#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blq s SER 2 N 0.00 2.98 0.00 0.00 1.04 -1.26 -4.57 113.70 111.89 1blq s SER 2 Ca 0.00 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1blq s SER 2 Cb 0.00 -0.83 0.00 0.00 0.10 0.00 0.00 66.02 65.29 1blq s SER 2 CO 0.00 0.24 0.00 0.23 0.98 0.00 0.00 173.24 174.69 1blq n MET 3 N 2.97 -1.33 0.00 4.02 0.00 -1.26 -4.92 117.12 116.61 1blq n MET 3 Ca -0.17 0.33 0.00 0.00 0.00 0.00 0.00 57.70 57.86 1blq n MET 3 Cb 0.52 -4.34 0.00 0.00 0.00 0.00 0.00 33.22 29.40 1blq n MET 3 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1blq n THR 4 N -2.32 0.00 0.05 2.03 5.66 -1.26 -4.85 114.28 113.60 1blq n THR 4 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 1blq n THR 4 Cb 0.33 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.05 1blq n THR 4 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1blq n ASP 5 N 0.00 0.81 0.00 1.09 -0.08 -1.26 -3.86 116.55 113.25 1blq n ASP 5 Ca 0.00 0.34 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 1blq n ASP 5 Cb 0.00 0.35 0.00 0.00 2.34 0.00 0.00 41.12 43.81 1blq n ASP 5 CO 0.00 0.00 0.00 1.67 0.12 0.00 0.00 177.20 178.99 1blq n GLN 6 N -2.78 0.00 0.28 -0.67 -0.06 -1.26 -1.72 117.38 111.17 1blq n GLN 6 Ca -0.06 0.49 0.14 0.00 -2.00 0.00 0.00 57.00 55.57 1blq n GLN 6 Cb 0.73 -1.42 0.75 0.00 -4.06 0.00 0.00 30.24 26.25 1blq n GLN 6 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 1blq h GLN 7 N 0.00 0.00 -0.11 3.69 7.50 -1.89 -0.99 115.11 123.31 1blq h GLN 7 Ca 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.12 1blq h GLN 7 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.53 1blq h GLN 7 CO 0.00 0.00 -0.05 0.00 -1.50 0.00 0.00 178.83 177.28 1blq h ALA 8 N 1.46 0.15 0.03 3.87 0.00 -1.44 -2.49 119.26 120.85 1blq h ALA 8 Ca 0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1blq h ALA 8 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1blq h ALA 8 CO 0.00 -0.08 -0.01 0.93 0.00 0.00 0.00 179.25 180.08 1blq h GLU 9 N -0.13 -0.04 -0.58 0.00 5.08 -0.48 -2.59 114.58 115.84 1blq h GLU 9 Ca 0.02 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1blq h GLU 9 Cb 0.49 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 1blq h GLU 9 CO 0.01 0.18 -0.50 0.00 -1.00 0.00 0.00 179.01 177.71 1blq h ALA 10 N -0.79 -0.61 -0.97 3.43 0.00 -1.55 0.41 119.26 119.17 1blq h ALA 10 Ca -0.00 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.04 1blq h ALA 10 Cb 0.23 1.19 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 1blq h ALA 10 CO 0.01 -0.90 0.62 -0.09 0.00 0.00 0.00 179.25 178.89 1blq h ARG 11 N -0.19 1.00 -0.89 0.00 2.43 -1.60 -1.30 114.38 113.82 1blq h ARG 11 Ca 0.10 -0.06 0.24 0.00 -0.81 0.00 0.00 59.98 59.45 1blq h ARG 11 Cb 0.45 -0.23 -0.15 0.00 -0.42 0.00 0.00 29.97 29.62 1blq h ARG 11 CO -0.65 0.66 0.23 0.00 -1.51 0.00 0.00 179.97 178.71 1blq h ALA 12 N 1.51 1.30 0.04 2.80 0.00 0.24 0.41 119.26 125.56 1blq h ALA 12 Ca 0.45 0.23 -0.23 0.00 0.00 0.00 0.00 54.91 55.36 1blq h ALA 12 Cb 0.34 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1blq h ALA 12 CO -0.20 -0.49 -1.02 0.74 0.00 0.00 0.00 179.25 178.28 1blq h PHE 13 N 0.19 0.47 -2.22 0.00 0.04 -0.79 -3.37 116.94 111.26 1blq h PHE 13 Ca 0.56 -0.29 -0.74 0.00 2.80 0.00 0.00 57.97 60.30 1blq h PHE 13 Cb 1.16 -0.04 -0.18 0.00 2.20 0.00 0.00 35.95 39.08 1blq h PHE 13 CO -0.27 1.14 1.34 1.28 -0.60 0.00 0.00 178.31 181.20 1blq n LEU 14 N -3.65 5.35 -4.10 1.54 4.77 0.14 -4.98 117.00 116.07 1blq n LEU 14 Ca -0.06 -4.52 -0.33 0.00 -0.03 0.00 0.00 56.01 51.07 1blq n LEU 14 Cb 0.89 -1.60 0.10 0.00 -2.33 0.00 0.00 43.42 40.48 1blq n LEU 14 CO 0.51 0.82 -1.23 -1.20 -1.33 0.00 0.00 177.39 174.96 1blq n SER 15 N 5.28 -2.70 -0.22 -1.43 7.64 -1.23 -4.34 113.62 116.62 1blq n SER 15 Ca 0.36 -0.09 0.15 0.00 1.01 0.00 0.00 58.87 60.31 1blq n SER 15 Cb 0.42 -0.70 0.46 0.00 -1.01 0.00 0.00 64.21 63.38 1blq n SER 15 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1blq h GLU 16 N -1.62 0.49 -0.41 1.43 4.57 -1.95 0.49 114.58 117.57 1blq h GLU 16 Ca -0.42 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 57.64 1blq h GLU 16 Cb 1.27 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.73 1blq h GLU 16 CO 0.27 0.32 -0.12 1.49 -1.18 0.00 0.00 179.01 179.79 1blq h GLU 17 N 0.50 0.74 0.00 1.92 4.81 -1.99 -1.76 114.58 118.80 1blq h GLU 17 Ca 0.43 -0.25 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1blq h GLU 17 Cb 0.91 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 1blq h GLU 17 CO -0.17 0.83 -0.11 1.98 -0.73 0.00 0.00 179.01 180.81 1blq h MET 18 N 0.67 0.00 0.00 1.92 4.05 -1.14 -2.35 114.93 118.07 1blq h MET 18 Ca 0.11 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 1blq h MET 18 Cb 0.59 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1blq h MET 18 CO 0.04 0.11 0.00 -0.89 0.23 0.00 0.00 176.91 176.40 1blq n ILE 19 N -3.30 0.00 -0.09 1.77 5.41 -0.90 -2.64 119.36 119.61 1blq n ILE 19 Ca -0.00 0.45 0.26 0.00 1.00 0.00 0.00 62.75 64.45 1blq n ILE 19 Cb 0.34 -1.38 0.60 0.00 -0.71 0.00 0.00 39.64 38.49 1blq n ILE 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1blq h ALA 20 N -2.00 2.62 0.19 -1.39 0.00 -1.47 0.62 119.26 117.83 1blq h ALA 20 Ca 0.00 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 1blq h ALA 20 Cb 0.00 0.06 0.03 0.00 0.00 0.00 0.00 17.79 17.88 1blq h ALA 20 CO 0.00 -1.28 -1.13 1.49 0.00 0.00 0.00 179.25 178.33 1blq h GLU 21 N 0.00 0.43 0.00 0.00 4.22 -1.56 -3.22 114.58 114.45 1blq h GLU 21 Ca 0.37 -0.72 0.00 0.00 0.08 0.00 0.00 59.36 59.10 1blq h GLU 21 Cb 2.12 0.26 0.00 0.00 0.50 0.00 0.00 28.75 31.63 1blq h GLU 21 CO -0.00 1.34 0.00 0.35 -2.18 0.00 0.00 179.01 178.52 1blq h PHE 22 N -0.10 0.00 0.00 0.92 3.57 0.43 -2.40 116.94 119.36 1blq h PHE 22 Ca -0.20 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.28 1blq h PHE 22 Cb 1.89 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.62 1blq h PHE 22 CO 0.16 0.00 -0.12 -0.22 -2.23 0.00 0.00 178.31 175.90 1blq h LYS 23 N 0.00 0.00 0.93 1.11 3.64 -1.19 -2.46 116.57 118.60 1blq h LYS 23 Ca 0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1blq h LYS 23 Cb 0.41 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1blq h LYS 23 CO 0.00 0.12 -0.45 0.00 -2.27 0.00 0.00 179.45 176.85 1blq h ALA 24 N 1.88 -1.25 0.00 5.00 0.00 -1.57 -1.26 119.26 122.06 1blq h ALA 24 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1blq h ALA 24 Cb 0.30 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1blq h ALA 24 CO 0.02 -1.19 -0.01 0.00 0.00 0.00 0.00 179.25 178.07 1blq h ALA 25 N -1.23 1.47 -0.29 0.00 0.00 -1.70 -0.96 119.26 116.55 1blq h ALA 25 Ca -0.13 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.65 1blq h ALA 25 Cb 0.96 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1blq h ALA 25 CO 0.21 0.01 -0.31 0.35 0.00 0.00 0.00 179.25 179.51 1blq h PHE 26 N 0.00 0.72 -1.05 0.00 3.04 -0.90 -2.89 116.94 115.86 1blq h PHE 26 Ca -0.00 -0.18 0.34 0.00 3.98 0.00 0.00 57.97 62.10 1blq h PHE 26 Cb 0.03 -0.17 -0.14 0.00 2.56 0.00 0.00 35.95 38.23 1blq h PHE 26 CO 0.00 0.87 0.62 0.22 -2.02 0.00 0.00 178.31 178.00 1blq h ASP 27 N 0.53 0.46 -0.16 0.41 1.82 -0.02 0.38 116.42 119.85 1blq h ASP 27 Ca 0.06 0.18 -0.05 0.00 -0.39 0.00 0.00 57.03 56.83 1blq h ASP 27 Cb 0.80 0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.94 1blq h ASP 27 CO 0.07 -0.13 -0.08 -0.03 -1.61 0.00 0.00 179.24 177.45 1blq h MET 28 N 0.28 0.34 -0.12 0.28 4.05 -1.64 -3.26 114.93 114.86 1blq h MET 28 Ca 0.74 -0.15 0.03 0.00 -0.28 0.00 0.00 59.70 60.04 1blq h MET 28 Cb 1.82 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 32.55 1blq h MET 28 CO -0.56 0.65 -0.46 0.74 0.23 0.00 0.00 176.91 177.52 1blq h PHE 29 N 0.02 -1.37 -1.26 1.39 0.04 -0.31 -3.41 116.94 112.05 1blq h PHE 29 Ca 0.04 0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.82 1blq h PHE 29 Cb 0.55 0.61 0.02 0.00 2.20 0.00 0.00 35.95 39.34 1blq h PHE 29 CO 0.06 -0.46 -0.02 -0.40 -0.60 0.00 0.00 178.31 176.90 1blq n ASP 30 N -4.97 -2.12 0.00 2.17 5.68 -0.95 -4.87 116.55 111.49 1blq n ASP 30 Ca -0.05 -0.14 0.00 0.00 -0.50 0.00 0.00 54.79 54.10 1blq n ASP 30 Cb 0.32 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 1blq n ASP 30 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1blq n ALA 31 N -3.29 0.00 0.07 2.12 0.00 -1.26 -4.89 120.51 113.26 1blq n ALA 31 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1blq n ALA 31 Cb 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.41 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 -1.92 0.31 0.02 0.00 9.92 -1.26 -4.19 116.55 119.43 1blq n ASP 32 Ca 0.00 0.08 -0.01 0.00 -0.53 0.00 0.00 54.79 54.33 1blq n ASP 32 Cb 0.00 1.44 -0.09 0.00 -0.64 0.00 0.00 41.12 41.83 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 1.24 -1.17 3.15 0.44 0.00 -1.26 -4.95 105.19 102.64 1blq n GLY 33 Ca -0.02 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 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 1.42 -0.50 0.00 -0.02 0.00 -1.26 -4.57 105.19 100.25 1blq n GLY 34 Ca -0.11 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.32 0.00 3.60 -0.02 0.00 -1.26 -5.02 105.19 101.18 1blq n GLY 35 Ca -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.12 -0.06 1.61 1.47 -1.26 -4.60 116.67 113.70 1blq s ASP 36 Ca 0.00 -0.01 -0.07 0.00 1.18 0.00 0.00 52.55 53.65 1blq s ASP 36 Cb 0.00 0.13 0.02 0.00 -0.34 0.00 0.00 42.92 42.73 1blq s ASP 36 CO 0.00 -0.22 0.19 -0.63 0.68 0.00 0.00 175.17 175.19 1blq s ILE 37 N -2.39 0.01 0.31 2.11 1.01 -0.77 -4.29 121.20 117.20 1blq s ILE 37 Ca 0.10 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.66 1blq s ILE 37 Cb -0.01 -0.32 0.03 0.00 0.01 0.00 0.00 42.46 42.18 1blq s ILE 37 CO -0.04 -0.06 0.26 -1.20 0.00 0.00 0.00 174.94 173.90 1blq n SER 38 N 2.69 1.87 0.17 3.58 7.64 -1.26 -1.99 113.62 126.33 1blq n SER 38 Ca -0.14 -2.04 0.03 0.00 1.01 0.00 0.00 58.87 57.72 1blq n SER 38 Cb 0.58 -0.06 0.30 0.00 -1.01 0.00 0.00 64.21 64.03 1blq n SER 38 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1blq h THR 39 N 0.51 1.17 0.00 0.44 1.35 -1.83 -1.84 112.91 112.71 1blq h THR 39 Ca -0.19 -1.63 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 1blq h THR 39 Cb 0.72 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 1blq h THR 39 CO 0.30 0.44 -0.63 1.17 -0.25 0.00 0.00 175.52 176.55 1blq n LYS 40 N -3.78 0.14 -0.10 4.72 4.81 -1.26 -2.61 118.16 120.08 1blq n LYS 40 Ca -0.01 0.03 -0.19 0.00 -0.87 0.00 0.00 58.31 57.27 1blq n LYS 40 Cb 0.51 -1.58 -0.09 0.00 0.02 0.00 0.00 35.03 33.89 1blq n LYS 40 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1blq n GLU 41 N -1.77 0.54 0.19 1.64 0.00 -1.03 -3.49 120.64 116.72 1blq n GLU 41 Ca 0.04 0.56 0.07 0.00 0.00 0.00 0.00 57.16 57.83 1blq n GLU 41 Cb 0.38 -1.73 0.24 0.00 0.00 0.00 0.00 31.44 30.34 1blq n GLU 41 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.13 178.50 1blq h LEU 42 N -1.00 0.00 -0.30 4.31 8.10 -1.52 -3.18 115.31 121.72 1blq h LEU 42 Ca -0.29 0.00 -0.19 0.00 0.11 0.00 0.00 57.88 57.51 1blq h LEU 42 Cb 1.15 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.38 1blq h LEU 42 CO -0.18 0.31 -0.60 1.23 -4.11 0.00 0.00 178.44 175.10 1blq h GLY 43 N 2.88 0.89 1.11 0.17 0.00 -1.68 -2.68 103.07 103.77 1blq h GLY 43 Ca -0.00 -1.08 0.00 0.00 0.00 0.00 0.00 47.33 46.24 1blq h GLY 43 CO 0.04 0.97 0.00 -1.30 0.00 0.00 0.00 176.54 176.25 1blq n THR 44 N -3.98 0.04 0.00 4.70 -2.24 -1.20 -2.12 114.28 109.48 1blq n THR 44 Ca -0.05 0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.56 1blq n THR 44 Cb 0.65 -0.60 -0.14 0.00 -2.10 0.00 0.00 70.33 68.14 1blq n THR 44 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1blq n VAL 45 N -1.06 1.75 0.46 2.28 0.31 -1.01 -4.09 118.33 116.98 1blq n VAL 45 Ca 0.18 -0.69 0.12 0.00 -0.01 0.00 0.00 64.34 63.94 1blq n VAL 45 Cb 0.11 -1.59 0.10 0.00 -0.91 0.00 0.00 33.84 31.55 1blq n VAL 45 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1blq n MET 46 N -3.39 0.36 0.17 5.55 2.81 -1.17 -3.87 117.12 117.59 1blq n MET 46 Ca -0.28 0.07 0.02 0.00 -1.81 0.00 0.00 57.70 55.70 1blq n MET 46 Cb 1.05 -1.69 0.37 0.00 -0.71 0.00 0.00 33.22 32.24 1blq n MET 46 CO 0.00 0.00 0.00 0.07 1.51 0.00 0.00 175.97 177.55 1blq h ARG 47 N 0.00 0.07 0.00 0.03 0.11 -1.57 -3.10 114.38 109.91 1blq h ARG 47 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1blq h ARG 47 Cb 0.80 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.87 1blq h ARG 47 CO 0.00 0.37 0.00 -1.33 0.10 0.00 0.00 179.97 179.11 1blq n MET 48 N -4.16 0.00 -1.20 0.08 2.81 -1.25 -2.37 117.12 111.02 1blq n MET 48 Ca -0.02 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.66 1blq n MET 48 Cb 0.36 -0.48 -0.04 0.00 -0.71 0.00 0.00 33.22 32.35 1blq n MET 48 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1blq n LEU 49 N 0.00 6.27 0.00 4.03 -0.00 -1.26 -4.69 117.00 121.36 1blq n LEU 49 Ca 0.00 -3.65 0.00 0.00 -0.00 0.00 0.00 56.01 52.36 1blq n LEU 49 Cb 0.00 -1.20 0.00 0.00 -0.00 0.00 0.00 43.42 42.22 1blq n LEU 49 CO 0.00 1.54 0.00 0.61 -0.00 0.00 0.00 177.39 179.54 1blq n GLY 50 N 0.94 2.84 3.12 1.47 0.00 -1.00 -5.13 105.19 107.43 1blq n GLY 50 Ca 0.40 -0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 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 2.00 0.39 0.17 1.61 -1.52 -1.24 -5.00 119.66 116.07 1blq s GLN 51 Ca 0.00 -0.01 -0.32 0.00 -1.95 0.00 0.00 55.36 53.08 1blq s GLN 51 Cb 0.00 0.17 -0.12 0.00 -0.22 0.00 0.00 33.01 32.85 1blq s GLN 51 CO 0.00 -0.08 1.76 0.09 -0.25 0.00 0.00 175.29 176.81 1blq n ASN 52 N 2.22 3.95 -4.89 5.90 4.13 -1.26 -4.37 115.26 120.93 1blq n ASN 52 Ca -0.17 1.03 -0.30 0.00 1.68 0.00 0.00 54.58 56.82 1blq n ASN 52 Cb 0.57 -1.55 -0.04 0.00 -1.54 0.00 0.00 39.78 37.22 1blq n ASN 52 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1blq s PRO 53 N 1.76 3.73 0.50 3.52 0.04 -1.26 -5.07 135.00 138.21 1blq s PRO 53 Ca 0.78 0.24 -0.04 0.00 0.04 0.00 0.00 61.00 62.02 1blq s PRO 53 Cb -0.51 -2.55 -0.02 0.00 0.04 0.00 0.00 34.50 31.46 1blq s PRO 53 CO 0.35 0.14 0.78 0.99 0.04 0.00 0.00 177.00 179.30 1blq s THR 54 N -2.14 4.39 0.37 1.26 2.01 -1.26 -4.92 115.64 115.35 1blq s THR 54 Ca 0.47 -0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.49 1blq s THR 54 Cb -0.11 -3.67 0.21 0.00 0.01 0.00 0.00 72.50 68.94 1blq s THR 54 CO 0.28 -0.62 1.97 0.50 -0.69 0.00 0.00 174.62 176.06 1blq h LYS 55 N 0.18 0.55 0.00 4.92 3.64 -1.98 0.26 116.57 124.14 1blq h LYS 55 Ca -0.47 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1blq h LYS 55 Cb 1.23 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1blq h LYS 55 CO 0.61 0.46 -0.22 1.49 -2.27 0.00 0.00 179.45 179.52 1blq h GLU 56 N 0.54 0.00 -0.75 1.90 4.81 -2.00 -3.19 114.58 115.90 1blq h GLU 56 Ca 0.13 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1blq h GLU 56 Cb 0.13 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1blq h GLU 56 CO -0.01 0.00 0.24 1.49 -0.73 0.00 0.00 179.01 179.99 1blq h GLU 57 N 0.00 1.16 0.00 1.92 4.57 -1.30 -2.32 114.58 118.61 1blq h GLU 57 Ca 0.00 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 57.85 1blq h GLU 57 Cb 0.90 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.31 1blq h GLU 57 CO 0.00 0.98 -0.38 -0.07 -1.18 0.00 0.00 179.01 178.36 1blq h LEU 58 N 1.11 0.00 -2.31 1.64 -0.00 -1.55 -3.14 115.31 111.06 1blq h LEU 58 Ca 0.24 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.11 1blq h LEU 58 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.96 1blq h LEU 58 CO -0.01 0.38 -0.04 -0.78 -0.00 0.00 0.00 178.44 177.99 1blq h ASP 59 N 0.00 0.00 0.17 -0.43 1.82 -1.41 -1.28 116.42 115.29 1blq h ASP 59 Ca -0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.63 1blq h ASP 59 Cb 1.26 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.27 1blq h ASP 59 CO 0.05 0.04 -0.08 0.00 -1.61 0.00 0.00 179.24 177.64 1blq h ALA 60 N 1.96 -0.22 0.00 -0.78 0.00 -1.48 -1.99 119.26 116.74 1blq h ALA 60 Ca -0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1blq h ALA 60 Cb 0.13 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1blq h ALA 60 CO 0.01 -0.47 -0.40 0.82 0.00 0.00 0.00 179.25 179.20 1blq h ILE 61 N -0.54 1.27 -0.71 0.00 5.03 -1.64 -2.76 117.51 118.16 1blq h ILE 61 Ca -0.02 -1.40 -0.02 0.00 -0.12 0.00 0.00 64.86 63.30 1blq h ILE 61 Cb 0.41 1.76 -0.03 0.00 -3.03 0.00 0.00 36.82 35.93 1blq h ILE 61 CO 0.04 0.40 0.37 0.40 -0.68 0.00 0.00 178.15 178.68 1blq h ILE 62 N 0.00 1.22 0.00 -0.67 1.08 -1.05 -0.25 117.51 117.84 1blq h ILE 62 Ca -0.00 -0.59 0.00 0.00 -0.39 0.00 0.00 64.86 63.88 1blq h ILE 62 Cb 0.73 0.31 0.00 0.00 -3.07 0.00 0.00 36.82 34.78 1blq h ILE 62 CO 0.05 0.25 0.00 -0.62 -0.69 0.00 0.00 178.15 177.15 1blq n GLU 63 N -4.46 0.13 0.00 2.37 -0.58 -0.76 0.11 120.64 117.44 1blq n GLU 63 Ca 0.06 0.31 -0.17 0.00 -0.42 0.00 0.00 57.16 56.94 1blq n GLU 63 Cb 0.10 -1.72 -0.13 0.00 -0.57 0.00 0.00 31.44 29.13 1blq n GLU 63 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1blq h GLU 64 N 0.00 0.28 0.00 3.49 4.57 -0.89 -3.41 114.58 118.61 1blq h GLU 64 Ca 0.00 -0.36 -0.14 0.00 -1.18 0.00 0.00 59.36 57.68 1blq h GLU 64 Cb 0.39 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 1blq h GLU 64 CO 0.00 1.10 -1.50 1.33 -1.18 0.00 0.00 179.01 178.76 1blq n VAL 65 N -4.29 0.49 -2.11 0.32 0.24 -1.03 -4.78 118.33 107.17 1blq n VAL 65 Ca -0.11 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.61 1blq n VAL 65 Cb 0.66 -1.21 0.00 0.00 -1.47 0.00 0.00 33.84 31.82 1blq n VAL 65 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1blq n ASP 66 N -3.08 4.36 0.23 -1.34 8.00 0.30 -4.66 116.55 120.36 1blq n ASP 66 Ca -0.16 -2.88 0.12 0.00 0.71 0.00 0.00 54.79 52.58 1blq n ASP 66 Cb 0.64 -1.69 0.39 0.00 -0.02 0.00 0.00 41.12 40.45 1blq n ASP 66 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1blq h GLU 67 N 6.63 0.00 0.00 -1.24 4.57 -1.79 -2.96 114.58 119.79 1blq h GLU 67 Ca 0.51 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.69 1blq h GLU 67 Cb 0.73 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1blq h GLU 67 CO 1.70 0.10 -0.00 -0.44 -1.18 0.00 0.00 179.01 179.19 1blq h ASP 68 N 0.00 0.00 0.00 1.04 5.19 -1.90 -3.45 116.42 117.30 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 0.82 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.33 1blq h ASP 68 CO 0.01 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.74 1blq n GLY 69 N -1.13 0.83 0.10 2.75 0.00 -1.12 -4.98 105.19 101.65 1blq n GLY 69 Ca -0.03 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 1blq n GLY 69 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1blq h SER 70 N 0.00 0.16 0.00 1.61 0.02 -1.88 -3.49 113.55 109.98 1blq h SER 70 Ca 0.00 -0.82 0.00 0.00 -0.84 0.00 0.00 61.79 60.13 1blq h SER 70 Cb 0.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1blq h SER 70 CO 0.00 1.35 0.00 0.61 -1.14 0.00 0.00 176.83 177.65 1blq n GLY 71 N 1.60 1.69 3.49 -3.77 0.00 -1.26 -5.00 105.19 101.95 1blq n GLY 71 Ca -0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.65 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 0.01 0.18 2.61 -1.32 -1.25 -2.18 115.64 111.69 1blq s THR 72 Ca 0.00 -0.06 0.08 0.00 -1.21 0.00 0.00 61.69 60.50 1blq s THR 72 Cb 0.00 -0.91 -0.04 0.00 -1.51 0.00 0.00 72.50 70.03 1blq s THR 72 CO 0.00 -0.03 -0.16 -0.63 -2.21 0.00 0.00 174.62 171.58 1blq s ILE 73 N -0.68 1.78 0.00 5.08 1.09 -0.84 -4.81 121.20 122.81 1blq s ILE 73 Ca -0.08 -2.06 0.00 0.00 -1.10 0.00 0.00 60.65 57.42 1blq s ILE 73 Cb -0.02 -1.93 0.00 0.00 -1.06 0.00 0.00 42.46 39.45 1blq s ILE 73 CO 0.06 -0.45 0.00 0.47 -0.10 0.00 0.00 174.94 174.92 1blq n ASP 74 N -0.04 0.00 -0.33 3.58 9.92 -1.26 -1.85 116.55 126.57 1blq n ASP 74 Ca -0.11 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.30 1blq n ASP 74 Cb 0.59 0.00 0.58 0.00 -0.64 0.00 0.00 41.12 41.65 1blq n ASP 74 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 1blq n PHE 75 N 0.00 0.00 -0.07 1.24 -1.74 -1.26 -3.22 117.46 112.40 1blq n PHE 75 Ca 0.00 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.82 1blq n PHE 75 Cb 0.00 -0.04 -0.03 0.00 1.52 0.00 0.00 39.48 40.93 1blq n PHE 75 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 1blq h GLU 76 N 1.63 0.00 -0.33 3.97 5.08 -1.97 -3.37 114.58 119.58 1blq h GLU 76 Ca 0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1blq h GLU 76 Cb 0.41 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1blq h GLU 76 CO 0.00 0.20 -0.11 0.93 -1.00 0.00 0.00 179.01 179.03 1blq h GLU 77 N -1.00 0.57 -0.72 2.33 5.08 -1.96 -2.26 114.58 116.62 1blq h GLU 77 Ca -0.06 -0.17 0.21 0.00 -1.00 0.00 0.00 59.36 58.35 1blq h GLU 77 Cb 0.57 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1blq h GLU 77 CO -0.03 0.67 0.71 0.35 -1.00 0.00 0.00 179.01 179.71 1blq h PHE 78 N 0.53 0.00 0.03 4.33 3.57 -1.73 0.45 116.94 124.11 1blq h PHE 78 Ca 0.10 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1blq h PHE 78 Cb 0.50 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1blq h PHE 78 CO 0.02 0.00 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.02 1blq h LEU 79 N 0.00 -0.03 -1.90 0.59 4.07 -1.56 -2.68 115.31 113.80 1blq h LEU 79 Ca 0.34 -0.64 0.00 0.00 0.08 0.00 0.00 57.88 57.67 1blq h LEU 79 Cb 1.76 0.01 0.00 0.00 1.08 0.00 0.00 40.66 43.51 1blq h LEU 79 CO -0.00 0.64 0.24 -0.37 -1.08 0.00 0.00 178.44 177.87 1blq h VAL 80 N -0.73 0.00 0.00 1.22 -1.51 -1.02 0.18 116.25 114.40 1blq h VAL 80 Ca -0.00 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 65.35 1blq h VAL 80 Cb 0.66 0.63 -0.02 0.00 -2.13 0.00 0.00 31.29 30.44 1blq h VAL 80 CO 0.01 0.00 -0.64 -0.03 -1.23 0.00 0.00 177.57 175.68 1blq h MET 81 N 0.00 0.00 0.00 5.19 1.85 -1.35 -3.33 114.93 117.29 1blq h MET 81 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1blq h MET 81 Cb 0.48 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.51 1blq h MET 81 CO 0.00 0.98 0.00 0.00 -0.40 0.00 0.00 176.91 177.49 1blq n MET 82 N -4.52 0.97 0.11 0.39 0.00 -0.62 -3.25 117.12 110.20 1blq n MET 82 Ca -0.21 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.47 1blq n MET 82 Cb 0.58 -1.50 0.04 0.00 0.00 0.00 0.00 33.22 32.34 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 0.00 1.38 0.00 3.17 2.07 -0.79 -3.40 116.25 118.68 1blq h VAL 83 Ca 0.00 -2.63 0.00 0.00 0.82 0.00 0.00 66.70 64.89 1blq h VAL 83 Cb 0.00 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1blq h VAL 83 CO 0.00 0.71 0.00 0.54 0.02 0.00 0.00 177.57 178.84 1blq n ARG 84 N -3.46 0.00 -2.42 1.57 1.74 -1.20 -4.41 116.66 108.49 1blq n ARG 84 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 1blq n ARG 84 Cb 0.77 -0.30 -0.02 0.00 -1.02 0.00 0.00 32.46 31.88 1blq n ARG 84 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1blq s GLN 85 N 0.00 3.81 0.02 5.56 -2.07 -1.26 -4.98 119.66 120.74 1blq s GLN 85 Ca 0.00 1.11 -0.30 0.00 -1.82 0.00 0.00 55.36 54.35 1blq s GLN 85 Cb 0.00 -3.92 -0.04 0.00 -1.09 0.00 0.00 33.01 27.96 1blq s GLN 85 CO 0.00 -1.26 1.08 -1.64 -1.32 0.00 0.00 175.29 172.15 1blq s MET 86 N 4.39 4.50 0.52 9.60 -1.94 -1.26 -4.90 119.30 130.20 1blq s MET 86 Ca 0.57 1.57 0.28 0.00 -1.71 0.00 0.00 55.69 56.41 1blq s MET 86 Cb -0.15 -3.42 1.39 0.00 2.01 0.00 0.00 34.83 34.66 1blq s MET 86 CO 0.26 -0.15 2.03 0.87 -0.01 0.00 0.00 175.02 178.02 1blq h LYS 87 N 6.82 0.00 -1.39 2.03 1.57 -1.94 -2.69 116.57 120.98 1blq h LYS 87 Ca -0.41 0.00 0.41 0.00 -1.87 0.00 0.00 60.65 58.78 1blq h LYS 87 Cb 1.21 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.44 1blq h LYS 87 CO 0.78 0.12 0.97 1.49 -0.57 0.00 0.00 179.45 182.24 1blq h GLU 88 N 0.00 0.07 0.00 3.15 4.81 -2.00 -3.41 114.58 117.21 1blq h GLU 88 Ca -0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1blq h GLU 88 Cb 0.42 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1blq h GLU 88 CO 0.02 0.05 0.00 -3.47 -0.73 0.00 0.00 179.01 174.88 1blq n ASP 89 N -4.30 0.00 0.00 1.04 -0.08 -1.04 -5.32 116.55 106.85 1blq n ASP 89 Ca 0.33 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.61 1blq n ASP 89 Cb 1.43 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.89 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32