#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 0.12 -0.56 0.00 3.41 -1.26 -4.95 113.62 110.38 1blq n SER 2 Ca 0.00 -1.10 0.03 0.00 -0.26 0.00 0.00 58.87 57.53 1blq n SER 2 Cb 0.00 -0.07 0.10 0.00 -0.26 0.00 0.00 64.21 63.98 1blq n SER 2 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1blq n MET 3 N -1.19 1.70 0.00 4.33 3.85 -1.26 -4.10 117.12 120.45 1blq n MET 3 Ca 0.02 -0.80 0.00 0.00 -1.00 0.00 0.00 57.70 55.92 1blq n MET 3 Cb 0.06 -1.35 0.00 0.00 -1.05 0.00 0.00 33.22 30.87 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 0.13 0.00 0.05 3.17 -1.04 -1.26 -2.22 114.28 113.11 1blq n THR 4 Ca 0.07 0.09 0.21 0.00 -2.04 0.00 0.00 64.05 62.38 1blq n THR 4 Cb 0.29 -0.53 0.64 0.00 -1.82 0.00 0.00 70.33 68.91 1blq n THR 4 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1blq h ASP 5 N 0.00 0.00 0.11 8.00 1.82 -2.01 0.12 116.42 124.47 1blq h ASP 5 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1blq h ASP 5 Cb 0.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 1blq h ASP 5 CO 0.00 0.00 -0.10 -0.61 -1.61 0.00 0.00 179.24 176.92 1blq h GLN 6 N 0.00 -0.22 0.00 0.28 5.75 -1.71 -1.53 115.11 117.69 1blq h GLN 6 Ca 0.24 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.72 1blq h GLN 6 Cb 1.58 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 30.17 1blq h GLN 6 CO -0.00 -0.14 -0.17 -0.56 -2.65 0.00 0.00 178.83 175.30 1blq h GLN 7 N -0.22 0.00 -0.69 1.69 3.07 -0.28 -2.49 115.11 116.18 1blq h GLN 7 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 1blq h GLN 7 Cb 0.21 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.74 1blq h GLN 7 CO -0.02 0.17 0.33 0.00 0.09 0.00 0.00 178.83 179.40 1blq h ALA 8 N 1.83 0.90 0.00 0.06 0.00 -1.08 -0.56 119.26 120.41 1blq h ALA 8 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1blq h ALA 8 Cb 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1blq h ALA 8 CO 0.02 0.46 0.00 1.49 0.00 0.00 0.00 179.25 181.22 1blq h GLU 9 N 0.97 0.00 0.00 0.00 4.81 -0.97 -2.54 114.58 116.85 1blq h GLU 9 Ca 0.24 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.33 1blq h GLU 9 Cb 0.12 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1blq h GLU 9 CO -0.03 0.00 -1.29 0.00 -0.73 0.00 0.00 179.01 176.96 1blq h ALA 10 N 2.13 0.63 -0.05 2.92 0.00 -1.12 -3.35 119.26 120.42 1blq h ALA 10 Ca 0.00 -0.68 -0.22 0.00 0.00 0.00 0.00 54.91 54.01 1blq h ALA 10 Cb 0.44 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1blq h ALA 10 CO 0.00 0.74 -0.87 -0.09 0.00 0.00 0.00 179.25 179.03 1blq h ARG 11 N 0.00 0.51 -0.48 0.00 9.65 -0.73 -1.51 114.38 121.83 1blq h ARG 11 Ca -0.13 -0.49 0.06 0.00 -1.10 0.00 0.00 59.98 58.33 1blq h ARG 11 Cb 1.47 0.12 -0.09 0.00 -1.39 0.00 0.00 29.97 30.09 1blq h ARG 11 CO 0.04 1.12 -0.50 0.00 2.80 0.00 0.00 179.97 183.43 1blq h ALA 12 N 0.72 -0.59 0.02 2.80 0.00 -1.66 -1.08 119.26 119.47 1blq h ALA 12 Ca -0.07 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 1blq h ALA 12 Cb 1.49 1.05 -0.01 0.00 0.00 0.00 0.00 17.79 20.32 1blq h ALA 12 CO 0.16 -0.96 -0.93 0.35 0.00 0.00 0.00 179.25 177.87 1blq h PHE 13 N -0.33 0.22 -1.46 0.00 3.57 -1.76 -3.36 116.94 113.83 1blq h PHE 13 Ca 0.12 -0.13 -0.74 0.00 3.53 0.00 0.00 57.97 60.75 1blq h PHE 13 Cb 0.58 -0.02 -0.14 0.00 2.79 0.00 0.00 35.95 39.16 1blq h PHE 13 CO -0.72 0.99 1.93 1.28 -2.23 0.00 0.00 178.31 179.57 1blq n LEU 14 N -3.58 6.09 -4.30 0.59 4.77 -0.42 -4.93 117.00 115.23 1blq n LEU 14 Ca -0.03 -4.48 -0.29 0.00 -0.03 0.00 0.00 56.01 51.18 1blq n LEU 14 Cb 0.85 -1.56 0.23 0.00 -2.33 0.00 0.00 43.42 40.61 1blq n LEU 14 CO 0.48 1.05 0.08 -1.54 -1.33 0.00 0.00 177.39 176.13 1blq n SER 15 N 4.99 -2.63 0.24 -1.43 3.41 -1.19 -4.63 113.62 112.39 1blq n SER 15 Ca 0.41 -0.34 0.15 0.00 -0.26 0.00 0.00 58.87 58.83 1blq n SER 15 Cb 0.39 -1.05 0.82 0.00 -0.26 0.00 0.00 64.21 64.11 1blq n SER 15 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1blq h GLU 16 N -2.73 0.00 -0.02 4.33 4.81 -1.94 -1.10 114.58 117.92 1blq h GLU 16 Ca -0.52 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.52 1blq h GLU 16 Cb 1.28 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.67 1blq h GLU 16 CO 0.38 0.00 -0.73 1.49 -0.73 0.00 0.00 179.01 179.42 1blq h GLU 17 N 0.00 0.53 0.21 1.92 4.57 -1.98 -2.48 114.58 117.36 1blq h GLU 17 Ca 0.00 -0.54 0.00 0.00 -1.18 0.00 0.00 59.36 57.64 1blq h GLU 17 Cb 0.12 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1blq h GLU 17 CO 0.00 1.17 -0.19 0.52 -1.18 0.00 0.00 179.01 179.34 1blq h MET 18 N 0.10 -0.40 0.00 1.92 2.86 -1.47 0.07 114.93 118.01 1blq h MET 18 Ca -0.08 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1blq h MET 18 Cb 1.41 0.09 0.00 0.00 0.06 0.00 0.00 31.60 33.16 1blq h MET 18 CO 0.14 -0.27 0.00 -0.89 1.06 0.00 0.00 176.91 176.96 1blq n ILE 19 N -5.31 1.19 -0.02 -1.22 -0.00 -1.19 -1.21 119.36 111.60 1blq n ILE 19 Ca -0.08 0.30 -0.11 0.00 -0.00 0.00 0.00 62.75 62.85 1blq n ILE 19 Cb 0.22 -1.10 -0.10 0.00 -0.00 0.00 0.00 39.64 38.67 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 2.40 -0.06 0.00 -1.39 0.00 -0.50 -1.84 119.26 117.87 1blq h ALA 20 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1blq h ALA 20 Cb 0.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1blq h ALA 20 CO 0.00 -0.13 -0.44 -1.91 0.00 0.00 0.00 179.25 176.78 1blq n GLU 21 N -4.76 0.08 -0.01 0.00 2.13 -0.98 -3.92 120.64 113.19 1blq n GLU 21 Ca -0.08 0.03 -0.16 0.00 0.66 0.00 0.00 57.16 57.61 1blq n GLU 21 Cb 0.33 -1.56 -0.14 0.00 0.27 0.00 0.00 31.44 30.34 1blq n GLU 21 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1blq n PHE 22 N -1.68 1.13 0.10 4.31 7.35 -0.35 -3.97 117.46 124.35 1blq n PHE 22 Ca 0.05 0.30 0.19 0.00 -0.76 0.00 0.00 57.45 57.23 1blq n PHE 22 Cb 0.37 -1.17 0.75 0.00 0.35 0.00 0.00 39.48 39.78 1blq n PHE 22 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 1blq h LYS 23 N 0.04 0.00 0.02 -4.13 2.10 -1.45 0.14 116.57 113.30 1blq h LYS 23 Ca -0.37 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.07 1blq h LYS 23 Cb 2.03 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 33.34 1blq h LYS 23 CO 0.08 0.00 -0.96 0.00 -2.00 0.00 0.00 179.45 176.57 1blq h ALA 24 N 1.68 0.43 0.00 0.07 0.00 -1.74 -3.10 119.26 116.59 1blq h ALA 24 Ca 0.18 -0.82 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 1blq h ALA 24 Cb 0.84 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1blq h ALA 24 CO -0.00 1.07 -0.07 0.00 0.00 0.00 0.00 179.25 180.24 1blq h ALA 25 N 0.97 1.35 0.01 0.00 0.00 -0.84 -1.98 119.26 118.78 1blq h ALA 25 Ca -0.04 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.54 1blq h ALA 25 Cb 1.66 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.40 1blq h ALA 25 CO 0.14 0.09 -1.42 0.35 0.00 0.00 0.00 179.25 178.41 1blq h PHE 26 N 0.00 0.05 0.00 0.00 3.04 -1.47 -3.26 116.94 115.30 1blq h PHE 26 Ca -0.00 -0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.91 1blq h PHE 26 Cb 0.21 -0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.72 1blq h PHE 26 CO 0.00 1.05 0.00 -0.25 -2.02 0.00 0.00 178.31 177.09 1blq n ASP 27 N -3.21 0.00 -0.09 0.41 9.92 -0.79 -4.11 116.55 118.68 1blq n ASP 27 Ca -0.10 -0.19 -0.06 0.00 -0.53 0.00 0.00 54.79 53.91 1blq n ASP 27 Cb 1.01 -0.26 -0.05 0.00 -0.64 0.00 0.00 41.12 41.18 1blq n ASP 27 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 1blq h MET 28 N 0.00 -0.14 0.23 -1.24 4.05 -1.49 -2.43 114.93 113.91 1blq h MET 28 Ca 0.00 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 1blq h MET 28 Cb 0.25 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.08 1blq h MET 28 CO 0.00 -0.09 -0.11 0.74 0.23 0.00 0.00 176.91 177.68 1blq h PHE 29 N -0.14 -0.29 -3.00 1.39 0.04 -1.85 -3.40 116.94 109.69 1blq h PHE 29 Ca 0.04 -0.01 -0.73 0.00 2.80 0.00 0.00 57.97 60.07 1blq h PHE 29 Cb 0.25 0.09 -0.22 0.00 2.20 0.00 0.00 35.95 38.28 1blq h PHE 29 CO -0.72 -0.18 -0.05 0.34 -0.60 0.00 0.00 178.31 177.09 1blq s ASP 30 N -3.73 6.19 -0.12 2.17 -1.08 -1.21 -4.81 116.67 114.08 1blq s ASP 30 Ca -0.05 -1.60 0.02 0.00 -0.52 0.00 0.00 52.55 50.40 1blq s ASP 30 Cb 0.00 -2.26 -0.08 0.00 -1.46 0.00 0.00 42.92 39.13 1blq s ASP 30 CO 0.14 -0.99 -0.09 0.00 0.52 0.00 0.00 175.17 174.75 1blq n ALA 31 N 5.79 1.75 -0.21 3.66 0.00 -0.92 -3.95 120.51 126.64 1blq n ALA 31 Ca -0.12 -0.51 0.05 0.00 0.00 0.00 0.00 53.44 52.86 1blq n ALA 31 Cb 0.41 0.21 0.27 0.00 0.00 0.00 0.00 19.45 20.34 1blq n ALA 31 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1blq n ASP 32 N -2.80 4.05 -0.02 0.00 2.03 -1.26 -4.25 116.55 114.30 1blq n ASP 32 Ca -0.20 -2.57 -0.06 0.00 0.52 0.00 0.00 54.79 52.47 1blq n ASP 32 Cb 0.73 -0.60 -0.02 0.00 -0.72 0.00 0.00 41.12 40.51 1blq n ASP 32 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1blq n GLY 33 N 0.48 -0.11 0.00 0.27 0.00 -1.26 -5.07 105.19 99.50 1blq n GLY 33 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 2.69 1.78 0.00 -0.02 0.00 -1.26 -5.01 105.19 103.37 1blq n GLY 34 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 0.28 2.61 -0.02 0.00 -1.25 -4.99 105.19 101.82 1blq n GLY 35 Ca 0.00 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.18 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 2.91 -0.01 1.61 1.47 -1.26 -3.84 116.67 117.55 1blq s ASP 36 Ca 0.00 -1.12 -0.14 0.00 1.18 0.00 0.00 52.55 52.47 1blq s ASP 36 Cb 0.00 -0.06 -0.06 0.00 -0.34 0.00 0.00 42.92 42.46 1blq s ASP 36 CO 0.00 -0.42 0.38 -0.63 0.68 0.00 0.00 175.17 175.18 1blq s ILE 37 N 2.17 5.08 0.02 2.11 1.01 -1.03 -4.86 121.20 125.70 1blq s ILE 37 Ca 0.09 0.77 -0.00 0.00 0.00 0.00 0.00 60.65 61.51 1blq s ILE 37 Cb -0.15 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.64 1blq s ILE 37 CO -0.35 0.58 0.03 -1.20 0.00 0.00 0.00 174.94 174.00 1blq n SER 38 N 1.82 0.01 -0.03 3.58 7.64 -1.26 -1.48 113.62 123.89 1blq n SER 38 Ca -0.14 -1.02 -0.14 0.00 1.01 0.00 0.00 58.87 58.58 1blq n SER 38 Cb 0.53 -0.02 -0.11 0.00 -1.01 0.00 0.00 64.21 63.60 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 -0.82 1.52 0.19 0.44 1.35 -1.81 0.27 112.91 114.05 1blq h THR 39 Ca -0.01 -1.72 0.01 0.00 -0.55 0.00 0.00 66.41 64.15 1blq h THR 39 Cb 0.03 2.60 -0.04 0.00 -1.73 0.00 0.00 68.15 69.01 1blq h THR 39 CO 0.01 0.46 -0.38 0.50 -0.25 0.00 0.00 175.52 175.86 1blq h LYS 40 N -0.52 -0.63 0.00 4.72 3.64 -1.88 -0.54 116.57 121.35 1blq h LYS 40 Ca -0.01 0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1blq h LYS 40 Cb 0.82 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1blq h LYS 40 CO 0.03 -0.42 -0.19 1.49 -2.27 0.00 0.00 179.45 178.09 1blq h GLU 41 N -0.65 0.00 0.00 1.90 4.57 -1.95 -1.46 114.58 116.99 1blq h GLU 41 Ca 0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1blq h GLU 41 Cb 0.65 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 1blq h GLU 41 CO -0.18 0.19 0.00 -0.11 -1.18 0.00 0.00 179.01 177.73 1blq n LEU 42 N -3.58 0.00 -0.00 1.64 0.00 0.08 -3.29 117.00 111.85 1blq n LEU 42 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 56.01 56.01 1blq n LEU 42 Cb 0.33 -0.00 -0.02 0.00 0.00 0.00 0.00 43.42 43.73 1blq n LEU 42 CO 0.32 -0.00 -0.54 0.61 0.00 0.00 0.00 177.39 177.79 1blq n GLY 43 N 0.96 -0.11 0.00 -3.96 0.00 -0.35 -4.53 105.19 97.19 1blq n GLY 43 Ca 0.24 -0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.35 1blq n GLY 43 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1blq n THR 44 N -1.66 0.00 -0.02 2.61 5.66 -0.85 -2.38 114.28 117.64 1blq n THR 44 Ca -0.01 -0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.78 1blq n THR 44 Cb 0.14 -0.49 -0.13 0.00 -1.55 0.00 0.00 70.33 68.29 1blq n THR 44 CO 0.00 0.00 0.00 1.62 -3.05 0.00 0.00 175.07 173.64 1blq h VAL 45 N 0.01 0.91 0.00 1.08 3.04 -1.80 -3.36 116.25 116.13 1blq h VAL 45 Ca 0.00 -2.34 -0.06 0.00 -1.01 0.00 0.00 66.70 63.30 1blq h VAL 45 Cb 0.13 2.56 -0.01 0.00 -2.01 0.00 0.00 31.29 31.97 1blq h VAL 45 CO 0.00 0.67 -0.51 0.00 -1.01 0.00 0.00 177.57 176.72 1blq h MET 46 N -0.37 0.00 -0.53 4.17 -0.00 -1.83 -3.26 114.93 113.11 1blq h MET 46 Ca -0.34 0.00 0.09 0.00 -0.00 0.00 0.00 59.70 59.45 1blq h MET 46 Cb 1.72 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 33.29 1blq h MET 46 CO 0.01 0.21 0.36 0.07 -0.00 0.00 0.00 176.91 177.56 1blq h ARG 47 N 0.00 0.34 0.00 -0.10 -0.00 -1.62 -1.60 114.38 111.40 1blq h ARG 47 Ca -0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.94 1blq h ARG 47 Cb 1.21 -0.08 0.00 0.00 -0.00 0.00 0.00 29.97 31.10 1blq h ARG 47 CO 0.03 0.23 0.00 -1.33 -0.00 0.00 0.00 179.97 178.90 1blq n MET 48 N -4.47 0.00 -1.06 0.08 2.81 -1.23 -2.47 117.12 110.78 1blq n MET 48 Ca 0.08 0.10 -0.20 0.00 -1.81 0.00 0.00 57.70 55.87 1blq n MET 48 Cb 0.35 -0.64 0.02 0.00 -0.71 0.00 0.00 33.22 32.23 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 -0.24 6.54 0.00 4.03 -0.00 -1.23 -4.74 117.00 121.35 1blq n LEU 49 Ca 0.00 -3.54 0.00 0.00 -0.00 0.00 0.00 56.01 52.47 1blq n LEU 49 Cb 0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 43.42 42.32 1blq n LEU 49 CO 0.00 1.36 0.00 0.61 -0.00 0.00 0.00 177.39 179.36 1blq n GLY 50 N 0.42 3.77 3.01 1.47 0.00 -0.60 -5.10 105.19 108.15 1blq n GLY 50 Ca 0.36 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 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 2.63 0.26 0.17 1.61 -1.52 -1.25 -4.95 119.66 116.62 1blq s GLN 51 Ca 0.00 -0.20 -0.32 0.00 -1.95 0.00 0.00 55.36 52.89 1blq s GLN 51 Cb 0.00 0.11 -0.11 0.00 -0.22 0.00 0.00 33.01 32.78 1blq s GLN 51 CO 0.00 -0.05 1.78 0.09 -0.25 0.00 0.00 175.29 176.86 1blq n ASN 52 N 2.25 4.06 -4.96 5.90 3.02 -1.26 -4.28 115.26 119.97 1blq n ASN 52 Ca -0.18 1.03 -0.22 0.00 -0.03 0.00 0.00 54.58 55.18 1blq n ASN 52 Cb 0.57 -1.57 0.03 0.00 -0.61 0.00 0.00 39.78 38.21 1blq n ASN 52 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1blq s PRO 53 N 1.86 2.62 0.18 3.52 0.04 -1.26 -5.07 135.00 136.89 1blq s PRO 53 Ca 0.78 -0.67 -0.00 0.00 0.04 0.00 0.00 61.00 61.15 1blq s PRO 53 Cb -0.49 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 31.54 1blq s PRO 53 CO 0.34 -0.67 0.36 0.99 0.04 0.00 0.00 177.00 178.06 1blq s THR 54 N -2.77 5.24 0.45 1.26 2.01 -1.26 -4.96 115.64 115.61 1blq s THR 54 Ca 0.56 -0.42 0.12 0.00 0.31 0.00 0.00 61.69 62.26 1blq s THR 54 Cb -0.10 -3.73 0.28 0.00 0.01 0.00 0.00 72.50 68.97 1blq s THR 54 CO 0.39 -0.13 2.07 0.50 -0.69 0.00 0.00 174.62 176.76 1blq h LYS 55 N 2.12 0.33 0.00 4.92 3.64 -1.99 -0.32 116.57 125.26 1blq h LYS 55 Ca -0.48 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 58.78 1blq h LYS 55 Cb 1.19 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 1blq h LYS 55 CO 0.69 0.22 -0.86 1.49 -2.27 0.00 0.00 179.45 178.71 1blq h GLU 56 N 0.34 0.00 -0.55 1.90 4.81 -1.99 -3.32 114.58 115.76 1blq h GLU 56 Ca 0.13 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.42 1blq h GLU 56 Cb 0.11 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.44 1blq h GLU 56 CO -0.03 0.31 0.27 1.49 -0.73 0.00 0.00 179.01 180.32 1blq h GLU 57 N 0.00 0.50 0.00 1.92 4.57 -1.43 0.11 114.58 120.25 1blq h GLU 57 Ca -0.06 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1blq h GLU 57 Cb 1.37 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1blq h GLU 57 CO 0.04 0.33 -0.09 -0.07 -1.18 0.00 0.00 179.01 178.05 1blq h LEU 58 N 0.51 0.00 -2.17 1.64 -0.00 -1.63 -2.21 115.31 111.45 1blq h LEU 58 Ca 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.12 1blq h LEU 58 Cb 0.19 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.84 1blq h LEU 58 CO -0.19 0.09 -0.06 -0.78 -0.00 0.00 0.00 178.44 177.50 1blq h ASP 59 N 0.00 0.00 0.44 -0.43 1.82 -0.88 -1.85 116.42 115.52 1blq h ASP 59 Ca -0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.62 1blq h ASP 59 Cb 0.50 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.51 1blq h ASP 59 CO 0.01 0.06 -0.21 0.00 -1.61 0.00 0.00 179.24 177.49 1blq h ALA 60 N 1.94 -0.64 -0.52 -0.78 0.00 -1.30 -1.47 119.26 116.49 1blq h ALA 60 Ca -0.00 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1blq h ALA 60 Cb 0.24 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1blq h ALA 60 CO 0.01 -0.60 0.35 0.82 0.00 0.00 0.00 179.25 179.84 1blq h ILE 61 N -1.06 0.89 -0.62 0.00 5.03 -1.67 -0.03 117.51 120.04 1blq h ILE 61 Ca -0.06 -0.10 -0.08 0.00 -0.12 0.00 0.00 64.86 64.49 1blq h ILE 61 Cb 0.45 0.55 -0.02 0.00 -3.03 0.00 0.00 36.82 34.77 1blq h ILE 61 CO 0.10 0.06 0.08 0.40 -0.68 0.00 0.00 178.15 178.10 1blq h ILE 62 N 0.31 1.26 0.00 -0.67 2.04 -1.29 -1.08 117.51 118.08 1blq h ILE 62 Ca 0.24 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1blq h ILE 62 Cb 0.55 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1blq h ILE 62 CO -0.05 0.39 0.00 1.21 0.00 0.00 0.00 178.15 179.69 1blq n GLU 63 N -4.25 0.11 0.25 2.37 2.13 -0.04 0.06 120.64 121.27 1blq n GLU 63 Ca 0.03 0.55 0.09 0.00 0.66 0.00 0.00 57.16 58.49 1blq n GLU 63 Cb 0.30 -1.82 0.62 0.00 0.27 0.00 0.00 31.44 30.81 1blq n GLU 63 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1blq h GLU 64 N 0.00 0.00 0.00 5.31 4.57 -1.02 -3.39 114.58 120.05 1blq h GLU 64 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1blq h GLU 64 Cb 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1blq h GLU 64 CO 0.00 0.13 0.00 1.33 -1.18 0.00 0.00 179.01 179.29 1blq n VAL 65 N -4.11 0.00 -0.44 0.32 0.24 -0.68 -5.03 118.33 108.62 1blq n VAL 65 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1blq n VAL 65 Cb 0.21 -0.17 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 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 -1.93 0.00 0.00 -1.34 5.75 0.11 -4.72 116.55 114.42 1blq n ASP 66 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1blq n ASP 66 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1blq n ASP 66 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1blq n GLU 67 N -0.10 0.00 0.00 0.11 -0.58 -1.26 -4.37 120.64 114.43 1blq n GLU 67 Ca 0.00 0.56 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 1blq n GLU 67 Cb 0.00 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.54 1blq n GLU 67 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1blq n ASP 68 N -1.88 0.64 -3.81 1.62 8.00 -1.26 -4.87 116.55 115.00 1blq n ASP 68 Ca 0.00 -1.30 -0.42 0.00 0.71 0.00 0.00 54.79 53.78 1blq n ASP 68 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.11 1blq n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1blq n GLY 69 N -0.15 5.45 3.20 0.44 0.00 -1.26 -4.95 105.19 107.92 1blq n GLY 69 Ca 0.00 -2.50 -0.07 0.00 0.00 0.00 0.00 46.02 43.46 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 1.24 -1.22 0.00 1.61 2.88 -1.26 0.17 113.62 117.04 1blq n SER 70 Ca 0.39 -1.44 0.00 0.00 -1.33 0.00 0.00 58.87 56.49 1blq n SER 70 Cb 0.30 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 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 5.03 1.82 3.48 0.46 0.00 -1.26 -5.05 105.19 109.67 1blq n GLY 71 Ca 0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 -0.00 2.61 -1.32 0.13 -2.17 115.64 112.88 1blq s THR 72 Ca 0.00 -0.12 -0.03 0.00 -1.21 0.00 0.00 61.69 60.33 1blq s THR 72 Cb 0.00 -1.12 -0.00 0.00 -1.51 0.00 0.00 72.50 69.86 1blq s THR 72 CO 0.00 0.00 0.06 -0.63 -2.21 0.00 0.00 174.62 171.84 1blq s ILE 73 N -3.75 0.06 0.08 5.08 1.01 -0.55 -4.70 121.20 118.43 1blq s ILE 73 Ca 0.02 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.19 1blq s ILE 73 Cb -0.02 -0.26 0.01 0.00 0.01 0.00 0.00 42.46 42.21 1blq s ILE 73 CO -0.10 -0.27 0.11 -0.67 0.00 0.00 0.00 174.94 174.00 1blq n ASP 74 N 2.10 0.27 0.13 3.58 2.03 -1.26 -2.48 116.55 120.92 1blq n ASP 74 Ca -0.19 -1.20 0.12 0.00 0.52 0.00 0.00 54.79 54.04 1blq n ASP 74 Cb 0.57 -0.06 0.06 0.00 -0.72 0.00 0.00 41.12 40.97 1blq n ASP 74 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1blq h PHE 75 N -0.02 0.00 -0.34 -0.67 -0.00 -1.95 -3.16 116.94 110.80 1blq h PHE 75 Ca -0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 57.97 57.87 1blq h PHE 75 Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.10 1blq h PHE 75 CO 0.00 0.00 -0.02 1.49 -0.00 0.00 0.00 178.31 179.78 1blq h GLU 76 N 0.00 0.61 -0.02 6.09 4.81 -1.95 -3.17 114.58 120.96 1blq h GLU 76 Ca 0.00 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1blq h GLU 76 Cb 0.98 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.31 1blq h GLU 76 CO 0.00 0.75 -0.08 0.93 -0.73 0.00 0.00 179.01 179.88 1blq h GLU 77 N 0.42 0.09 -1.73 1.92 3.07 -1.97 -3.10 114.58 113.28 1blq h GLU 77 Ca 0.09 -0.07 0.50 0.00 -0.50 0.00 0.00 59.36 59.39 1blq h GLU 77 Cb 0.48 0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 28.33 1blq h GLU 77 CO 0.02 0.70 1.33 0.34 -1.40 0.00 0.00 179.01 180.01 1blq n PHE 78 N -4.69 0.00 0.13 4.33 7.35 -1.19 -0.31 117.46 123.07 1blq n PHE 78 Ca -0.09 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.54 1blq n PHE 78 Cb 0.36 -0.43 -0.03 0.00 0.35 0.00 0.00 39.48 39.73 1blq n PHE 78 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1blq h LEU 79 N 0.00 -0.35 -1.41 -2.13 4.07 -1.51 -1.86 115.31 112.12 1blq h LEU 79 Ca 0.82 0.01 0.16 0.00 0.08 0.00 0.00 57.88 58.96 1blq h LEU 79 Cb 3.48 0.09 -0.02 0.00 1.08 0.00 0.00 40.66 45.29 1blq h LEU 79 CO -0.01 0.06 0.80 1.62 -1.08 0.00 0.00 178.44 179.82 1blq h VAL 80 N -1.02 0.14 0.09 1.22 3.04 -0.75 0.20 116.25 119.16 1blq h VAL 80 Ca -0.04 0.00 -0.25 0.00 -1.01 0.00 0.00 66.70 65.40 1blq h VAL 80 Cb 0.31 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 29.92 1blq h VAL 80 CO 0.07 0.00 -1.27 -0.03 -1.01 0.00 0.00 177.57 175.33 1blq h MET 81 N 0.00 0.20 0.00 4.17 1.85 -1.40 -3.26 114.93 116.49 1blq h MET 81 Ca 0.27 -0.34 -0.00 0.00 -0.61 0.00 0.00 59.70 59.02 1blq h MET 81 Cb 1.86 0.13 -0.00 0.00 0.43 0.00 0.00 31.60 34.01 1blq h MET 81 CO -0.00 1.16 -0.01 0.52 -0.40 0.00 0.00 176.91 178.18 1blq h MET 82 N -0.44 0.00 0.00 0.39 2.07 0.23 -0.39 114.93 116.79 1blq h MET 82 Ca -0.28 0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.28 1blq h MET 82 Cb 1.64 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 31.36 1blq h MET 82 CO 0.03 0.01 -0.62 0.28 1.07 0.00 0.00 176.91 177.67 1blq h VAL 83 N 0.00 0.44 0.00 -2.22 2.07 -1.41 -3.38 116.25 111.75 1blq h VAL 83 Ca -0.00 -1.68 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1blq h VAL 83 Cb 0.08 2.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1blq h VAL 83 CO 0.00 0.25 0.00 0.54 0.02 0.00 0.00 177.57 178.38 1blq n ARG 84 N -3.05 0.00 -2.89 1.57 1.74 -0.18 -4.70 116.66 109.16 1blq n ARG 84 Ca 0.00 0.13 -0.43 0.00 -0.77 0.00 0.00 57.85 56.78 1blq n ARG 84 Cb 0.67 -0.58 -0.04 0.00 -1.02 0.00 0.00 32.46 31.50 1blq n ARG 84 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1blq s GLN 85 N -0.32 3.11 0.31 5.56 0.74 -1.08 -5.02 119.66 122.96 1blq s GLN 85 Ca 0.00 -0.92 -0.08 0.00 0.05 0.00 0.00 55.36 54.41 1blq s GLN 85 Cb 0.00 -4.25 -0.06 0.00 1.10 0.00 0.00 33.01 29.80 1blq s GLN 85 CO 0.00 -1.78 0.63 -1.64 -0.55 0.00 0.00 175.29 171.95 1blq s MET 86 N 3.87 3.74 0.14 1.67 -1.94 -1.26 -4.72 119.30 120.79 1blq s MET 86 Ca 0.21 0.25 0.27 0.00 -1.71 0.00 0.00 55.69 54.71 1blq s MET 86 Cb -0.17 -2.55 0.90 0.00 2.01 0.00 0.00 34.83 35.01 1blq s MET 86 CO 0.09 0.16 1.78 1.63 -0.01 0.00 0.00 175.02 178.67 1blq n LYS 87 N -0.83 0.18 0.13 2.03 5.02 -1.26 -2.29 118.16 121.14 1blq n LYS 87 Ca 0.00 0.14 0.19 0.00 -2.02 0.00 0.00 58.31 56.62 1blq n LYS 87 Cb 0.54 -1.70 0.69 0.00 -0.02 0.00 0.00 35.03 34.53 1blq n LYS 87 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1blq h GLU 88 N 0.00 0.00 0.00 1.97 -0.00 -2.00 -3.29 114.58 111.27 1blq h GLU 88 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.36 59.27 1blq h GLU 88 Cb 0.66 0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 29.32 1blq h GLU 88 CO 0.00 0.00 0.17 -3.47 -0.00 0.00 0.00 179.01 175.71 1blq n ASP 89 N -3.38 -1.15 0.00 3.06 -0.08 -1.22 -5.32 116.55 108.46 1blq n ASP 89 Ca 0.07 -1.68 0.00 0.00 -1.51 0.00 0.00 54.79 51.66 1blq n ASP 89 Cb 0.69 1.02 0.00 0.00 2.34 0.00 0.00 41.12 45.18 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32