#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bcb s SER 2 N 0.00 6.36 0.42 4.39 1.04 -1.26 -4.98 113.70 119.68 2bcb s SER 2 Ca 0.00 0.52 0.24 0.00 0.48 0.00 0.00 55.95 57.19 2bcb s SER 2 Cb 0.00 -2.06 1.26 0.00 0.10 0.00 0.00 66.02 65.32 2bcb s SER 2 CO 0.00 -0.20 1.72 -0.65 0.98 0.00 0.00 173.24 175.09 2bcb h PRO 3 N 1.36 0.24 -0.92 4.02 0.11 -2.00 0.61 132.00 135.43 2bcb h PRO 3 Ca -0.49 -0.01 0.23 0.00 0.11 0.00 0.00 66.00 65.84 2bcb h PRO 3 Cb 1.20 -0.05 -0.13 0.00 0.11 0.00 0.00 31.00 32.13 2bcb h PRO 3 CO 0.64 0.16 0.42 0.93 -0.21 0.00 0.00 178.00 179.95 2bcb h GLU 4 N 0.25 0.39 -0.56 1.05 5.08 -1.98 0.26 114.58 119.08 2bcb h GLU 4 Ca 0.67 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.99 2bcb h GLU 4 Cb 1.96 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 31.09 2bcb h GLU 4 CO -0.32 0.26 0.28 1.05 -1.00 0.00 0.00 179.01 179.29 2bcb h GLU 5 N 0.40 0.79 0.03 2.33 4.11 -1.25 0.31 114.58 121.29 2bcb h GLU 5 Ca 0.58 -0.11 -0.21 0.00 0.07 0.00 0.00 59.36 59.70 2bcb h GLU 5 Cb 1.14 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 2bcb h GLU 5 CO -0.54 0.63 -0.98 -0.07 0.07 0.00 0.00 179.01 178.12 2bcb h LEU 6 N 0.75 0.17 -0.22 3.06 3.38 -1.09 -2.24 115.31 119.11 2bcb h LEU 6 Ca 0.19 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2bcb h LEU 6 Cb 0.09 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2bcb h LEU 6 CO -0.03 1.04 0.11 0.50 0.09 0.00 0.00 178.44 180.16 2bcb h LYS 7 N 0.05 0.23 -0.08 1.13 1.63 -0.39 0.19 116.57 119.33 2bcb h LYS 7 Ca -0.05 -0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.78 2bcb h LYS 7 Cb 1.67 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 33.21 2bcb h LYS 7 CO 0.14 0.15 -0.16 0.78 -3.45 0.00 0.00 179.45 176.91 2bcb h GLY 8 N 0.24 -0.14 0.79 5.01 0.00 -0.75 0.10 103.07 108.33 2bcb h GLY 8 Ca 0.09 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2bcb h GLY 8 CO -0.06 -0.16 -0.20 -2.22 0.00 0.00 0.00 176.54 173.90 2bcb h ILE 9 N -0.23 0.56 -0.38 2.60 1.08 -1.17 0.13 117.51 120.11 2bcb h ILE 9 Ca 0.08 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.63 2bcb h ILE 9 Cb 0.34 0.56 -0.09 0.00 -3.07 0.00 0.00 36.82 34.56 2bcb h ILE 9 CO -0.21 0.00 -0.24 0.15 -0.69 0.00 0.00 178.15 177.15 2bcb h PHE 10 N -0.46 -0.64 -0.26 1.37 3.04 -0.33 -0.53 116.94 119.13 2bcb h PHE 10 Ca -0.01 0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.01 2bcb h PHE 10 Cb 0.41 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.24 2bcb h PHE 10 CO -0.14 -0.32 0.12 1.49 -2.02 0.00 0.00 178.31 177.44 2bcb h GLU 11 N -0.18 0.25 -0.29 1.11 4.81 -0.52 0.18 114.58 119.94 2bcb h GLU 11 Ca 0.18 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.46 2bcb h GLU 11 Cb 0.47 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.73 2bcb h GLU 11 CO -0.49 0.16 -0.14 -0.22 -0.73 0.00 0.00 179.01 177.59 2bcb h LYS 12 N 0.26 -0.10 0.14 1.92 3.64 0.20 0.95 116.57 123.58 2bcb h LYS 12 Ca 0.11 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2bcb h LYS 12 Cb 0.04 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2bcb h LYS 12 CO -0.09 -0.07 -0.07 1.88 -2.27 0.00 0.00 179.45 178.84 2bcb h TYR 13 N -0.10 -0.18 -0.88 1.91 -1.99 -0.82 -3.20 116.97 111.71 2bcb h TYR 13 Ca 0.15 -0.00 0.22 0.00 2.00 0.00 0.00 58.73 61.10 2bcb h TYR 13 Cb 0.33 0.06 -0.13 0.00 2.00 0.00 0.00 36.73 38.99 2bcb h TYR 13 CO -0.34 0.18 0.33 0.00 -0.00 0.00 0.00 178.16 178.33 2bcb h ALA 14 N 0.20 1.36 -0.13 3.88 0.00 -0.29 -0.63 119.26 123.64 2bcb h ALA 14 Ca -0.02 0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2bcb h ALA 14 Cb 0.44 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2bcb h ALA 14 CO 0.03 -0.39 0.20 0.00 0.00 0.00 0.00 179.25 179.09 2bcb h ALA 15 N 1.73 1.63 -0.67 0.00 0.00 -0.81 -2.62 119.26 118.52 2bcb h ALA 15 Ca 0.55 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.39 2bcb h ALA 15 Cb 1.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 2bcb h ALA 15 CO -0.57 -0.27 0.16 0.87 0.00 0.00 0.00 179.25 179.44 2bcb h LYS 16 N 0.00 1.07 0.00 0.00 6.56 -1.21 -3.43 116.57 119.56 2bcb h LYS 16 Ca 0.06 -0.25 0.00 0.00 -1.06 0.00 0.00 60.65 59.40 2bcb h LYS 16 Cb 0.46 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 31.97 2bcb h LYS 16 CO -0.00 0.95 0.00 0.39 -2.06 0.00 0.00 179.45 178.73 2bcb n GLU 17 N -4.24 0.00 -0.60 3.15 1.02 -0.99 -4.95 120.64 114.03 2bcb n GLU 17 Ca 0.05 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.12 2bcb n GLU 17 Cb 0.26 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.58 2bcb n GLU 17 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bcb n GLY 18 N 3.60 2.21 1.14 0.62 0.00 -1.22 -4.87 105.19 106.67 2bcb n GLY 18 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2bcb n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bcb n ASP 19 N 2.67 -6.28 0.24 1.61 -0.08 -1.24 -3.08 116.55 110.39 2bcb n ASP 19 Ca 0.26 1.14 0.06 0.00 -1.51 0.00 0.00 54.79 54.73 2bcb n ASP 19 Cb 0.56 -3.29 0.32 0.00 2.34 0.00 0.00 41.12 41.04 2bcb n ASP 19 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2bcb h PRO 20 N 0.63 0.00 0.00 -0.67 0.13 -1.84 -0.52 132.00 129.73 2bcb h PRO 20 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 2bcb h PRO 20 Cb 0.37 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 2bcb h PRO 20 CO 0.00 0.00 -1.13 -0.97 -0.23 0.00 0.00 178.00 175.67 2bcb h ASN 21 N 0.00 0.00 -4.39 1.44 -1.24 -1.88 -3.40 115.58 106.12 2bcb h ASN 21 Ca 0.00 0.00 -0.61 0.00 0.71 0.00 0.00 56.30 56.40 2bcb h ASN 21 Cb 1.10 0.00 -0.28 0.00 0.73 0.00 0.00 38.32 39.87 2bcb h ASN 21 CO 0.00 0.28 -0.86 -1.10 -1.29 0.00 0.00 177.43 174.47 2bcb s GLN 22 N -3.14 1.63 -0.38 6.67 1.11 -0.20 -3.65 119.66 121.69 2bcb s GLN 22 Ca -0.01 -0.85 -0.13 0.00 0.01 0.00 0.00 55.36 54.38 2bcb s GLN 22 Cb 0.09 -1.65 0.01 0.00 -1.01 0.00 0.00 33.01 30.46 2bcb s GLN 22 CO 0.79 0.44 0.26 -0.51 0.01 0.00 0.00 175.29 176.28 2bcb s LEU 23 N -0.77 4.85 0.99 2.90 1.43 0.72 -4.18 118.68 124.63 2bcb s LEU 23 Ca 0.08 -0.82 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 2bcb s LEU 23 Cb -0.09 -2.11 0.19 0.00 0.03 0.00 0.00 46.19 44.21 2bcb s LEU 23 CO 0.00 -0.38 1.09 -0.94 0.23 0.00 0.00 176.35 176.35 2bcb s SER 24 N 1.65 2.66 0.13 2.29 1.04 -1.26 -0.37 113.70 119.84 2bcb s SER 24 Ca 0.04 1.19 -0.19 0.00 0.48 0.00 0.00 55.95 57.47 2bcb s SER 24 Cb -0.19 -1.85 -0.02 0.00 0.10 0.00 0.00 66.02 64.06 2bcb s SER 24 CO 0.09 -3.11 1.74 0.50 0.98 0.00 0.00 173.24 173.44 2bcb h LYS 25 N -1.88 0.14 -0.25 4.02 3.64 -1.97 0.14 116.57 120.40 2bcb h LYS 25 Ca -0.54 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 58.87 2bcb h LYS 25 Cb 1.33 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 33.08 2bcb h LYS 25 CO 0.58 0.09 0.03 1.49 -2.27 0.00 0.00 179.45 179.36 2bcb h GLU 26 N 0.14 0.11 -0.39 1.90 4.22 -1.97 -2.70 114.58 115.89 2bcb h GLU 26 Ca 0.10 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.53 2bcb h GLU 26 Cb 0.09 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2bcb h GLU 26 CO -0.13 0.07 0.24 1.49 -2.18 0.00 0.00 179.01 178.50 2bcb h GLU 27 N 0.11 0.54 -0.81 1.92 4.57 -1.72 -2.65 114.58 116.55 2bcb h GLU 27 Ca 0.12 -0.05 0.11 0.00 -1.18 0.00 0.00 59.36 58.36 2bcb h GLU 27 Cb 0.14 -0.11 -0.08 0.00 -0.16 0.00 0.00 28.75 28.54 2bcb h GLU 27 CO -0.18 0.41 0.44 1.25 -1.18 0.00 0.00 179.01 179.75 2bcb h LEU 28 N 0.52 0.59 0.07 1.64 5.85 -0.57 -1.58 115.31 121.82 2bcb h LEU 28 Ca 0.14 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2bcb h LEU 28 Cb 0.01 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2bcb h LEU 28 CO -0.03 0.31 -0.20 0.50 -0.34 0.00 0.00 178.44 178.69 2bcb h LYS 29 N 0.70 -0.29 -0.81 1.25 1.63 -1.15 -0.43 116.57 117.48 2bcb h LYS 29 Ca 0.41 0.02 0.18 0.00 -0.85 0.00 0.00 60.65 60.40 2bcb h LYS 29 Cb 0.45 0.07 -0.11 0.00 -0.60 0.00 0.00 32.23 32.03 2bcb h LYS 29 CO -0.29 -0.19 0.30 -0.07 -3.45 0.00 0.00 179.45 175.75 2bcb h LEU 30 N -0.30 0.22 0.24 5.20 3.38 -1.49 0.10 115.31 122.67 2bcb h LEU 30 Ca -0.01 0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2bcb h LEU 30 Cb 0.29 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2bcb h LEU 30 CO -0.10 0.02 -0.38 0.25 0.09 0.00 0.00 178.44 178.33 2bcb h LEU 31 N 0.38 -1.09 -0.82 1.67 6.46 -0.72 0.46 115.31 121.65 2bcb h LEU 31 Ca 0.47 0.10 0.01 0.00 -0.12 0.00 0.00 57.88 58.35 2bcb h LEU 31 Cb 0.82 0.38 -0.04 0.00 -0.73 0.00 0.00 40.66 41.08 2bcb h LEU 31 CO -0.49 -0.45 0.54 -0.07 -0.62 0.00 0.00 178.44 177.35 2bcb h LEU 32 N -0.66 0.93 -0.67 2.25 3.38 -0.59 -0.37 115.31 119.58 2bcb h LEU 32 Ca -0.03 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.98 2bcb h LEU 32 Cb 0.60 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 2bcb h LEU 32 CO -0.12 0.66 0.37 1.56 0.09 0.00 0.00 178.44 181.01 2bcb h GLN 33 N 1.09 0.67 -0.02 1.13 4.20 -0.56 0.18 115.11 121.81 2bcb h GLN 33 Ca 0.31 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.94 2bcb h GLN 33 Cb -0.09 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.54 2bcb h GLN 33 CO -0.08 0.45 -0.14 1.15 -0.67 0.00 0.00 178.83 179.54 2bcb h THR 34 N 0.69 1.51 0.14 -0.54 2.02 -0.24 -3.34 112.91 113.15 2bcb h THR 34 Ca 0.30 -1.69 -0.23 0.00 0.77 0.00 0.00 66.41 65.55 2bcb h THR 34 Cb 0.18 2.56 0.01 0.00 -1.74 0.00 0.00 68.15 69.16 2bcb h THR 34 CO -0.18 0.46 -1.09 -0.33 0.37 0.00 0.00 175.52 174.75 2bcb h GLU 35 N -0.49 0.30 -0.89 6.66 4.39 -0.97 -3.44 114.58 120.15 2bcb h GLU 35 Ca -0.01 -0.52 -0.22 0.00 0.34 0.00 0.00 59.36 58.96 2bcb h GLU 35 Cb 0.82 0.19 -0.18 0.00 -0.10 0.00 0.00 28.75 29.48 2bcb h GLU 35 CO 0.03 1.25 -0.55 1.97 -1.16 0.00 0.00 179.01 180.55 2bcb n PHE 36 N -4.02 -3.37 0.16 4.33 1.16 0.57 -5.02 117.46 111.28 2bcb n PHE 36 Ca -0.18 -1.69 0.08 0.00 -1.87 0.00 0.00 57.45 53.79 2bcb n PHE 36 Cb 0.88 1.35 0.45 0.00 -1.61 0.00 0.00 39.48 40.54 2bcb n PHE 36 CO 0.00 0.00 0.00 -0.35 -1.87 0.00 0.00 176.76 174.54 2bcb n PRO 37 N 2.55 0.11 0.06 3.97 -0.04 -0.74 -1.39 135.00 139.52 2bcb n PRO 37 Ca 0.17 0.60 -0.21 0.00 -0.04 0.00 0.00 63.50 64.02 2bcb n PRO 37 Cb 0.57 -2.04 -0.13 0.00 -0.04 0.00 0.00 33.50 31.86 2bcb n PRO 37 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2bcb h SER 38 N 0.00 0.73 -1.00 3.54 0.87 -1.94 -3.34 113.55 112.40 2bcb h SER 38 Ca 0.00 -0.83 0.17 0.00 -1.23 0.00 0.00 61.79 59.90 2bcb h SER 38 Cb 0.37 -0.23 -0.10 0.00 -0.44 0.00 0.00 62.40 62.00 2bcb h SER 38 CO 0.00 1.48 0.62 -0.07 -0.53 0.00 0.00 176.83 178.33 2bcb h LEU 39 N 0.07 0.81 -2.09 2.23 3.38 -1.57 -0.17 115.31 117.98 2bcb h LEU 39 Ca -0.15 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2bcb h LEU 39 Cb 1.71 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.39 2bcb h LEU 39 CO 0.19 0.33 0.00 0.17 0.09 0.00 0.00 178.44 179.22 2bcb h LEU 40 N 0.81 0.00 -0.84 1.67 8.10 -1.69 0.19 115.31 123.56 2bcb h LEU 40 Ca 0.55 0.00 -0.11 0.00 0.11 0.00 0.00 57.88 58.43 2bcb h LEU 40 Cb 0.80 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.00 2bcb h LEU 40 CO -0.34 0.00 -0.53 0.11 -4.11 0.00 0.00 178.44 173.56 2bcb h LYS 41 N 0.00 0.00 -4.66 0.17 1.79 -1.22 -3.38 116.57 109.27 2bcb h LYS 41 Ca 0.00 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.86 2bcb h LYS 41 Cb 0.10 0.00 0.07 0.00 -1.58 0.00 0.00 32.23 30.82 2bcb h LYS 41 CO 0.00 0.53 1.98 0.41 -1.08 0.00 0.00 179.45 181.29 2bcb n GLY 42 N 0.21 1.95 0.00 3.86 0.00 0.68 -0.88 105.19 111.00 2bcb n GLY 42 Ca -0.01 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2bcb n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bcb n GLY 43 N 4.73 0.04 4.87 -0.02 0.00 -1.26 -4.90 105.19 108.64 2bcb n GLY 43 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2bcb n GLY 43 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2bcb n SER 44 N 0.00 0.00 -4.10 1.61 2.88 -0.06 -4.25 113.62 109.70 2bcb n SER 44 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 2bcb n SER 44 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 2bcb n SER 44 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2bcb s THR 45 N 0.00 0.78 0.31 2.46 -4.23 -1.26 -4.99 115.64 108.72 2bcb s THR 45 Ca 0.00 -1.08 0.04 0.00 -1.18 0.00 0.00 61.69 59.47 2bcb s THR 45 Cb 0.00 -0.79 0.29 0.00 1.34 0.00 0.00 72.50 73.35 2bcb s THR 45 CO 0.00 -0.25 1.87 0.25 -0.54 0.00 0.00 174.62 175.95 2bcb h LEU 46 N 4.59 0.83 0.65 4.79 5.85 -1.87 -0.02 115.31 130.13 2bcb h LEU 46 Ca -0.37 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 2bcb h LEU 46 Cb 1.20 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 42.09 2bcb h LEU 46 CO 0.42 0.47 -0.31 -0.78 -0.34 0.00 0.00 178.44 177.89 2bcb h ASP 47 N 0.91 -0.73 -0.49 1.25 3.58 -1.96 0.12 116.42 119.09 2bcb h ASP 47 Ca 0.45 -0.01 0.08 0.00 0.42 0.00 0.00 57.03 57.97 2bcb h ASP 47 Cb 0.47 0.19 -0.07 0.00 1.72 0.00 0.00 39.33 41.64 2bcb h ASP 47 CO -0.21 -0.37 0.10 -0.33 -2.88 0.00 0.00 179.24 175.55 2bcb h GLU 48 N -1.14 0.23 0.76 0.28 4.39 -1.77 0.39 114.58 117.73 2bcb h GLU 48 Ca -0.09 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 2bcb h GLU 48 Cb 0.70 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2bcb h GLU 48 CO 0.15 0.15 -0.50 1.25 -1.16 0.00 0.00 179.01 178.90 2bcb h LEU 49 N 0.24 -1.27 -1.33 1.33 5.85 -0.96 0.18 115.31 119.35 2bcb h LEU 49 Ca 0.24 0.08 0.10 0.00 0.84 0.00 0.00 57.88 59.14 2bcb h LEU 49 Cb 0.32 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 41.67 2bcb h LEU 49 CO -0.32 -0.75 0.53 0.15 -0.34 0.00 0.00 178.44 177.72 2bcb h PHE 50 N -1.18 0.80 -0.54 1.25 3.57 -0.52 -0.32 116.94 120.00 2bcb h PHE 50 Ca -0.10 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.31 2bcb h PHE 50 Cb 0.96 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 2bcb h PHE 50 CO -0.13 0.37 -0.08 0.93 -2.23 0.00 0.00 178.31 177.18 2bcb h GLU 51 N 0.74 1.01 -0.32 1.11 5.08 0.24 0.63 114.58 123.07 2bcb h GLU 51 Ca 0.38 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2bcb h GLU 51 Cb 0.46 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2bcb h GLU 51 CO -0.15 1.04 0.17 1.49 -1.00 0.00 0.00 179.01 180.57 2bcb h GLU 52 N 0.88 0.44 -0.31 2.33 4.57 0.12 -3.06 114.58 119.55 2bcb h GLU 52 Ca 0.14 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.19 2bcb h GLU 52 Cb 0.64 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.12 2bcb h GLU 52 CO 0.04 0.37 -0.15 -0.07 -1.18 0.00 0.00 179.01 178.02 2bcb h LEU 53 N 0.39 0.53 -8.30 1.64 3.38 -0.71 -3.40 115.31 108.84 2bcb h LEU 53 Ca 0.11 -0.15 -0.72 0.00 0.09 0.00 0.00 57.88 57.21 2bcb h LEU 53 Cb 0.06 -0.14 -0.21 0.00 0.09 0.00 0.00 40.66 40.46 2bcb h LEU 53 CO -0.02 0.70 -0.15 -0.62 0.09 0.00 0.00 178.44 178.44 2bcb s ASP 54 N -6.77 6.18 0.42 -0.43 2.15 0.22 -4.71 116.67 113.73 2bcb s ASP 54 Ca -0.07 -1.24 0.23 0.00 0.43 0.00 0.00 52.55 51.90 2bcb s ASP 54 Cb 0.14 -2.23 1.22 0.00 -0.30 0.00 0.00 42.92 41.75 2bcb s ASP 54 CO 0.79 -0.79 1.75 0.07 -0.17 0.00 0.00 175.17 176.81 2bcb h LYS 55 N 8.89 0.28 0.00 4.34 2.10 -1.78 0.34 116.57 130.73 2bcb h LYS 55 Ca -0.28 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.35 2bcb h LYS 55 Cb 1.10 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.37 2bcb h LYS 55 CO 0.94 0.18 -0.69 -0.97 -2.00 0.00 0.00 179.45 176.92 2bcb h ASN 56 N 0.29 0.00 -6.49 7.07 -0.00 -1.89 -3.49 115.58 111.07 2bcb h ASN 56 Ca 0.63 -0.15 -0.50 0.00 -0.00 0.00 0.00 56.30 56.29 2bcb h ASN 56 Cb 1.79 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 40.12 2bcb h ASN 56 CO -0.28 0.07 -0.94 0.61 -0.00 0.00 0.00 177.43 176.89 2bcb n GLY 57 N 1.28 -0.66 1.03 1.57 0.00 0.12 -4.76 105.19 103.78 2bcb n GLY 57 Ca 0.02 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2bcb n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bcb n ASP 58 N -2.69 0.00 0.00 1.61 5.75 -1.26 -5.00 116.55 114.95 2bcb n ASP 58 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.60 2bcb n ASP 58 Cb 0.62 0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.97 2bcb n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bcb n GLY 59 N -1.36 0.51 3.63 6.12 0.00 -1.26 -5.04 105.19 107.79 2bcb n GLY 59 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2bcb n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bcb s GLU 60 N 0.00 1.54 0.61 1.61 8.01 -1.26 -4.51 118.70 124.69 2bcb s GLU 60 Ca 0.00 -0.97 -0.03 0.00 0.01 0.00 0.00 54.97 53.98 2bcb s GLU 60 Cb 0.00 0.54 0.04 0.00 -4.31 0.00 0.00 34.13 30.40 2bcb s GLU 60 CO 0.00 -0.67 0.88 0.08 0.01 0.00 0.00 175.26 175.56 2bcb s VAL 61 N -3.92 2.72 0.19 2.63 1.01 0.50 -4.74 120.40 118.80 2bcb s VAL 61 Ca 0.12 -0.41 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 2bcb s VAL 61 Cb -0.02 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 2bcb s VAL 61 CO 0.02 -0.08 0.36 -0.94 0.00 0.00 0.00 175.10 174.47 2bcb s SER 62 N -4.43 -0.04 0.29 3.32 1.04 -1.26 -0.20 113.70 112.41 2bcb s SER 62 Ca 0.57 -0.82 0.03 0.00 0.48 0.00 0.00 55.95 56.21 2bcb s SER 62 Cb -0.10 0.49 0.71 0.00 0.10 0.00 0.00 66.02 67.21 2bcb s SER 62 CO 0.42 -0.97 1.70 0.15 0.98 0.00 0.00 173.24 175.52 2bcb h PHE 63 N 2.42 0.64 -0.98 5.02 3.57 -1.94 0.69 116.94 126.37 2bcb h PHE 63 Ca -0.30 0.04 0.30 0.00 3.53 0.00 0.00 57.97 61.54 2bcb h PHE 63 Cb 1.24 -0.14 -0.18 0.00 2.79 0.00 0.00 35.95 39.66 2bcb h PHE 63 CO 0.39 -0.04 0.15 1.49 -2.23 0.00 0.00 178.31 178.07 2bcb h GLU 64 N 0.41 0.03 0.02 1.11 4.81 -1.96 -1.50 114.58 117.49 2bcb h GLU 64 Ca 0.55 -0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.56 2bcb h GLU 64 Cb 1.03 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 2bcb h GLU 64 CO -0.52 0.02 -1.19 0.93 -0.73 0.00 0.00 179.01 177.52 2bcb h GLU 65 N 0.03 0.04 -0.09 1.92 4.39 -1.25 -3.37 114.58 116.24 2bcb h GLU 65 Ca 0.64 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 60.31 2bcb h GLU 65 Cb 1.42 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2bcb h GLU 65 CO -0.86 1.03 0.60 0.35 -1.16 0.00 0.00 179.01 178.97 2bcb h PHE 66 N -0.87 0.00 -0.75 4.33 3.04 -0.23 0.40 116.94 122.86 2bcb h PHE 66 Ca -0.32 0.00 0.18 0.00 3.98 0.00 0.00 57.97 61.82 2bcb h PHE 66 Cb 1.36 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.83 2bcb h PHE 66 CO 0.12 0.00 0.51 1.96 -2.02 0.00 0.00 178.31 178.88 2bcb h GLN 67 N 0.00 0.21 -0.70 1.11 1.08 -1.47 0.55 115.11 115.89 2bcb h GLN 67 Ca 0.04 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2bcb h GLN 67 Cb 1.25 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.59 2bcb h GLN 67 CO -0.00 0.14 0.45 0.28 -0.95 0.00 0.00 178.83 178.75 2bcb h VAL 68 N 0.22 1.19 -0.01 -0.54 2.07 -1.21 0.12 116.25 118.09 2bcb h VAL 68 Ca 0.37 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2bcb h VAL 68 Cb 1.11 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2bcb h VAL 68 CO -0.08 0.18 -0.00 0.25 0.02 0.00 0.00 177.57 177.95 2bcb h LEU 69 N 0.95 0.02 -1.20 2.57 7.12 -0.15 0.63 115.31 125.25 2bcb h LEU 69 Ca 0.25 -0.33 0.21 0.00 0.13 0.00 0.00 57.88 58.14 2bcb h LEU 69 Cb -0.08 -0.00 -0.09 0.00 -0.53 0.00 0.00 40.66 39.95 2bcb h LEU 69 CO -0.05 0.34 0.62 0.58 -0.13 0.00 0.00 178.44 179.80 2bcb h VAL 70 N -0.31 0.67 0.19 1.05 2.07 -0.27 0.76 116.25 120.41 2bcb h VAL 70 Ca 0.00 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2bcb h VAL 70 Cb 0.34 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2bcb h VAL 70 CO 0.00 0.11 -0.09 0.50 0.02 0.00 0.00 177.57 178.11 2bcb h LYS 71 N 0.61 -0.25 0.00 1.57 3.64 -0.41 -3.33 116.57 118.40 2bcb h LYS 71 Ca 0.55 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 2bcb h LYS 71 Cb 1.07 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 2bcb h LYS 71 CO -0.31 0.15 0.00 0.87 -2.27 0.00 0.00 179.45 177.89 2bcb h LYS 72 N -0.81 0.00 -0.02 1.90 1.57 0.25 -2.64 116.57 116.82 2bcb h LYS 72 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2bcb h LYS 72 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.83 2bcb h LYS 72 CO 0.04 0.00 0.01 -0.84 -0.57 0.00 0.00 179.45 178.10 2bcb h ILE 73 N 0.00 0.83 0.00 1.86 3.07 -1.01 0.36 117.51 122.63 2bcb h ILE 73 Ca 0.00 0.00 -0.06 0.00 1.55 0.00 0.00 64.86 66.35 2bcb h ILE 73 Cb 0.27 0.99 -0.01 0.00 -0.27 0.00 0.00 36.82 37.80 2bcb h ILE 73 CO 0.00 0.00 -0.28 0.77 -1.05 0.00 0.00 178.15 177.59 2bcb h SER 74 N 0.00 0.00 -0.01 2.16 4.64 -1.69 -3.53 113.55 115.13 2bcb h SER 74 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2bcb h SER 74 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2bcb h SER 74 CO -0.00 0.28 0.00 1.67 -0.87 0.00 0.00 176.83 177.91