#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 -2.68 -1.26 0.00 3.41 -1.26 -4.80 113.62 107.03 1blq n SER 2 Ca 0.00 -0.37 0.02 0.00 -0.26 0.00 0.00 58.87 58.26 1blq n SER 2 Cb 0.00 -0.55 0.20 0.00 -0.26 0.00 0.00 64.21 63.60 1blq n SER 2 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1blq n MET 3 N -2.09 2.85 0.00 4.33 2.00 -1.26 -4.22 117.12 118.73 1blq n MET 3 Ca 0.06 -1.60 0.00 0.00 0.00 0.00 0.00 57.70 56.15 1blq n MET 3 Cb 0.25 -1.86 0.00 0.00 0.00 0.00 0.00 33.22 31.61 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 0.25 0.00 0.22 2.03 -1.04 -1.26 -2.80 114.28 111.67 1blq n THR 4 Ca 0.16 0.01 0.17 0.00 -2.04 0.00 0.00 64.05 62.35 1blq n THR 4 Cb 0.78 -0.04 0.72 0.00 -1.82 0.00 0.00 70.33 69.97 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 -0.10 8.00 5.19 -1.97 0.99 116.42 128.53 1blq h ASP 5 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1blq h ASP 5 Cb 0.00 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1blq h ASP 5 CO 0.00 0.00 0.02 -0.61 -3.12 0.00 0.00 179.24 175.53 1blq h GLN 6 N 0.00 0.16 0.00 3.56 4.15 -1.73 -1.87 115.11 119.38 1blq h GLN 6 Ca 0.10 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.48 1blq h GLN 6 Cb 1.02 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.69 1blq h GLN 6 CO -0.00 0.35 0.00 0.37 -1.93 0.00 0.00 178.83 177.62 1blq h GLN 7 N -0.06 0.00 0.04 1.69 -0.00 -0.64 -2.10 115.11 114.04 1blq h GLN 7 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.68 1blq h GLN 7 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.74 1blq h GLN 7 CO 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 178.83 178.81 1blq h ALA 8 N 2.05 -0.05 -0.59 3.38 0.00 -1.02 -2.28 119.26 120.75 1blq h ALA 8 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 1blq h ALA 8 Cb 0.48 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1blq h ALA 8 CO 0.00 -0.16 -0.00 1.49 0.00 0.00 0.00 179.25 180.58 1blq h GLU 9 N -0.79 1.04 0.94 0.00 4.22 -1.29 -1.79 114.58 116.91 1blq h GLU 9 Ca -0.01 -0.33 -0.05 0.00 0.08 0.00 0.00 59.36 59.06 1blq h GLU 9 Cb 0.67 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.83 1blq h GLU 9 CO 0.01 1.03 -0.45 0.00 -2.18 0.00 0.00 179.01 177.41 1blq h ALA 10 N 0.98 -1.34 -0.43 2.92 0.00 -1.46 -2.32 119.26 117.62 1blq h ALA 10 Ca 0.17 -0.28 0.12 0.00 0.00 0.00 0.00 54.91 54.92 1blq h ALA 10 Cb 0.56 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1blq h ALA 10 CO 0.03 -1.24 0.33 0.00 0.00 0.00 0.00 179.25 178.36 1blq h ARG 11 N -1.27 0.00 0.16 0.00 3.08 -1.43 -1.63 114.38 113.30 1blq h ARG 11 Ca -0.13 0.00 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1blq h ARG 11 Cb 0.97 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 1blq h ARG 11 CO 0.21 0.00 -0.35 0.00 -1.07 0.00 0.00 179.97 178.76 1blq h ALA 12 N 1.75 -0.64 0.00 0.04 0.00 -0.75 -1.62 119.26 118.04 1blq h ALA 12 Ca 0.20 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1blq h ALA 12 Cb 0.85 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1blq h ALA 12 CO -0.00 -0.92 -0.43 0.35 0.00 0.00 0.00 179.25 178.25 1blq h PHE 13 N -0.61 0.00 -1.71 0.00 3.57 -1.25 -3.35 116.94 113.59 1blq h PHE 13 Ca 0.02 0.00 -0.72 0.00 3.53 0.00 0.00 57.97 60.79 1blq h PHE 13 Cb 0.62 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.21 1blq h PHE 13 CO -0.29 0.43 1.69 1.28 -2.23 0.00 0.00 178.31 179.18 1blq n LEU 14 N -3.71 5.33 -4.26 0.59 4.77 -0.61 -5.00 117.00 114.11 1blq n LEU 14 Ca -0.01 -4.33 -0.30 0.00 -0.03 0.00 0.00 56.01 51.34 1blq n LEU 14 Cb 0.51 -1.64 0.19 0.00 -2.33 0.00 0.00 43.42 40.15 1blq n LEU 14 CO 0.38 0.66 -0.28 -1.20 -1.33 0.00 0.00 177.39 175.62 1blq n SER 15 N 6.17 -2.51 0.00 -1.43 7.64 -1.25 -4.78 113.62 117.45 1blq n SER 15 Ca 0.41 -0.23 0.08 0.00 1.01 0.00 0.00 58.87 60.14 1blq n SER 15 Cb 0.43 -0.97 0.48 0.00 -1.01 0.00 0.00 64.21 63.14 1blq n SER 15 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1blq n GLU 16 N -2.69 0.93 -0.02 1.43 2.13 -1.26 -3.52 120.64 117.63 1blq n GLU 16 Ca 0.02 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.65 1blq n GLU 16 Cb 0.58 -1.27 -0.13 0.00 0.27 0.00 0.00 31.44 30.88 1blq n GLU 16 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1blq h GLU 17 N 0.00 0.15 -0.35 5.31 5.08 -1.99 -2.37 114.58 120.42 1blq h GLU 17 Ca 0.00 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 1blq h GLU 17 Cb 0.00 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1blq h GLU 17 CO 0.00 1.12 0.00 0.00 -1.00 0.00 0.00 179.01 179.14 1blq h MET 18 N -0.63 0.61 0.00 2.33 -0.00 -1.91 -2.85 114.93 112.49 1blq h MET 18 Ca -0.19 -0.19 -0.12 0.00 -0.00 0.00 0.00 59.70 59.20 1blq h MET 18 Cb 1.45 -0.06 -0.02 0.00 -0.00 0.00 0.00 31.60 32.98 1blq h MET 18 CO 0.02 0.72 -0.55 0.82 -0.00 0.00 0.00 176.91 177.92 1blq h ILE 19 N 0.42 1.35 -0.68 -0.10 5.03 -1.72 -2.84 117.51 118.97 1blq h ILE 19 Ca 0.10 -1.93 0.18 0.00 -0.12 0.00 0.00 64.86 63.09 1blq h ILE 19 Cb 0.45 2.06 -0.03 0.00 -3.03 0.00 0.00 36.82 36.26 1blq h ILE 19 CO 0.02 0.54 0.48 0.00 -0.68 0.00 0.00 178.15 178.51 1blq h ALA 20 N 1.45 2.49 0.00 1.87 0.00 -1.17 0.22 119.26 124.11 1blq h ALA 20 Ca -0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1blq h ALA 20 Cb 1.01 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1blq h ALA 20 CO 0.07 -0.68 -1.18 -1.91 0.00 0.00 0.00 179.25 175.55 1blq n GLU 21 N -4.38 0.61 0.13 0.00 4.07 -1.08 -3.92 120.64 116.08 1blq n GLU 21 Ca 0.13 0.11 0.12 0.00 -0.06 0.00 0.00 57.16 57.47 1blq n GLU 21 Cb 0.68 -1.79 0.22 0.00 -0.06 0.00 0.00 31.44 30.49 1blq n GLU 21 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 1blq h PHE 22 N 0.00 0.00 0.00 4.31 -1.00 -0.52 -3.26 116.94 116.47 1blq h PHE 22 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 1blq h PHE 22 Cb 1.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.68 1blq h PHE 22 CO 0.00 0.00 0.11 1.57 -1.61 0.00 0.00 178.31 178.38 1blq h LYS 23 N 0.00 0.00 0.00 1.51 2.10 -1.17 -1.85 116.57 117.16 1blq h LYS 23 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1blq h LYS 23 Cb 0.86 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 1blq h LYS 23 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 1blq n ALA 24 N -1.81 -0.10 0.08 0.07 0.00 -1.23 -0.63 120.51 116.89 1blq n ALA 24 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.28 1blq n ALA 24 Cb 0.15 0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.61 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 -1.92 0.28 0.16 0.00 0.00 -1.85 -2.86 119.26 113.07 1blq h ALA 25 Ca 0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 1blq h ALA 25 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1blq h ALA 25 CO 0.00 0.85 -0.08 0.35 0.00 0.00 0.00 179.25 180.37 1blq h PHE 26 N 0.19 -0.20 0.00 0.00 3.04 -1.43 -3.08 116.94 115.46 1blq h PHE 26 Ca -0.10 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.85 1blq h PHE 26 Cb 1.70 0.07 0.00 0.00 2.56 0.00 0.00 35.95 40.27 1blq h PHE 26 CO 0.06 -0.12 0.30 0.22 -2.02 0.00 0.00 178.31 176.75 1blq h ASP 27 N -0.34 0.00 -1.01 0.41 1.82 -0.98 -2.24 116.42 114.08 1blq h ASP 27 Ca -0.02 0.00 0.35 0.00 -0.39 0.00 0.00 57.03 56.97 1blq h ASP 27 Cb 0.16 0.00 -0.16 0.00 0.68 0.00 0.00 39.33 40.02 1blq h ASP 27 CO 0.04 0.00 0.57 -0.03 -1.61 0.00 0.00 179.24 178.21 1blq h MET 28 N 0.00 0.24 0.00 0.28 4.05 -1.28 -3.18 114.93 115.03 1blq h MET 28 Ca 0.00 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1blq h MET 28 Cb 0.61 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.36 1blq h MET 28 CO 0.00 0.16 0.00 1.19 0.23 0.00 0.00 176.91 178.49 1blq n PHE 29 N -5.09 0.00 -1.71 1.39 3.01 -0.84 -4.84 117.46 109.37 1blq n PHE 29 Ca 0.33 0.00 -0.58 0.00 1.01 0.00 0.00 57.45 58.22 1blq n PHE 29 Cb 1.07 -0.07 -0.07 0.00 -0.01 0.00 0.00 39.48 40.39 1blq n PHE 29 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1blq n ASP 30 N -1.38 2.36 0.00 4.37 2.03 0.47 -4.52 116.55 119.88 1blq n ASP 30 Ca 0.00 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.39 1blq n ASP 30 Cb 0.00 -1.14 0.00 0.00 -0.72 0.00 0.00 41.12 39.26 1blq n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1blq n ALA 31 N 5.33 2.00 0.69 -1.67 0.00 -1.26 -4.68 120.51 120.92 1blq n ALA 31 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.79 1blq n ALA 31 Cb 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.47 1blq n ALA 31 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1blq n ASP 32 N -1.71 0.83 0.00 0.00 9.92 -1.26 -4.96 116.55 119.37 1blq n ASP 32 Ca 0.00 -0.77 0.00 0.00 -0.53 0.00 0.00 54.79 53.49 1blq n ASP 32 Cb 0.00 1.13 0.00 0.00 -0.64 0.00 0.00 41.12 41.61 1blq n ASP 32 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1blq n GLY 33 N 1.42 1.00 0.00 0.44 0.00 -1.26 -5.04 105.19 101.75 1blq n GLY 33 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 2.07 -0.02 0.00 -1.26 -5.04 105.19 100.94 1blq n GLY 34 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 6.36 3.13 -0.02 0.00 -1.26 -4.88 105.19 108.52 1blq n GLY 35 Ca 0.00 -2.67 -0.24 0.00 0.00 0.00 0.00 46.02 43.11 1blq n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1blq n ASP 36 N -0.69 -3.38 -4.43 1.61 8.00 -1.26 -0.40 116.55 116.00 1blq n ASP 36 Ca 0.44 -0.56 -0.32 0.00 0.71 0.00 0.00 54.79 55.06 1blq n ASP 36 Cb 0.93 -0.90 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 1blq n ASP 36 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1blq s ILE 37 N -2.12 2.76 0.36 0.53 -4.36 -0.85 -4.71 121.20 112.82 1blq s ILE 37 Ca 0.51 -0.92 0.00 0.00 -0.26 0.00 0.00 60.65 59.99 1blq s ILE 37 Cb -0.10 -2.07 0.07 0.00 1.25 0.00 0.00 42.46 41.61 1blq s ILE 37 CO 0.46 0.53 0.49 -1.20 0.24 0.00 0.00 174.94 175.46 1blq n SER 38 N 2.17 0.71 0.00 4.36 7.64 -1.26 -1.36 113.62 125.88 1blq n SER 38 Ca -0.17 -1.59 0.10 0.00 1.01 0.00 0.00 58.87 58.23 1blq n SER 38 Cb 0.52 -0.31 0.46 0.00 -1.01 0.00 0.00 64.21 63.86 1blq n SER 38 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1blq n THR 39 N -2.08 0.53 -0.04 0.44 -2.24 0.52 -1.17 114.28 110.24 1blq n THR 39 Ca 0.08 0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.99 1blq n THR 39 Cb 0.30 -0.77 -0.00 0.00 -2.10 0.00 0.00 70.33 67.76 1blq n THR 39 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1blq h LYS 40 N 0.00 0.00 -0.08 -0.78 3.64 -1.93 -3.15 116.57 114.28 1blq h LYS 40 Ca 0.00 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1blq h LYS 40 Cb 0.36 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1blq h LYS 40 CO 0.00 0.00 -0.45 0.93 -2.27 0.00 0.00 179.45 177.66 1blq h GLU 41 N -0.65 0.19 -0.43 1.90 4.39 -1.95 -1.80 114.58 116.23 1blq h GLU 41 Ca 0.00 -0.10 0.03 0.00 0.34 0.00 0.00 59.36 59.64 1blq h GLU 41 Cb 0.06 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 1blq h GLU 41 CO 0.00 0.61 0.28 1.25 -1.16 0.00 0.00 179.01 179.99 1blq h LEU 42 N 0.16 0.38 0.00 1.33 6.46 -1.31 0.21 115.31 122.54 1blq h LEU 42 Ca 0.01 -0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.69 1blq h LEU 42 Cb 0.86 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.68 1blq h LEU 42 CO 0.07 0.26 -1.01 1.23 -0.62 0.00 0.00 178.44 178.37 1blq h GLY 43 N 0.45 0.00 1.51 3.75 0.00 -1.41 -3.26 103.07 104.10 1blq h GLY 43 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1blq h GLY 43 CO -0.04 0.00 -0.25 2.41 0.00 0.00 0.00 176.54 178.65 1blq n THR 44 N -2.86 0.02 -0.09 4.70 -1.04 -0.32 -1.91 114.28 112.79 1blq n THR 44 Ca -0.03 -0.01 -0.21 0.00 -2.04 0.00 0.00 64.05 61.76 1blq n THR 44 Cb 0.68 -0.14 -0.12 0.00 -1.82 0.00 0.00 70.33 68.93 1blq n THR 44 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1blq h VAL 45 N 0.00 1.06 0.00 12.58 2.07 -0.72 -3.35 116.25 127.89 1blq h VAL 45 Ca 0.00 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.29 1blq h VAL 45 Cb 0.51 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 32.74 1blq h VAL 45 CO 0.00 0.40 0.00 0.24 0.02 0.00 0.00 177.57 178.23 1blq h MET 46 N -0.92 0.00 -0.05 1.57 2.86 -1.68 -3.28 114.93 113.44 1blq h MET 46 Ca -0.29 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.36 1blq h MET 46 Cb 1.31 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.95 1blq h MET 46 CO -0.15 0.00 -0.05 -0.09 1.06 0.00 0.00 176.91 177.68 1blq h ARG 47 N 0.00 -0.06 0.14 1.72 2.43 -1.53 -2.43 114.38 114.65 1blq h ARG 47 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1blq h ARG 47 Cb 0.90 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 1blq h ARG 47 CO 0.00 -0.04 -0.13 0.52 -1.51 0.00 0.00 179.97 178.81 1blq h MET 48 N -0.07 -0.28 -2.35 0.20 2.86 -1.69 -2.76 114.93 110.83 1blq h MET 48 Ca 0.04 0.02 -0.60 0.00 -2.06 0.00 0.00 59.70 57.10 1blq h MET 48 Cb 0.12 0.06 -0.13 0.00 0.06 0.00 0.00 31.60 31.71 1blq h MET 48 CO -0.09 -0.19 1.49 1.28 1.06 0.00 0.00 176.91 180.47 1blq n LEU 49 N -5.25 7.26 0.00 1.22 7.99 -1.06 -4.75 117.00 122.40 1blq n LEU 49 Ca -0.08 -4.40 0.00 0.00 -0.01 0.00 0.00 56.01 51.53 1blq n LEU 49 Cb 0.17 -1.33 0.00 0.00 -0.11 0.00 0.00 43.42 42.15 1blq n LEU 49 CO 0.31 1.91 0.00 0.61 -1.51 0.00 0.00 177.39 178.71 1blq n GLY 50 N 1.57 -0.76 3.11 -0.72 0.00 -0.94 -4.92 105.19 102.52 1blq n GLY 50 Ca 0.57 0.54 -0.07 0.00 0.00 0.00 0.00 46.02 47.05 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 0.00 0.64 0.08 1.61 -1.52 -1.16 -4.99 119.66 114.32 1blq s GLN 51 Ca 0.00 -1.13 -0.31 0.00 -1.95 0.00 0.00 55.36 51.97 1blq s GLN 51 Cb 0.00 0.23 -0.08 0.00 -0.22 0.00 0.00 33.01 32.94 1blq s GLN 51 CO 0.00 -0.14 1.49 -0.80 -0.25 0.00 0.00 175.29 175.60 1blq s ASN 52 N -2.83 6.73 0.63 5.90 0.01 -1.26 -4.30 114.94 119.82 1blq s ASN 52 Ca 0.05 2.37 -0.00 0.00 -0.71 0.00 0.00 52.86 54.57 1blq s ASN 52 Cb 0.06 -2.58 0.10 0.00 0.41 0.00 0.00 41.25 39.25 1blq s ASN 52 CO -0.10 -0.76 0.69 -0.81 -1.51 0.00 0.00 177.10 174.62 1blq n PRO 53 N 4.73 0.12 -4.11 -0.60 -0.04 -1.26 -5.08 135.00 128.75 1blq n PRO 53 Ca 0.13 -1.90 -0.26 0.00 -0.04 0.00 0.00 63.50 61.44 1blq n PRO 53 Cb 0.41 -0.46 -0.06 0.00 -0.04 0.00 0.00 33.50 33.36 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 -2.07 4.31 0.40 0.52 2.01 -1.26 -4.96 115.64 114.58 1blq s THR 54 Ca 0.46 -1.20 0.09 0.00 0.31 0.00 0.00 61.69 61.35 1blq s THR 54 Cb -0.03 -3.21 0.30 0.00 0.01 0.00 0.00 72.50 69.58 1blq s THR 54 CO 0.31 -0.14 1.98 0.50 -0.69 0.00 0.00 174.62 176.57 1blq h LYS 55 N 2.36 0.58 0.00 4.92 1.63 -1.99 -0.12 116.57 123.95 1blq h LYS 55 Ca -0.48 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.25 1blq h LYS 55 Cb 1.21 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.70 1blq h LYS 55 CO 0.62 0.38 -0.89 1.49 -3.45 0.00 0.00 179.45 177.60 1blq h GLU 56 N 0.59 0.00 -0.08 1.90 4.81 -1.96 -3.31 114.58 116.53 1blq h GLU 56 Ca 0.28 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 1blq h GLU 56 Cb 0.35 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 1blq h GLU 56 CO -0.09 0.10 0.02 1.49 -0.73 0.00 0.00 179.01 179.79 1blq h GLU 57 N 0.00 0.10 0.00 1.92 4.81 -1.39 -0.90 114.58 119.13 1blq h GLU 57 Ca -0.03 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1blq h GLU 57 Cb 1.15 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1blq h GLU 57 CO 0.01 0.10 -0.66 -0.07 -0.73 0.00 0.00 179.01 177.66 1blq h LEU 58 N 0.11 0.00 -0.00 1.64 -0.00 -1.60 -3.24 115.31 112.22 1blq h LEU 58 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 1blq h LEU 58 Cb 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 1blq h LEU 58 CO -0.00 0.16 -0.00 -0.67 -0.00 0.00 0.00 178.44 177.93 1blq n ASP 59 N -2.93 0.01 -0.06 -0.43 2.03 -0.37 -2.79 116.55 112.01 1blq n ASP 59 Ca 0.00 -0.15 -0.22 0.00 0.52 0.00 0.00 54.79 54.95 1blq n ASP 59 Cb 0.61 -0.28 -0.12 0.00 -0.72 0.00 0.00 41.12 40.61 1blq n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1blq h ALA 60 N 3.43 0.32 -0.25 -1.67 0.00 -1.50 -2.87 119.26 116.72 1blq h ALA 60 Ca 0.00 -1.28 -0.11 0.00 0.00 0.00 0.00 54.91 53.52 1blq h ALA 60 Cb 0.29 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1blq h ALA 60 CO 0.00 0.93 -0.32 0.82 0.00 0.00 0.00 179.25 180.68 1blq h ILE 61 N -0.59 1.28 0.00 0.00 5.03 -1.68 -2.51 117.51 119.04 1blq h ILE 61 Ca -0.38 -1.41 -0.07 0.00 -0.12 0.00 0.00 64.86 62.88 1blq h ILE 61 Cb 1.59 1.44 -0.01 0.00 -3.03 0.00 0.00 36.82 36.81 1blq h ILE 61 CO -0.09 0.45 -0.35 0.40 -0.68 0.00 0.00 178.15 177.87 1blq h ILE 62 N 0.44 0.70 -0.56 -0.67 2.04 -1.68 -3.23 117.51 114.54 1blq h ILE 62 Ca 0.05 -1.62 0.11 0.00 1.00 0.00 0.00 64.86 64.40 1blq h ILE 62 Cb 0.77 2.07 -0.08 0.00 -0.74 0.00 0.00 36.82 38.84 1blq h ILE 62 CO 0.06 0.34 0.08 -0.08 0.00 0.00 0.00 178.15 178.55 1blq h GLU 63 N 0.00 0.20 -2.27 2.37 4.81 -1.21 -0.22 114.58 118.26 1blq h GLU 63 Ca -0.00 -0.01 -0.62 0.00 -0.13 0.00 0.00 59.36 58.59 1blq h GLU 63 Cb 1.04 -0.05 -0.16 0.00 0.63 0.00 0.00 28.75 30.22 1blq h GLU 63 CO 0.05 0.13 1.30 -0.85 -0.73 0.00 0.00 179.01 178.90 1blq n GLU 64 N -5.17 3.46 0.01 1.92 0.28 -1.22 -4.33 120.64 115.60 1blq n GLU 64 Ca 0.08 -2.93 0.00 0.00 -0.16 0.00 0.00 57.16 54.14 1blq n GLU 64 Cb 0.30 -2.37 0.00 0.00 1.43 0.00 0.00 31.44 30.81 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 1.17 0.00 0.00 3.84 0.24 -0.85 -4.96 118.33 117.77 1blq n VAL 65 Ca 0.55 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.85 1blq n VAL 65 Cb 0.40 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 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 -2.26 0.00 0.01 -1.34 5.68 -0.15 -4.83 116.55 113.66 1blq n ASP 66 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1blq n ASP 66 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1blq n ASP 66 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1blq n GLU 67 N 0.00 0.00 -0.49 0.11 2.13 -1.26 -4.95 120.64 116.18 1blq n GLU 67 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1blq n GLU 67 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1blq n GLU 67 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1blq n ASP 68 N -2.33 0.00 0.00 4.31 -0.08 -1.26 -5.04 116.55 112.15 1blq n ASP 68 Ca 0.00 -1.22 0.00 0.00 -1.51 0.00 0.00 54.79 52.06 1blq n ASP 68 Cb 0.00 -0.04 0.00 0.00 2.34 0.00 0.00 41.12 43.42 1blq n ASP 68 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1blq n GLY 69 N 0.00 0.78 0.00 0.27 0.00 -1.26 -5.07 105.19 99.91 1blq n GLY 69 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1blq n GLY 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1blq n SER 70 N 0.00 3.34 0.00 1.61 3.41 -1.26 -5.04 113.62 115.69 1blq n SER 70 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1blq n SER 70 Cb 0.00 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1blq n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1blq n GLY 71 N 2.54 0.95 3.17 5.00 0.00 -1.26 -4.85 105.19 110.75 1blq n GLY 71 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.00 0.13 -0.07 2.61 -1.32 -1.26 0.19 115.64 113.92 1blq s THR 72 Ca 0.00 -1.73 -0.25 0.00 -1.21 0.00 0.00 61.69 58.50 1blq s THR 72 Cb 0.00 -1.83 0.06 0.00 -1.51 0.00 0.00 72.50 69.22 1blq s THR 72 CO 0.00 -0.57 0.57 0.27 -2.21 0.00 0.00 174.62 172.68 1blq s ILE 73 N -3.99 0.01 0.00 5.08 -4.36 -0.46 -4.34 121.20 113.14 1blq s ILE 73 Ca 0.17 -0.12 0.00 0.00 -0.26 0.00 0.00 60.65 60.44 1blq s ILE 73 Cb 0.07 -0.88 0.00 0.00 1.25 0.00 0.00 42.46 42.90 1blq s ILE 73 CO -0.02 -0.07 0.00 -0.90 0.24 0.00 0.00 174.94 174.19 1blq n ASP 74 N 1.30 1.24 0.00 4.36 5.75 -1.26 -2.00 116.55 125.94 1blq n ASP 74 Ca -0.19 -0.35 0.07 0.00 -0.01 0.00 0.00 54.79 54.31 1blq n ASP 74 Cb 0.57 0.00 0.32 0.00 -1.03 0.00 0.00 41.12 40.97 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 -0.13 0.00 -0.10 2.11 3.01 -1.26 -0.90 117.46 120.20 1blq n PHE 75 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.29 1blq n PHE 75 Cb 0.00 -0.44 -0.08 0.00 -0.01 0.00 0.00 39.48 38.95 1blq n PHE 75 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1blq n GLU 76 N -1.44 0.53 0.03 -1.08 1.02 -1.26 -3.77 120.64 114.67 1blq n GLU 76 Ca 0.04 0.55 0.13 0.00 -0.02 0.00 0.00 57.16 57.86 1blq n GLU 76 Cb 0.15 -1.72 0.47 0.00 -0.02 0.00 0.00 31.44 30.32 1blq n GLU 76 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1blq n GLU 77 N -4.48 0.09 0.09 3.49 -0.58 -1.20 -2.18 120.64 115.87 1blq n GLU 77 Ca -0.25 0.06 -0.22 0.00 -0.42 0.00 0.00 57.16 56.33 1blq n GLU 77 Cb 0.56 -1.60 -0.15 0.00 -0.57 0.00 0.00 31.44 29.69 1blq n GLU 77 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1blq h PHE 78 N 0.00 0.75 0.04 -0.32 3.04 -1.20 -3.34 116.94 115.91 1blq h PHE 78 Ca 0.00 -0.54 -0.32 0.00 3.98 0.00 0.00 57.97 61.09 1blq h PHE 78 Cb 0.58 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 39.02 1blq h PHE 78 CO 0.00 1.42 -1.83 1.28 -2.02 0.00 0.00 178.31 177.16 1blq n LEU 79 N -3.95 1.47 0.15 0.59 4.32 -1.25 -4.01 117.00 114.33 1blq n LEU 79 Ca -0.15 0.33 0.19 0.00 -0.02 0.00 0.00 56.01 56.36 1blq n LEU 79 Cb 0.94 -0.27 0.78 0.00 -1.62 0.00 0.00 43.42 43.26 1blq n LEU 79 CO 0.54 0.55 1.17 1.62 -1.22 0.00 0.00 177.39 180.05 1blq h VAL 80 N 0.02 0.36 0.00 4.08 3.04 -1.61 0.11 116.25 122.27 1blq h VAL 80 Ca -0.34 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 65.15 1blq h VAL 80 Cb 2.03 0.71 -0.01 0.00 -2.01 0.00 0.00 31.29 32.00 1blq h VAL 80 CO 0.08 0.00 -0.89 0.00 -1.01 0.00 0.00 177.57 175.75 1blq h MET 81 N 0.00 0.22 0.00 4.17 -0.00 -1.70 -3.13 114.93 114.50 1blq h MET 81 Ca 0.14 -0.25 -0.02 0.00 -0.00 0.00 0.00 59.70 59.57 1blq h MET 81 Cb 0.86 0.07 -0.00 0.00 -0.00 0.00 0.00 31.60 32.52 1blq h MET 81 CO -0.00 0.98 -0.15 0.00 -0.00 0.00 0.00 176.91 177.74 1blq h MET 82 N 0.12 0.00 0.00 -0.10 -0.00 -1.00 -3.18 114.93 110.77 1blq h MET 82 Ca -0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.60 1blq h MET 82 Cb 1.52 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.12 1blq h MET 82 CO 0.14 0.10 -0.22 0.28 -0.00 0.00 0.00 176.91 177.21 1blq h VAL 83 N 0.00 1.09 0.00 -0.10 2.07 -1.27 -3.10 116.25 114.94 1blq h VAL 83 Ca -0.00 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1blq h VAL 83 Cb 1.08 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1blq h VAL 83 CO 0.01 0.22 0.00 0.54 0.02 0.00 0.00 177.57 178.36 1blq n ARG 84 N -4.18 0.00 -2.96 1.57 1.74 -1.20 -4.59 116.66 107.04 1blq n ARG 84 Ca -0.02 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.62 1blq n ARG 84 Cb 0.29 -0.28 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 1blq n ARG 84 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1blq s GLN 85 N -0.02 3.85 0.00 5.56 1.11 -1.25 -4.76 119.66 124.15 1blq s GLN 85 Ca 0.00 -2.22 0.28 0.00 0.01 0.00 0.00 55.36 53.44 1blq s GLN 85 Cb 0.00 -4.96 1.10 0.00 -1.01 0.00 0.00 33.01 28.15 1blq s GLN 85 CO 0.00 -1.74 1.79 0.00 0.01 0.00 0.00 175.29 175.35 1blq n MET 86 N 5.91 0.59 0.30 2.91 0.00 -1.17 -4.02 117.12 121.64 1blq n MET 86 Ca 0.30 -0.23 -0.16 0.00 0.00 0.00 0.00 57.70 57.61 1blq n MET 86 Cb 0.46 -1.50 -0.08 0.00 0.00 0.00 0.00 33.22 32.10 1blq n MET 86 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1blq h LYS 87 N 0.55 -0.72 0.00 3.17 1.79 -1.89 -1.07 116.57 118.41 1blq h LYS 87 Ca 0.00 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1blq h LYS 87 Cb 0.40 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1blq h LYS 87 CO 0.00 -0.44 0.00 -0.85 -1.08 0.00 0.00 179.45 177.08 1blq n GLU 88 N -5.37 0.04 0.00 3.15 0.28 -1.26 -4.86 120.64 112.63 1blq n GLU 88 Ca -0.12 0.40 0.00 0.00 -0.16 0.00 0.00 57.16 57.28 1blq n GLU 88 Cb 0.32 -1.59 0.00 0.00 1.43 0.00 0.00 31.44 31.60 1blq n GLU 88 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1blq n ASP 89 N -1.67 0.00 0.00 -1.84 -0.08 -0.41 -5.21 116.55 107.34 1blq n ASP 89 Ca 0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 1blq n ASP 89 Cb 0.11 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.57 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32