#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 -0.39 0.55 4.39 1.04 -1.26 -5.03 113.70 113.00 2bcb s SER 2 Ca 0.00 0.11 0.34 0.00 0.48 0.00 0.00 55.95 56.87 2bcb s SER 2 Cb 0.00 0.39 1.50 0.00 0.10 0.00 0.00 66.02 68.01 2bcb s SER 2 CO 0.00 -0.59 1.83 -0.65 0.98 0.00 0.00 173.24 174.81 2bcb h PRO 3 N 2.15 0.00 -1.02 4.02 0.11 -2.04 -0.94 132.00 134.28 2bcb h PRO 3 Ca -0.22 0.00 0.25 0.00 0.11 0.00 0.00 66.00 66.14 2bcb h PRO 3 Cb 1.23 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.24 2bcb h PRO 3 CO 0.32 0.00 0.65 0.93 -0.21 0.00 0.00 178.00 179.69 2bcb h GLU 4 N 0.00 0.42 0.22 1.05 5.08 -1.97 0.29 114.58 119.67 2bcb h GLU 4 Ca 0.47 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.80 2bcb h GLU 4 Cb 1.97 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.13 2bcb h GLU 4 CO -0.00 0.28 -0.11 0.93 -1.00 0.00 0.00 179.01 179.11 2bcb h GLU 5 N 0.44 -0.28 0.00 2.33 5.08 -1.59 0.11 114.58 120.67 2bcb h GLU 5 Ca 0.58 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.88 2bcb h GLU 5 Cb 1.39 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 2bcb h GLU 5 CO -0.29 -0.14 -0.36 -0.07 -1.00 0.00 0.00 179.01 177.15 2bcb h LEU 6 N -0.36 0.00 -0.37 1.33 3.38 -1.23 -0.90 115.31 117.16 2bcb h LEU 6 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2bcb h LEU 6 Cb 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2bcb h LEU 6 CO 0.05 0.36 0.12 0.50 0.09 0.00 0.00 178.44 179.55 2bcb h LYS 7 N 0.00 0.57 0.01 1.13 3.64 -0.09 0.18 116.57 122.01 2bcb h LYS 7 Ca -0.00 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2bcb h LYS 7 Cb 0.64 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2bcb h LYS 7 CO 0.05 0.58 -0.03 0.78 -2.27 0.00 0.00 179.45 178.56 2bcb h GLY 8 N 0.45 -0.04 0.71 5.01 0.00 0.04 0.71 103.07 109.95 2bcb h GLY 8 Ca 0.12 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.49 2bcb h GLY 8 CO -0.00 -0.03 -0.23 -2.22 0.00 0.00 0.00 176.54 174.05 2bcb h ILE 9 N -0.06 0.50 -0.30 2.60 1.08 -1.05 0.16 117.51 120.45 2bcb h ILE 9 Ca 0.01 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.55 2bcb h ILE 9 Cb 0.07 0.50 -0.08 0.00 -3.07 0.00 0.00 36.82 34.24 2bcb h ILE 9 CO -0.02 0.00 -0.30 0.15 -0.69 0.00 0.00 178.15 177.28 2bcb h PHE 10 N -0.48 -0.83 -0.37 1.37 3.04 -0.47 -1.70 116.94 117.51 2bcb h PHE 10 Ca 0.00 0.05 0.04 0.00 3.98 0.00 0.00 57.97 62.04 2bcb h PHE 10 Cb 0.46 0.41 -0.04 0.00 2.56 0.00 0.00 35.95 39.34 2bcb h PHE 10 CO -0.17 -0.37 0.15 1.49 -2.02 0.00 0.00 178.31 177.39 2bcb h GLU 11 N -0.28 0.31 -0.35 1.11 4.81 -0.56 0.16 114.58 119.78 2bcb h GLU 11 Ca 0.15 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2bcb h GLU 11 Cb 0.52 -0.07 -0.08 0.00 0.63 0.00 0.00 28.75 29.75 2bcb h GLU 11 CO -0.46 0.20 -0.23 -0.22 -0.73 0.00 0.00 179.01 177.58 2bcb h LYS 12 N 0.32 -0.18 -0.09 1.92 3.64 0.10 0.14 116.57 122.42 2bcb h LYS 12 Ca 0.16 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.48 2bcb h LYS 12 Cb 0.11 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2bcb h LYS 12 CO -0.15 -0.12 -0.23 1.88 -2.27 0.00 0.00 179.45 178.57 2bcb h TYR 13 N -0.18 0.41 -0.98 1.91 -1.99 -1.00 -3.19 116.97 111.96 2bcb h TYR 13 Ca 0.17 -0.16 0.21 0.00 2.00 0.00 0.00 58.73 60.96 2bcb h TYR 13 Cb 0.45 -0.07 -0.09 0.00 2.00 0.00 0.00 36.73 39.02 2bcb h TYR 13 CO -0.44 0.84 0.62 0.00 -0.00 0.00 0.00 178.16 179.19 2bcb h ALA 14 N 0.49 1.99 0.00 3.88 0.00 -0.22 -0.59 119.26 124.82 2bcb h ALA 14 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bcb h ALA 14 Cb 0.84 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2bcb h ALA 14 CO 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 178.96 2bcb n ALA 15 N -2.43 1.48 0.50 0.00 0.00 0.45 -2.93 120.51 117.58 2bcb n ALA 15 Ca 0.22 0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.49 2bcb n ALA 15 Cb 0.69 -1.25 -0.10 0.00 0.00 0.00 0.00 19.45 18.79 2bcb n ALA 15 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2bcb h LYS 16 N 0.00 -1.25 0.00 0.00 1.63 -1.20 -3.45 116.57 112.30 2bcb h LYS 16 Ca 0.00 0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 2bcb h LYS 16 Cb 0.21 0.28 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 2bcb h LYS 16 CO 0.00 -0.84 -0.01 0.39 -3.45 0.00 0.00 179.45 175.55 2bcb n GLU 17 N -5.65 0.00 -0.08 1.90 4.71 -1.25 -4.95 120.64 115.32 2bcb n GLU 17 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 56.99 2bcb n GLU 17 Cb 0.52 -0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.95 2bcb n GLU 17 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2bcb n GLY 18 N 1.51 1.18 1.08 0.62 0.00 -1.22 -4.88 105.19 103.48 2bcb n GLY 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.06 -6.25 0.30 1.61 -0.08 -1.15 -3.71 116.55 108.33 2bcb n ASP 19 Ca 0.00 0.80 0.13 0.00 -1.51 0.00 0.00 54.79 54.21 2bcb n ASP 19 Cb 0.26 -2.65 0.63 0.00 2.34 0.00 0.00 41.12 41.70 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 1.54 0.00 0.00 -0.67 0.13 -1.85 0.47 132.00 131.61 2bcb h PRO 20 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2bcb h PRO 20 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2bcb h PRO 20 CO 0.00 0.00 -1.02 -1.71 -0.23 0.00 0.00 178.00 175.04 2bcb n ASN 21 N -2.89 0.71 -4.27 1.44 5.15 -1.26 -4.48 115.26 109.66 2bcb n ASN 21 Ca -0.00 0.16 -0.26 0.00 -0.60 0.00 0.00 54.58 53.87 2bcb n ASN 21 Cb 0.56 0.58 -0.14 0.00 -0.53 0.00 0.00 39.78 40.26 2bcb n ASN 21 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2bcb s GLN 22 N -3.31 1.43 -0.37 1.20 1.11 0.16 -3.72 119.66 116.16 2bcb s GLN 22 Ca 0.01 -1.00 -0.11 0.00 0.01 0.00 0.00 55.36 54.27 2bcb s GLN 22 Cb 0.12 -1.58 0.02 0.00 -1.01 0.00 0.00 33.01 30.56 2bcb s GLN 22 CO 0.79 0.40 0.21 -0.51 0.01 0.00 0.00 175.29 176.19 2bcb s LEU 23 N -1.27 4.69 0.69 2.90 1.43 0.55 -4.25 118.68 123.43 2bcb s LEU 23 Ca 0.08 -0.93 -0.11 0.00 -1.03 0.00 0.00 54.13 52.14 2bcb s LEU 23 Cb -0.09 -2.03 0.01 0.00 0.03 0.00 0.00 46.19 44.10 2bcb s LEU 23 CO 0.02 -0.37 1.06 -0.94 0.23 0.00 0.00 176.35 176.35 2bcb s SER 24 N 1.57 5.45 0.07 2.29 1.04 -1.26 -0.32 113.70 122.53 2bcb s SER 24 Ca 0.03 1.48 -0.16 0.00 0.48 0.00 0.00 55.95 57.77 2bcb s SER 24 Cb -0.19 -2.37 -0.05 0.00 0.10 0.00 0.00 66.02 63.51 2bcb s SER 24 CO 0.07 -1.38 1.27 0.50 0.98 0.00 0.00 173.24 174.68 2bcb h LYS 25 N -0.68 -0.16 -0.71 4.02 3.64 -1.93 0.17 116.57 120.92 2bcb h LYS 25 Ca -0.44 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.08 2bcb h LYS 25 Cb 1.22 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.03 2bcb h LYS 25 CO 0.59 -0.11 0.47 1.49 -2.27 0.00 0.00 179.45 179.62 2bcb h GLU 26 N -0.17 0.42 -0.33 1.90 4.57 -1.96 -1.95 114.58 117.06 2bcb h GLU 26 Ca 0.04 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 2bcb h GLU 26 Cb 0.28 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 2bcb h GLU 26 CO -0.32 0.28 -0.01 1.49 -1.18 0.00 0.00 179.01 179.27 2bcb h GLU 27 N 0.43 0.60 -0.85 1.92 4.81 -1.33 -2.69 114.58 117.48 2bcb h GLU 27 Ca 0.34 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 59.43 2bcb h GLU 27 Cb 0.73 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.99 2bcb h GLU 27 CO -0.11 0.73 0.52 1.25 -0.73 0.00 0.00 179.01 180.67 2bcb h LEU 28 N 0.40 0.83 0.04 1.64 5.85 -0.02 -2.15 115.31 121.90 2bcb h LEU 28 Ca 0.09 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.84 2bcb h LEU 28 Cb 0.46 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2bcb h LEU 28 CO 0.02 0.53 -0.24 0.50 -0.34 0.00 0.00 178.44 178.91 2bcb h LYS 29 N 0.96 -0.32 -0.83 1.25 1.63 -1.09 0.03 116.57 118.21 2bcb h LYS 29 Ca 0.37 0.02 0.20 0.00 -0.85 0.00 0.00 60.65 60.39 2bcb h LYS 29 Cb 0.15 0.07 -0.12 0.00 -0.60 0.00 0.00 32.23 31.73 2bcb h LYS 29 CO -0.17 -0.21 0.25 -0.07 -3.45 0.00 0.00 179.45 175.80 2bcb h LEU 30 N -0.33 0.09 0.24 5.20 3.38 -1.43 0.69 115.31 123.15 2bcb h LEU 30 Ca -0.00 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2bcb h LEU 30 Cb 0.34 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2bcb h LEU 30 CO -0.14 -0.06 -0.41 0.25 0.09 0.00 0.00 178.44 178.16 2bcb h LEU 31 N 0.29 -1.20 -0.60 1.67 6.46 -0.65 0.34 115.31 121.63 2bcb h LEU 31 Ca 0.50 0.11 0.03 0.00 -0.12 0.00 0.00 57.88 58.40 2bcb h LEU 31 Cb 0.92 0.42 -0.04 0.00 -0.73 0.00 0.00 40.66 41.23 2bcb h LEU 31 CO -0.56 -0.49 0.36 -0.07 -0.62 0.00 0.00 178.44 177.07 2bcb h LEU 32 N -0.70 0.59 -1.05 2.25 3.38 -0.38 -0.01 115.31 119.39 2bcb h LEU 32 Ca -0.03 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.00 2bcb h LEU 32 Cb 0.65 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 2bcb h LEU 32 CO -0.14 0.41 0.63 1.56 0.09 0.00 0.00 178.44 180.99 2bcb h GLN 33 N 0.72 1.14 0.01 1.13 4.20 -0.63 0.28 115.11 121.96 2bcb h GLN 33 Ca 0.24 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.83 2bcb h GLN 33 Cb 0.02 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.55 2bcb h GLN 33 CO -0.10 0.75 -0.20 1.15 -0.67 0.00 0.00 178.83 179.76 2bcb h THR 34 N 1.17 1.60 0.09 -0.54 2.02 -0.21 -3.38 112.91 113.65 2bcb h THR 34 Ca 0.41 -2.02 -0.17 0.00 0.77 0.00 0.00 66.41 65.40 2bcb h THR 34 Cb 0.11 2.91 0.01 0.00 -1.74 0.00 0.00 68.15 69.43 2bcb h THR 34 CO -0.15 0.55 -0.81 -0.33 0.37 0.00 0.00 175.52 175.15 2bcb h GLU 35 N -0.62 0.19 -0.80 6.66 4.39 -0.86 -3.45 114.58 120.08 2bcb h GLU 35 Ca -0.03 -0.32 -0.12 0.00 0.34 0.00 0.00 59.36 59.24 2bcb h GLU 35 Cb 1.00 0.12 -0.16 0.00 -0.10 0.00 0.00 28.75 29.61 2bcb h GLU 35 CO 0.04 1.15 -0.41 1.97 -1.16 0.00 0.00 179.01 180.60 2bcb n PHE 36 N -4.22 -3.19 -0.14 4.33 1.16 0.85 -5.01 117.46 111.24 2bcb n PHE 36 Ca -0.17 -1.23 0.23 0.00 -1.87 0.00 0.00 57.45 54.41 2bcb n PHE 36 Cb 0.75 1.41 0.65 0.00 -1.61 0.00 0.00 39.48 40.68 2bcb n PHE 36 CO 0.00 0.00 0.00 -1.00 -1.87 0.00 0.00 176.76 173.89 2bcb h PRO 37 N 4.80 0.11 -1.00 3.97 0.13 -1.35 -1.75 132.00 136.90 2bcb h PRO 37 Ca 0.04 -0.01 0.30 0.00 -0.87 0.00 0.00 66.00 65.46 2bcb h PRO 37 Cb 1.12 -0.03 -0.14 0.00 0.13 0.00 0.00 31.00 32.08 2bcb h PRO 37 CO -0.01 0.07 0.56 0.66 -0.23 0.00 0.00 178.00 179.06 2bcb h SER 38 N 0.12 0.53 -0.19 1.44 4.64 -1.95 0.36 113.55 118.50 2bcb h SER 38 Ca 0.38 0.18 0.05 0.00 -0.47 0.00 0.00 61.79 61.93 2bcb h SER 38 Cb 1.32 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 2bcb h SER 38 CO -0.05 -0.07 0.22 -0.07 -0.87 0.00 0.00 176.83 175.99 2bcb h LEU 39 N 0.39 0.00 -2.03 5.97 3.38 -1.67 -0.36 115.31 120.99 2bcb h LEU 39 Ca 0.70 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.65 2bcb h LEU 39 Cb 1.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.27 2bcb h LEU 39 CO -0.57 0.00 -0.09 -0.07 0.09 0.00 0.00 178.44 177.80 2bcb h LEU 40 N 0.00 0.00 -1.19 1.67 3.38 -1.12 0.15 115.31 118.19 2bcb h LEU 40 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2bcb h LEU 40 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2bcb h LEU 40 CO -0.00 0.09 0.05 0.11 0.09 0.00 0.00 178.44 178.78 2bcb h LYS 41 N 0.00 0.61 -2.59 1.13 1.57 -1.23 -2.74 116.57 113.32 2bcb h LYS 41 Ca -0.00 -0.12 -0.26 0.00 -1.87 0.00 0.00 60.65 58.40 2bcb h LYS 41 Cb 0.21 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 2bcb h LYS 41 CO 0.01 0.60 0.95 0.41 -0.57 0.00 0.00 179.45 180.84 2bcb n GLY 42 N -0.91 2.86 0.00 3.86 0.00 0.51 -3.34 105.19 108.18 2bcb n GLY 42 Ca 0.02 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 2.98 0.39 0.21 -0.02 0.00 -1.20 -4.86 105.19 102.68 2bcb n GLY 43 Ca 0.41 -0.49 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.53 -4.82 1.61 2.88 -1.04 -4.17 113.62 107.55 2bcb n SER 44 Ca 0.00 0.95 -0.37 0.00 -1.33 0.00 0.00 58.87 58.12 2bcb n SER 44 Cb 0.00 -0.15 -0.06 0.00 -0.75 0.00 0.00 64.21 63.25 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 -5.01 4.75 0.32 2.46 -4.23 -1.26 -4.81 115.64 107.85 2bcb s THR 45 Ca -0.06 1.11 0.09 0.00 -1.18 0.00 0.00 61.69 61.65 2bcb s THR 45 Cb 0.05 -3.85 0.31 0.00 1.34 0.00 0.00 72.50 70.36 2bcb s THR 45 CO 0.31 0.41 1.74 0.25 -0.54 0.00 0.00 174.62 176.79 2bcb h LEU 46 N 4.08 0.70 0.76 4.79 5.85 -1.93 -1.61 115.31 127.95 2bcb h LEU 46 Ca -0.49 0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2bcb h LEU 46 Cb 1.20 0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.26 2bcb h LEU 46 CO 0.64 0.14 -0.36 0.44 -0.34 0.00 0.00 178.44 178.96 2bcb h ASP 47 N 0.62 -0.86 -0.30 1.25 5.19 -1.92 0.14 116.42 120.54 2bcb h ASP 47 Ca 0.63 0.03 0.07 0.00 -0.62 0.00 0.00 57.03 57.14 2bcb h ASP 47 Cb 1.16 0.22 -0.08 0.00 0.18 0.00 0.00 39.33 40.81 2bcb h ASP 47 CO -0.46 -0.61 -0.22 -0.33 -3.12 0.00 0.00 179.24 174.50 2bcb h GLU 48 N -1.04 -0.19 0.91 3.56 5.08 -1.64 0.36 114.58 121.63 2bcb h GLU 48 Ca -0.10 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2bcb h GLU 48 Cb 0.79 0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.09 2bcb h GLU 48 CO 0.17 -0.13 -0.46 1.25 -1.00 0.00 0.00 179.01 178.85 2bcb h LEU 49 N -0.20 -1.09 -1.13 1.33 5.85 -1.20 -0.20 115.31 118.67 2bcb h LEU 49 Ca 0.16 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.05 2bcb h LEU 49 Cb 0.44 0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.68 2bcb h LEU 49 CO -0.42 -0.76 0.61 0.15 -0.34 0.00 0.00 178.44 177.68 2bcb h PHE 50 N -1.25 1.00 -0.45 1.25 3.57 -0.61 -0.14 116.94 120.31 2bcb h PHE 50 Ca -0.12 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.28 2bcb h PHE 50 Cb 0.96 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 2bcb h PHE 50 CO -0.00 0.38 -0.23 1.49 -2.23 0.00 0.00 178.31 177.72 2bcb h GLU 51 N 0.86 0.93 -0.29 1.11 4.81 0.01 0.58 114.58 122.58 2bcb h GLU 51 Ca 0.48 -0.39 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2bcb h GLU 51 Cb 0.60 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2bcb h GLU 51 CO -0.24 1.05 0.16 1.49 -0.73 0.00 0.00 179.01 180.73 2bcb h GLU 52 N 0.80 0.41 -0.38 1.92 4.57 0.04 -3.05 114.58 118.90 2bcb h GLU 52 Ca 0.10 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 2bcb h GLU 52 Cb 0.79 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 2bcb h GLU 52 CO 0.07 0.37 -0.03 -0.07 -1.18 0.00 0.00 179.01 178.16 2bcb h LEU 53 N 0.35 0.58 -8.36 1.64 3.38 -0.65 -3.40 115.31 108.84 2bcb h LEU 53 Ca 0.10 -0.13 -0.69 0.00 0.09 0.00 0.00 57.88 57.26 2bcb h LEU 53 Cb 0.08 -0.15 -0.18 0.00 0.09 0.00 0.00 40.66 40.49 2bcb h LEU 53 CO -0.02 0.67 0.02 -0.62 0.09 0.00 0.00 178.44 178.59 2bcb s ASP 54 N -6.71 6.22 0.43 -0.43 -1.08 0.20 -4.74 116.67 110.55 2bcb s ASP 54 Ca -0.08 -0.98 0.25 0.00 -0.52 0.00 0.00 52.55 51.23 2bcb s ASP 54 Cb 0.15 -2.28 1.29 0.00 -1.46 0.00 0.00 42.92 40.62 2bcb s ASP 54 CO 0.78 -0.89 1.70 0.07 0.52 0.00 0.00 175.17 177.35 2bcb h LYS 55 N 8.99 0.21 0.00 4.34 2.10 -1.79 0.33 116.57 130.75 2bcb h LYS 55 Ca -0.28 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2bcb h LYS 55 Cb 1.10 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.38 2bcb h LYS 55 CO 0.97 0.14 -0.78 -1.71 -2.00 0.00 0.00 179.45 176.07 2bcb n ASN 56 N -4.62 0.67 -3.92 7.07 2.85 -1.26 -5.00 115.26 111.04 2bcb n ASN 56 Ca 0.31 0.02 -0.25 0.00 -0.11 0.00 0.00 54.58 54.55 2bcb n ASN 56 Cb 1.18 0.39 -0.01 0.00 1.24 0.00 0.00 39.78 42.57 2bcb n ASN 56 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2bcb n GLY 57 N 1.34 -0.23 0.35 8.20 0.00 0.12 -4.72 105.19 110.25 2bcb n GLY 57 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2bcb n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bcb n ASP 58 N -2.99 0.00 0.00 1.61 2.03 -1.26 -4.98 116.55 110.96 2bcb n ASP 58 Ca -0.31 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.00 2bcb n ASP 58 Cb 0.68 0.09 0.00 0.00 -0.72 0.00 0.00 41.12 41.17 2bcb n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bcb n GLY 59 N -1.25 0.72 3.62 0.27 0.00 -1.26 -4.96 105.19 102.33 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 -4.27 118.70 124.94 2bcb s GLU 60 Ca 0.00 -1.09 0.03 0.00 0.01 0.00 0.00 54.97 53.92 2bcb s GLU 60 Cb 0.00 0.51 0.08 0.00 -4.31 0.00 0.00 34.13 30.41 2bcb s GLU 60 CO 0.00 -0.65 0.85 0.08 0.01 0.00 0.00 175.26 175.55 2bcb s VAL 61 N -3.96 2.35 0.16 2.63 1.01 0.56 -4.69 120.40 118.47 2bcb s VAL 61 Ca 0.16 -0.75 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 2bcb s VAL 61 Cb -0.02 -2.60 0.03 0.00 0.00 0.00 0.00 36.38 33.79 2bcb s VAL 61 CO 0.05 0.00 0.43 -0.94 0.00 0.00 0.00 175.10 174.64 2bcb s SER 62 N -4.61 -0.20 0.30 3.32 1.04 -1.26 -0.33 113.70 111.95 2bcb s SER 62 Ca 0.62 -0.46 0.05 0.00 0.48 0.00 0.00 55.95 56.64 2bcb s SER 62 Cb -0.07 0.51 0.75 0.00 0.10 0.00 0.00 66.02 67.31 2bcb s SER 62 CO 0.40 -0.94 1.72 0.15 0.98 0.00 0.00 173.24 175.56 2bcb h PHE 63 N 2.32 0.82 -0.75 5.02 3.57 -1.95 0.13 116.94 126.11 2bcb h PHE 63 Ca -0.31 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.30 2bcb h PHE 63 Cb 1.25 -0.22 -0.10 0.00 2.79 0.00 0.00 35.95 39.67 2bcb h PHE 63 CO 0.35 0.05 -0.57 1.49 -2.23 0.00 0.00 178.31 177.40 2bcb h GLU 64 N 0.53 -0.16 0.05 1.11 4.81 -1.96 -1.59 114.58 117.36 2bcb h GLU 64 Ca 0.57 0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 59.58 2bcb h GLU 64 Cb 1.04 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 2bcb h GLU 64 CO -0.47 -0.11 -1.07 1.05 -0.73 0.00 0.00 179.01 177.67 2bcb h GLU 65 N -0.17 0.12 -0.27 1.92 4.11 -1.68 -3.18 114.58 115.43 2bcb h GLU 65 Ca 0.13 -0.19 0.08 0.00 0.07 0.00 0.00 59.36 59.44 2bcb h GLU 65 Cb 0.49 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2bcb h GLU 65 CO -0.79 1.07 0.41 0.35 0.07 0.00 0.00 179.01 180.12 2bcb h PHE 66 N 0.04 0.00 -0.12 2.06 3.57 0.17 0.58 116.94 123.24 2bcb h PHE 66 Ca -0.06 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.48 2bcb h PHE 66 Cb 1.81 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.55 2bcb h PHE 66 CO 0.03 0.00 0.15 1.96 -2.23 0.00 0.00 178.31 178.22 2bcb h GLN 67 N 0.00 0.00 -0.54 1.11 1.08 -1.37 0.44 115.11 115.82 2bcb h GLN 67 Ca 0.13 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.29 2bcb h GLN 67 Cb 0.94 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.35 2bcb h GLN 67 CO -0.00 0.00 0.19 0.28 -0.95 0.00 0.00 178.83 178.35 2bcb h VAL 68 N 0.00 1.23 -0.20 -0.54 2.07 -1.13 0.92 116.25 118.59 2bcb h VAL 68 Ca 0.06 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2bcb h VAL 68 Cb 0.35 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2bcb h VAL 68 CO -0.00 0.28 0.12 0.25 0.02 0.00 0.00 177.57 178.24 2bcb h LEU 69 N 0.75 0.25 -0.79 2.57 7.12 -0.36 0.69 115.31 125.53 2bcb h LEU 69 Ca 0.18 -0.05 0.12 0.00 0.13 0.00 0.00 57.88 58.25 2bcb h LEU 69 Cb 0.25 -0.06 -0.08 0.00 -0.53 0.00 0.00 40.66 40.23 2bcb h LEU 69 CO -0.01 0.23 0.40 0.58 -0.13 0.00 0.00 178.44 179.51 2bcb h VAL 70 N 0.24 0.79 -0.57 1.05 2.07 -0.68 0.80 116.25 119.94 2bcb h VAL 70 Ca 0.07 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 2bcb h VAL 70 Cb 0.03 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 29.88 2bcb h VAL 70 CO -0.01 0.11 0.07 0.50 0.02 0.00 0.00 177.57 178.26 2bcb h LYS 71 N 0.62 0.93 0.00 1.57 3.64 0.08 -3.17 116.57 120.25 2bcb h LYS 71 Ca 0.41 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.43 2bcb h LYS 71 Cb 0.51 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2bcb h LYS 71 CO -0.32 0.88 -0.58 0.87 -2.27 0.00 0.00 179.45 178.04 2bcb h LYS 72 N 0.88 0.00 -0.56 1.90 1.57 0.14 -3.13 116.57 117.36 2bcb h LYS 72 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2bcb h LYS 72 Cb 0.42 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 2bcb h LYS 72 CO 0.01 0.58 0.32 -0.84 -0.57 0.00 0.00 179.45 178.95 2bcb h ILE 73 N 0.00 1.17 -0.12 1.86 3.07 -1.07 0.26 117.51 122.67 2bcb h ILE 73 Ca -0.01 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 66.02 2bcb h ILE 73 Cb 1.03 0.39 0.00 0.00 -0.27 0.00 0.00 36.82 37.97 2bcb h ILE 73 CO 0.07 0.18 0.00 -1.54 -1.05 0.00 0.00 178.15 175.81 2bcb n SER 74 N -4.41 1.84 0.00 2.16 3.41 -1.19 -5.15 113.62 110.29 2bcb n SER 74 Ca 0.05 -2.17 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 2bcb n SER 74 Cb 0.08 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 2bcb n SER 74 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55