#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 -1.13 0.00 7.64 -1.26 -4.93 113.62 113.94 1blq n SER 2 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1blq n SER 2 Cb 0.00 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.42 1blq n SER 2 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1blq n MET 3 N 0.00 2.17 0.00 1.43 3.85 -1.26 -4.62 117.12 118.69 1blq n MET 3 Ca 0.00 -3.07 0.00 0.00 -1.00 0.00 0.00 57.70 53.63 1blq n MET 3 Cb 0.00 -1.84 0.00 0.00 -1.05 0.00 0.00 33.22 30.33 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 -0.95 0.00 0.24 3.17 -1.04 -1.26 -4.22 114.28 110.22 1blq n THR 4 Ca 0.31 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.47 1blq n THR 4 Cb 1.03 -0.28 0.65 0.00 -1.82 0.00 0.00 70.33 69.91 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 -0.62 8.00 1.82 -1.99 -1.21 116.42 122.42 1blq h ASP 5 Ca 0.00 0.00 0.13 0.00 -0.39 0.00 0.00 57.03 56.77 1blq h ASP 5 Cb 0.00 0.00 -0.11 0.00 0.68 0.00 0.00 39.33 39.90 1blq h ASP 5 CO 0.00 0.00 -0.02 -0.61 -1.61 0.00 0.00 179.24 177.00 1blq h GLN 6 N 0.00 0.10 -0.00 0.28 4.15 -1.82 0.13 115.11 117.95 1blq h GLN 6 Ca 0.08 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1blq h GLN 6 Cb 1.11 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.78 1blq h GLN 6 CO -0.00 0.06 -0.42 0.00 -1.93 0.00 0.00 178.83 176.55 1blq n GLN 7 N -5.30 0.16 -0.08 1.69 10.64 -0.47 -3.95 117.38 120.08 1blq n GLN 7 Ca 0.09 -0.09 -0.13 0.00 -1.83 0.00 0.00 57.00 55.04 1blq n GLN 7 Cb 0.35 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.23 1blq n GLN 7 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1blq h ALA 8 N 3.13 0.57 -0.15 2.61 0.00 -0.68 -2.28 119.26 122.47 1blq h ALA 8 Ca 0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 1blq h ALA 8 Cb 0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1blq h ALA 8 CO 0.00 0.68 -0.32 0.93 0.00 0.00 0.00 179.25 180.54 1blq h GLU 9 N 0.66 0.29 -0.17 0.00 5.08 -1.56 -2.64 114.58 116.23 1blq h GLU 9 Ca 0.03 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 1blq h GLU 9 Cb 1.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1blq h GLU 9 CO 0.11 0.59 -0.35 0.00 -1.00 0.00 0.00 179.01 178.35 1blq h ALA 10 N 1.41 0.28 -0.27 3.43 0.00 -1.69 -3.04 119.26 119.37 1blq h ALA 10 Ca 0.03 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1blq h ALA 10 Cb 0.70 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1blq h ALA 10 CO 0.05 0.34 0.17 -0.09 0.00 0.00 0.00 179.25 179.73 1blq h ARG 11 N 0.20 0.35 -0.59 0.00 2.43 -1.29 -2.32 114.38 113.17 1blq h ARG 11 Ca 0.00 -0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.27 1blq h ARG 11 Cb 0.95 -0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 30.32 1blq h ARG 11 CO 0.08 0.24 -0.03 0.00 -1.51 0.00 0.00 179.97 178.75 1blq h ALA 12 N 1.83 0.54 -0.24 2.80 0.00 -1.35 -1.11 119.26 121.73 1blq h ALA 12 Ca 0.10 0.19 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1blq h ALA 12 Cb -0.04 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1blq h ALA 12 CO -0.02 -0.40 -0.12 0.35 0.00 0.00 0.00 179.25 179.06 1blq h PHE 13 N 0.09 0.58 -0.81 0.00 3.57 -1.53 -3.34 116.94 115.50 1blq h PHE 13 Ca 0.30 -0.15 -0.63 0.00 3.53 0.00 0.00 57.97 61.02 1blq h PHE 13 Cb 0.48 -0.13 -0.08 0.00 2.79 0.00 0.00 35.95 39.01 1blq h PHE 13 CO -0.38 0.77 2.06 -0.51 -2.23 0.00 0.00 178.31 178.02 1blq s LEU 14 N -9.21 3.73 0.96 0.59 1.43 -0.42 -4.97 118.68 110.80 1blq s LEU 14 Ca -0.13 -2.34 -0.15 0.00 -1.03 0.00 0.00 54.13 50.48 1blq s LEU 14 Cb 0.07 -2.58 0.09 0.00 0.03 0.00 0.00 46.19 43.80 1blq s LEU 14 CO 0.77 -1.42 -0.02 -1.20 0.23 0.00 0.00 176.35 174.72 1blq n SER 15 N 9.17 -2.76 0.28 2.29 7.64 -1.25 -4.15 113.62 124.85 1blq n SER 15 Ca 0.48 -0.24 0.13 0.00 1.01 0.00 0.00 58.87 60.25 1blq n SER 15 Cb 0.46 -0.73 0.82 0.00 -1.01 0.00 0.00 64.21 63.75 1blq n SER 15 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1blq h GLU 16 N -2.28 0.00 -0.02 1.43 5.08 -1.93 -0.91 114.58 115.95 1blq h GLU 16 Ca -0.28 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.91 1blq h GLU 16 Cb 0.86 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1blq h GLU 16 CO 0.18 0.03 -0.74 1.49 -1.00 0.00 0.00 179.01 178.97 1blq h GLU 17 N 0.00 0.16 -0.00 2.33 4.57 -1.99 -1.37 114.58 118.28 1blq h GLU 17 Ca -0.00 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 57.98 1blq h GLU 17 Cb 0.07 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1blq h GLU 17 CO 0.00 0.83 -0.24 0.52 -1.18 0.00 0.00 179.01 178.94 1blq h MET 18 N 0.10 0.17 -0.59 1.92 2.86 -1.44 -2.67 114.93 115.28 1blq h MET 18 Ca -0.02 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.40 1blq h MET 18 Cb 1.31 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.99 1blq h MET 18 CO 0.11 0.91 0.20 0.82 1.06 0.00 0.00 176.91 180.01 1blq h ILE 19 N -0.50 1.24 -0.22 -1.22 2.04 -1.43 -0.78 117.51 116.65 1blq h ILE 19 Ca -0.03 -0.79 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 1blq h ILE 19 Cb 0.99 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1blq h ILE 19 CO 0.05 0.30 0.13 0.00 0.00 0.00 0.00 178.15 178.63 1blq h ALA 20 N 1.06 1.82 0.00 1.87 0.00 -1.31 -0.73 119.26 121.97 1blq h ALA 20 Ca 0.19 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1blq h ALA 20 Cb 0.26 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1blq h ALA 20 CO -0.01 0.16 -0.73 1.49 0.00 0.00 0.00 179.25 180.16 1blq h GLU 21 N 0.30 0.00 -0.11 0.00 4.57 -1.01 -3.22 114.58 115.10 1blq h GLU 21 Ca 0.08 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.13 1blq h GLU 21 Cb -0.01 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1blq h GLU 21 CO -0.02 0.73 -0.51 0.74 -1.18 0.00 0.00 179.01 178.77 1blq h PHE 22 N 0.00 0.38 -0.48 0.92 0.04 0.29 -3.16 116.94 114.92 1blq h PHE 22 Ca -0.01 -0.13 0.09 0.00 2.80 0.00 0.00 57.97 60.73 1blq h PHE 22 Cb 1.53 -0.08 -0.08 0.00 2.20 0.00 0.00 35.95 39.52 1blq h PHE 22 CO 0.00 0.76 -0.01 -0.22 -0.60 0.00 0.00 178.31 178.24 1blq h LYS 23 N 0.24 0.10 -1.14 1.51 3.64 -1.39 -0.02 116.57 119.52 1blq h LYS 23 Ca 0.01 -0.01 0.40 0.00 -1.27 0.00 0.00 60.65 59.78 1blq h LYS 23 Cb 0.99 -0.02 -0.15 0.00 -0.41 0.00 0.00 32.23 32.64 1blq h LYS 23 CO 0.08 0.07 0.69 0.00 -2.27 0.00 0.00 179.45 178.02 1blq h ALA 24 N 1.44 2.36 0.04 5.00 0.00 -1.70 0.64 119.26 127.04 1blq h ALA 24 Ca 0.24 0.18 -0.28 0.00 0.00 0.00 0.00 54.91 55.04 1blq h ALA 24 Cb 0.36 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1blq h ALA 24 CO -0.41 -1.02 -1.53 0.00 0.00 0.00 0.00 179.25 176.28 1blq h ALA 25 N 1.78 0.52 0.79 0.00 0.00 -1.22 -3.22 119.26 117.91 1blq h ALA 25 Ca 0.80 -1.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1blq h ALA 25 Cb 2.22 0.31 0.00 0.00 0.00 0.00 0.00 17.79 20.33 1blq h ALA 25 CO -0.56 1.37 -0.42 0.35 0.00 0.00 0.00 179.25 179.99 1blq h PHE 26 N 0.02 -1.10 -0.34 0.00 3.57 0.14 -2.08 116.94 117.15 1blq h PHE 26 Ca -0.23 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.32 1blq h PHE 26 Cb 1.96 0.38 -0.06 0.00 2.79 0.00 0.00 35.95 41.02 1blq h PHE 26 CO 0.02 -0.65 -0.08 -0.44 -2.23 0.00 0.00 178.31 174.93 1blq h ASP 27 N -1.11 -0.30 -0.72 0.41 3.32 -1.45 -1.88 116.42 114.70 1blq h ASP 27 Ca -0.11 0.10 0.13 0.00 0.02 0.00 0.00 57.03 57.17 1blq h ASP 27 Cb 0.87 0.20 -0.13 0.00 0.22 0.00 0.00 39.33 40.49 1blq h ASP 27 CO 0.15 -0.11 -0.31 -0.03 -1.72 0.00 0.00 179.24 177.22 1blq h MET 28 N 0.01 -0.09 -0.11 3.56 4.05 -1.53 -1.80 114.93 119.02 1blq h MET 28 Ca 0.16 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.60 1blq h MET 28 Cb 0.25 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.05 1blq h MET 28 CO -0.34 -0.06 -0.10 0.74 0.23 0.00 0.00 176.91 177.38 1blq h PHE 29 N -0.09 -0.30 -2.58 1.39 0.04 -0.61 -3.24 116.94 111.55 1blq h PHE 29 Ca 0.29 0.02 -0.62 0.00 2.80 0.00 0.00 57.97 60.46 1blq h PHE 29 Cb 0.57 0.14 -0.14 0.00 2.20 0.00 0.00 35.95 38.72 1blq h PHE 29 CO -0.68 -0.07 0.64 0.34 -0.60 0.00 0.00 178.31 177.93 1blq s ASP 30 N -3.23 6.19 -0.18 2.17 -1.08 -0.68 -4.83 116.67 115.04 1blq s ASP 30 Ca -0.02 -0.97 -0.09 0.00 -0.52 0.00 0.00 52.55 50.95 1blq s ASP 30 Cb 0.02 -2.44 -0.22 0.00 -1.46 0.00 0.00 42.92 38.82 1blq s ASP 30 CO 0.10 -1.48 0.15 0.00 0.52 0.00 0.00 175.17 174.46 1blq n ALA 31 N 7.91 0.99 -0.31 3.66 0.00 -1.22 -4.23 120.51 127.30 1blq n ALA 31 Ca -0.01 -0.71 0.15 0.00 0.00 0.00 0.00 53.44 52.86 1blq n ALA 31 Cb 0.46 -0.47 0.31 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.29 -0.13 0.00 0.00 1.82 -1.92 -3.44 116.42 112.46 1blq h ASP 32 Ca -0.46 0.23 0.00 0.00 -0.39 0.00 0.00 57.03 56.40 1blq h ASP 32 Cb 1.81 0.34 0.00 0.00 0.68 0.00 0.00 39.33 42.15 1blq h ASP 32 CO -0.06 -0.24 0.00 0.61 -1.61 0.00 0.00 179.24 177.94 1blq n GLY 33 N -1.40 0.27 1.69 -0.78 0.00 -1.26 -5.11 105.19 98.59 1blq n GLY 33 Ca 0.23 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1blq n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1blq n GLY 34 N 0.00 -0.18 0.00 -0.02 0.00 -1.26 -5.08 105.19 98.64 1blq n GLY 34 Ca 0.00 0.00 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 2.13 0.81 3.44 -0.02 0.00 -1.26 -5.12 105.19 105.16 1blq n GLY 35 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1blq n GLY 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1blq s ASP 36 N -1.59 -0.57 -0.06 1.61 -1.08 -1.26 -4.66 116.67 109.06 1blq s ASP 36 Ca 0.00 1.09 0.02 0.00 -0.52 0.00 0.00 52.55 53.14 1blq s ASP 36 Cb 0.00 1.09 -0.03 0.00 -1.46 0.00 0.00 42.92 42.52 1blq s ASP 36 CO 0.00 -0.19 -0.10 -0.63 0.52 0.00 0.00 175.17 174.77 1blq s ILE 37 N 0.41 3.41 0.26 4.11 1.09 -0.66 -4.66 121.20 125.15 1blq s ILE 37 Ca -0.01 -0.59 0.01 0.00 -1.10 0.00 0.00 60.65 58.96 1blq s ILE 37 Cb -0.04 -2.37 -0.05 0.00 -1.06 0.00 0.00 42.46 38.94 1blq s ILE 37 CO -0.01 0.59 0.10 -0.44 -0.10 0.00 0.00 174.94 175.08 1blq s SER 38 N -0.76 1.24 0.54 3.58 0.01 -1.26 -3.36 113.70 113.69 1blq s SER 38 Ca 0.12 -1.38 0.25 0.00 1.31 0.00 0.00 55.95 56.24 1blq s SER 38 Cb -0.11 0.15 1.54 0.00 0.21 0.00 0.00 66.02 67.82 1blq s SER 38 CO 0.01 -0.73 2.16 0.00 0.41 0.00 0.00 173.24 175.09 1blq h THR 39 N 2.37 0.68 -0.09 1.44 1.03 -1.93 0.77 112.91 117.19 1blq h THR 39 Ca -0.38 -0.22 -0.21 0.00 -0.01 0.00 0.00 66.41 65.59 1blq h THR 39 Cb 1.25 1.13 0.00 0.00 -1.07 0.00 0.00 68.15 69.46 1blq h THR 39 CO 0.61 0.05 -0.80 0.50 -0.01 0.00 0.00 175.52 175.88 1blq h LYS 40 N 0.00 0.56 0.00 0.00 3.64 -1.92 -1.53 116.57 117.32 1blq h LYS 40 Ca -0.00 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1blq h LYS 40 Cb 0.13 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1blq h LYS 40 CO 0.01 1.11 -0.12 1.49 -2.27 0.00 0.00 179.45 179.67 1blq h GLU 41 N 0.37 0.00 0.00 1.90 4.57 -1.73 -3.29 114.58 116.40 1blq h GLU 41 Ca -0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1blq h GLU 41 Cb 1.41 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.00 1blq h GLU 41 CO 0.15 0.00 0.06 1.37 -1.18 0.00 0.00 179.01 179.41 1blq h LEU 42 N -0.36 0.00 -0.10 1.64 8.10 -1.07 -0.96 115.31 122.57 1blq h LEU 42 Ca 0.00 0.00 -0.24 0.00 0.11 0.00 0.00 57.88 57.75 1blq h LEU 42 Cb 0.12 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.35 1blq h LEU 42 CO 0.00 0.00 -0.95 1.23 -4.11 0.00 0.00 178.44 174.61 1blq h GLY 43 N 0.00 0.72 0.81 0.17 0.00 -1.36 -3.18 103.07 100.23 1blq h GLY 43 Ca 0.00 -1.19 -0.28 0.00 0.00 0.00 0.00 47.33 45.86 1blq h GLY 43 CO 0.00 1.05 -1.36 -0.91 0.00 0.00 0.00 176.54 175.32 1blq h THR 44 N 0.39 1.17 -1.01 4.70 1.35 -1.26 -2.10 112.91 116.15 1blq h THR 44 Ca -0.10 -2.52 0.24 0.00 -0.55 0.00 0.00 66.41 63.48 1blq h THR 44 Cb 1.58 2.91 -0.10 0.00 -1.73 0.00 0.00 68.15 70.81 1blq h THR 44 CO 0.18 0.76 0.63 0.58 -0.25 0.00 0.00 175.52 177.43 1blq h VAL 45 N -0.14 0.59 0.11 6.82 2.07 -1.51 0.10 116.25 124.29 1blq h VAL 45 Ca -0.27 -0.18 -0.33 0.00 0.82 0.00 0.00 66.70 66.74 1blq h VAL 45 Cb 1.89 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1blq h VAL 45 CO 0.15 0.10 -1.79 0.24 0.02 0.00 0.00 177.57 176.29 1blq h MET 46 N 0.53 0.23 0.00 1.57 2.07 -1.65 -3.32 114.93 114.36 1blq h MET 46 Ca 0.59 -0.39 0.00 0.00 -2.07 0.00 0.00 59.70 57.83 1blq h MET 46 Cb 1.26 0.15 0.00 0.00 -1.87 0.00 0.00 31.60 31.14 1blq h MET 46 CO -0.34 1.19 0.00 -2.13 1.07 0.00 0.00 176.91 176.69 1blq n ARG 47 N -3.71 0.09 0.00 1.72 0.63 -0.79 -2.64 116.66 111.96 1blq n ARG 47 Ca -0.31 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 1blq n ARG 47 Cb 0.97 -1.76 0.00 0.00 0.45 0.00 0.00 32.46 32.12 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 -1.94 0.00 -0.53 -0.14 2.81 0.28 -2.87 117.12 114.73 1blq n MET 48 Ca -0.00 0.19 0.44 0.00 -1.81 0.00 0.00 57.70 56.52 1blq n MET 48 Cb 0.04 -0.82 0.77 0.00 -0.71 0.00 0.00 33.22 32.50 1blq n MET 48 CO 0.00 0.00 0.00 1.37 1.51 0.00 0.00 175.97 178.85 1blq h LEU 49 N 0.00 0.05 0.00 4.03 8.10 -1.71 -3.40 115.31 122.38 1blq h LEU 49 Ca 0.00 0.02 0.00 0.00 0.11 0.00 0.00 57.88 58.01 1blq h LEU 49 Cb 0.00 0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.24 1blq h LEU 49 CO 0.00 -0.02 0.00 0.61 -4.11 0.00 0.00 178.44 174.92 1blq n GLY 50 N -1.80 3.76 0.00 0.17 0.00 -1.08 -5.10 105.19 101.13 1blq n GLY 50 Ca 0.37 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.34 1.61 7.27 -1.14 -4.71 117.38 120.07 1blq n GLN 51 Ca 0.00 0.00 0.13 0.00 0.07 0.00 0.00 57.00 57.20 1blq n GLN 51 Cb 0.00 0.00 0.26 0.00 2.41 0.00 0.00 30.24 32.91 1blq n GLN 51 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 1blq h ASN 52 N 0.00 -0.53 -0.59 1.69 4.21 -1.88 -3.20 115.58 115.28 1blq h ASN 52 Ca 0.00 0.28 -0.26 0.00 1.21 0.00 0.00 56.30 57.52 1blq h ASN 52 Cb 0.00 0.49 -0.04 0.00 -1.12 0.00 0.00 38.32 37.65 1blq h ASN 52 CO 0.00 -0.34 0.72 -2.16 -1.29 0.00 0.00 177.43 174.37 1blq s PRO 53 N -6.05 2.39 0.75 0.81 0.04 -1.26 -4.92 135.00 126.76 1blq s PRO 53 Ca -0.13 -0.46 -0.11 0.00 0.04 0.00 0.00 61.00 60.34 1blq s PRO 53 Cb 0.28 -5.08 0.05 0.00 0.04 0.00 0.00 34.50 29.79 1blq s PRO 53 CO 0.78 -3.74 1.09 0.99 0.04 0.00 0.00 177.00 176.16 1blq s THR 54 N 11.09 3.33 0.44 1.26 2.01 -1.21 -4.00 115.64 128.57 1blq s THR 54 Ca 0.72 0.46 0.13 0.00 0.31 0.00 0.00 61.69 63.31 1blq s THR 54 Cb -0.06 -2.96 0.31 0.00 0.01 0.00 0.00 72.50 69.81 1blq s THR 54 CO 0.05 -0.54 2.02 0.50 -0.69 0.00 0.00 174.62 175.95 1blq h LYS 55 N -0.94 0.37 0.00 4.92 3.64 -1.89 0.57 116.57 123.23 1blq h LYS 55 Ca -0.44 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.91 1blq h LYS 55 Cb 1.23 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1blq h LYS 55 CO 0.52 0.24 -1.03 -0.85 -2.27 0.00 0.00 179.45 176.06 1blq n GLU 56 N -4.47 0.61 0.26 1.90 -0.00 -1.26 -3.78 120.64 113.90 1blq n GLU 56 Ca 0.07 0.13 0.13 0.00 -0.00 0.00 0.00 57.16 57.49 1blq n GLU 56 Cb 0.28 -1.83 0.70 0.00 -0.00 0.00 0.00 31.44 30.60 1blq n GLU 56 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 1blq h GLU 57 N 0.00 0.00 0.00 3.44 4.57 -1.22 -1.51 114.58 119.86 1blq h GLU 57 Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1blq h GLU 57 Cb 1.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1blq h GLU 57 CO 0.00 0.13 -0.61 -0.07 -1.18 0.00 0.00 179.01 177.28 1blq h LEU 58 N 0.00 0.00 -1.14 1.64 -0.00 -1.57 -3.28 115.31 110.97 1blq h LEU 58 Ca -0.00 -0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.70 1blq h LEU 58 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 1blq h LEU 58 CO 0.02 0.09 0.00 -0.78 -0.00 0.00 0.00 178.44 177.77 1blq h ASP 59 N 0.00 0.00 -0.22 -0.43 1.82 -1.40 -2.47 116.42 113.71 1blq h ASP 59 Ca 0.00 0.00 -0.15 0.00 -0.39 0.00 0.00 57.03 56.49 1blq h ASP 59 Cb 0.77 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.78 1blq h ASP 59 CO 0.00 0.00 -0.46 0.00 -1.61 0.00 0.00 179.24 177.17 1blq h ALA 60 N 2.02 0.36 -0.07 -0.78 0.00 -1.61 -0.47 119.26 118.71 1blq h ALA 60 Ca 0.00 -0.48 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 1blq h ALA 60 Cb 0.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1blq h ALA 60 CO 0.00 0.50 -0.82 0.82 0.00 0.00 0.00 179.25 179.75 1blq h ILE 61 N 0.42 1.35 0.00 0.00 5.03 -1.72 -2.85 117.51 119.74 1blq h ILE 61 Ca 0.01 -2.18 0.00 0.00 -0.12 0.00 0.00 64.86 62.57 1blq h ILE 61 Cb 1.06 2.17 0.00 0.00 -3.03 0.00 0.00 36.82 37.03 1blq h ILE 61 CO 0.10 0.66 0.00 0.40 -0.68 0.00 0.00 178.15 178.64 1blq h ILE 62 N 0.34 0.00 0.00 -0.67 1.08 -1.42 -2.40 117.51 114.45 1blq h ILE 62 Ca -0.06 -0.45 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 1blq h ILE 62 Cb 1.43 1.35 0.00 0.00 -3.07 0.00 0.00 36.82 36.53 1blq h ILE 62 CO 0.15 0.00 -0.13 -0.08 -0.69 0.00 0.00 178.15 177.40 1blq h GLU 63 N 0.00 0.00 0.00 2.37 4.81 -0.83 0.19 114.58 121.12 1blq h GLU 63 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1blq h GLU 63 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1blq h GLU 63 CO 0.00 0.00 0.00 -0.85 -0.73 0.00 0.00 179.01 177.43 1blq n GLU 64 N -2.29 0.03 0.05 1.92 -0.00 -0.90 -4.49 120.64 114.94 1blq n GLU 64 Ca 0.05 0.01 0.00 0.00 -0.00 0.00 0.00 57.16 57.22 1blq n GLU 64 Cb 0.44 -1.50 0.00 0.00 -0.00 0.00 0.00 31.44 30.38 1blq n GLU 64 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1blq n VAL 65 N -1.49 0.03 0.00 3.84 0.24 -1.19 -5.05 118.33 114.72 1blq n VAL 65 Ca 0.07 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1blq n VAL 65 Cb 0.33 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 1blq n VAL 65 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1blq n ASP 66 N -2.84 0.00 0.00 -1.34 -0.08 0.65 -4.99 116.55 107.94 1blq n ASP 66 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1blq n ASP 66 Cb 0.02 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.48 1blq n ASP 66 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1blq n GLU 67 N 0.00 0.00 0.00 -0.67 1.02 -1.24 -4.79 120.64 114.96 1blq n GLU 67 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1blq n GLU 67 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1blq n GLU 67 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1blq n ASP 68 N 0.00 0.16 0.00 1.62 2.03 -1.26 -4.84 116.55 114.25 1blq n ASP 68 Ca 0.00 -0.49 0.00 0.00 0.52 0.00 0.00 54.79 54.82 1blq n ASP 68 Cb 0.00 0.49 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 1blq n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1blq n GLY 69 N 0.49 0.40 2.03 0.27 0.00 -1.26 -5.06 105.19 102.06 1blq n GLY 69 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -0.67 -4.23 1.61 2.88 -1.26 -4.96 113.62 106.99 1blq n SER 70 Ca 0.00 0.26 -0.42 0.00 -1.33 0.00 0.00 58.87 57.38 1blq n SER 70 Cb 0.00 0.79 -0.00 0.00 -0.75 0.00 0.00 64.21 64.24 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 0.45 3.24 0.00 0.46 0.00 -1.26 -4.92 105.19 103.16 1blq n GLY 71 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1blq n GLY 71 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1blq n THR 72 N 5.94 0.00 -4.07 2.61 -2.24 -1.26 -3.35 114.28 111.91 1blq n THR 72 Ca 0.50 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 62.20 1blq n THR 72 Cb 0.43 -0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.22 1blq n THR 72 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1blq s ILE 73 N 0.00 0.28 0.00 2.28 -5.25 -1.21 -4.82 121.20 112.47 1blq s ILE 73 Ca 0.00 -1.54 0.00 0.00 -0.99 0.00 0.00 60.65 58.12 1blq s ILE 73 Cb 0.00 -1.15 0.00 0.00 2.95 0.00 0.00 42.46 44.26 1blq s ILE 73 CO 0.00 -0.81 0.00 0.47 -1.79 0.00 0.00 174.94 172.81 1blq n ASP 74 N 0.57 0.00 0.00 4.36 9.92 -1.26 -1.66 116.55 128.48 1blq n ASP 74 Ca -0.17 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.04 1blq n ASP 74 Cb 0.59 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.95 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 1.00 0.05 1.24 -1.74 -1.26 -3.01 117.46 113.74 1blq n PHE 75 Ca 0.00 0.35 -0.03 0.00 -0.56 0.00 0.00 57.45 57.21 1blq n PHE 75 Cb 0.00 -1.14 -0.02 0.00 1.52 0.00 0.00 39.48 39.84 1blq n PHE 75 CO 0.00 0.00 0.00 1.49 -0.56 0.00 0.00 176.76 177.69 1blq h GLU 76 N 0.00 -0.21 0.00 3.97 4.81 -1.98 -2.42 114.58 118.76 1blq h GLU 76 Ca -0.23 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1blq h GLU 76 Cb 1.83 0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.25 1blq h GLU 76 CO 0.06 -0.14 0.00 0.93 -0.73 0.00 0.00 179.01 179.14 1blq h GLU 77 N -0.81 0.00 0.00 1.92 5.08 -1.95 -1.24 114.58 117.58 1blq h GLU 77 Ca -0.02 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.11 1blq h GLU 77 Cb 0.16 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1blq h GLU 77 CO 0.04 0.00 -1.19 0.35 -1.00 0.00 0.00 179.01 177.20 1blq h PHE 78 N 0.00 0.00 -0.24 4.33 3.57 -1.57 -3.22 116.94 119.81 1blq h PHE 78 Ca 0.00 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.42 1blq h PHE 78 Cb 0.12 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1blq h PHE 78 CO 0.00 0.98 -0.20 -0.07 -2.23 0.00 0.00 178.31 176.79 1blq h LEU 79 N 0.00 0.42 -0.53 0.59 3.38 -0.69 -2.60 115.31 115.88 1blq h LEU 79 Ca -0.09 -0.12 -0.16 0.00 0.09 0.00 0.00 57.88 57.59 1blq h LEU 79 Cb 1.82 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.45 1blq h LEU 79 CO 0.11 0.63 -0.64 1.62 0.09 0.00 0.00 178.44 180.26 1blq h VAL 80 N 0.39 1.37 0.00 1.22 3.04 -1.61 -2.50 116.25 118.16 1blq h VAL 80 Ca 0.07 -2.01 -0.03 0.00 -1.01 0.00 0.00 66.70 63.72 1blq h VAL 80 Cb 0.57 2.00 -0.00 0.00 -2.01 0.00 0.00 31.29 31.84 1blq h VAL 80 CO 0.04 0.60 -0.13 -0.03 -1.01 0.00 0.00 177.57 177.04 1blq h MET 81 N 0.26 0.00 0.00 4.17 1.85 -1.48 -3.13 114.93 116.60 1blq h MET 81 Ca -0.01 0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 59.01 1blq h MET 81 Cb 1.18 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.20 1blq h MET 81 CO 0.11 0.13 -0.39 0.52 -0.40 0.00 0.00 176.91 176.87 1blq h MET 82 N 0.00 0.00 -1.32 0.39 2.07 -1.25 -3.32 114.93 111.51 1blq h MET 82 Ca -0.00 0.00 0.40 0.00 -2.07 0.00 0.00 59.70 58.03 1blq h MET 82 Cb 0.51 0.00 -0.10 0.00 -1.87 0.00 0.00 31.60 30.14 1blq h MET 82 CO 0.02 0.79 0.88 0.28 1.07 0.00 0.00 176.91 179.95 1blq h VAL 83 N -1.00 0.24 0.00 -2.22 2.07 -1.43 -3.08 116.25 110.83 1blq h VAL 83 Ca -0.10 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1blq h VAL 83 Cb 0.91 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1blq h VAL 83 CO -0.06 0.02 0.00 -1.14 0.02 0.00 0.00 177.57 176.41 1blq n ARG 84 N -4.50 0.00 -2.21 1.57 0.63 -1.19 -2.99 116.66 107.98 1blq n ARG 84 Ca 0.34 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.84 1blq n ARG 84 Cb 1.35 -0.45 -0.00 0.00 0.45 0.00 0.00 32.46 33.81 1blq n ARG 84 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1blq n GLN 85 N 0.00 3.04 -0.09 -0.14 6.02 -1.16 -4.64 117.38 120.41 1blq n GLN 85 Ca 0.00 -2.98 -0.14 0.00 -0.01 0.00 0.00 57.00 53.87 1blq n GLN 85 Cb 0.00 -3.41 -0.07 0.00 1.02 0.00 0.00 30.24 27.78 1blq n GLN 85 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1blq n MET 86 N 7.41 0.51 0.03 -1.09 2.81 -1.16 -4.13 117.12 121.50 1blq n MET 86 Ca 0.50 0.55 -0.06 0.00 -1.81 0.00 0.00 57.70 56.88 1blq n MET 86 Cb 0.43 -1.72 0.12 0.00 -0.71 0.00 0.00 33.22 31.34 1blq n MET 86 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1blq h LYS 87 N -1.00 0.44 -0.72 0.03 2.10 -1.87 -2.00 116.57 113.55 1blq h LYS 87 Ca -0.19 -0.25 0.15 0.00 -2.00 0.00 0.00 60.65 58.37 1blq h LYS 87 Cb 0.92 0.02 -0.13 0.00 -0.90 0.00 0.00 32.23 32.14 1blq h LYS 87 CO -0.11 0.83 -0.08 1.49 -2.00 0.00 0.00 179.45 179.57 1blq h GLU 88 N 0.36 0.05 0.00 0.07 4.57 -1.91 -3.40 114.58 114.32 1blq h GLU 88 Ca 0.02 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1blq h GLU 88 Cb 0.97 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.55 1blq h GLU 88 CO 0.08 0.03 0.00 -3.47 -1.18 0.00 0.00 179.01 174.48 1blq n ASP 89 N -5.40 0.00 0.00 1.04 2.03 -1.17 -5.18 116.55 107.87 1blq n ASP 89 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 1blq n ASP 89 Cb 0.41 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.81 1blq n ASP 89 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28