#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blq n SER 2 N 0.00 0.00 0.00 0.00 7.64 -1.26 -2.40 113.62 117.60 1blq n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1blq n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1blq n SER 2 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1blq n MET 3 N 0.00 0.00 0.00 1.43 0.00 -1.26 -4.81 117.12 112.48 1blq n MET 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1blq n MET 3 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 33.22 33.07 1blq n MET 3 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1blq n THR 4 N -2.01 0.00 -0.57 1.12 -1.04 -1.23 -2.68 114.28 107.87 1blq n THR 4 Ca 0.00 0.59 0.47 0.00 -2.04 0.00 0.00 64.05 63.07 1blq n THR 4 Cb 0.00 -1.53 0.79 0.00 -1.82 0.00 0.00 70.33 67.77 1blq n THR 4 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1blq h ASP 5 N 0.00 0.00 -0.57 8.00 5.19 -1.96 0.77 116.42 127.86 1blq h ASP 5 Ca 0.00 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.51 1blq h ASP 5 Cb 0.00 0.00 -0.11 0.00 0.18 0.00 0.00 39.33 39.40 1blq h ASP 5 CO 0.00 0.00 -0.37 -0.61 -3.12 0.00 0.00 179.24 175.14 1blq h GLN 6 N 0.00 -0.19 -0.87 3.56 -0.00 -1.25 0.43 115.11 116.80 1blq h GLN 6 Ca 0.81 0.01 0.13 0.00 -0.00 0.00 0.00 58.65 59.60 1blq h GLN 6 Cb 3.27 0.04 -0.07 0.00 0.00 0.00 0.00 27.48 30.73 1blq h GLN 6 CO -0.01 -0.13 0.56 0.37 0.00 0.00 0.00 178.83 179.62 1blq h GLN 7 N -0.20 0.66 -0.01 1.69 4.15 -0.65 -1.75 115.11 119.00 1blq h GLN 7 Ca 0.21 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.62 1blq h GLN 7 Cb 0.56 -0.15 -0.05 0.00 0.21 0.00 0.00 27.48 28.04 1blq h GLN 7 CO -0.67 0.44 -0.37 0.00 -1.93 0.00 0.00 178.83 176.30 1blq h ALA 8 N 1.60 -0.56 0.00 3.38 0.00 -0.22 -0.93 119.26 122.53 1blq h ALA 8 Ca 0.43 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 1blq h ALA 8 Cb 0.68 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1blq h ALA 8 CO -0.19 -0.89 -0.35 0.93 0.00 0.00 0.00 179.25 178.75 1blq h GLU 9 N -0.52 0.00 -0.15 0.00 5.08 -1.22 -2.47 114.58 115.30 1blq h GLU 9 Ca 0.06 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1blq h GLU 9 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1blq h GLU 9 CO -0.30 0.35 0.01 0.00 -1.00 0.00 0.00 179.01 178.06 1blq h ALA 10 N 1.65 0.13 0.00 3.43 0.00 -0.34 -1.91 119.26 122.24 1blq h ALA 10 Ca -0.00 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1blq h ALA 10 Cb 0.65 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1blq h ALA 10 CO 0.04 -0.44 -0.50 0.00 0.00 0.00 0.00 179.25 178.35 1blq h ARG 11 N 0.06 0.00 -0.46 0.00 3.08 -1.24 -1.70 114.38 114.12 1blq h ARG 11 Ca 0.07 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.21 1blq h ARG 11 Cb 0.08 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.03 1blq h ARG 11 CO -0.11 0.50 -0.26 0.00 -1.07 0.00 0.00 179.97 179.03 1blq h ALA 12 N 1.50 0.01 0.14 0.04 0.00 -0.87 -2.55 119.26 117.53 1blq h ALA 12 Ca -0.01 0.14 -0.33 0.00 0.00 0.00 0.00 54.91 54.72 1blq h ALA 12 Cb 1.00 0.61 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 1blq h ALA 12 CO 0.07 -0.62 -1.66 0.35 0.00 0.00 0.00 179.25 177.38 1blq h PHE 13 N -0.17 0.52 -0.73 0.00 3.57 -1.54 -3.40 116.94 115.20 1blq h PHE 13 Ca 0.21 -0.38 -0.55 0.00 3.53 0.00 0.00 57.97 60.78 1blq h PHE 13 Cb 0.50 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 39.15 1blq h PHE 13 CO -0.51 1.50 1.75 -0.51 -2.23 0.00 0.00 178.31 178.31 1blq s LEU 14 N -7.04 3.53 1.00 0.59 2.01 -0.64 -4.96 118.68 113.17 1blq s LEU 14 Ca -0.12 -2.11 -0.19 0.00 0.01 0.00 0.00 54.13 51.72 1blq s LEU 14 Cb 0.06 -2.58 -0.14 0.00 0.01 0.00 0.00 46.19 43.54 1blq s LEU 14 CO 0.84 -1.90 -0.88 -1.20 1.01 0.00 0.00 176.35 174.23 1blq n SER 15 N 10.66 -5.07 0.18 2.29 7.64 -1.25 -4.63 113.62 123.43 1blq n SER 15 Ca 0.47 0.14 0.13 0.00 1.01 0.00 0.00 58.87 60.63 1blq n SER 15 Cb 0.46 -0.74 0.60 0.00 -1.01 0.00 0.00 64.21 63.53 1blq n SER 15 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1blq h GLU 16 N -1.06 0.00 -0.06 1.43 5.08 -1.93 -2.43 114.58 115.61 1blq h GLU 16 Ca -0.43 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.72 1blq h GLU 16 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1blq h GLU 16 CO 0.24 0.00 -0.81 0.93 -1.00 0.00 0.00 179.01 178.36 1blq h GLU 17 N 0.00 0.48 0.61 2.33 5.08 -1.98 -1.43 114.58 119.67 1blq h GLU 17 Ca 0.00 -0.43 -0.03 0.00 -1.00 0.00 0.00 59.36 57.90 1blq h GLU 17 Cb 0.28 0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.63 1blq h GLU 17 CO 0.00 1.07 -0.29 0.52 -1.00 0.00 0.00 179.01 179.30 1blq h MET 18 N 0.31 -0.79 -0.61 2.33 2.86 -1.72 -2.31 114.93 115.01 1blq h MET 18 Ca -0.05 0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1blq h MET 18 Cb 1.42 0.18 -0.05 0.00 0.06 0.00 0.00 31.60 33.21 1blq h MET 18 CO 0.14 -0.53 0.35 0.82 1.06 0.00 0.00 176.91 178.75 1blq h ILE 19 N -1.13 1.01 -0.63 -1.22 2.04 -1.67 -1.93 117.51 113.98 1blq h ILE 19 Ca -0.08 -0.23 0.13 0.00 1.00 0.00 0.00 64.86 65.68 1blq h ILE 19 Cb 0.63 0.29 -0.10 0.00 -0.74 0.00 0.00 36.82 36.90 1blq h ILE 19 CO 0.14 0.12 0.08 0.00 0.00 0.00 0.00 178.15 178.48 1blq h ALA 20 N 1.30 0.70 -0.10 1.87 0.00 -1.28 0.31 119.26 122.05 1blq h ALA 20 Ca 0.26 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.28 1blq h ALA 20 Cb 0.11 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1blq h ALA 20 CO -0.14 -0.36 -0.19 1.49 0.00 0.00 0.00 179.25 180.05 1blq h GLU 21 N 0.19 0.16 0.00 0.00 4.81 -0.77 -1.76 114.58 117.21 1blq h GLU 21 Ca 0.33 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1blq h GLU 21 Cb 0.53 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1blq h GLU 21 CO -0.48 0.36 0.00 0.35 -0.73 0.00 0.00 179.01 178.51 1blq h PHE 22 N 0.15 0.00 0.00 0.92 3.57 0.08 -2.94 116.94 118.73 1blq h PHE 22 Ca 0.03 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1blq h PHE 22 Cb 0.43 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.17 1blq h PHE 22 CO 0.00 0.00 0.00 0.87 -2.23 0.00 0.00 178.31 176.95 1blq h LYS 23 N 0.00 0.00 0.00 1.11 1.57 0.01 -0.44 116.57 118.82 1blq h LYS 23 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 1blq h LYS 23 Cb 0.81 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.07 1blq h LYS 23 CO 0.00 0.00 -1.65 0.00 -0.57 0.00 0.00 179.45 177.23 1blq h ALA 24 N 2.04 0.75 0.00 3.86 0.00 -1.61 -3.15 119.26 121.15 1blq h ALA 24 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 54.91 53.51 1blq h ALA 24 Cb 0.22 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1blq h ALA 24 CO 0.00 1.53 -0.38 0.00 0.00 0.00 0.00 179.25 180.40 1blq n ALA 25 N -2.53 2.98 -0.02 0.00 0.00 -0.71 -3.56 120.51 116.66 1blq n ALA 25 Ca -0.16 -0.23 -0.22 0.00 0.00 0.00 0.00 53.44 52.83 1blq n ALA 25 Cb 1.03 -1.25 -0.13 0.00 0.00 0.00 0.00 19.45 19.10 1blq n ALA 25 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1blq n PHE 26 N -1.75 1.21 0.68 0.00 7.35 -0.25 -3.89 117.46 120.80 1blq n PHE 26 Ca 0.05 0.32 0.08 0.00 -0.76 0.00 0.00 57.45 57.14 1blq n PHE 26 Cb 0.38 -1.15 0.38 0.00 0.35 0.00 0.00 39.48 39.44 1blq n PHE 26 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1blq n ASP 27 N -3.75 0.00 0.23 -2.13 9.92 -1.19 -2.81 116.55 116.82 1blq n ASP 27 Ca -0.32 0.25 0.07 0.00 -0.53 0.00 0.00 54.79 54.26 1blq n ASP 27 Cb 0.95 -0.38 0.58 0.00 -0.64 0.00 0.00 41.12 41.63 1blq n ASP 27 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 1blq h MET 28 N 0.00 0.03 0.21 -1.24 2.86 -1.67 -2.61 114.93 112.51 1blq h MET 28 Ca 0.00 -0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.29 1blq h MET 28 Cb 0.21 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 31.88 1blq h MET 28 CO 0.00 0.09 -1.66 0.74 1.06 0.00 0.00 176.91 177.13 1blq h PHE 29 N 0.03 0.82 -3.61 -0.22 0.04 -1.77 -3.42 116.94 108.80 1blq h PHE 29 Ca 0.01 -0.60 -0.68 0.00 2.80 0.00 0.00 57.97 59.50 1blq h PHE 29 Cb 0.12 -0.03 -0.37 0.00 2.20 0.00 0.00 35.95 37.86 1blq h PHE 29 CO 0.00 1.64 -0.65 0.16 -0.60 0.00 0.00 178.31 178.87 1blq s ASP 30 N -7.40 4.98 0.00 2.17 1.47 -0.99 -4.92 116.67 111.98 1blq s ASP 30 Ca -0.14 -2.04 0.27 0.00 1.18 0.00 0.00 52.55 51.82 1blq s ASP 30 Cb 0.05 -1.72 1.13 0.00 -0.34 0.00 0.00 42.92 42.04 1blq s ASP 30 CO 0.89 -0.44 1.78 0.00 0.68 0.00 0.00 175.17 178.08 1blq n ALA 31 N 4.42 2.58 -0.05 2.11 0.00 -1.22 -3.81 120.51 124.55 1blq n ALA 31 Ca -0.00 -0.41 -0.15 0.00 0.00 0.00 0.00 53.44 52.88 1blq n ALA 31 Cb 0.42 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 1blq n ALA 31 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1blq n ASP 32 N -0.02 1.38 0.00 0.00 5.68 -1.26 -5.01 116.55 117.32 1blq n ASP 32 Ca 0.19 0.16 0.00 0.00 -0.50 0.00 0.00 54.79 54.64 1blq n ASP 32 Cb 0.30 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 1blq n ASP 32 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1blq n GLY 33 N 1.89 0.16 0.00 6.12 0.00 -1.25 -5.08 105.19 107.03 1blq n GLY 33 Ca -0.31 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1blq n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1blq n GLY 34 N 0.00 0.00 3.76 -0.02 0.00 -1.26 -5.03 105.19 102.64 1blq n GLY 34 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1blq n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1blq n GLY 35 N 3.17 -0.37 3.75 -0.02 0.00 -1.26 -4.95 105.19 105.51 1blq n GLY 35 Ca 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 1blq n GLY 35 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1blq s ASP 36 N -4.24 -0.15 0.09 1.61 -4.77 -1.26 -4.25 116.67 103.69 1blq s ASP 36 Ca 0.07 -0.39 -0.18 0.00 -3.30 0.00 0.00 52.55 48.74 1blq s ASP 36 Cb -0.02 0.45 0.04 0.00 -1.09 0.00 0.00 42.92 42.30 1blq s ASP 36 CO 0.84 -0.84 0.44 0.27 0.70 0.00 0.00 175.17 176.58 1blq s ILE 37 N -3.13 0.05 0.00 2.11 -4.36 -1.04 -4.75 121.20 110.07 1blq s ILE 37 Ca 0.13 -0.44 0.00 0.00 -0.26 0.00 0.00 60.65 60.08 1blq s ILE 37 Cb -0.01 -1.06 0.00 0.00 1.25 0.00 0.00 42.46 42.65 1blq s ILE 37 CO 0.02 -0.24 0.00 -1.54 0.24 0.00 0.00 174.94 173.41 1blq n SER 38 N 0.10 0.00 -0.07 4.36 3.41 -1.26 -2.10 113.62 118.06 1blq n SER 38 Ca -0.17 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.25 1blq n SER 38 Cb 0.62 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.44 1blq n SER 38 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1blq h THR 39 N 0.00 1.27 -0.64 6.66 1.35 -1.91 -2.75 112.91 116.89 1blq h THR 39 Ca 0.00 -2.29 0.18 0.00 -0.55 0.00 0.00 66.41 63.76 1blq h THR 39 Cb 0.00 2.76 -0.03 0.00 -1.73 0.00 0.00 68.15 69.15 1blq h THR 39 CO 0.00 0.50 0.52 0.50 -0.25 0.00 0.00 175.52 176.79 1blq h LYS 40 N -0.86 0.00 0.09 4.72 3.11 -1.88 0.22 116.57 121.97 1blq h LYS 40 Ca -0.21 0.00 -0.30 0.00 -2.81 0.00 0.00 60.65 57.33 1blq h LYS 40 Cb 1.28 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.50 1blq h LYS 40 CO -0.08 0.00 -1.53 0.93 -2.81 0.00 0.00 179.45 175.96 1blq h GLU 41 N 0.00 0.20 0.00 1.90 5.08 -1.94 -1.10 114.58 118.72 1blq h GLU 41 Ca 0.30 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1blq h GLU 41 Cb 1.34 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.71 1blq h GLU 41 CO -0.00 1.03 0.00 -0.11 -1.00 0.00 0.00 179.01 178.93 1blq n LEU 42 N -3.39 0.43 -0.04 1.33 0.00 0.64 -1.32 117.00 114.65 1blq n LEU 42 Ca -0.16 0.60 -0.01 0.00 0.00 0.00 0.00 56.01 56.44 1blq n LEU 42 Cb 1.04 -0.54 -0.09 0.00 0.00 0.00 0.00 43.42 43.83 1blq n LEU 42 CO 0.49 -0.43 -0.78 0.61 0.00 0.00 0.00 177.39 177.28 1blq n GLY 43 N 0.07 -0.54 0.13 -3.96 0.00 -0.29 -4.49 105.19 96.11 1blq n GLY 43 Ca 0.03 -0.22 0.03 0.00 0.00 0.00 0.00 46.02 45.86 1blq n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1blq h THR 44 N 0.00 0.61 -0.17 2.61 1.03 -1.03 -0.62 112.91 115.33 1blq h THR 44 Ca -0.19 -1.94 -0.00 0.00 -0.01 0.00 0.00 66.41 64.27 1blq h THR 44 Cb 1.26 2.19 -0.01 0.00 -1.07 0.00 0.00 68.15 70.52 1blq h THR 44 CO 0.01 0.34 0.09 1.62 -0.01 0.00 0.00 175.52 177.57 1blq h VAL 45 N 0.00 1.11 0.07 0.00 3.04 -1.43 0.71 116.25 119.75 1blq h VAL 45 Ca -0.05 -0.32 -0.32 0.00 -1.01 0.00 0.00 66.70 65.01 1blq h VAL 45 Cb 1.37 1.02 -0.03 0.00 -2.01 0.00 0.00 31.29 31.64 1blq h VAL 45 CO 0.05 0.11 -1.73 0.00 -1.01 0.00 0.00 177.57 174.98 1blq h MET 46 N 0.16 0.14 -0.79 4.17 -0.00 -1.79 -3.30 114.93 113.51 1blq h MET 46 Ca 0.06 -0.25 -0.01 0.00 -0.00 0.00 0.00 59.70 59.50 1blq h MET 46 Cb 0.09 0.09 -0.01 0.00 -0.00 0.00 0.00 31.60 31.78 1blq h MET 46 CO -0.01 0.89 0.01 -2.13 -0.00 0.00 0.00 176.91 175.67 1blq n ARG 47 N -3.29 2.99 0.17 -0.10 3.00 -0.24 -4.44 116.66 114.74 1blq n ARG 47 Ca -0.21 -1.63 -0.15 0.00 -0.00 0.00 0.00 57.85 55.85 1blq n ARG 47 Cb 1.04 -1.89 -0.08 0.00 0.00 0.00 0.00 32.46 31.54 1blq n ARG 47 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.63 179.61 1blq h MET 48 N 2.02 -0.71 -1.21 -0.14 4.05 0.36 -1.17 114.93 118.13 1blq h MET 48 Ca 0.01 0.05 -0.30 0.00 -0.28 0.00 0.00 59.70 59.18 1blq h MET 48 Cb 1.30 0.16 -0.15 0.00 -0.80 0.00 0.00 31.60 32.11 1blq h MET 48 CO 0.27 -0.47 0.38 1.47 0.23 0.00 0.00 176.91 178.78 1blq n LEU 49 N -5.48 5.59 0.00 3.39 -0.00 -1.26 -4.66 117.00 114.57 1blq n LEU 49 Ca -0.09 -2.90 0.00 0.00 -0.00 0.00 0.00 56.01 53.03 1blq n LEU 49 Cb 0.39 -0.83 0.00 0.00 -0.00 0.00 0.00 43.42 42.98 1blq n LEU 49 CO 0.23 0.97 0.00 0.61 -0.00 0.00 0.00 177.39 179.20 1blq n GLY 50 N -0.07 1.06 3.06 1.47 0.00 -0.44 -5.15 105.19 105.13 1blq n GLY 50 Ca 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.24 1blq n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1blq s GLN 51 N 1.38 0.50 0.12 1.61 -0.21 -1.23 -5.09 119.66 116.74 1blq s GLN 51 Ca 0.00 -0.86 -0.31 0.00 0.02 0.00 0.00 55.36 54.21 1blq s GLN 51 Cb 0.00 0.18 -0.09 0.00 1.00 0.00 0.00 33.01 34.10 1blq s GLN 51 CO 0.00 -0.10 1.57 -0.80 -2.12 0.00 0.00 175.29 173.84 1blq s ASN 52 N -2.16 6.63 0.68 5.90 -0.87 -1.26 -4.90 114.94 118.95 1blq s ASN 52 Ca -0.05 2.53 -0.01 0.00 -1.57 0.00 0.00 52.86 53.76 1blq s ASN 52 Cb -0.01 -2.58 0.12 0.00 -0.02 0.00 0.00 41.25 38.75 1blq s ASN 52 CO -0.05 -0.82 0.79 -0.81 -2.57 0.00 0.00 177.10 173.64 1blq n PRO 53 N 4.53 -0.00 -3.57 -0.60 -0.04 -1.26 -5.10 135.00 128.97 1blq n PRO 53 Ca 0.14 -2.09 -0.26 0.00 -0.04 0.00 0.00 63.50 61.25 1blq n PRO 53 Cb 0.40 -0.54 -0.02 0.00 -0.04 0.00 0.00 33.50 33.29 1blq n PRO 53 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1blq s THR 54 N -2.39 5.15 0.13 0.52 2.01 -1.26 -4.98 115.64 114.82 1blq s THR 54 Ca 0.52 -0.37 0.25 0.00 0.31 0.00 0.00 61.69 62.40 1blq s THR 54 Cb -0.03 -3.78 0.26 0.00 0.01 0.00 0.00 72.50 68.96 1blq s THR 54 CO 0.35 -0.32 1.85 0.50 -0.69 0.00 0.00 174.62 176.31 1blq h LYS 55 N 1.52 0.00 0.00 4.92 3.11 -1.99 -2.88 116.57 121.25 1blq h LYS 55 Ca -0.49 0.00 -0.17 0.00 -2.81 0.00 0.00 60.65 57.18 1blq h LYS 55 Cb 1.20 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.40 1blq h LYS 55 CO 0.65 0.19 -1.42 0.93 -2.81 0.00 0.00 179.45 176.99 1blq h GLU 56 N 0.00 0.00 -0.14 1.90 5.08 -1.99 -3.30 114.58 116.13 1blq h GLU 56 Ca -0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1blq h GLU 56 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1blq h GLU 56 CO 0.02 0.30 0.10 1.49 -1.00 0.00 0.00 179.01 179.92 1blq h GLU 57 N 0.00 0.14 0.00 2.33 4.81 -1.90 -0.26 114.58 119.70 1blq h GLU 57 Ca -0.17 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1blq h GLU 57 Cb 1.60 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.95 1blq h GLU 57 CO 0.05 0.09 -0.65 1.28 -0.73 0.00 0.00 179.01 179.04 1blq n LEU 58 N -4.51 0.60 0.20 1.64 7.99 -1.23 -3.82 117.00 117.86 1blq n LEU 58 Ca -0.01 0.08 0.05 0.00 -0.01 0.00 0.00 56.01 56.13 1blq n LEU 58 Cb 0.12 -0.19 0.44 0.00 -0.11 0.00 0.00 43.42 43.68 1blq n LEU 58 CO 0.34 0.04 0.79 -0.78 -1.51 0.00 0.00 177.39 176.27 1blq h ASP 59 N 0.00 0.00 0.38 -1.43 1.82 -1.11 -0.13 116.42 115.95 1blq h ASP 59 Ca 0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 1blq h ASP 59 Cb 0.64 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.65 1blq h ASP 59 CO 0.00 0.30 -0.18 0.00 -1.61 0.00 0.00 179.24 177.75 1blq h ALA 60 N 1.70 -0.51 0.00 -0.78 0.00 -1.65 0.29 119.26 118.31 1blq h ALA 60 Ca -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1blq h ALA 60 Cb 0.59 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1blq h ALA 60 CO 0.04 -0.64 -0.12 0.82 0.00 0.00 0.00 179.25 179.35 1blq h ILE 61 N -0.79 0.37 -0.00 0.00 5.03 -1.74 -1.49 117.51 118.89 1blq h ILE 61 Ca -0.05 -0.73 0.00 0.00 -0.12 0.00 0.00 64.86 63.96 1blq h ILE 61 Cb 0.53 1.54 0.00 0.00 -3.03 0.00 0.00 36.82 35.85 1blq h ILE 61 CO 0.08 0.12 -0.24 -0.38 -0.68 0.00 0.00 178.15 177.05 1blq n ILE 62 N -3.35 0.00 0.09 -0.67 2.08 -0.07 -3.55 119.36 113.89 1blq n ILE 62 Ca -0.00 -0.04 0.02 0.00 0.56 0.00 0.00 62.75 63.29 1blq n ILE 62 Cb 0.32 0.01 -0.02 0.00 -0.75 0.00 0.00 39.64 39.20 1blq n ILE 62 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 1blq h GLU 63 N 0.33 0.00 0.00 0.38 4.81 0.69 -1.27 114.58 119.52 1blq h GLU 63 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1blq h GLU 63 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1blq h GLU 63 CO 0.00 0.36 -0.45 -0.85 -0.73 0.00 0.00 179.01 177.34 1blq n GLU 64 N -3.03 0.27 -0.08 1.92 0.28 -1.22 -3.86 120.64 114.92 1blq n GLU 64 Ca -0.03 0.12 -0.12 0.00 -0.16 0.00 0.00 57.16 56.97 1blq n GLU 64 Cb 0.76 -1.71 -0.07 0.00 1.43 0.00 0.00 31.44 31.84 1blq n GLU 64 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1blq n VAL 65 N -2.13 0.93 -0.49 3.84 0.24 -1.24 -4.51 118.33 114.97 1blq n VAL 65 Ca 0.04 -0.35 -0.10 0.00 -2.04 0.00 0.00 64.34 61.89 1blq n VAL 65 Cb 0.43 -1.13 0.03 0.00 -1.47 0.00 0.00 33.84 31.71 1blq n VAL 65 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1blq n ASP 66 N -3.04 5.34 0.33 -1.34 5.75 -0.48 -4.48 116.55 118.64 1blq n ASP 66 Ca -0.29 -2.76 0.15 0.00 -0.01 0.00 0.00 54.79 51.87 1blq n ASP 66 Cb 0.80 -0.96 0.79 0.00 -1.03 0.00 0.00 41.12 40.73 1blq n ASP 66 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1blq h GLU 67 N 1.05 0.00 -0.36 0.11 4.11 -1.79 0.78 114.58 118.48 1blq h GLU 67 Ca 0.20 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.55 1blq h GLU 67 Cb 1.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1blq h GLU 67 CO 0.47 0.00 -0.07 0.38 0.07 0.00 0.00 179.01 179.86 1blq h ASP 68 N 0.00 0.69 0.00 3.06 3.04 -1.93 -3.48 116.42 117.80 1blq h ASP 68 Ca 0.00 -0.36 0.00 0.00 -3.24 0.00 0.00 57.03 53.43 1blq h ASP 68 Cb 0.70 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 38.80 1blq h ASP 68 CO 0.00 0.88 0.00 0.61 -2.04 0.00 0.00 179.24 178.69 1blq n GLY 69 N -0.21 0.69 1.67 7.15 0.00 0.27 -5.09 105.19 109.67 1blq n GLY 69 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1blq n GLY 69 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1blq n SER 70 N 0.00 0.00 -0.02 1.61 2.88 -1.26 -5.05 113.62 111.79 1blq n SER 70 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1blq n SER 70 Cb 0.00 0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1blq n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1blq n GLY 71 N -0.31 1.38 3.41 0.46 0.00 -1.26 -5.07 105.19 103.80 1blq n GLY 71 Ca 0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 1blq n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1blq s THR 72 N -2.03 0.00 0.05 2.61 -4.23 -1.26 -3.55 115.64 107.23 1blq s THR 72 Ca 0.00 -1.72 -0.03 0.00 -1.18 0.00 0.00 61.69 58.76 1blq s THR 72 Cb 0.00 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 1blq s THR 72 CO 0.00 0.00 0.02 0.27 -0.54 0.00 0.00 174.62 174.37 1blq s ILE 73 N -3.50 0.19 0.00 2.99 -4.36 -0.89 -4.62 121.20 111.00 1blq s ILE 73 Ca 0.33 -1.54 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 1blq s ILE 73 Cb 0.02 -1.29 0.00 0.00 1.25 0.00 0.00 42.46 42.43 1blq s ILE 73 CO 0.18 -0.85 0.00 -0.90 0.24 0.00 0.00 174.94 173.61 1blq n ASP 74 N 0.31 0.00 0.00 4.36 5.75 -1.26 -2.50 116.55 123.20 1blq n ASP 74 Ca -0.16 -0.71 0.06 0.00 -0.01 0.00 0.00 54.79 53.97 1blq n ASP 74 Cb 0.60 0.00 0.32 0.00 -1.03 0.00 0.00 41.12 41.01 1blq n ASP 74 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1blq n PHE 75 N 0.00 0.00 -0.06 2.11 3.01 -1.26 -1.04 117.46 120.22 1blq n PHE 75 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 1blq n PHE 75 Cb 0.00 -0.28 -0.01 0.00 -0.01 0.00 0.00 39.48 39.18 1blq n PHE 75 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1blq h GLU 76 N 0.00 0.00 0.00 -1.08 4.22 -1.94 -3.34 114.58 112.44 1blq h GLU 76 Ca 0.00 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.31 1blq h GLU 76 Cb 0.12 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1blq h GLU 76 CO 0.00 0.00 -0.80 0.93 -2.18 0.00 0.00 179.01 176.96 1blq h GLU 77 N -0.91 0.00 -1.04 1.92 3.07 -1.95 -3.34 114.58 112.32 1blq h GLU 77 Ca 0.00 0.00 0.33 0.00 -0.50 0.00 0.00 59.36 59.19 1blq h GLU 77 Cb 0.30 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 28.07 1blq h GLU 77 CO 0.00 0.73 0.61 0.35 -1.40 0.00 0.00 179.01 179.30 1blq h PHE 78 N -1.00 0.86 -0.30 4.33 3.04 -1.37 0.38 116.94 122.89 1blq h PHE 78 Ca -0.19 0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.82 1blq h PHE 78 Cb 1.00 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 39.25 1blq h PHE 78 CO 0.06 -0.16 0.12 -0.07 -2.02 0.00 0.00 178.31 176.24 1blq h LEU 79 N 0.30 0.15 -0.68 0.59 3.38 -1.68 -0.33 115.31 117.04 1blq h LEU 79 Ca 0.74 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.73 1blq h LEU 79 Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.53 1blq h LEU 79 CO -0.56 0.12 0.00 -0.37 0.09 0.00 0.00 178.44 177.72 1blq h VAL 80 N 0.26 0.00 0.00 1.22 -1.51 -0.42 -2.46 116.25 113.34 1blq h VAL 80 Ca 0.13 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1blq h VAL 80 Cb 0.08 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 30.39 1blq h VAL 80 CO -0.12 0.00 -0.49 -0.03 -1.23 0.00 0.00 177.57 175.71 1blq h MET 81 N 0.00 0.00 0.00 5.19 4.05 0.11 -3.24 114.93 121.04 1blq h MET 81 Ca 0.00 0.00 -0.21 0.00 -0.28 0.00 0.00 59.70 59.21 1blq h MET 81 Cb 0.46 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.23 1blq h MET 81 CO 0.00 0.00 -1.19 -0.12 0.23 0.00 0.00 176.91 175.83 1blq n MET 82 N -2.77 0.55 -0.05 0.39 0.00 -0.59 -4.04 117.12 110.61 1blq n MET 82 Ca 0.02 0.57 0.23 0.00 0.00 0.00 0.00 57.70 58.52 1blq n MET 82 Cb 0.52 -1.74 0.71 0.00 0.00 0.00 0.00 33.22 32.72 1blq n MET 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1blq h VAL 83 N -1.00 0.63 0.00 1.12 2.07 -1.64 -3.30 116.25 114.13 1blq h VAL 83 Ca -0.31 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1blq h VAL 83 Cb 1.21 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1blq h VAL 83 CO -0.19 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.29 1blq n ARG 84 N -4.26 3.32 -1.63 1.57 1.85 -1.22 -4.55 116.66 111.73 1blq n ARG 84 Ca 0.12 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.82 1blq n ARG 84 Cb 0.73 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 32.06 1blq n ARG 84 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 1blq s GLN 85 N 0.00 1.64 0.15 2.89 0.74 -1.26 -4.91 119.66 118.91 1blq s GLN 85 Ca 0.00 0.24 -0.15 0.00 0.05 0.00 0.00 55.36 55.51 1blq s GLN 85 Cb 0.00 -4.85 -0.07 0.00 1.10 0.00 0.00 33.01 29.19 1blq s GLN 85 CO 0.00 -4.50 0.55 0.00 -0.55 0.00 0.00 175.29 170.79 1blq s MET 86 N 8.60 3.99 0.14 1.67 0.23 -1.24 -4.95 119.30 127.74 1blq s MET 86 Ca 0.88 0.51 0.24 0.00 -1.03 0.00 0.00 55.69 56.28 1blq s MET 86 Cb -0.11 -2.94 0.91 0.00 -1.53 0.00 0.00 34.83 31.17 1blq s MET 86 CO 0.09 0.48 1.73 1.63 -2.03 0.00 0.00 175.02 176.91 1blq n LYS 87 N 0.82 0.14 -0.22 3.16 5.02 -1.26 -2.76 118.16 123.05 1blq n LYS 87 Ca -0.05 0.24 0.31 0.00 -2.02 0.00 0.00 58.31 56.80 1blq n LYS 87 Cb 0.52 -1.71 0.69 0.00 -0.02 0.00 0.00 35.03 34.51 1blq n LYS 87 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1blq h GLU 88 N 0.00 0.00 0.00 1.97 4.81 -1.97 -3.40 114.58 115.99 1blq h GLU 88 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1blq h GLU 88 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1blq h GLU 88 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.03 1blq n ASP 89 N -3.85 -0.43 0.00 1.04 8.00 -1.20 -5.32 116.55 114.79 1blq n ASP 89 Ca 0.22 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1blq n ASP 89 Cb 1.20 0.62 0.00 0.00 -0.02 0.00 0.00 41.12 42.92 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81