#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 -0.94 0.00 7.64 -1.26 -2.64 113.62 116.43 1blq n SER 2 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1blq n SER 2 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 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 0.10 0.00 1.43 0.00 -1.26 -5.01 117.12 112.38 1blq n MET 3 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 57.70 57.38 1blq n MET 3 Cb 0.00 0.41 0.00 0.00 0.00 0.00 0.00 33.22 33.63 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 -0.11 0.00 -0.04 1.12 -1.04 -1.08 -3.94 114.28 109.18 1blq n THR 4 Ca -0.08 0.00 0.24 0.00 -2.04 0.00 0.00 64.05 62.17 1blq n THR 4 Cb 0.44 -0.06 0.72 0.00 -1.82 0.00 0.00 70.33 69.61 1blq n THR 4 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1blq h ASP 5 N 0.00 0.00 -0.67 8.00 1.82 -1.98 -0.10 116.42 123.50 1blq h ASP 5 Ca 0.00 0.00 0.13 0.00 -0.39 0.00 0.00 57.03 56.77 1blq h ASP 5 Cb 0.00 0.00 -0.10 0.00 0.68 0.00 0.00 39.33 39.91 1blq h ASP 5 CO 0.00 0.00 0.16 -0.61 -1.61 0.00 0.00 179.24 177.18 1blq h GLN 6 N 0.00 0.27 0.00 0.28 5.75 -1.85 0.02 115.11 119.57 1blq h GLN 6 Ca 0.31 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.74 1blq h GLN 6 Cb 1.43 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.92 1blq h GLN 6 CO -0.00 0.18 -0.79 -0.56 -2.65 0.00 0.00 178.83 175.00 1blq h GLN 7 N 0.27 0.00 0.00 1.69 3.07 -1.15 -3.27 115.11 115.73 1blq h GLN 7 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.10 1blq h GLN 7 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.14 1blq h GLN 7 CO -0.45 0.14 0.00 0.00 0.09 0.00 0.00 178.83 178.61 1blq h ALA 8 N 1.80 1.00 0.16 0.06 0.00 -0.53 -2.29 119.26 119.46 1blq h ALA 8 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.53 1blq h ALA 8 Cb 1.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1blq h ALA 8 CO 0.02 0.00 -1.75 0.93 0.00 0.00 0.00 179.25 178.45 1blq h GLU 9 N 0.00 0.33 0.39 0.00 5.08 -1.30 -3.24 114.58 115.84 1blq h GLU 9 Ca 0.00 -0.56 -0.02 0.00 -1.00 0.00 0.00 59.36 57.78 1blq h GLU 9 Cb 0.38 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1blq h GLU 9 CO 0.00 1.27 -0.19 0.00 -1.00 0.00 0.00 179.01 179.09 1blq h ALA 10 N 0.06 -0.53 -0.97 3.43 0.00 -1.59 -2.66 119.26 116.99 1blq h ALA 10 Ca -0.36 -0.17 0.22 0.00 0.00 0.00 0.00 54.91 54.60 1blq h ALA 10 Cb 2.01 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 19.92 1blq h ALA 10 CO 0.13 -0.70 0.62 -0.09 0.00 0.00 0.00 179.25 179.21 1blq h ARG 11 N -0.72 0.49 -0.81 0.00 2.43 -1.60 -0.04 114.38 114.13 1blq h ARG 11 Ca -0.05 -0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.26 1blq h ARG 11 Cb 0.51 -0.11 -0.15 0.00 -0.42 0.00 0.00 29.97 29.80 1blq h ARG 11 CO 0.09 0.32 -0.12 0.00 -1.51 0.00 0.00 179.97 178.75 1blq h ALA 12 N 1.62 0.66 0.00 2.80 0.00 -1.49 0.69 119.26 123.54 1blq h ALA 12 Ca 0.54 0.30 -0.10 0.00 0.00 0.00 0.00 54.91 55.64 1blq h ALA 12 Cb 1.20 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 1blq h ALA 12 CO -0.26 -0.43 -0.49 0.35 0.00 0.00 0.00 179.25 178.42 1blq h PHE 13 N 0.03 0.00 -2.02 0.00 3.57 -1.10 -3.38 116.94 114.04 1blq h PHE 13 Ca 0.41 0.00 -0.73 0.00 3.53 0.00 0.00 57.97 61.18 1blq h PHE 13 Cb 0.69 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 39.26 1blq h PHE 13 CO -0.56 0.49 1.45 -0.51 -2.23 0.00 0.00 178.31 176.95 1blq s LEU 14 N -6.46 4.91 0.99 0.59 1.43 0.24 -5.01 118.68 115.38 1blq s LEU 14 Ca 0.04 -2.93 -0.17 0.00 -1.03 0.00 0.00 54.13 50.03 1blq s LEU 14 Cb 0.07 -2.42 -0.12 0.00 0.03 0.00 0.00 46.19 43.75 1blq s LEU 14 CO 0.74 -0.79 -0.68 -0.24 0.23 0.00 0.00 176.35 175.61 1blq n SER 15 N 5.96 -5.12 0.23 2.29 2.88 -1.24 -4.53 113.62 114.10 1blq n SER 15 Ca 0.38 0.18 0.18 0.00 -1.33 0.00 0.00 58.87 58.28 1blq n SER 15 Cb 0.43 -0.81 0.81 0.00 -0.75 0.00 0.00 64.21 63.89 1blq n SER 15 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1blq h GLU 16 N -1.11 0.00 -0.39 -1.46 5.08 -1.95 0.39 114.58 115.15 1blq h GLU 16 Ca -0.44 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.83 1blq h GLU 16 Cb 1.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 1blq h GLU 16 CO 0.25 0.00 -0.12 0.93 -1.00 0.00 0.00 179.01 179.06 1blq h GLU 17 N 0.00 0.78 0.48 2.33 4.39 -1.99 -0.56 114.58 120.00 1blq h GLU 17 Ca 0.08 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 1blq h GLU 17 Cb 0.77 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1blq h GLU 17 CO -0.00 0.92 -0.35 1.98 -1.16 0.00 0.00 179.01 180.40 1blq h MET 18 N 0.58 -0.78 0.00 2.33 4.05 -1.16 -1.14 114.93 118.81 1blq h MET 18 Ca 0.10 0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.57 1blq h MET 18 Cb 0.66 0.18 0.00 0.00 -0.80 0.00 0.00 31.60 31.63 1blq h MET 18 CO 0.04 -0.52 0.00 0.82 0.23 0.00 0.00 176.91 177.48 1blq h ILE 19 N -0.81 0.00 0.13 1.77 5.03 -1.56 -0.24 117.51 121.83 1blq h ILE 19 Ca -0.05 -0.24 -0.01 0.00 -0.12 0.00 0.00 64.86 64.45 1blq h ILE 19 Cb 0.69 1.02 0.00 0.00 -3.03 0.00 0.00 36.82 35.50 1blq h ILE 19 CO 0.02 0.00 -0.06 0.00 -0.68 0.00 0.00 178.15 177.42 1blq h ALA 20 N 2.12 -0.56 0.00 1.87 0.00 0.15 -0.80 119.26 122.05 1blq h ALA 20 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1blq h ALA 20 Cb 0.30 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1blq h ALA 20 CO 0.00 -0.54 0.00 1.49 0.00 0.00 0.00 179.25 180.20 1blq h GLU 21 N -0.30 0.00 0.00 0.00 4.57 -1.45 -2.76 114.58 114.65 1blq h GLU 21 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1blq h GLU 21 Cb 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1blq h GLU 21 CO 0.03 0.00 -0.39 0.35 -1.18 0.00 0.00 179.01 177.82 1blq h PHE 22 N 0.00 0.00 -0.56 0.92 3.04 -1.10 -3.29 116.94 115.95 1blq h PHE 22 Ca 0.00 0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.98 1blq h PHE 22 Cb 0.61 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.08 1blq h PHE 22 CO 0.00 0.00 0.33 -0.22 -2.02 0.00 0.00 178.31 176.40 1blq h LYS 23 N 0.00 0.63 0.00 1.11 3.64 -0.82 -1.28 116.57 119.84 1blq h LYS 23 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1blq h LYS 23 Cb 0.88 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1blq h LYS 23 CO 0.00 0.42 -0.21 0.00 -2.27 0.00 0.00 179.45 177.39 1blq n ALA 24 N -2.30 2.77 0.13 5.00 0.00 -1.25 -3.42 120.51 121.44 1blq n ALA 24 Ca 0.05 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.20 1blq n ALA 24 Cb 0.09 -1.33 -0.06 0.00 0.00 0.00 0.00 19.45 18.15 1blq n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blq h ALA 25 N 2.93 -0.39 0.00 0.00 0.00 -1.31 -3.12 119.26 117.37 1blq h ALA 25 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1blq h ALA 25 Cb 0.54 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1blq h ALA 25 CO 0.00 -0.42 -0.02 0.35 0.00 0.00 0.00 179.25 179.16 1blq h PHE 26 N -0.99 0.00 0.00 0.00 3.04 -1.63 -2.17 116.94 115.19 1blq h PHE 26 Ca -0.04 0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.87 1blq h PHE 26 Cb 0.47 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.97 1blq h PHE 26 CO 0.04 0.02 -0.19 -0.44 -2.02 0.00 0.00 178.31 175.72 1blq h ASP 27 N 0.00 0.00 0.66 0.41 5.19 -1.57 -2.28 116.42 118.83 1blq h ASP 27 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1blq h ASP 27 Cb 0.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.90 1blq h ASP 27 CO 0.00 0.19 0.00 -0.03 -3.12 0.00 0.00 179.24 176.28 1blq h MET 28 N 0.00 0.00 -0.83 3.56 4.05 -1.32 -2.22 114.93 118.16 1blq h MET 28 Ca -0.00 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.38 1blq h MET 28 Cb 0.63 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.41 1blq h MET 28 CO 0.02 0.00 0.05 1.19 0.23 0.00 0.00 176.91 178.41 1blq n PHE 29 N -2.43 1.08 -3.00 1.39 3.72 -0.86 -4.89 117.46 112.47 1blq n PHE 29 Ca 0.01 -0.48 -0.18 0.00 -0.05 0.00 0.00 57.45 56.76 1blq n PHE 29 Cb 0.21 -0.35 0.01 0.00 -0.94 0.00 0.00 39.48 38.42 1blq n PHE 29 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 1blq s ASP 30 N -0.32 5.64 0.17 4.37 -4.77 -0.84 -4.56 116.67 116.36 1blq s ASP 30 Ca 0.26 -0.35 0.00 0.00 -3.30 0.00 0.00 52.55 49.16 1blq s ASP 30 Cb 0.20 -0.73 0.00 0.00 -1.09 0.00 0.00 42.92 41.30 1blq s ASP 30 CO 0.07 -0.78 0.00 0.00 0.70 0.00 0.00 175.17 175.16 1blq n ALA 31 N -1.89 3.00 0.36 2.11 0.00 -1.26 -4.79 120.51 118.04 1blq n ALA 31 Ca 0.07 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.66 1blq n ALA 31 Cb 0.59 0.13 0.53 0.00 0.00 0.00 0.00 19.45 20.69 1blq n ALA 31 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1blq h ASP 32 N 0.00 0.00 0.00 0.00 3.04 -1.97 -3.47 116.42 114.02 1blq h ASP 32 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1blq h ASP 32 Cb 0.09 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.38 1blq h ASP 32 CO 0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 1blq n GLY 33 N 0.28 0.55 1.14 7.15 0.00 -1.26 -5.07 105.19 107.97 1blq n GLY 33 Ca 0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.49 0.00 -0.02 0.00 -1.26 -5.11 105.19 97.31 1blq n GLY 34 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.26 1.23 3.64 -0.02 0.00 -1.26 -5.01 105.19 102.51 1blq n GLY 35 Ca 0.00 -0.38 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 -0.35 -0.03 1.61 1.47 -1.26 -4.51 116.67 113.60 1blq s ASP 36 Ca 0.00 0.60 0.06 0.00 1.18 0.00 0.00 52.55 54.40 1blq s ASP 36 Cb 0.00 0.94 -0.02 0.00 -0.34 0.00 0.00 42.92 43.50 1blq s ASP 36 CO 0.00 -0.10 -0.22 0.27 0.68 0.00 0.00 175.17 175.80 1blq s ILE 37 N 0.83 2.42 0.75 2.11 -4.36 -0.77 -4.62 121.20 117.56 1blq s ILE 37 Ca -0.04 -0.97 -0.02 0.00 -0.26 0.00 0.00 60.65 59.36 1blq s ILE 37 Cb -0.04 -1.88 0.14 0.00 1.25 0.00 0.00 42.46 41.93 1blq s ILE 37 CO -0.12 0.58 1.03 -0.94 0.24 0.00 0.00 174.94 175.74 1blq s SER 38 N -0.65 4.19 0.33 4.36 1.04 -1.26 -2.22 113.70 119.49 1blq s SER 38 Ca 0.10 -0.34 0.23 0.00 0.48 0.00 0.00 55.95 56.42 1blq s SER 38 Cb -0.10 0.01 1.21 0.00 0.10 0.00 0.00 66.02 67.24 1blq s SER 38 CO -0.00 -1.98 1.69 0.71 0.98 0.00 0.00 173.24 174.64 1blq h THR 39 N -0.65 0.00 0.00 2.02 1.35 -1.87 0.41 112.91 114.17 1blq h THR 39 Ca -0.37 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1blq h THR 39 Cb 1.26 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1blq h THR 39 CO 0.39 0.00 -0.00 0.50 -0.25 0.00 0.00 175.52 176.16 1blq h LYS 40 N 0.00 -0.00 -0.45 4.72 3.11 -1.89 -3.30 116.57 118.75 1blq h LYS 40 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1blq h LYS 40 Cb 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.26 1blq h LYS 40 CO 0.00 0.86 0.00 0.39 -2.81 0.00 0.00 179.45 177.89 1blq n GLU 41 N -4.64 2.07 -0.03 1.90 -0.58 -0.93 -3.15 120.64 115.29 1blq n GLU 41 Ca -0.09 -1.41 -0.15 0.00 -0.42 0.00 0.00 57.16 55.09 1blq n GLU 41 Cb 0.41 -1.40 -0.09 0.00 -0.57 0.00 0.00 31.44 29.79 1blq n GLU 41 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1blq h LEU 42 N 2.19 0.40 0.00 -4.62 6.46 -1.01 -3.35 115.31 115.39 1blq h LEU 42 Ca 0.00 -0.64 0.00 0.00 -0.12 0.00 0.00 57.88 57.12 1blq h LEU 42 Cb 0.64 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 1blq h LEU 42 CO 0.04 0.98 -0.75 0.61 -0.62 0.00 0.00 178.44 178.70 1blq n GLY 43 N 0.67 0.00 0.15 3.75 0.00 -1.26 -4.65 105.19 103.85 1blq n GLY 43 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1blq n GLY 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1blq n THR 44 N -2.05 1.01 -0.22 2.61 -1.04 -1.19 -2.06 114.28 111.34 1blq n THR 44 Ca 0.00 0.59 -0.07 0.00 -2.04 0.00 0.00 64.05 62.53 1blq n THR 44 Cb 0.38 -1.57 0.04 0.00 -1.82 0.00 0.00 70.33 67.35 1blq n THR 44 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 1blq h VAL 45 N 0.00 1.20 0.08 12.58 3.04 -1.69 1.05 116.25 132.50 1blq h VAL 45 Ca 0.00 -0.53 -0.32 0.00 -1.01 0.00 0.00 66.70 64.84 1blq h VAL 45 Cb 0.10 0.42 -0.02 0.00 -2.01 0.00 0.00 31.29 29.78 1blq h VAL 45 CO 0.00 0.22 -1.73 1.15 -1.01 0.00 0.00 177.57 176.21 1blq n MET 46 N -4.54 0.69 -0.02 4.17 0.00 -0.87 -3.90 117.12 112.64 1blq n MET 46 Ca 0.04 0.38 0.05 0.00 0.00 0.00 0.00 57.70 58.17 1blq n MET 46 Cb 0.10 -1.72 0.27 0.00 0.00 0.00 0.00 33.22 31.86 1blq n MET 46 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 1blq n ARG 47 N -3.85 1.12 -0.62 3.17 3.00 -0.91 -4.10 116.66 114.48 1blq n ARG 47 Ca -0.32 -0.19 0.49 0.00 -0.00 0.00 0.00 57.85 57.83 1blq n ARG 47 Cb 0.91 -1.17 0.80 0.00 0.00 0.00 0.00 32.46 33.00 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 0.34 0.01 -1.75 -0.14 1.85 0.10 0.89 114.93 116.23 1blq h MET 48 Ca 0.00 -0.00 -0.41 0.00 -0.61 0.00 0.00 59.70 58.68 1blq h MET 48 Cb 0.08 -0.00 -0.16 0.00 0.43 0.00 0.00 31.60 31.95 1blq h MET 48 CO 0.00 0.00 0.39 1.28 -0.40 0.00 0.00 176.91 178.19 1blq n LEU 49 N -4.06 6.47 0.00 3.39 4.32 -1.26 -4.75 117.00 121.11 1blq n LEU 49 Ca 0.41 -3.68 0.00 0.00 -0.02 0.00 0.00 56.01 52.72 1blq n LEU 49 Cb 1.83 -1.15 0.00 0.00 -1.62 0.00 0.00 43.42 42.49 1blq n LEU 49 CO 0.42 1.48 0.00 0.61 -1.22 0.00 0.00 177.39 178.68 1blq n GLY 50 N 0.62 0.33 0.00 -0.72 0.00 0.31 -5.07 105.19 100.66 1blq n GLY 50 Ca 0.40 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.90 1blq n GLY 50 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1blq n GLN 51 N 0.00 0.00 -0.13 1.61 7.27 -1.24 -5.00 117.38 119.90 1blq n GLN 51 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 57.00 57.07 1blq n GLN 51 Cb 0.00 0.00 0.02 0.00 2.41 0.00 0.00 30.24 32.67 1blq n GLN 51 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1blq n ASN 52 N 0.00 -0.21 -4.78 1.69 3.02 -1.26 -4.05 115.26 109.68 1blq n ASN 52 Ca 0.00 0.57 -0.37 0.00 -0.03 0.00 0.00 54.58 54.75 1blq n ASN 52 Cb 0.00 -0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.01 1blq n ASN 52 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1blq s PRO 53 N -5.32 4.01 0.09 3.52 0.04 -1.26 -5.03 135.00 131.06 1blq s PRO 53 Ca -0.05 1.64 0.04 0.00 0.04 0.00 0.00 61.00 62.67 1blq s PRO 53 Cb 0.07 -2.51 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 1blq s PRO 53 CO 0.24 -0.30 -0.11 0.99 0.04 0.00 0.00 177.00 177.86 1blq s THR 54 N -1.59 0.96 0.26 1.26 2.01 -1.26 -4.85 115.64 112.43 1blq s THR 54 Ca 0.60 -1.59 -0.01 0.00 0.31 0.00 0.00 61.69 61.00 1blq s THR 54 Cb -0.25 -1.31 0.25 0.00 0.01 0.00 0.00 72.50 71.20 1blq s THR 54 CO 0.31 -0.51 1.71 0.50 -0.69 0.00 0.00 174.62 175.94 1blq h LYS 55 N 3.66 0.41 0.00 4.92 3.64 -1.93 -0.10 116.57 127.16 1blq h LYS 55 Ca -0.38 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1blq h LYS 55 Cb 1.19 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1blq h LYS 55 CO 0.51 0.27 -0.97 0.39 -2.27 0.00 0.00 179.45 177.38 1blq n GLU 56 N -5.03 0.49 -0.21 1.90 1.02 -1.26 -4.07 120.64 113.47 1blq n GLU 56 Ca 0.18 0.08 -0.01 0.00 -0.02 0.00 0.00 57.16 57.39 1blq n GLU 56 Cb 0.52 -1.74 0.21 0.00 -0.02 0.00 0.00 31.44 30.40 1blq n GLU 56 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1blq h GLU 57 N 0.00 0.99 0.00 3.49 3.07 -1.37 -1.59 114.58 119.17 1blq h GLU 57 Ca 0.00 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.74 1blq h GLU 57 Cb 0.90 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1blq h GLU 57 CO 0.00 0.71 -0.11 -0.07 -1.40 0.00 0.00 179.01 178.14 1blq h LEU 58 N 1.01 0.00 -2.57 1.33 -0.00 -1.65 -3.09 115.31 110.34 1blq h LEU 58 Ca 0.26 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 58.14 1blq h LEU 58 Cb -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1blq h LEU 58 CO -0.04 0.11 -0.02 -0.78 -0.00 0.00 0.00 178.44 177.71 1blq h ASP 59 N 0.00 0.00 0.40 -0.43 1.82 -1.43 -0.79 116.42 115.98 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 0.99 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.01 1blq h ASP 59 CO 0.01 0.02 -0.19 0.00 -1.61 0.00 0.00 179.24 177.47 1blq h ALA 60 N 1.98 -0.53 0.00 -0.78 0.00 -1.57 -1.86 119.26 116.50 1blq h ALA 60 Ca -0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1blq h ALA 60 Cb 0.09 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1blq h ALA 60 CO 0.00 -0.57 -0.07 0.82 0.00 0.00 0.00 179.25 179.43 1blq h ILE 61 N -1.00 0.37 0.00 0.00 5.03 -1.66 -1.02 117.51 119.23 1blq h ILE 61 Ca -0.05 -0.42 -0.07 0.00 -0.12 0.00 0.00 64.86 64.20 1blq h ILE 61 Cb 0.54 1.30 -0.01 0.00 -3.03 0.00 0.00 36.82 35.62 1blq h ILE 61 CO 0.09 0.07 -0.34 0.40 -0.68 0.00 0.00 178.15 177.69 1blq h ILE 62 N 0.00 0.76 0.00 -0.67 1.08 -0.99 -2.87 117.51 114.82 1blq h ILE 62 Ca -0.00 -1.48 -0.10 0.00 -0.39 0.00 0.00 64.86 62.89 1blq h ILE 62 Cb 0.29 1.95 -0.01 0.00 -3.07 0.00 0.00 36.82 35.98 1blq h ILE 62 CO 0.01 0.33 -0.45 -0.33 -0.69 0.00 0.00 178.15 177.02 1blq h GLU 63 N 0.00 0.00 0.00 2.37 5.08 -0.32 0.50 114.58 122.21 1blq h GLU 63 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1blq h GLU 63 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1blq h GLU 63 CO 0.04 0.45 -0.05 1.05 -1.00 0.00 0.00 179.01 179.51 1blq h GLU 64 N 0.00 0.00 0.00 2.33 -0.00 -1.45 -3.40 114.58 112.07 1blq h GLU 64 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1blq h GLU 64 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.00 1blq h GLU 64 CO 0.06 0.00 -0.13 0.28 -0.00 0.00 0.00 179.01 179.22 1blq n VAL 65 N -2.91 0.97 -2.39 -1.06 0.31 -1.16 -4.84 118.33 107.25 1blq n VAL 65 Ca 0.04 0.30 -0.37 0.00 -0.01 0.00 0.00 64.34 64.29 1blq n VAL 65 Cb 0.51 -1.56 -0.02 0.00 -0.91 0.00 0.00 33.84 31.85 1blq n VAL 65 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1blq s ASP 66 N -5.70 6.15 0.45 4.52 -1.08 0.17 -4.68 116.67 116.51 1blq s ASP 66 Ca -0.04 -2.11 0.25 0.00 -0.52 0.00 0.00 52.55 50.13 1blq s ASP 66 Cb 0.01 -2.58 0.52 0.00 -1.46 0.00 0.00 42.92 39.40 1blq s ASP 66 CO 0.06 -1.90 1.67 1.05 0.52 0.00 0.00 175.17 176.57 1blq h GLU 67 N 8.48 0.00 -0.63 4.34 4.11 -1.76 -3.18 114.58 125.94 1blq h GLU 67 Ca 0.35 0.00 0.17 0.00 0.07 0.00 0.00 59.36 59.95 1blq h GLU 67 Cb 0.90 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 1blq h GLU 67 CO 1.37 0.02 0.45 -0.44 0.07 0.00 0.00 179.01 180.48 1blq h ASP 68 N 0.00 0.07 0.00 3.06 5.19 -1.93 -3.45 116.42 119.37 1blq h ASP 68 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1blq h ASP 68 Cb 0.92 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.42 1blq h ASP 68 CO 0.00 0.04 0.00 0.61 -3.12 0.00 0.00 179.24 176.77 1blq n GLY 69 N -1.63 0.51 0.30 2.75 0.00 -1.20 -4.92 105.19 100.99 1blq n GLY 69 Ca 0.12 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.32 1blq n GLY 69 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1blq h SER 70 N 0.00 0.00 -2.69 1.61 0.87 -1.87 -3.46 113.55 108.01 1blq h SER 70 Ca 0.00 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.43 1blq h SER 70 Cb 0.00 0.00 0.05 0.00 -0.44 0.00 0.00 62.40 62.01 1blq h SER 70 CO 0.00 0.03 -0.23 0.61 -0.53 0.00 0.00 176.83 176.71 1blq n GLY 71 N -0.57 0.43 3.49 5.77 0.00 -1.26 -5.03 105.19 108.01 1blq n GLY 71 Ca -0.01 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1blq n GLY 71 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1blq s THR 72 N -3.11 0.01 0.06 2.61 -1.32 -1.26 -3.25 115.64 109.38 1blq s THR 72 Ca 0.19 -0.31 -0.07 0.00 -1.21 0.00 0.00 61.69 60.29 1blq s THR 72 Cb -0.08 -1.24 -0.01 0.00 -1.51 0.00 0.00 72.50 69.66 1blq s THR 72 CO 0.25 -0.05 0.14 0.27 -2.21 0.00 0.00 174.62 173.02 1blq s ILE 73 N -3.80 0.15 0.00 5.08 -4.36 -0.94 -4.64 121.20 112.68 1blq s ILE 73 Ca 0.04 -1.20 0.00 0.00 -0.26 0.00 0.00 60.65 59.23 1blq s ILE 73 Cb -0.01 -1.19 0.00 0.00 1.25 0.00 0.00 42.46 42.50 1blq s ILE 73 CO -0.09 -0.66 0.00 0.47 0.24 0.00 0.00 174.94 174.90 1blq n ASP 74 N 0.28 0.00 0.21 4.36 8.00 -1.26 -1.85 116.55 126.29 1blq n ASP 74 Ca -0.16 -0.63 0.12 0.00 0.71 0.00 0.00 54.79 54.83 1blq n ASP 74 Cb 0.61 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.91 1blq n ASP 74 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 1blq h PHE 75 N -0.02 0.00 0.05 1.24 -0.00 -1.93 -2.04 116.94 114.24 1blq h PHE 75 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1blq h PHE 75 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 35.95 1blq h PHE 75 CO 0.00 0.00 -0.03 0.93 -0.00 0.00 0.00 178.31 179.21 1blq h GLU 76 N 0.00 -0.07 0.00 6.09 5.08 -1.96 -1.43 114.58 122.29 1blq h GLU 76 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1blq h GLU 76 Cb 0.96 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1blq h GLU 76 CO 0.00 0.34 0.00 0.93 -1.00 0.00 0.00 179.01 179.28 1blq h GLU 77 N -0.98 0.00 0.00 2.33 3.07 -1.95 -2.41 114.58 114.64 1blq h GLU 77 Ca -0.01 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.71 1blq h GLU 77 Cb 0.44 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.33 1blq h GLU 77 CO 0.01 0.00 -1.12 0.35 -1.40 0.00 0.00 179.01 176.85 1blq h PHE 78 N 0.00 0.00 0.00 4.33 3.57 -1.41 -3.31 116.94 120.12 1blq h PHE 78 Ca 0.00 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.37 1blq h PHE 78 Cb 0.43 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1blq h PHE 78 CO 0.00 0.54 -0.61 -0.07 -2.23 0.00 0.00 178.31 175.94 1blq h LEU 79 N 0.00 0.00 0.00 0.59 3.38 -0.74 -2.78 115.31 115.77 1blq h LEU 79 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1blq h LEU 79 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1blq h LEU 79 CO 0.05 0.61 0.00 0.55 0.09 0.00 0.00 178.44 179.75 1blq n VAL 80 N -3.55 0.04 0.05 1.22 3.14 -1.15 -3.08 118.33 115.00 1blq n VAL 80 Ca -0.00 0.01 -0.18 0.00 -2.96 0.00 0.00 64.34 61.20 1blq n VAL 80 Cb 0.67 -0.55 -0.14 0.00 -1.06 0.00 0.00 33.84 32.76 1blq n VAL 80 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 1blq h MET 81 N 0.00 0.27 0.12 1.45 4.05 -1.61 -3.15 114.93 116.06 1blq h MET 81 Ca 0.00 -0.46 -0.19 0.00 -0.28 0.00 0.00 59.70 58.77 1blq h MET 81 Cb 0.15 0.17 0.02 0.00 -0.80 0.00 0.00 31.60 31.14 1blq h MET 81 CO 0.00 1.13 -0.83 0.52 0.23 0.00 0.00 176.91 177.96 1blq h MET 82 N 0.07 0.34 0.00 0.39 2.07 -1.65 -3.25 114.93 112.91 1blq h MET 82 Ca -0.31 -0.53 -0.01 0.00 -2.07 0.00 0.00 59.70 56.77 1blq h MET 82 Cb 2.04 0.19 -0.00 0.00 -1.87 0.00 0.00 31.60 31.96 1blq h MET 82 CO 0.14 1.24 -0.07 0.28 1.07 0.00 0.00 176.91 179.57 1blq h VAL 83 N -0.28 0.82 0.00 -2.22 2.07 -1.71 -3.34 116.25 111.59 1blq h VAL 83 Ca -0.14 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1blq h VAL 83 Cb 1.63 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1blq h VAL 83 CO 0.16 0.07 0.00 0.54 0.02 0.00 0.00 177.57 178.36 1blq n ARG 84 N -4.11 0.00 -3.04 1.57 5.12 -1.19 -4.19 116.66 110.81 1blq n ARG 84 Ca -0.03 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.47 1blq n ARG 84 Cb 0.15 -0.35 -0.06 0.00 -1.16 0.00 0.00 32.46 31.04 1blq n ARG 84 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1blq s GLN 85 N 0.00 3.52 0.03 5.56 0.74 -1.25 -4.88 119.66 123.37 1blq s GLN 85 Ca 0.00 -0.05 0.25 0.00 0.05 0.00 0.00 55.36 55.61 1blq s GLN 85 Cb 0.00 -3.88 0.52 0.00 1.10 0.00 0.00 33.01 30.75 1blq s GLN 85 CO 0.00 -0.93 1.43 -1.33 -0.55 0.00 0.00 175.29 173.90 1blq n MET 86 N 6.35 0.08 -0.08 1.67 2.81 -1.26 -2.84 117.12 123.86 1blq n MET 86 Ca 0.00 0.02 -0.17 0.00 -1.81 0.00 0.00 57.70 55.75 1blq n MET 86 Cb 0.48 -1.55 -0.13 0.00 -0.71 0.00 0.00 33.22 31.32 1blq n MET 86 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1blq h LYS 87 N 0.00 0.01 0.00 0.03 1.63 -1.94 -3.25 116.57 113.05 1blq h LYS 87 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1blq h LYS 87 Cb 0.57 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.20 1blq h LYS 87 CO 0.00 1.01 0.00 -1.91 -3.45 0.00 0.00 179.45 175.10 1blq n GLU 88 N -4.53 0.11 -2.18 1.90 2.13 -1.26 -4.80 120.64 112.01 1blq n GLU 88 Ca -0.17 0.56 -0.02 0.00 0.66 0.00 0.00 57.16 58.19 1blq n GLU 88 Cb 0.56 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.45 1blq n GLU 88 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1blq n ASP 89 N -2.05 -1.70 0.00 4.31 2.03 -1.23 -5.15 116.55 112.76 1blq n ASP 89 Ca -0.00 -0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1blq n ASP 89 Cb 0.06 -0.92 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28