#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 -0.54 0.00 7.64 -1.26 -4.99 113.62 114.47 1blq n SER 2 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 1blq n SER 2 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1blq n SER 2 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1blq n MET 3 N 0.00 0.00 0.00 1.43 0.00 -1.26 -4.94 117.12 112.35 1blq n MET 3 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 57.70 57.55 1blq n MET 3 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 33.22 33.21 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 0.00 0.00 -0.17 1.12 -1.04 -1.26 -2.77 114.28 110.16 1blq n THR 4 Ca -0.02 0.00 0.29 0.00 -2.04 0.00 0.00 64.05 62.28 1blq n THR 4 Cb 0.53 -0.03 0.61 0.00 -1.82 0.00 0.00 70.33 69.62 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 0.25 8.00 5.19 -2.00 0.27 116.42 128.14 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 -0.12 -0.61 -3.12 0.00 0.00 179.24 175.39 1blq h GLN 6 N 0.00 -0.32 -0.10 3.56 4.15 -1.92 -2.85 115.11 117.63 1blq h GLN 6 Ca 0.44 0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.83 1blq h GLN 6 Cb 2.34 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 30.09 1blq h GLN 6 CO -0.00 -0.08 -0.19 -0.56 -1.93 0.00 0.00 178.83 176.07 1blq h GLN 7 N -0.53 0.16 -0.75 1.69 3.07 -0.29 -2.66 115.11 115.80 1blq h GLN 7 Ca -0.03 -0.04 0.09 0.00 0.09 0.00 0.00 58.65 58.76 1blq h GLN 7 Cb 0.39 -0.02 -0.07 0.00 0.08 0.00 0.00 27.48 27.86 1blq h GLN 7 CO 0.06 0.36 0.39 0.00 0.09 0.00 0.00 178.83 179.73 1blq h ALA 8 N 1.66 1.04 -0.32 0.06 0.00 -1.19 -1.06 119.26 119.45 1blq h ALA 8 Ca 0.03 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 1blq h ALA 8 Cb 0.43 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1blq h ALA 8 CO 0.03 0.01 -0.51 0.93 0.00 0.00 0.00 179.25 179.71 1blq h GLU 9 N 0.67 0.90 0.00 0.00 5.08 -1.33 -2.65 114.58 117.25 1blq h GLU 9 Ca 0.36 -0.54 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1blq h GLU 9 Cb 0.36 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1blq h GLU 9 CO -0.26 1.19 -0.00 0.00 -1.00 0.00 0.00 179.01 178.94 1blq h ALA 10 N 0.71 1.06 0.08 3.43 0.00 -1.09 -2.31 119.26 121.14 1blq h ALA 10 Ca 0.03 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1blq h ALA 10 Cb 1.11 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1blq h ALA 10 CO 0.12 0.01 -0.59 -0.09 0.00 0.00 0.00 179.25 178.69 1blq h ARG 11 N 0.00 0.18 0.06 0.00 9.65 -0.88 -2.33 114.38 121.06 1blq h ARG 11 Ca -0.00 -0.31 0.02 0.00 -1.10 0.00 0.00 59.98 58.60 1blq h ARG 11 Cb 0.07 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.71 1blq h ARG 11 CO 0.00 1.15 -0.48 0.00 2.80 0.00 0.00 179.97 183.44 1blq h ALA 12 N 0.02 -0.84 0.14 2.80 0.00 -1.23 -2.45 119.26 117.70 1blq h ALA 12 Ca -0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1blq h ALA 12 Cb 1.41 0.83 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 1blq h ALA 12 CO 0.08 -1.05 -0.09 0.35 0.00 0.00 0.00 179.25 178.54 1blq h PHE 13 N -0.67 -0.22 -1.09 0.00 3.57 -1.66 -3.27 116.94 113.60 1blq h PHE 13 Ca 0.02 -0.00 -0.69 0.00 3.53 0.00 0.00 57.97 60.82 1blq h PHE 13 Cb 0.71 0.08 -0.10 0.00 2.79 0.00 0.00 35.95 39.43 1blq h PHE 13 CO -0.44 -0.14 2.08 1.28 -2.23 0.00 0.00 178.31 178.86 1blq n LEU 14 N -5.20 5.09 -4.11 0.59 4.77 -0.88 -4.98 117.00 112.28 1blq n LEU 14 Ca -0.08 -4.04 -0.36 0.00 -0.03 0.00 0.00 56.01 51.50 1blq n LEU 14 Cb 0.12 -1.72 0.07 0.00 -2.33 0.00 0.00 43.42 39.57 1blq n LEU 14 CO 0.33 0.32 -1.24 -1.20 -1.33 0.00 0.00 177.39 174.26 1blq n SER 15 N 7.71 -3.96 -0.26 -1.43 7.64 -1.20 -4.41 113.62 117.71 1blq n SER 15 Ca 0.47 0.11 0.06 0.00 1.01 0.00 0.00 58.87 60.52 1blq n SER 15 Cb 0.45 -0.79 0.17 0.00 -1.01 0.00 0.00 64.21 63.03 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 -1.25 0.10 -0.81 1.43 4.57 -1.92 0.25 114.58 116.95 1blq h GLU 16 Ca -0.44 -0.01 0.20 0.00 -1.18 0.00 0.00 59.36 57.93 1blq h GLU 16 Cb 1.33 -0.02 -0.14 0.00 -0.16 0.00 0.00 28.75 29.76 1blq h GLU 16 CO 0.27 0.07 0.05 1.05 -1.18 0.00 0.00 179.01 179.26 1blq h GLU 17 N 0.11 0.11 0.14 1.92 4.11 -1.99 -1.12 114.58 117.86 1blq h GLU 17 Ca 0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.85 1blq h GLU 17 Cb 0.76 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1blq h GLU 17 CO -0.67 0.07 -0.29 0.52 0.07 0.00 0.00 179.01 178.71 1blq h MET 18 N 0.11 -0.45 -0.03 1.06 2.86 -0.74 0.13 114.93 117.87 1blq h MET 18 Ca 0.46 0.03 0.01 0.00 -2.06 0.00 0.00 59.70 58.14 1blq h MET 18 Cb 0.86 0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.62 1blq h MET 18 CO -0.70 -0.30 0.39 0.82 1.06 0.00 0.00 176.91 178.18 1blq h ILE 19 N -0.47 0.02 -0.04 -1.22 5.03 -1.29 0.17 117.51 119.71 1blq h ILE 19 Ca -0.02 0.00 -0.25 0.00 -0.12 0.00 0.00 64.86 64.47 1blq h ILE 19 Cb 0.45 0.61 0.02 0.00 -3.03 0.00 0.00 36.82 34.86 1blq h ILE 19 CO -0.11 0.00 -0.97 0.00 -0.68 0.00 0.00 178.15 176.39 1blq h ALA 20 N 1.24 0.19 0.00 1.87 0.00 0.41 -2.91 119.26 120.06 1blq h ALA 20 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1blq h ALA 20 Cb 0.80 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1blq h ALA 20 CO -0.00 0.69 -0.41 0.93 0.00 0.00 0.00 179.25 180.46 1blq h GLU 21 N 0.43 0.00 0.00 0.00 4.39 0.17 -3.25 114.58 116.32 1blq h GLU 21 Ca -0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.59 1blq h GLU 21 Cb 1.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.27 1blq h GLU 21 CO 0.19 0.00 -0.03 0.74 -1.16 0.00 0.00 179.01 178.75 1blq h PHE 22 N 0.00 0.00 0.01 4.33 0.04 -1.24 -3.20 116.94 116.88 1blq h PHE 22 Ca 0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 1blq h PHE 22 Cb 1.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.15 1blq h PHE 22 CO 0.00 0.00 -0.00 -0.22 -0.60 0.00 0.00 178.31 177.49 1blq h LYS 23 N 0.00 -0.01 -0.09 1.51 3.64 -1.54 -2.17 116.57 117.91 1blq h LYS 23 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1blq h LYS 23 Cb 0.97 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1blq h LYS 23 CO 0.00 0.18 0.00 0.00 -2.27 0.00 0.00 179.45 177.36 1blq n ALA 24 N -2.19 2.53 -0.01 5.00 0.00 -1.24 -2.71 120.51 121.89 1blq n ALA 24 Ca -0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 53.44 53.12 1blq n ALA 24 Cb 0.11 -1.11 -0.00 0.00 0.00 0.00 0.00 19.45 18.45 1blq n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1blq n ALA 25 N -0.27 0.08 0.23 0.00 0.00 -0.83 -3.84 120.51 115.88 1blq n ALA 25 Ca 0.10 -0.18 0.13 0.00 0.00 0.00 0.00 53.44 53.49 1blq n ALA 25 Cb 0.13 0.00 0.40 0.00 0.00 0.00 0.00 19.45 19.98 1blq n ALA 25 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1blq h PHE 26 N -0.18 0.00 -0.09 0.00 3.57 -1.68 -2.73 116.94 115.83 1blq h PHE 26 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1blq h PHE 26 Cb 0.09 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.83 1blq h PHE 26 CO -0.04 0.09 0.00 -3.47 -2.23 0.00 0.00 178.31 172.66 1blq n ASP 27 N -3.16 0.76 -0.30 0.41 2.03 -1.10 -4.06 116.55 111.13 1blq n ASP 27 Ca 0.02 -1.66 0.08 0.00 0.52 0.00 0.00 54.79 53.75 1blq n ASP 27 Cb 0.45 -0.06 0.24 0.00 -0.72 0.00 0.00 41.12 41.02 1blq n ASP 27 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1blq h MET 28 N 0.96 0.60 0.00 -0.67 2.86 -1.59 -3.28 114.93 113.81 1blq h MET 28 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1blq h MET 28 Cb 0.21 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1blq h MET 28 CO 0.00 0.40 0.00 0.34 1.06 0.00 0.00 176.91 178.71 1blq n PHE 29 N -4.87 0.00 -2.11 -0.22 7.35 -1.26 -4.69 117.46 111.66 1blq n PHE 29 Ca 0.18 0.00 -0.38 0.00 -0.76 0.00 0.00 57.45 56.49 1blq n PHE 29 Cb 0.46 -0.28 -0.03 0.00 0.35 0.00 0.00 39.48 39.97 1blq n PHE 29 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1blq s ASP 30 N -2.97 5.39 -0.00 -2.13 1.11 -1.24 -4.63 116.67 112.20 1blq s ASP 30 Ca 0.00 0.10 0.01 0.00 0.18 0.00 0.00 52.55 52.84 1blq s ASP 30 Cb 0.00 -2.54 0.01 0.00 1.07 0.00 0.00 42.92 41.46 1blq s ASP 30 CO 0.00 -2.33 0.68 0.00 1.18 0.00 0.00 175.17 174.70 1blq n ALA 31 N 12.39 1.36 -2.70 5.23 0.00 -1.25 -4.25 120.51 131.29 1blq n ALA 31 Ca 0.20 -0.74 -0.09 0.00 0.00 0.00 0.00 53.44 52.82 1blq n ALA 31 Cb 0.51 -0.10 0.06 0.00 0.00 0.00 0.00 19.45 19.92 1blq n ALA 31 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1blq n ASP 32 N -0.12 0.22 0.01 0.00 5.75 -1.26 -4.97 116.55 116.18 1blq n ASP 32 Ca 0.01 -2.67 0.00 0.00 -0.01 0.00 0.00 54.79 52.12 1blq n ASP 32 Cb 0.51 0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 1blq n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1blq n GLY 33 N -0.21 -1.95 0.18 6.12 0.00 -1.26 -5.04 105.19 103.03 1blq n GLY 33 Ca 0.06 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 -1.48 0.09 0.00 -0.02 0.00 -1.26 -5.10 105.19 97.42 1blq n GLY 34 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 0.32 0.75 3.62 -0.02 0.00 -1.26 -5.03 105.19 103.58 1blq n GLY 35 Ca 0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.09 -0.32 -0.02 1.61 1.47 -1.26 -4.46 116.67 112.60 1blq s ASP 36 Ca 0.00 0.50 0.04 0.00 1.18 0.00 0.00 52.55 54.27 1blq s ASP 36 Cb 0.00 0.47 -0.03 0.00 -0.34 0.00 0.00 42.92 43.02 1blq s ASP 36 CO 0.00 -0.19 -0.14 0.27 0.68 0.00 0.00 175.17 175.80 1blq s ILE 37 N -0.41 3.13 0.20 2.11 -0.00 -1.03 -4.72 121.20 120.47 1blq s ILE 37 Ca 0.03 -0.83 -0.03 0.00 -0.00 0.00 0.00 60.65 59.81 1blq s ILE 37 Cb -0.03 -2.27 0.05 0.00 -0.00 0.00 0.00 42.46 40.21 1blq s ILE 37 CO -0.05 0.50 0.21 -1.20 -0.00 0.00 0.00 174.94 174.40 1blq n SER 38 N 1.99 -0.74 0.09 4.36 7.64 -1.26 -1.92 113.62 123.77 1blq n SER 38 Ca -0.17 -0.79 -0.07 0.00 1.01 0.00 0.00 58.87 58.85 1blq n SER 38 Cb 0.52 -0.18 0.03 0.00 -1.01 0.00 0.00 64.21 63.57 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 -1.50 1.49 -0.00 0.44 1.35 0.25 -2.82 112.91 112.11 1blq h THR 39 Ca -0.07 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 1blq h THR 39 Cb 0.22 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 1blq h THR 39 CO 0.05 0.73 -0.13 1.17 -0.25 0.00 0.00 175.52 177.09 1blq n LYS 40 N -3.69 0.06 -0.01 4.72 0.00 -1.26 -2.85 118.16 115.12 1blq n LYS 40 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 58.31 58.26 1blq n LYS 40 Cb 0.76 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 34.29 1blq n LYS 40 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1blq n GLU 41 N -1.46 0.09 0.24 1.64 -0.58 -1.13 -3.49 120.64 115.95 1blq n GLU 41 Ca 0.07 0.30 0.16 0.00 -0.42 0.00 0.00 57.16 57.27 1blq n GLU 41 Cb 0.33 -0.93 0.86 0.00 -0.57 0.00 0.00 31.44 31.13 1blq n GLU 41 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 1blq h LEU 42 N -0.20 0.00 0.12 -4.62 -0.00 -1.68 -0.95 115.31 107.98 1blq h LEU 42 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.88 57.58 1blq h LEU 42 Cb 0.10 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 40.79 1blq h LEU 42 CO 0.00 0.00 -1.26 1.23 -0.00 0.00 0.00 178.44 178.41 1blq h GLY 43 N 0.00 0.71 1.81 0.17 0.00 -1.70 -2.57 103.07 101.50 1blq h GLY 43 Ca 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 47.33 45.82 1blq h GLY 43 CO 0.00 1.30 -0.33 -0.91 0.00 0.00 0.00 176.54 176.60 1blq h THR 44 N 0.28 0.24 0.05 4.70 1.35 -1.28 -2.20 112.91 116.04 1blq h THR 44 Ca -0.19 -1.35 -0.28 0.00 -0.55 0.00 0.00 66.41 64.04 1blq h THR 44 Cb 1.93 2.04 0.02 0.00 -1.73 0.00 0.00 68.15 70.41 1blq h THR 44 CO 0.24 0.14 -1.11 0.58 -0.25 0.00 0.00 175.52 175.11 1blq h VAL 45 N 0.00 1.29 0.00 6.82 2.07 -1.26 -3.14 116.25 122.03 1blq h VAL 45 Ca -0.01 -2.36 -0.05 0.00 0.82 0.00 0.00 66.70 65.10 1blq h VAL 45 Cb 1.12 2.50 -0.01 0.00 -1.52 0.00 0.00 31.29 33.39 1blq h VAL 45 CO 0.02 0.72 -0.30 0.24 0.02 0.00 0.00 177.57 178.27 1blq h MET 46 N 0.33 0.00 0.00 1.57 2.07 -1.51 -3.05 114.93 114.34 1blq h MET 46 Ca -0.15 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.48 1blq h MET 46 Cb 1.77 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 31.50 1blq h MET 46 CO 0.21 0.23 0.00 -2.13 1.07 0.00 0.00 176.91 176.30 1blq n ARG 47 N -3.13 0.03 0.00 1.72 0.63 -0.83 -2.00 116.66 113.08 1blq n ARG 47 Ca 0.03 0.19 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1blq n ARG 47 Cb 0.63 -1.55 0.00 0.00 0.45 0.00 0.00 32.46 32.00 1blq n ARG 47 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 1blq n MET 48 N -1.60 0.00 -0.22 -0.14 2.81 -1.15 -0.37 117.12 116.44 1blq n MET 48 Ca 0.04 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.99 1blq n MET 48 Cb 0.24 -0.80 0.16 0.00 -0.71 0.00 0.00 33.22 32.11 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 -0.38 2.13 0.00 4.03 -0.00 -1.26 -3.79 117.00 117.73 1blq n LEU 49 Ca 0.00 -1.07 0.00 0.00 -0.00 0.00 0.00 56.01 54.94 1blq n LEU 49 Cb 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 43.42 43.12 1blq n LEU 49 CO 0.00 0.46 0.10 0.61 -0.00 0.00 0.00 177.39 178.56 1blq n GLY 50 N 0.91 -0.55 0.00 1.47 0.00 -0.85 -5.01 105.19 101.16 1blq n GLY 50 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 1.61 7.27 0.50 -3.42 117.38 123.34 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 0.35 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.00 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 0.00 -3.53 1.69 3.02 -1.26 -4.21 115.26 110.98 1blq n ASN 52 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.27 1blq n ASN 52 Cb 0.00 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.43 1blq n ASN 52 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1blq n PRO 53 N -3.82 -3.95 -3.78 3.52 -0.04 -1.22 -5.00 135.00 120.72 1blq n PRO 53 Ca 0.00 -1.17 -0.02 0.00 -0.04 0.00 0.00 63.50 62.27 1blq n PRO 53 Cb 0.00 -1.86 -0.00 0.00 -0.04 0.00 0.00 33.50 31.60 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 -2.15 0.00 0.21 0.52 2.01 -1.26 -4.76 115.64 110.21 1blq s THR 54 Ca 0.61 -0.56 -0.10 0.00 0.31 0.00 0.00 61.69 61.95 1blq s THR 54 Cb -0.13 -2.28 0.15 0.00 0.01 0.00 0.00 72.50 70.25 1blq s THR 54 CO 0.54 0.00 1.84 0.50 -0.69 0.00 0.00 174.62 176.81 1blq h LYS 55 N 2.00 1.03 0.00 4.92 3.64 -1.81 -1.44 116.57 124.91 1blq h LYS 55 Ca -0.26 -0.10 -0.16 0.00 -1.27 0.00 0.00 60.65 58.87 1blq h LYS 55 Cb 1.22 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 1blq h LYS 55 CO 0.29 0.73 -1.39 -0.85 -2.27 0.00 0.00 179.45 175.97 1blq n GLU 56 N -4.50 0.62 0.26 1.90 0.28 -1.26 -3.75 120.64 114.19 1blq n GLU 56 Ca 0.07 0.22 0.13 0.00 -0.16 0.00 0.00 57.16 57.42 1blq n GLU 56 Cb 0.06 -1.81 0.69 0.00 1.43 0.00 0.00 31.44 31.81 1blq n GLU 56 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 1blq h GLU 57 N 0.00 0.00 0.00 3.44 4.22 -1.83 -0.99 114.58 119.42 1blq h GLU 57 Ca -0.15 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.29 1blq h GLU 57 Cb 1.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1blq h GLU 57 CO 0.04 0.13 -0.16 1.28 -2.18 0.00 0.00 179.01 178.12 1blq n LEU 58 N -3.49 0.63 0.11 1.64 7.99 -0.57 -3.34 117.00 119.97 1blq n LEU 58 Ca -0.01 0.46 -0.03 0.00 -0.01 0.00 0.00 56.01 56.41 1blq n LEU 58 Cb 0.28 -0.32 0.08 0.00 -0.11 0.00 0.00 43.42 43.35 1blq n LEU 58 CO 0.30 -0.10 0.38 -0.78 -1.51 0.00 0.00 177.39 175.68 1blq h ASP 59 N 0.00 0.00 0.10 -1.43 3.58 -1.30 -1.83 116.42 115.54 1blq h ASP 59 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1blq h ASP 59 Cb 0.68 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.73 1blq h ASP 59 CO 0.00 0.74 -0.05 0.00 -2.88 0.00 0.00 179.24 177.05 1blq h ALA 60 N 1.26 -0.14 0.00 -0.78 0.00 -1.58 0.27 119.26 118.29 1blq h ALA 60 Ca -0.01 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1blq h ALA 60 Cb 1.32 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1blq h ALA 60 CO 0.10 -0.45 -0.26 0.82 0.00 0.00 0.00 179.25 179.45 1blq h ILE 61 N -0.39 0.72 0.00 0.00 5.03 -1.70 -2.14 117.51 119.02 1blq h ILE 61 Ca -0.01 -1.15 0.00 0.00 -0.12 0.00 0.00 64.86 63.58 1blq h ILE 61 Cb 0.32 1.73 0.00 0.00 -3.03 0.00 0.00 36.82 35.84 1blq h ILE 61 CO 0.02 0.26 0.00 0.40 -0.68 0.00 0.00 178.15 178.15 1blq h ILE 62 N 0.00 0.00 -0.14 -0.67 2.04 -0.93 -3.17 117.51 114.64 1blq h ILE 62 Ca -0.00 -0.80 -0.13 0.00 1.00 0.00 0.00 64.86 64.93 1blq h ILE 62 Cb 0.71 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 1blq h ILE 62 CO 0.03 0.00 -0.45 -0.08 0.00 0.00 0.00 178.15 177.65 1blq h GLU 63 N 0.00 0.35 -0.99 2.37 4.81 0.24 0.46 114.58 121.82 1blq h GLU 63 Ca 0.00 -0.19 -0.26 0.00 -0.13 0.00 0.00 59.36 58.79 1blq h GLU 63 Cb 0.90 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.13 1blq h GLU 63 CO 0.00 0.74 0.32 -0.85 -0.73 0.00 0.00 179.01 178.49 1blq n GLU 64 N -3.99 1.75 0.09 1.92 0.28 -1.20 -4.50 120.64 114.99 1blq n GLU 64 Ca -0.02 -1.58 0.00 0.00 -0.16 0.00 0.00 57.16 55.40 1blq n GLU 64 Cb 0.52 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.76 1blq n GLU 64 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1blq n VAL 65 N -0.32 0.00 -0.49 3.84 0.31 -1.03 -5.03 118.33 115.61 1blq n VAL 65 Ca 0.30 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.63 1blq n VAL 65 Cb 1.10 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.02 1blq n VAL 65 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1blq n ASP 66 N -2.86 0.00 0.20 4.52 5.75 0.16 -4.69 116.55 119.62 1blq n ASP 66 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.61 1blq n ASP 66 Cb 0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 39.99 1blq n ASP 66 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1blq h GLU 67 N 0.40 -0.84 -0.00 0.11 4.57 -1.86 0.10 114.58 117.05 1blq h GLU 67 Ca 0.00 0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1blq h GLU 67 Cb 0.00 0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1blq h GLU 67 CO 0.00 -0.56 0.01 -0.44 -1.18 0.00 0.00 179.01 176.83 1blq h ASP 68 N -0.87 0.00 -5.25 1.04 3.32 -1.85 -3.46 116.42 109.36 1blq h ASP 68 Ca -0.03 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.74 1blq h ASP 68 Cb 0.81 0.00 0.16 0.00 0.22 0.00 0.00 39.33 40.52 1blq h ASP 68 CO -0.17 0.00 -0.71 0.61 -1.72 0.00 0.00 179.24 177.24 1blq n GLY 69 N -1.11 -0.47 0.93 2.75 0.00 0.35 -4.92 105.19 102.71 1blq n GLY 69 Ca -0.03 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1blq n GLY 69 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1blq n SER 70 N -2.95 0.21 -3.18 1.61 2.88 -1.26 -4.99 113.62 105.94 1blq n SER 70 Ca -0.20 -1.86 -0.18 0.00 -1.33 0.00 0.00 58.87 55.30 1blq n SER 70 Cb 0.64 -0.14 0.07 0.00 -0.75 0.00 0.00 64.21 64.04 1blq n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1blq n GLY 71 N 0.18 -0.31 3.34 0.46 0.00 -1.26 -4.75 105.19 102.84 1blq n GLY 71 Ca -0.02 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.30 0.05 0.05 2.61 -1.32 -1.26 0.22 115.64 112.69 1blq s THR 72 Ca 0.25 -0.37 0.02 0.00 -1.21 0.00 0.00 61.69 60.37 1blq s THR 72 Cb -0.11 -0.92 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 1blq s THR 72 CO 0.64 -0.21 -0.07 -0.63 -2.21 0.00 0.00 174.62 172.15 1blq s ILE 73 N -2.23 0.50 0.00 5.08 1.09 -0.81 -4.71 121.20 120.12 1blq s ILE 73 Ca -0.07 -1.22 0.00 0.00 -1.10 0.00 0.00 60.65 58.27 1blq s ILE 73 Cb -0.01 -0.76 0.00 0.00 -1.06 0.00 0.00 42.46 40.62 1blq s ILE 73 CO -0.00 -0.49 0.00 0.47 -0.10 0.00 0.00 174.94 174.81 1blq n ASP 74 N 1.20 0.57 0.09 3.58 9.92 -1.26 -2.45 116.55 128.20 1blq n ASP 74 Ca -0.21 -0.85 0.04 0.00 -0.53 0.00 0.00 54.79 53.24 1blq n ASP 74 Cb 0.56 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.02 1blq n ASP 74 CO 0.00 0.00 0.00 2.19 0.13 0.00 0.00 177.20 179.52 1blq h PHE 75 N 0.24 0.00 -0.00 1.24 -0.00 -1.93 -3.23 116.94 113.26 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 0.39 -0.46 -1.91 -0.00 0.00 0.00 178.31 176.33 1blq n GLU 76 N -2.94 0.13 -0.08 6.09 2.13 -1.26 -3.00 120.64 121.70 1blq n GLU 76 Ca -0.04 -0.07 -0.13 0.00 0.66 0.00 0.00 57.16 57.58 1blq n GLU 76 Cb 0.73 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.87 1blq n GLU 76 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1blq h GLU 77 N 0.18 0.00 0.00 5.31 4.39 -1.95 -3.35 114.58 119.15 1blq h GLU 77 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1blq h GLU 77 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1blq h GLU 77 CO 0.00 0.55 0.00 1.97 -1.16 0.00 0.00 179.01 180.37 1blq n PHE 78 N -4.54 0.00 -0.12 4.33 -1.74 -1.22 -3.24 117.46 110.93 1blq n PHE 78 Ca -0.18 0.00 0.02 0.00 -0.56 0.00 0.00 57.45 56.73 1blq n PHE 78 Cb 0.45 -0.30 0.33 0.00 1.52 0.00 0.00 39.48 41.48 1blq n PHE 78 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 1blq h LEU 79 N 0.00 0.69 -0.34 5.98 3.38 -1.67 -0.94 115.31 122.40 1blq h LEU 79 Ca 0.00 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 1blq h LEU 79 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1blq h LEU 79 CO 0.00 0.50 -0.65 1.62 0.09 0.00 0.00 178.44 180.00 1blq h VAL 80 N 0.81 1.24 0.00 1.22 3.04 -1.76 -3.10 116.25 117.70 1blq h VAL 80 Ca 0.22 -2.42 -0.07 0.00 -1.01 0.00 0.00 66.70 63.41 1blq h VAL 80 Cb -0.09 2.40 -0.01 0.00 -2.01 0.00 0.00 31.29 31.58 1blq h VAL 80 CO -0.05 0.64 -0.34 -0.03 -1.01 0.00 0.00 177.57 176.78 1blq h MET 81 N 0.00 0.00 0.00 4.17 1.85 -1.38 -2.75 114.93 116.82 1blq h MET 81 Ca -0.01 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.08 1blq h MET 81 Cb 1.35 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.38 1blq h MET 81 CO 0.08 0.34 0.00 -1.33 -0.40 0.00 0.00 176.91 175.60 1blq n MET 82 N -3.36 0.02 0.05 0.39 2.00 -0.61 -3.30 117.12 112.31 1blq n MET 82 Ca 0.01 0.06 -0.19 0.00 0.00 0.00 0.00 57.70 57.58 1blq n MET 82 Cb 0.55 -1.52 -0.14 0.00 0.00 0.00 0.00 33.22 32.10 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 0.98 0.00 2.03 2.07 -1.55 -3.29 116.25 116.49 1blq h VAL 83 Ca 0.00 -2.62 0.00 0.00 0.82 0.00 0.00 66.70 64.90 1blq h VAL 83 Cb 0.47 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1blq h VAL 83 CO 0.00 0.82 0.00 0.54 0.02 0.00 0.00 177.57 178.95 1blq n ARG 84 N -3.47 0.00 -2.18 1.57 3.00 -1.21 -3.71 116.66 110.66 1blq n ARG 84 Ca -0.22 0.03 -0.42 0.00 -0.01 0.00 0.00 57.85 57.23 1blq n ARG 84 Cb 1.06 -0.64 0.00 0.00 0.00 0.00 0.00 32.46 32.87 1blq n ARG 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1blq n GLN 85 N -0.17 3.79 -0.01 5.56 6.02 -1.26 -4.67 117.38 126.63 1blq n GLN 85 Ca 0.00 -3.40 -0.11 0.00 -0.01 0.00 0.00 57.00 53.48 1blq n GLN 85 Cb 0.00 -2.88 0.03 0.00 1.02 0.00 0.00 30.24 28.41 1blq n GLN 85 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1blq h MET 86 N 5.47 0.63 -0.38 -1.09 -0.00 -1.64 -2.94 114.93 114.98 1blq h MET 86 Ca 0.49 -0.40 -0.08 0.00 -0.00 0.00 0.00 59.70 59.71 1blq h MET 86 Cb 0.54 0.05 -0.02 0.00 -0.00 0.00 0.00 31.60 32.17 1blq h MET 86 CO 1.62 1.01 -0.08 1.57 -0.00 0.00 0.00 176.91 181.03 1blq h LYS 87 N 0.48 0.65 -0.98 -0.10 2.10 -1.89 -1.11 116.57 115.72 1blq h LYS 87 Ca 0.01 -0.19 0.13 0.00 -2.00 0.00 0.00 60.65 58.60 1blq h LYS 87 Cb 1.12 -0.07 -0.08 0.00 -0.90 0.00 0.00 32.23 32.30 1blq h LYS 87 CO 0.11 0.73 0.62 1.49 -2.00 0.00 0.00 179.45 180.40 1blq h GLU 88 N 0.60 0.87 0.00 0.07 4.81 -1.89 -3.41 114.58 115.62 1blq h GLU 88 Ca 0.11 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1blq h GLU 88 Cb 0.50 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1blq h GLU 88 CO 0.03 0.57 0.00 -3.47 -0.73 0.00 0.00 179.01 175.41 1blq n ASP 89 N -4.62 0.00 0.00 1.04 -0.08 -0.79 -5.17 116.55 106.93 1blq n ASP 89 Ca 0.19 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.47 1blq n ASP 89 Cb 0.41 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.87 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32