#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 -2.34 0.00 0.00 2.88 -1.26 -4.99 113.62 107.91 1blq n SER 2 Ca 0.00 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.11 1blq n SER 2 Cb 0.00 2.36 0.00 0.00 -0.75 0.00 0.00 64.21 65.82 1blq n SER 2 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1blq n MET 3 N -3.02 0.00 -0.01 -1.46 1.56 -1.26 -4.86 117.12 108.07 1blq n MET 3 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 57.70 57.24 1blq n MET 3 Cb 0.00 0.00 -0.14 0.00 2.15 0.00 0.00 33.22 35.23 1blq n MET 3 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1blq h THR 4 N 0.00 1.35 -0.08 1.12 1.03 -1.98 -2.80 112.91 111.55 1blq h THR 4 Ca 0.00 -2.40 -0.13 0.00 -0.01 0.00 0.00 66.41 63.86 1blq h THR 4 Cb 0.00 2.97 -0.01 0.00 -1.07 0.00 0.00 68.15 70.04 1blq h THR 4 CO 0.00 0.63 -0.54 0.44 -0.01 0.00 0.00 175.52 176.04 1blq h ASP 5 N -0.59 0.25 -0.37 0.00 5.19 -1.96 -1.25 116.42 117.70 1blq h ASP 5 Ca -0.19 -0.13 -0.15 0.00 -0.62 0.00 0.00 57.03 55.94 1blq h ASP 5 Cb 1.48 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 40.91 1blq h ASP 5 CO 0.04 0.75 -0.35 -0.61 -3.12 0.00 0.00 179.24 175.94 1blq h GLN 6 N 0.18 0.89 -0.07 3.56 4.15 -1.89 -2.78 115.11 119.14 1blq h GLN 6 Ca 0.00 -0.46 -0.15 0.00 0.77 0.00 0.00 58.65 58.81 1blq h GLN 6 Cb 1.01 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.71 1blq h GLN 6 CO 0.08 1.11 -0.62 -0.56 -1.93 0.00 0.00 178.83 176.92 1blq h GLN 7 N 0.70 0.25 -0.73 1.69 3.07 -1.38 -3.03 115.11 115.68 1blq h GLN 7 Ca 0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 58.65 58.60 1blq h GLN 7 Cb 0.94 0.03 -0.03 0.00 0.08 0.00 0.00 27.48 28.50 1blq h GLN 7 CO 0.09 0.79 0.35 0.00 0.09 0.00 0.00 178.83 180.15 1blq h ALA 8 N 1.17 1.25 0.62 0.06 0.00 -1.10 0.06 119.26 121.32 1blq h ALA 8 Ca -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1blq h ALA 8 Cb 1.13 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1blq h ALA 8 CO 0.10 0.58 -0.30 0.93 0.00 0.00 0.00 179.25 180.56 1blq h GLU 9 N 1.03 -0.80 0.00 0.00 4.39 -1.38 -1.95 114.58 115.87 1blq h GLU 9 Ca 0.25 0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.01 1blq h GLU 9 Cb 0.10 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1blq h GLU 9 CO -0.03 -0.53 0.07 0.00 -1.16 0.00 0.00 179.01 177.36 1blq h ALA 10 N -1.47 1.06 0.05 3.43 0.00 -1.49 0.11 119.26 120.94 1blq h ALA 10 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.59 1blq h ALA 10 Cb 0.63 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1blq h ALA 10 CO 0.14 -0.06 -1.04 -0.09 0.00 0.00 0.00 179.25 178.20 1blq h ARG 11 N 0.00 0.24 -0.53 0.00 2.43 -0.49 -2.46 114.38 113.57 1blq h ARG 11 Ca 0.00 -0.32 0.08 0.00 -0.81 0.00 0.00 59.98 58.92 1blq h ARG 11 Cb 0.15 0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 29.70 1blq h ARG 11 CO 0.00 1.09 -0.46 0.00 -1.51 0.00 0.00 179.97 179.08 1blq h ALA 12 N 0.79 -0.44 0.02 2.80 0.00 -0.21 -1.16 119.26 121.05 1blq h ALA 12 Ca -0.08 0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 1blq h ALA 12 Cb 1.73 0.99 -0.02 0.00 0.00 0.00 0.00 17.79 20.48 1blq h ALA 12 CO 0.17 -0.88 -1.01 0.74 0.00 0.00 0.00 179.25 178.26 1blq h PHE 13 N -0.27 0.08 -1.33 0.00 0.04 -1.71 -3.38 116.94 110.38 1blq h PHE 13 Ca 0.15 -0.06 -0.70 0.00 2.80 0.00 0.00 57.97 60.16 1blq h PHE 13 Cb 0.57 -0.00 -0.11 0.00 2.20 0.00 0.00 35.95 38.60 1blq h PHE 13 CO -0.71 1.02 1.90 -0.51 -0.60 0.00 0.00 178.31 179.41 1blq s LEU 14 N -6.85 4.26 1.03 1.54 2.01 -0.44 -4.99 118.68 115.25 1blq s LEU 14 Ca 0.00 -2.63 -0.21 0.00 0.01 0.00 0.00 54.13 51.30 1blq s LEU 14 Cb 0.10 -2.52 -0.03 0.00 0.01 0.00 0.00 46.19 43.76 1blq s LEU 14 CO 0.83 -1.03 -0.66 -0.24 1.01 0.00 0.00 176.35 176.26 1blq n SER 15 N 7.43 -2.68 0.21 2.29 2.88 -1.24 -4.69 113.62 117.82 1blq n SER 15 Ca 0.44 -0.09 0.07 0.00 -1.33 0.00 0.00 58.87 57.95 1blq n SER 15 Cb 0.45 -0.72 0.46 0.00 -0.75 0.00 0.00 64.21 63.66 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 -1.67 0.00 0.00 -1.46 3.07 -1.94 -2.46 114.58 110.12 1blq h GLU 16 Ca -0.42 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.43 1blq h GLU 16 Cb 1.26 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.17 1blq h GLU 16 CO 0.27 0.29 -0.03 0.93 -1.40 0.00 0.00 179.01 179.07 1blq h GLU 17 N 0.00 0.00 0.00 2.33 5.08 -1.99 -0.65 114.58 119.35 1blq h GLU 17 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1blq h GLU 17 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1blq h GLU 17 CO 0.04 0.03 0.00 -1.33 -1.00 0.00 0.00 179.01 176.75 1blq n MET 18 N -4.35 0.00 -0.29 2.33 2.81 -0.93 -3.07 117.12 113.62 1blq n MET 18 Ca -0.03 0.12 0.34 0.00 -1.81 0.00 0.00 57.70 56.32 1blq n MET 18 Cb 0.11 -0.85 0.67 0.00 -0.71 0.00 0.00 33.22 32.45 1blq n MET 18 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1blq h ILE 19 N 0.00 0.18 0.51 2.02 5.03 -1.65 0.46 117.51 124.06 1blq h ILE 19 Ca 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.73 1blq h ILE 19 Cb 0.00 0.24 -0.02 0.00 -3.03 0.00 0.00 36.82 34.01 1blq h ILE 19 CO 0.00 0.00 -0.47 0.00 -0.68 0.00 0.00 178.15 177.00 1blq h ALA 20 N 1.06 -1.06 -0.00 1.87 0.00 -1.12 -1.70 119.26 118.31 1blq h ALA 20 Ca 0.55 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1blq h ALA 20 Cb 2.57 0.66 0.00 0.00 0.00 0.00 0.00 17.79 21.02 1blq h ALA 20 CO -0.01 -1.13 -0.01 -1.91 0.00 0.00 0.00 179.25 176.19 1blq n GLU 21 N -5.55 0.18 -0.02 0.00 0.00 0.02 -3.53 120.64 111.74 1blq n GLU 21 Ca -0.12 -0.00 -0.16 0.00 0.00 0.00 0.00 57.16 56.87 1blq n GLU 21 Cb 0.45 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.30 1blq n GLU 21 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1blq h PHE 22 N 0.01 0.74 0.00 4.31 3.57 -0.35 -2.92 116.94 122.30 1blq h PHE 22 Ca 0.00 -0.34 0.00 0.00 3.53 0.00 0.00 57.97 61.16 1blq h PHE 22 Cb 0.41 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1blq h PHE 22 CO 0.00 1.12 0.00 0.36 -2.23 0.00 0.00 178.31 177.56 1blq n LYS 23 N -4.19 0.11 0.00 1.11 2.85 -0.74 -1.93 118.16 115.36 1blq n LYS 23 Ca -0.08 0.51 0.00 0.00 -1.05 0.00 0.00 58.31 57.68 1blq n LYS 23 Cb 0.63 -1.79 0.00 0.00 -0.65 0.00 0.00 35.03 33.22 1blq n LYS 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1blq n ALA 24 N -1.69 -0.29 0.29 0.58 0.00 -1.10 -2.33 120.51 115.97 1blq n ALA 24 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1blq n ALA 24 Cb 0.10 0.00 0.70 0.00 0.00 0.00 0.00 19.45 20.24 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 -2.00 1.00 0.23 0.00 0.00 -1.69 -3.02 119.26 113.78 1blq h ALA 25 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1blq h ALA 25 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1blq h ALA 25 CO 0.00 0.00 -0.11 0.35 0.00 0.00 0.00 179.25 179.49 1blq h PHE 26 N 0.00 -0.29 -0.12 0.00 3.57 -1.41 -2.33 116.94 116.36 1blq h PHE 26 Ca 0.00 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1blq h PHE 26 Cb 0.47 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.30 1blq h PHE 26 CO 0.00 -0.06 0.00 -0.40 -2.23 0.00 0.00 178.31 175.62 1blq n ASP 27 N -5.15 0.71 0.31 0.41 5.68 -0.98 -4.17 116.55 113.35 1blq n ASP 27 Ca -0.09 -2.01 -0.12 0.00 -0.50 0.00 0.00 54.79 52.07 1blq n ASP 27 Cb 0.20 -0.11 -0.06 0.00 -1.14 0.00 0.00 41.12 40.02 1blq n ASP 27 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 1blq h MET 28 N 0.71 -0.76 -0.61 0.11 4.05 -1.29 -3.20 114.93 113.94 1blq h MET 28 Ca 0.00 0.05 -0.06 0.00 -0.28 0.00 0.00 59.70 59.41 1blq h MET 28 Cb 0.19 0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.14 1blq h MET 28 CO 0.00 -0.51 0.15 0.74 0.23 0.00 0.00 176.91 177.52 1blq h PHE 29 N -0.93 1.03 -3.60 1.39 -1.00 -1.73 -3.38 116.94 108.72 1blq h PHE 29 Ca -0.08 -0.12 -0.70 0.00 2.81 0.00 0.00 57.97 59.87 1blq h PHE 29 Cb 0.61 -0.29 -0.27 0.00 3.61 0.00 0.00 35.95 39.60 1blq h PHE 29 CO 0.05 0.86 -0.55 0.34 -1.61 0.00 0.00 178.31 177.41 1blq s ASP 30 N -6.30 5.50 0.01 2.17 2.15 -1.22 -4.89 116.67 114.08 1blq s ASP 30 Ca -0.12 -1.20 0.00 0.00 0.43 0.00 0.00 52.55 51.65 1blq s ASP 30 Cb 0.13 -1.94 0.00 0.00 -0.30 0.00 0.00 42.92 40.81 1blq s ASP 30 CO 0.82 -0.40 0.00 0.00 -0.17 0.00 0.00 175.17 175.43 1blq n ALA 31 N 4.88 3.00 0.20 3.66 0.00 -1.21 -4.38 120.51 126.66 1blq n ALA 31 Ca -0.11 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.41 1blq n ALA 31 Cb 0.45 0.44 0.34 0.00 0.00 0.00 0.00 19.45 20.68 1blq n ALA 31 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1blq h ASP 32 N 0.00 0.00 0.00 0.00 3.58 -1.90 -3.36 116.42 114.74 1blq h ASP 32 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1blq h ASP 32 Cb 0.86 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.91 1blq h ASP 32 CO 0.00 0.28 0.00 0.61 -2.88 0.00 0.00 179.24 177.25 1blq n GLY 33 N 0.45 -1.63 0.00 -0.78 0.00 -1.26 -4.99 105.19 96.99 1blq n GLY 33 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 0.38 0.02 0.00 -0.02 0.00 -1.26 -5.08 105.19 99.23 1blq n GLY 34 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.31 0.88 3.64 -0.02 0.00 -1.26 -5.00 105.19 103.13 1blq n GLY 35 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.20 -0.05 1.61 1.47 -1.26 -4.35 116.67 113.89 1blq s ASP 36 Ca 0.00 0.39 0.02 0.00 1.18 0.00 0.00 52.55 54.13 1blq s ASP 36 Cb 0.00 0.39 -0.03 0.00 -0.34 0.00 0.00 42.92 42.94 1blq s ASP 36 CO 0.00 -0.07 -0.09 -0.63 0.68 0.00 0.00 175.17 175.06 1blq s ILE 37 N 0.08 3.53 0.28 2.11 -1.09 -0.68 -4.81 121.20 120.62 1blq s ILE 37 Ca 0.06 -0.60 0.07 0.00 -2.23 0.00 0.00 60.65 57.95 1blq s ILE 37 Cb -0.05 -2.45 -0.03 0.00 -1.58 0.00 0.00 42.46 38.35 1blq s ILE 37 CO -0.12 0.56 0.26 -0.44 -1.23 0.00 0.00 174.94 173.97 1blq s SER 38 N -0.91 5.57 0.44 3.58 0.01 -1.26 -2.19 113.70 118.95 1blq s SER 38 Ca 0.13 -0.28 0.23 0.00 1.31 0.00 0.00 55.95 57.34 1blq s SER 38 Cb -0.11 -1.31 1.22 0.00 0.21 0.00 0.00 66.02 66.03 1blq s SER 38 CO 0.02 -0.16 1.81 0.71 0.41 0.00 0.00 173.24 176.03 1blq h THR 39 N 1.34 0.54 0.63 1.44 1.35 -1.93 1.44 112.91 117.71 1blq h THR 39 Ca -0.48 -0.10 -0.03 0.00 -0.55 0.00 0.00 66.41 65.26 1blq h THR 39 Cb 1.24 0.23 0.01 0.00 -1.73 0.00 0.00 68.15 67.90 1blq h THR 39 CO 0.59 0.05 -0.30 0.50 -0.25 0.00 0.00 175.52 176.11 1blq h LYS 40 N 0.28 -0.81 -0.77 4.72 3.64 -1.93 -2.89 116.57 118.80 1blq h LYS 40 Ca 0.54 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.98 1blq h LYS 40 Cb 1.60 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.60 1blq h LYS 40 CO -0.19 -0.54 0.00 0.39 -2.27 0.00 0.00 179.45 176.84 1blq n GLU 41 N -4.59 2.50 -0.05 1.90 1.02 -0.73 -3.97 120.64 116.72 1blq n GLU 41 Ca -0.10 -1.26 -0.21 0.00 -0.02 0.00 0.00 57.16 55.56 1blq n GLU 41 Cb 0.33 -1.75 -0.13 0.00 -0.02 0.00 0.00 31.44 29.87 1blq n GLU 41 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1blq h LEU 42 N 1.65 0.18 -1.06 -4.62 5.85 0.22 -3.36 115.31 114.17 1blq h LEU 42 Ca 0.00 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.00 1blq h LEU 42 Cb 1.03 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.00 1blq h LEU 42 CO 0.18 1.56 0.00 0.61 -0.34 0.00 0.00 178.44 180.45 1blq n GLY 43 N 1.63 0.17 0.11 3.75 0.00 -1.22 -3.74 105.19 105.89 1blq n GLY 43 Ca -0.28 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.43 1blq n GLY 43 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1blq h THR 44 N 2.34 0.00 0.00 2.61 1.35 -1.70 -2.27 112.91 115.24 1blq h THR 44 Ca 0.00 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1blq h THR 44 Cb 0.50 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 1blq h THR 44 CO 0.00 0.00 -0.05 0.58 -0.25 0.00 0.00 175.52 175.80 1blq h VAL 45 N 0.00 0.00 0.00 6.82 2.07 -1.76 -3.34 116.25 120.05 1blq h VAL 45 Ca 0.00 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1blq h VAL 45 Cb 0.76 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1blq h VAL 45 CO 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 177.57 177.59 1blq h MET 46 N -0.45 0.00 -0.78 1.57 -0.00 -1.78 -1.89 114.93 111.60 1blq h MET 46 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 59.70 59.85 1blq h MET 46 Cb 0.05 0.00 -0.10 0.00 -0.00 0.00 0.00 31.60 31.55 1blq h MET 46 CO 0.00 0.00 0.31 -0.09 -0.00 0.00 0.00 176.91 177.13 1blq h ARG 47 N 0.00 0.42 0.00 -0.10 1.12 -1.52 -0.43 114.38 113.87 1blq h ARG 47 Ca -0.00 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.84 1blq h ARG 47 Cb 0.01 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 29.87 1blq h ARG 47 CO 0.00 0.28 0.00 -1.33 -3.11 0.00 0.00 179.97 175.81 1blq n MET 48 N -5.02 0.00 -1.53 0.20 2.81 -0.71 -1.95 117.12 110.92 1blq n MET 48 Ca 0.15 0.72 -0.28 0.00 -1.81 0.00 0.00 57.70 56.49 1blq n MET 48 Cb 0.45 -1.45 -0.06 0.00 -0.71 0.00 0.00 33.22 31.45 1blq n MET 48 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1blq n LEU 49 N -2.37 6.59 0.00 4.03 4.32 -0.98 -4.77 117.00 123.82 1blq n LEU 49 Ca 0.00 -4.12 0.00 0.00 -0.02 0.00 0.00 56.01 51.87 1blq n LEU 49 Cb 0.00 -1.25 0.00 0.00 -1.62 0.00 0.00 43.42 40.55 1blq n LEU 49 CO 0.00 1.76 0.00 0.61 -1.22 0.00 0.00 177.39 178.54 1blq n GLY 50 N 1.00 2.19 3.09 -0.72 0.00 -0.21 -5.00 105.19 105.55 1blq n GLY 50 Ca 0.50 0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.67 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 3.00 0.42 0.17 1.61 -1.52 -1.23 -4.96 119.66 117.14 1blq s GLN 51 Ca 0.00 -0.27 -0.32 0.00 -1.95 0.00 0.00 55.36 52.82 1blq s GLN 51 Cb 0.00 0.18 -0.11 0.00 -0.22 0.00 0.00 33.01 32.86 1blq s GLN 51 CO 0.00 -0.10 1.73 -0.80 -0.25 0.00 0.00 175.29 175.88 1blq s ASN 52 N -1.09 6.43 0.00 5.90 -0.87 -1.26 -4.55 114.94 119.50 1blq s ASN 52 Ca -0.12 2.79 0.00 0.00 -1.57 0.00 0.00 52.86 53.96 1blq s ASN 52 Cb -0.06 -2.59 0.00 0.00 -0.02 0.00 0.00 41.25 38.58 1blq s ASN 52 CO 0.01 -0.96 0.00 -0.81 -2.57 0.00 0.00 177.10 172.77 1blq n PRO 53 N 4.57 2.39 -4.40 -0.60 -0.04 -1.26 -5.12 135.00 130.53 1blq n PRO 53 Ca 0.16 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.42 1blq n PRO 53 Cb 0.37 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.72 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 1.25 0.97 0.24 0.52 2.01 -1.26 -4.98 115.64 114.39 1blq s THR 54 Ca 0.00 -2.00 -0.03 0.00 0.31 0.00 0.00 61.69 59.97 1blq s THR 54 Cb 0.00 -2.73 0.08 0.00 0.01 0.00 0.00 72.50 69.86 1blq s THR 54 CO 0.00 -0.01 1.70 0.50 -0.69 0.00 0.00 174.62 176.12 1blq h LYS 55 N 2.22 0.77 0.00 4.92 3.64 -2.00 -2.37 116.57 123.74 1blq h LYS 55 Ca -0.40 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1blq h LYS 55 Cb 1.24 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1blq h LYS 55 CO 0.66 0.85 -0.45 1.05 -2.27 0.00 0.00 179.45 179.30 1blq h GLU 56 N 0.70 0.00 -0.13 1.90 -0.00 -1.98 -3.29 114.58 111.78 1blq h GLU 56 Ca 0.12 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 59.41 1blq h GLU 56 Cb 0.58 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.32 1blq h GLU 56 CO 0.04 0.00 -0.22 1.49 -0.00 0.00 0.00 179.01 180.32 1blq h GLU 57 N 0.00 0.23 -0.01 1.06 4.57 -1.81 -1.42 114.58 117.20 1blq h GLU 57 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1blq h GLU 57 Cb 0.77 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.34 1blq h GLU 57 CO 0.00 0.44 -0.17 1.28 -1.18 0.00 0.00 179.01 179.38 1blq n LEU 58 N -4.20 0.94 0.02 1.64 7.99 -1.20 -3.93 117.00 118.26 1blq n LEU 58 Ca -0.01 -0.23 -0.18 0.00 -0.01 0.00 0.00 56.01 55.58 1blq n LEU 58 Cb 0.33 -0.11 -0.12 0.00 -0.11 0.00 0.00 43.42 43.41 1blq n LEU 58 CO 0.39 0.17 0.19 -0.78 -1.51 0.00 0.00 177.39 175.85 1blq h ASP 59 N 1.21 0.50 -0.48 -1.43 1.82 -1.36 -0.14 116.42 116.54 1blq h ASP 59 Ca 0.00 -0.83 0.10 0.00 -0.39 0.00 0.00 57.03 55.91 1blq h ASP 59 Cb 0.45 -0.16 -0.10 0.00 0.68 0.00 0.00 39.33 40.21 1blq h ASP 59 CO 0.00 1.27 -0.18 0.00 -1.61 0.00 0.00 179.24 178.72 1blq h ALA 60 N 0.24 0.21 -0.02 -0.78 0.00 -1.67 2.21 119.26 119.45 1blq h ALA 60 Ca -0.10 0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1blq h ALA 60 Cb 1.42 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 1blq h ALA 60 CO 0.13 -0.51 -0.73 0.82 0.00 0.00 0.00 179.25 178.96 1blq h ILE 61 N -0.07 1.47 -0.12 0.00 5.03 -1.76 -2.66 117.51 119.40 1blq h ILE 61 Ca 0.23 -2.37 0.00 0.00 -0.12 0.00 0.00 64.86 62.60 1blq h ILE 61 Cb 0.43 2.28 0.00 0.00 -3.03 0.00 0.00 36.82 36.49 1blq h ILE 61 CO -0.53 0.69 0.00 -0.38 -0.68 0.00 0.00 178.15 177.24 1blq n ILE 62 N -3.73 0.15 -0.07 -0.67 2.08 0.49 -3.84 119.36 113.77 1blq n ILE 62 Ca -0.02 -0.20 -0.19 0.00 0.56 0.00 0.00 62.75 62.89 1blq n ILE 62 Cb 0.71 0.08 -0.12 0.00 -0.75 0.00 0.00 39.64 39.55 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 1.13 0.05 0.00 0.38 4.57 0.39 -0.74 114.58 120.35 1blq h GLU 63 Ca 0.00 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 1blq h GLU 63 Cb 0.25 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1blq h GLU 63 CO 0.00 1.04 -0.24 1.05 -1.18 0.00 0.00 179.01 179.68 1blq h GLU 64 N -0.86 0.00 0.04 1.92 4.11 -1.67 -2.98 114.58 115.14 1blq h GLU 64 Ca -0.24 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 58.87 1blq h GLU 64 Cb 1.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.52 1blq h GLU 64 CO -0.10 0.24 -1.75 0.28 0.07 0.00 0.00 179.01 177.76 1blq n VAL 65 N -3.55 1.61 0.29 -1.06 0.31 -1.25 -3.98 118.33 110.70 1blq n VAL 65 Ca -0.01 -0.32 0.14 0.00 -0.01 0.00 0.00 64.34 64.15 1blq n VAL 65 Cb 0.39 -1.88 0.77 0.00 -0.91 0.00 0.00 33.84 32.21 1blq n VAL 65 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1blq h ASP 66 N -0.58 0.00 -1.24 4.52 3.58 -1.15 -2.06 116.42 119.49 1blq h ASP 66 Ca -0.44 0.00 0.36 0.00 0.42 0.00 0.00 57.03 57.38 1blq h ASP 66 Cb 1.63 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.63 1blq h ASP 66 CO -0.13 0.00 1.09 1.05 -2.88 0.00 0.00 179.24 178.37 1blq h GLU 67 N 0.00 0.00 0.68 0.28 4.11 -1.65 0.01 114.58 118.01 1blq h GLU 67 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1blq h GLU 67 Cb 0.52 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1blq h GLU 67 CO 0.00 0.00 -0.40 0.22 0.07 0.00 0.00 179.01 178.90 1blq h ASP 68 N 0.00 -1.00 0.00 3.06 3.58 -1.67 -3.47 116.42 116.92 1blq h ASP 68 Ca 0.59 0.05 0.00 0.00 0.42 0.00 0.00 57.03 58.09 1blq h ASP 68 Cb 2.77 0.29 0.00 0.00 1.72 0.00 0.00 39.33 44.10 1blq h ASP 68 CO -0.01 -0.62 0.00 0.61 -2.88 0.00 0.00 179.24 176.34 1blq n GLY 69 N -1.52 0.00 0.00 -0.78 0.00 -0.01 -5.05 105.19 97.84 1blq n GLY 69 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1blq n GLY 69 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1blq n SER 70 N 0.00 0.06 -0.23 1.61 7.64 -1.25 -5.05 113.62 116.40 1blq n SER 70 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1blq n SER 70 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1blq n SER 70 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1blq n GLY 71 N 1.50 0.94 3.77 0.23 0.00 -1.26 -5.06 105.19 105.30 1blq n GLY 71 Ca 0.00 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 1blq n GLY 71 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1blq n THR 72 N -2.19 0.00 -4.85 2.61 5.66 -1.26 -4.10 114.28 110.15 1blq n THR 72 Ca 0.00 -0.99 -0.26 0.00 -3.05 0.00 0.00 64.05 59.75 1blq n THR 72 Cb 0.35 0.99 -0.15 0.00 -1.55 0.00 0.00 70.33 69.97 1blq n THR 72 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1blq s ILE 73 N -2.10 1.63 0.00 1.09 1.01 -0.93 -4.55 121.20 117.36 1blq s ILE 73 Ca 0.16 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.80 1blq s ILE 73 Cb -0.05 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 41.04 1blq s ILE 73 CO 0.12 0.35 0.00 0.47 0.00 0.00 0.00 174.94 175.88 1blq n ASP 74 N 2.27 0.00 -0.01 3.58 8.00 -1.26 -1.69 116.55 127.44 1blq n ASP 74 Ca -0.16 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.21 1blq n ASP 74 Cb 0.53 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.49 1blq n ASP 74 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1blq n PHE 75 N 0.00 1.09 0.29 1.24 -1.74 -1.26 -2.97 117.46 114.11 1blq n PHE 75 Ca 0.00 0.33 0.12 0.00 -0.56 0.00 0.00 57.45 57.34 1blq n PHE 75 Cb 0.00 -1.18 0.10 0.00 1.52 0.00 0.00 39.48 39.92 1blq n PHE 75 CO 0.00 0.00 0.00 1.05 -0.56 0.00 0.00 176.76 177.25 1blq h GLU 76 N 0.03 0.00 0.01 3.97 4.11 -1.95 -3.34 114.58 117.41 1blq h GLU 76 Ca -0.33 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 58.80 1blq h GLU 76 Cb 2.02 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 31.23 1blq h GLU 76 CO 0.08 0.00 -1.70 0.93 0.07 0.00 0.00 179.01 178.39 1blq h GLU 77 N 0.00 0.03 -0.05 1.06 4.39 -1.95 -3.33 114.58 114.72 1blq h GLU 77 Ca 0.00 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.67 1blq h GLU 77 Cb 0.91 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.58 1blq h GLU 77 CO 0.00 0.58 0.14 0.35 -1.16 0.00 0.00 179.01 178.92 1blq h PHE 78 N 0.01 0.00 0.00 4.33 3.04 -1.65 -0.21 116.94 122.45 1blq h PHE 78 Ca -0.29 0.00 -0.24 0.00 3.98 0.00 0.00 57.97 61.42 1blq h PHE 78 Cb 2.01 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 40.48 1blq h PHE 78 CO 0.01 0.00 -1.38 1.37 -2.02 0.00 0.00 178.31 176.29 1blq h LEU 79 N 0.00 0.00 0.00 0.59 8.10 -1.74 -3.26 115.31 119.00 1blq h LEU 79 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.02 1blq h LEU 79 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.53 1blq h LEU 79 CO -0.00 0.92 0.00 1.33 -4.11 0.00 0.00 178.44 176.58 1blq n VAL 80 N -3.14 0.26 -0.03 0.15 0.24 -0.10 -1.75 118.33 113.97 1blq n VAL 80 Ca -0.09 0.07 -0.02 0.00 -2.04 0.00 0.00 64.34 62.25 1blq n VAL 80 Cb 0.97 -0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 32.58 1blq n VAL 80 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1blq n MET 81 N -1.17 0.18 0.26 7.34 1.56 -1.18 -3.54 117.12 120.58 1blq n MET 81 Ca 0.11 0.36 0.14 0.00 -0.27 0.00 0.00 57.70 58.05 1blq n MET 81 Cb 0.12 -1.13 0.67 0.00 2.15 0.00 0.00 33.22 35.03 1blq n MET 81 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1blq h MET 82 N -0.40 0.00 0.00 2.12 -0.00 -1.69 -2.18 114.93 112.77 1blq h MET 82 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1blq h MET 82 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.81 1blq h MET 82 CO 0.00 0.10 0.00 0.28 -0.00 0.00 0.00 176.91 177.29 1blq h VAL 83 N 0.00 0.00 0.00 -0.10 2.07 -1.54 -3.11 116.25 113.57 1blq h VAL 83 Ca -0.00 -0.82 -0.10 0.00 0.82 0.00 0.00 66.70 66.60 1blq h VAL 83 Cb 0.50 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1blq h VAL 83 CO 0.01 0.00 -0.47 -0.09 0.02 0.00 0.00 177.57 177.04 1blq h ARG 84 N 0.00 0.00 -2.36 1.57 2.43 -1.44 -3.27 114.38 111.31 1blq h ARG 84 Ca 0.00 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 1blq h ARG 84 Cb 0.87 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.27 1blq h ARG 84 CO 0.00 0.47 1.57 0.94 -1.51 0.00 0.00 179.97 181.44 1blq n GLN 85 N -3.53 3.71 -1.92 0.20 -0.06 -1.17 -4.88 117.38 109.73 1blq n GLN 85 Ca -0.00 -3.01 -0.30 0.00 -2.00 0.00 0.00 57.00 51.68 1blq n GLN 85 Cb 0.58 -2.43 0.02 0.00 -4.06 0.00 0.00 30.24 24.35 1blq n GLN 85 CO 0.00 0.00 0.00 -1.64 -0.20 0.00 0.00 177.06 175.22 1blq s MET 86 N -1.41 3.37 -0.03 3.69 -1.94 -1.24 -4.99 119.30 116.76 1blq s MET 86 Ca 0.56 0.62 -0.01 0.00 -1.71 0.00 0.00 55.69 55.15 1blq s MET 86 Cb 0.27 -2.08 -0.27 0.00 2.01 0.00 0.00 34.83 34.76 1blq s MET 86 CO -0.15 -0.69 0.73 0.87 -0.01 0.00 0.00 175.02 175.78 1blq h LYS 87 N -0.38 0.21 0.00 2.03 1.57 -1.93 -3.27 116.57 114.80 1blq h LYS 87 Ca -0.44 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 57.97 1blq h LYS 87 Cb 1.21 0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1blq h LYS 87 CO 0.62 1.04 0.00 -1.91 -0.57 0.00 0.00 179.45 178.63 1blq n GLU 88 N -3.39 0.27 -2.75 3.15 2.13 -1.26 -4.85 120.64 113.93 1blq n GLU 88 Ca -0.19 0.12 -0.08 0.00 0.66 0.00 0.00 57.16 57.66 1blq n GLU 88 Cb 1.05 -1.50 0.04 0.00 0.27 0.00 0.00 31.44 31.29 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 -1.25 -2.73 0.00 4.31 -0.08 -1.23 -5.27 116.55 110.29 1blq n ASP 89 Ca 0.08 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.11 1blq n ASP 89 Cb 0.12 -2.48 0.00 0.00 2.34 0.00 0.00 41.12 41.10 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32