n PHE 7 Cb 0.23 0.05 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 2b5t n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2b5t h GLU 8 N 0.00 -0.17 0.00 -1.08 3.07 -1.38 0.49 114.58 115.51 2b5t h GLU 8 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2b5t h GLU 8 Cb 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2b5t h GLU 8 CO 0.00 -0.12 0.00 0.87 -1.40 0.00 0.00 179.01 178.36 2b5t h LYS 9 N -0.18 0.00 -0.12 2.33 1.79 -1.55 -0.07 116.57 118.78 2b5t h LYS 9 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2b5t h LYS 9 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2b5t h LYS 9 CO -0.16 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.84 2b5t n LYS 10 N -2.34 2.17 -3.95 3.15 5.02 -0.90 -4.97 118.16 116.34 2b5t n LYS 10 Ca -0.01 -2.49 -0.32 0.00 -2.02 0.00 0.00 58.31 53.47 2b5t n LYS 10 Cb 0.06 -1.53 -0.00 0.00 -0.02 0.00 0.00 35.03 33.53 2b5t n LYS 10 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2b5t n SER 11 N -0.85 -3.99 -4.49 4.39 7.64 -0.04 -4.96 113.62 111.31 2b5t n SER 11 Ca 0.15 -0.81 -0.30 0.00 1.01 0.00 0.00 58.87 58.93 2b5t n SER 11 Cb 0.66 -3.23 -0.11 0.00 -1.01 0.00 0.00 64.21 60.51 2b5t n SER 11 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2b5t s LEU 12 N -7.13 2.73 0.09 -3.43 1.43 0.17 -5.01 118.68 107.52 2b5t s LEU 12 Ca 0.66 -0.52 0.06 0.00 -1.03 0.00 0.00 54.13 53.30 2b5t s LEU 12 Cb -0.35 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2b5t s LEU 12 CO 0.81 0.19 -0.08 -1.61 0.23 0.00 0.00 176.35 175.89 2b5t s GLU 13 N -2.05 2.23 0.77 1.70 2.02 -1.26 -3.70 118.70 118.41 2b5t s GLU 13 Ca 0.18 -0.97 -0.09 0.00 0.02 0.00 0.00 54.97 54.12 2b5t s GLU 13 Cb -0.11 -2.36 0.09 0.00 0.10 0.00 0.00 34.13 31.86 2b5t s GLU 13 CO 0.10 0.52 1.09 0.16 0.02 0.00 0.00 175.26 177.15 2b5t s ASP 14 N -2.14 4.45 0.65 -0.19 1.47 -1.26 -4.96 116.67 114.69 2b5t s ASP 14 Ca 0.22 0.43 0.38 0.00 1.18 0.00 0.00 52.55 54.76 2b5t s ASP 14 Cb -0.11 -0.93 2.11 0.00 -0.34 0.00 0.00 42.92 43.65 2b5t s ASP 14 CO 0.14 -1.86 2.23 0.07 0.68 0.00 0.00 175.17 176.43 2b5t h LYS 14 N -0.85 0.00 0.00 2.11 2.10 -2.05 -3.27 116.57 114.61 2b5t h LYS 14 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2b5t h LYS 14 Cb 1.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.63 2b5t h LYS 14 CO 0.56 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.26 2b5t n THR 14 N -3.22 0.16 0.29 0.07 -2.24 -1.26 -4.80 114.28 103.29 2b5t n THR 14 Ca -0.02 -0.26 0.17 0.00 -2.27 0.00 0.00 64.05 61.66 2b5t n THR 14 Cb 0.17 1.27 0.88 0.00 -2.10 0.00 0.00 70.33 70.55 2b5t n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2b5t h GLU 14 N 0.00 0.00 -0.12 -0.78 4.11 -1.96 -0.29 114.58 115.55 2b5t h GLU 14 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2b5t h GLU 14 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2b5t h GLU 14 CO 0.00 0.05 -0.06 -0.09 0.07 0.00 0.00 179.01 178.98 2b5t h ARG 14 N 0.00 0.17 -0.95 1.06 9.65 -1.87 -2.35 114.38 120.09 2b5t h ARG 14 Ca -0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 2b5t h ARG 14 Cb 0.24 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 2b5t h ARG 14 CO 0.01 0.24 0.00 -1.91 2.80 0.00 0.00 179.97 181.11 2b5t n GLU 14 N -4.37 0.07 0.00 0.20 2.13 -0.12 -0.94 120.64 117.60 2b5t n GLU 14 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 2b5t n GLU 14 Cb 0.19 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.67 2b5t n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2b5t n LEU 14 N 0.70 0.00 0.18 4.31 4.32 -0.89 -2.62 117.00 123.01 2b5t n LEU 14 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 56.01 56.02 2b5t n LEU 14 Cb 0.03 0.00 0.40 0.00 -1.62 0.00 0.00 43.42 42.22 2b5t n LEU 14 CO 0.00 0.00 0.81 -0.33 -1.22 0.00 0.00 177.39 176.65 2b5t h GLU 14 N 0.00 0.06 0.00 3.23 4.39 -1.32 -2.80 114.58 118.15 2b5t h GLU 14 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2b5t h GLU 14 Cb 0.00 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2b5t h GLU 14 CO 0.00 0.33 0.00 -1.13 -1.16 0.00 0.00 179.01 177.05 2b5t n SER 14 N -4.20 0.19 0.00 1.42 3.41 -1.08 -2.00 113.62 111.37 2b5t n SER 14 Ca -0.02 0.56 0.15 0.00 -0.26 0.00 0.00 58.87 59.30 2b5t n SER 14 Cb 0.33 -0.60 0.79 0.00 -0.26 0.00 0.00 64.21 64.48 2b5t n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2b5t n TYR 14 N -1.73 0.00 -1.70 7.33 4.01 -1.06 -4.85 117.16 119.17 2b5t n TYR 14 Ca 0.02 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.32 2b5t n TYR 14 Cb 0.12 -0.22 -0.03 0.00 -0.31 0.00 0.00 39.34 38.91 2b5t n TYR 14 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2b5t n ILE 14 N -1.22 0.61 -3.82 -0.72 5.41 -0.85 -4.96 119.36 113.82 2b5t n ILE 14 Ca 0.16 -0.15 -0.35 0.00 1.00 0.00 0.00 62.75 63.41 2b5t n ILE 14 Cb 0.21 -1.74 -0.12 0.00 -0.71 0.00 0.00 39.64 37.28 2b5t n ILE 14 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2b5t s ASP 14 N 0.64 5.13 0.47 4.38 1.01 -1.26 -5.08 116.67 121.96 2b5t s ASP 14 Ca 0.70 -2.21 -0.23 0.00 0.71 0.00 0.00 52.55 51.51 2b5t s ASP 14 Cb -0.58 -1.79 -0.07 0.00 1.01 0.00 0.00 42.92 41.49 2b5t s ASP 14 CO 0.44 -0.48 1.28 -0.83 0.21 0.00 0.00 175.17 175.79 2b5t s GLY 14 N 1.42 2.86 0.00 0.21 0.00 -1.26 -5.30 107.32 105.25 2b5t s GLY 14 Ca 0.10 1.17 0.25 0.00 0.00 0.00 0.00 44.72 46.24 2b5t s GLY 14 CO -0.05 1.69 1.32 0.54 0.00 0.00 0.00 173.10 176.61