#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xox n GLY 2 N 0.00 -0.07 3.17 3.17 0.00 -1.26 -5.07 105.19 105.14 1xox n GLY 2 Ca 0.00 0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1xox n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xox s ALA 3 N -3.19 1.18 1.07 4.61 0.00 -1.26 -5.15 121.76 119.02 1xox s ALA 3 Ca 0.13 -1.03 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 1xox s ALA 3 Cb -0.02 -0.08 0.18 0.00 0.00 0.00 0.00 23.12 23.20 1xox s ALA 3 CO 0.37 0.14 0.32 -2.30 0.00 0.00 0.00 175.76 174.29 1xox n PRO 4 N 1.16 -2.43 -2.20 0.00 -0.02 -1.26 -4.92 135.00 125.34 1xox n PRO 4 Ca -0.20 -0.71 -0.33 0.00 -2.02 0.00 0.00 63.50 60.23 1xox n PRO 4 Cb 0.55 -1.55 0.02 0.00 -0.02 0.00 0.00 33.50 32.50 1xox n PRO 4 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1xox n THR 5 N -4.55 2.94 -3.72 3.45 -2.24 -1.26 -5.02 114.28 103.88 1xox n THR 5 Ca 0.06 -4.60 -0.34 0.00 -2.27 0.00 0.00 64.05 56.90 1xox n THR 5 Cb 0.42 -1.25 -0.05 0.00 -2.10 0.00 0.00 70.33 67.35 1xox n THR 5 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1xox s LEU 6 N -3.78 4.36 0.94 3.22 1.43 -1.26 -5.10 118.68 118.48 1xox s LEU 6 Ca 0.50 0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 1xox s LEU 6 Cb 0.42 -2.79 0.15 0.00 0.03 0.00 0.00 46.19 44.00 1xox s LEU 6 CO -0.28 0.22 1.12 -2.16 0.23 0.00 0.00 176.35 175.48 1xox s PRO 7 N -1.86 0.94 0.59 1.29 0.04 -1.26 -4.91 135.00 129.83 1xox s PRO 7 Ca 0.30 0.38 0.36 0.00 0.04 0.00 0.00 61.00 62.08 1xox s PRO 7 Cb -0.13 -1.81 1.97 0.00 0.04 0.00 0.00 34.50 34.57 1xox s PRO 7 CO 0.17 -2.35 2.10 -1.35 0.04 0.00 0.00 177.00 175.62 1xox h PRO 8 N -1.61 0.00 0.00 0.56 0.11 -2.00 -3.30 132.00 125.75 1xox h PRO 8 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1xox h PRO 8 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1xox h PRO 8 CO 0.60 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 1xox n ALA 9 N -1.96 0.00 -2.76 -0.75 0.00 -1.26 -3.46 120.51 110.31 1xox n ALA 9 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.06 1xox n ALA 9 Cb 0.14 0.17 -0.00 0.00 0.00 0.00 0.00 19.45 19.75 1xox n ALA 9 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1xox n TRP 10 N -0.76 3.27 -0.02 0.00 8.01 -1.24 -4.78 117.44 121.92 1xox n TRP 10 Ca 0.00 -3.12 -0.09 0.00 -1.31 0.00 0.00 57.50 52.97 1xox n TRP 10 Cb 0.00 -0.92 -0.08 0.00 -2.01 0.00 0.00 31.31 28.30 1xox n TRP 10 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.69 177.05 1xox h GLN 11 N 3.75 -0.08 -0.62 -0.99 -0.00 -1.64 -3.29 115.11 112.24 1xox h GLN 11 Ca 0.38 0.01 0.18 0.00 -0.00 0.00 0.00 58.65 59.21 1xox h GLN 11 Cb 0.39 0.02 -0.02 0.00 0.00 0.00 0.00 27.48 27.87 1xox h GLN 11 CO 1.04 0.45 0.64 -1.35 0.00 0.00 0.00 178.83 179.61 1xox h PRO 12 N -0.94 0.00 -0.43 -2.39 0.11 -1.86 0.98 132.00 127.46 1xox h PRO 12 Ca -0.01 0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.23 1xox h PRO 12 Cb 0.56 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 1xox h PRO 12 CO 0.01 0.00 0.40 0.74 -0.21 0.00 0.00 178.00 178.94 1xox h PHE 13 N 0.00 0.00 -3.85 0.65 -1.00 -1.94 -3.41 116.94 107.38 1xox h PHE 13 Ca 0.30 0.00 -0.50 0.00 2.81 0.00 0.00 57.97 60.58 1xox h PHE 13 Cb 1.58 0.00 0.01 0.00 3.61 0.00 0.00 35.95 41.15 1xox h PHE 13 CO 0.00 0.00 0.44 -0.51 -1.61 0.00 0.00 178.31 176.63 1xox s LEU 14 N -7.84 4.42 -0.04 1.54 1.43 0.34 -4.98 118.68 113.55 1xox s LEU 14 Ca -0.05 2.16 -0.26 0.00 -1.03 0.00 0.00 54.13 54.95 1xox s LEU 14 Cb 0.17 -3.82 -0.21 0.00 0.03 0.00 0.00 46.19 42.36 1xox s LEU 14 CO 0.61 -0.23 1.18 0.50 0.23 0.00 0.00 176.35 178.63 1xox h LYS 15 N 3.40 -0.01 -0.95 1.70 1.63 -1.88 -3.00 116.57 117.46 1xox h LYS 15 Ca -0.47 0.00 0.16 0.00 -0.85 0.00 0.00 60.65 59.49 1xox h LYS 15 Cb 1.21 0.00 -0.10 0.00 -0.60 0.00 0.00 32.23 32.75 1xox h LYS 15 CO 0.65 0.55 0.56 0.38 -3.45 0.00 0.00 179.45 178.14 1xox h ASP 16 N -0.58 0.73 0.85 4.20 2.03 -1.94 -1.66 116.42 120.04 1xox h ASP 16 Ca -0.00 0.08 -0.04 0.00 -0.73 0.00 0.00 57.03 56.34 1xox h ASP 16 Cb 0.57 -0.05 0.01 0.00 -0.83 0.00 0.00 39.33 39.03 1xox h ASP 16 CO 0.00 0.31 -0.42 -0.74 -1.03 0.00 0.00 179.24 177.37 1xox h HIS 17 N 0.77 -1.08 -0.84 4.15 2.76 -1.88 0.15 115.15 119.18 1xox h HIS 17 Ca 0.52 -0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.89 1xox h HIS 17 Cb 0.71 0.36 -0.04 0.00 1.55 0.00 0.00 27.41 29.99 1xox h HIS 17 CO -0.03 -0.67 0.59 0.00 -1.30 0.00 0.00 177.93 176.52 1xox h ARG 18 N -1.15 0.11 0.08 5.26 3.08 -1.28 0.15 114.38 120.63 1xox h ARG 18 Ca -0.12 -0.01 -0.26 0.00 0.07 0.00 0.00 59.98 59.66 1xox h ARG 18 Cb 0.88 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.92 1xox h ARG 18 CO 0.18 0.07 -1.14 0.82 -1.07 0.00 0.00 179.97 178.84 1xox h ILE 19 N 0.12 1.41 -0.12 2.04 5.03 -0.83 -3.24 117.51 121.91 1xox h ILE 19 Ca 0.41 -2.68 -0.03 0.00 -0.12 0.00 0.00 64.86 62.44 1xox h ILE 19 Cb 1.44 2.69 -0.01 0.00 -3.03 0.00 0.00 36.82 37.92 1xox h ILE 19 CO -0.05 0.80 -0.07 -1.28 -0.68 0.00 0.00 178.15 176.86 1xox h SER 20 N 0.18 0.16 -0.78 1.72 0.87 0.21 -2.31 113.55 113.61 1xox h SER 20 Ca -0.13 -0.02 0.09 0.00 -1.23 0.00 0.00 61.79 60.50 1xox h SER 20 Cb 1.82 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 63.68 1xox h SER 20 CO 0.20 0.26 0.51 0.74 -0.53 0.00 0.00 176.83 178.01 1xox h THR 21 N 0.17 0.96 -2.48 2.23 2.02 -1.40 -3.40 112.91 111.01 1xox h THR 21 Ca 0.04 -0.25 -0.57 0.00 0.77 0.00 0.00 66.41 66.40 1xox h THR 21 Cb 0.24 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1xox h THR 21 CO 0.01 0.13 1.27 -0.36 0.37 0.00 0.00 175.52 176.95 1xox s PHE 22 N -5.67 1.66 -0.11 3.16 0.08 -0.87 -4.52 117.98 111.71 1xox s PHE 22 Ca -0.10 0.40 -0.03 0.00 0.12 0.00 0.00 56.93 57.32 1xox s PHE 22 Cb 0.20 -4.04 -0.01 0.00 -0.57 0.00 0.00 43.02 38.60 1xox s PHE 22 CO 0.78 -3.67 -0.06 -0.22 -0.10 0.00 0.00 175.22 171.95 1xox h LYS 23 N 12.30 0.00 0.00 0.44 1.63 -1.87 -3.48 116.57 125.59 1xox h LYS 23 Ca -0.38 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.42 1xox h LYS 23 Cb 1.19 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.82 1xox h LYS 23 CO 0.99 0.00 0.00 0.09 -3.45 0.00 0.00 179.45 177.08 1xox n ASN 24 N -4.68 0.00 -2.62 4.20 4.13 -1.26 -5.12 115.26 109.91 1xox n ASN 24 Ca -0.02 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.20 1xox n ASN 24 Cb 0.09 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.30 1xox n ASN 24 CO 0.00 0.00 0.00 1.87 0.28 0.00 0.00 177.26 179.41 1xox n TRP 25 N -1.90 -3.76 -0.31 3.10 -0.00 -1.26 -4.83 117.44 108.48 1xox n TRP 25 Ca 0.00 2.20 0.08 0.00 -0.00 0.00 0.00 57.50 59.78 1xox n TRP 25 Cb 0.00 -3.39 0.25 0.00 -0.00 0.00 0.00 31.31 28.16 1xox n TRP 25 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1xox h PRO 26 N 4.31 0.65 -5.50 5.87 0.11 -1.98 -3.34 132.00 132.12 1xox h PRO 26 Ca -0.39 -0.04 -0.27 0.00 0.11 0.00 0.00 66.00 65.41 1xox h PRO 26 Cb 0.88 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.81 1xox h PRO 26 CO 0.01 0.43 0.82 -0.06 -0.21 0.00 0.00 178.00 178.98 1xox s PHE 27 N -5.95 1.79 0.00 0.65 0.08 -1.26 -4.56 117.98 108.74 1xox s PHE 27 Ca -0.12 0.78 0.00 0.00 0.12 0.00 0.00 56.93 57.71 1xox s PHE 27 Cb 0.22 -3.91 0.00 0.00 -0.57 0.00 0.00 43.02 38.76 1xox s PHE 27 CO 0.79 -1.32 0.00 1.28 -0.10 0.00 0.00 175.22 175.87 1xox n LEU 28 N 15.05 0.00 -4.87 -0.37 4.77 -1.26 -3.41 117.00 126.91 1xox n LEU 28 Ca 0.43 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 56.09 1xox n LEU 28 Cb 0.46 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1xox n LEU 28 CO 0.64 -0.05 0.24 -1.61 -1.33 0.00 0.00 177.39 175.28 1xox s GLU 29 N -0.10 3.83 -1.57 3.23 0.41 -1.26 -4.15 118.70 119.08 1xox s GLU 29 Ca 0.00 0.32 -0.03 0.00 -0.41 0.00 0.00 54.97 54.85 1xox s GLU 29 Cb 0.00 -2.63 0.00 0.00 -1.78 0.00 0.00 34.13 29.72 1xox s GLU 29 CO 0.00 0.30 0.41 0.41 -0.49 0.00 0.00 175.26 175.90 1xox n GLY 30 N -0.14 -0.47 3.25 -1.39 0.00 -1.26 -4.98 105.19 100.20 1xox n GLY 30 Ca 0.01 0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1xox n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xox n ALA 32 N 0.61 3.13 -2.37 0.00 0.00 -1.26 -4.16 120.51 116.46 1xox n ALA 32 Ca -0.19 -1.18 -0.18 0.00 0.00 0.00 0.00 53.44 51.89 1xox n ALA 32 Cb 0.59 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 19.02 1xox n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xox s THR 34 N -4.50 3.51 0.16 0.00 -4.23 -1.22 -4.58 115.64 104.79 1xox s THR 34 Ca 0.43 0.49 -0.19 0.00 -1.18 0.00 0.00 61.69 61.23 1xox s THR 34 Cb 0.39 -3.22 0.08 0.00 1.34 0.00 0.00 72.50 71.09 1xox s THR 34 CO -0.03 -0.64 1.64 -0.65 -0.54 0.00 0.00 174.62 174.40 1xox h PRO 35 N -0.93 -0.12 -0.00 3.99 0.11 -1.88 0.69 132.00 133.86 1xox h PRO 35 Ca -0.45 0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.51 1xox h PRO 35 Cb 1.24 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1xox h PRO 35 CO 0.58 -0.08 -0.75 0.93 -0.21 0.00 0.00 178.00 178.47 1xox h GLU 36 N -0.13 0.03 -0.39 1.05 5.08 -1.93 -0.82 114.58 117.47 1xox h GLU 36 Ca 0.18 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.35 1xox h GLU 36 Cb 0.41 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1xox h GLU 36 CO -0.44 0.76 -0.38 -0.09 -1.00 0.00 0.00 179.01 177.86 1xox h ARG 37 N 0.02 0.95 0.00 2.33 9.65 -1.64 -2.82 114.38 122.87 1xox h ARG 37 Ca -0.01 -0.50 -0.00 0.00 -1.10 0.00 0.00 59.98 58.37 1xox h ARG 37 Cb 1.32 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.91 1xox h ARG 37 CO 0.10 1.15 -0.00 0.52 2.80 0.00 0.00 179.97 184.54 1xox h MET 38 N 0.77 -0.00 -0.84 0.20 2.86 0.35 -3.31 114.93 114.97 1xox h MET 38 Ca 0.06 0.00 0.24 0.00 -2.06 0.00 0.00 59.70 57.95 1xox h MET 38 Cb 0.98 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.60 1xox h MET 38 CO 0.09 0.85 0.67 0.00 1.06 0.00 0.00 176.91 179.58 1xox h ALA 39 N -0.14 2.73 0.00 6.32 0.00 -1.21 0.81 119.26 127.77 1xox h ALA 39 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xox h ALA 39 Cb 0.85 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xox h ALA 39 CO 0.00 -1.10 0.00 -1.91 0.00 0.00 0.00 179.25 176.24 1xox n GLU 40 N -4.06 0.10 0.00 0.00 4.07 -1.06 -2.05 120.64 117.63 1xox n GLU 40 Ca 0.17 0.35 0.08 0.00 -0.06 0.00 0.00 57.16 57.71 1xox n GLU 40 Cb 0.96 -1.69 -0.01 0.00 -0.06 0.00 0.00 31.44 30.65 1xox n GLU 40 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1xox n ALA 41 N -1.64 3.22 0.00 4.31 0.00 0.28 -4.82 120.51 121.86 1xox n ALA 41 Ca 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1xox n ALA 41 Cb 0.19 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1xox n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xox n GLY 42 N 1.17 1.32 3.72 0.00 0.00 -0.87 -4.82 105.19 105.70 1xox n GLY 42 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1xox n GLY 42 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xox s PHE 43 N -2.16 3.15 0.01 1.61 0.08 -1.20 -1.68 117.98 117.79 1xox s PHE 43 Ca 0.00 0.79 0.06 0.00 0.12 0.00 0.00 56.93 57.90 1xox s PHE 43 Cb 0.00 -3.80 -0.02 0.00 -0.57 0.00 0.00 43.02 38.63 1xox s PHE 43 CO 0.00 -2.89 -0.18 0.42 -0.10 0.00 0.00 175.22 172.46 1xox s ILE 44 N 1.11 1.46 -0.14 0.64 1.01 0.50 -3.65 121.20 122.13 1xox s ILE 44 Ca 0.67 -0.92 -0.39 0.00 0.00 0.00 0.00 60.65 60.01 1xox s ILE 44 Cb -0.40 -1.24 -0.16 0.00 0.01 0.00 0.00 42.46 40.66 1xox s ILE 44 CO 0.31 0.30 1.58 1.57 0.00 0.00 0.00 174.94 178.70 1xox n HIS 45 N 2.33 1.81 -2.72 3.97 -0.00 -1.26 -3.75 115.22 115.60 1xox n HIS 45 Ca -0.16 0.60 -0.08 0.00 -0.00 0.00 0.00 57.72 58.08 1xox n HIS 45 Cb 0.54 -2.40 0.09 0.00 -0.00 0.00 0.00 29.99 28.22 1xox n HIS 45 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1xox s PRO 47 N 0.25 4.07 0.27 0.00 0.04 -1.23 -4.67 135.00 133.74 1xox s PRO 47 Ca 0.22 1.93 -0.04 0.00 0.04 0.00 0.00 61.00 63.15 1xox s PRO 47 Cb 0.29 -2.74 0.06 0.00 0.04 0.00 0.00 34.50 32.15 1xox s PRO 47 CO -0.08 -0.33 0.37 2.41 0.04 0.00 0.00 177.00 179.41 1xox n THR 48 N 0.17 0.00 0.09 1.26 -1.04 -0.37 -4.90 114.28 109.49 1xox n THR 48 Ca 0.04 -0.32 -0.13 0.00 -2.04 0.00 0.00 64.05 61.60 1xox n THR 48 Cb 0.45 -1.74 -0.10 0.00 -1.82 0.00 0.00 70.33 67.12 1xox n THR 48 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1xox h GLU 49 N 0.00 0.22 0.00 -2.82 4.81 -2.00 -3.37 114.58 111.42 1xox h GLU 49 Ca -0.12 -0.33 -0.16 0.00 -0.13 0.00 0.00 59.36 58.62 1xox h GLU 49 Cb 0.35 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1xox h GLU 49 CO 0.09 1.12 -1.61 0.09 -0.73 0.00 0.00 179.01 177.97 1xox n ASN 50 N -3.55 2.87 -4.16 1.04 4.13 -1.26 -4.83 115.26 109.50 1xox n ASN 50 Ca -0.06 -0.01 -0.38 0.00 1.68 0.00 0.00 54.58 55.81 1xox n ASN 50 Cb 0.94 0.63 -0.06 0.00 -1.54 0.00 0.00 39.78 39.75 1xox n ASN 50 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1xox s GLU 51 N -2.21 3.30 0.50 3.52 0.41 -1.26 -4.88 118.70 118.08 1xox s GLU 51 Ca -0.05 -3.05 0.33 0.00 -0.41 0.00 0.00 54.97 51.78 1xox s GLU 51 Cb 0.03 -4.04 1.41 0.00 -1.78 0.00 0.00 34.13 29.75 1xox s GLU 51 CO 0.35 -1.25 1.97 -1.00 -0.49 0.00 0.00 175.26 174.84 1xox h PRO 52 N 6.46 0.00 -1.84 0.39 0.13 -1.88 -0.95 132.00 134.31 1xox h PRO 52 Ca 0.12 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.74 1xox h PRO 52 Cb 0.87 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.81 1xox h PRO 52 CO 0.84 0.00 0.51 -3.47 -0.23 0.00 0.00 178.00 175.65 1xox n ASP 53 N -2.89 6.69 -4.08 1.44 2.03 -1.26 -4.50 116.55 113.97 1xox n ASP 53 Ca 0.00 -3.30 -0.32 0.00 0.52 0.00 0.00 54.79 51.69 1xox n ASP 53 Cb 0.26 -1.16 -0.15 0.00 -0.72 0.00 0.00 41.12 39.34 1xox n ASP 53 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1xox s LEU 54 N -2.46 3.03 -0.33 -2.67 0.20 -1.21 -3.26 118.68 111.98 1xox s LEU 54 Ca 0.53 -1.17 -0.05 0.00 0.69 0.00 0.00 54.13 54.14 1xox s LEU 54 Cb 0.37 -1.52 0.05 0.00 -0.43 0.00 0.00 46.19 44.66 1xox s LEU 54 CO -0.19 -0.13 0.08 0.00 -0.29 0.00 0.00 176.35 175.81 1xox s ALA 55 N 1.16 2.98 0.51 5.97 0.00 -0.57 -3.53 121.76 128.27 1xox s ALA 55 Ca -0.05 -1.83 -0.01 0.00 0.00 0.00 0.00 51.96 50.08 1xox s ALA 55 Cb -0.18 -2.17 0.01 0.00 0.00 0.00 0.00 23.12 20.78 1xox s ALA 55 CO -0.07 -1.36 0.75 1.14 0.00 0.00 0.00 175.76 176.22 1xox s GLN 56 N 1.33 2.89 -0.04 0.00 -2.07 -1.25 -2.98 119.66 117.54 1xox s GLN 56 Ca -0.02 -0.46 0.06 0.00 -1.82 0.00 0.00 55.36 53.12 1xox s GLN 56 Cb -0.20 -2.48 -0.02 0.00 -1.09 0.00 0.00 33.01 29.23 1xox s GLN 56 CO 0.01 -0.48 -0.24 0.00 -1.32 0.00 0.00 175.29 173.26 1xox n PHE 58 N 2.67 -3.25 -1.93 0.00 -1.74 -0.68 -0.83 117.46 111.70 1xox n PHE 58 Ca -0.17 -1.28 -0.13 0.00 -0.56 0.00 0.00 57.45 55.31 1xox n PHE 58 Cb 0.52 -0.63 -0.03 0.00 1.52 0.00 0.00 39.48 40.86 1xox n PHE 58 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1xox n PHE 59 N -2.75 -0.89 0.00 2.97 7.35 -1.26 -3.95 117.46 118.93 1xox n PHE 59 Ca 0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.82 1xox n PHE 59 Cb 0.46 -2.74 0.00 0.00 0.35 0.00 0.00 39.48 37.55 1xox n PHE 59 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xox n PHE 61 N -0.49 -2.39 -3.07 0.00 3.72 -0.01 -4.92 117.46 110.30 1xox n PHE 61 Ca 0.00 1.43 0.05 0.00 -0.05 0.00 0.00 57.45 58.88 1xox n PHE 61 Cb 0.00 -2.85 0.00 0.00 -0.94 0.00 0.00 39.48 35.69 1xox n PHE 61 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1xox s LYS 62 N -1.68 0.17 0.11 -1.08 2.36 -1.19 -4.91 119.74 113.52 1xox s LYS 62 Ca 0.00 0.10 -0.31 0.00 -2.55 0.00 0.00 55.97 53.21 1xox s LYS 62 Cb 0.00 0.06 -0.08 0.00 -1.05 0.00 0.00 37.83 36.76 1xox s LYS 62 CO 0.00 -0.30 1.41 -1.21 1.55 0.00 0.00 175.35 176.80 1xox s GLU 63 N 2.72 4.31 -0.12 4.03 2.02 -1.26 -2.99 118.70 127.41 1xox s GLU 63 Ca 0.24 2.09 -0.04 0.00 0.02 0.00 0.00 54.97 57.29 1xox s GLU 63 Cb -0.01 -3.28 0.05 0.00 0.10 0.00 0.00 34.13 30.99 1xox s GLU 63 CO -0.21 -0.47 0.10 -0.51 0.02 0.00 0.00 175.26 174.19 1xox s LEU 64 N 1.28 0.18 0.24 1.80 1.43 -1.16 -4.98 118.68 117.47 1xox s LEU 64 Ca 0.65 -0.24 0.08 0.00 -1.03 0.00 0.00 54.13 53.59 1xox s LEU 64 Cb -0.37 -0.09 -0.05 0.00 0.03 0.00 0.00 46.19 45.71 1xox s LEU 64 CO 0.30 -0.30 -0.13 -0.70 0.23 0.00 0.00 176.35 175.75 1xox s GLU 65 N 2.19 1.46 0.00 1.70 2.12 -1.26 -1.51 118.70 123.39 1xox s GLU 65 Ca 0.04 -1.68 0.00 0.00 0.36 0.00 0.00 54.97 53.68 1xox s GLU 65 Cb -0.14 -1.24 0.00 0.00 0.26 0.00 0.00 34.13 33.00 1xox s GLU 65 CO -0.07 0.16 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 1xox n GLY 66 N -0.48 1.19 3.64 -1.50 0.00 -1.20 -5.04 105.19 101.80 1xox n GLY 66 Ca -0.07 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 1xox n GLY 66 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xox s TRP 67 N -2.12 1.90 0.14 1.61 0.52 -1.26 -5.08 118.94 114.66 1xox s TRP 67 Ca 0.00 1.32 -0.06 0.00 0.02 0.00 0.00 56.10 57.38 1xox s TRP 67 Cb 0.00 -3.18 -0.02 0.00 -1.15 0.00 0.00 33.47 29.12 1xox s TRP 67 CO 0.00 -2.92 0.19 -1.21 0.02 0.00 0.00 176.95 173.02 1xox s GLU 68 N -4.75 1.03 -0.42 4.98 2.02 -1.26 -5.04 118.70 115.26 1xox s GLU 68 Ca 0.66 -1.24 -0.04 0.00 0.02 0.00 0.00 54.97 54.37 1xox s GLU 68 Cb -0.21 0.32 -0.07 0.00 0.10 0.00 0.00 34.13 34.27 1xox s GLU 68 CO 0.59 -0.34 1.86 -2.30 0.02 0.00 0.00 175.26 175.09 1xox n PRO 69 N -0.15 1.31 0.00 0.39 -0.02 -1.26 -2.85 135.00 132.42 1xox n PRO 69 Ca -0.08 -0.91 0.00 0.00 -2.02 0.00 0.00 63.50 60.50 1xox n PRO 69 Cb 0.63 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1xox n PRO 69 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1xox n ASP 70 N 3.71 0.00 -3.79 2.55 9.92 -1.26 -4.50 116.55 123.18 1xox n ASP 70 Ca 0.28 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 54.24 1xox n ASP 70 Cb 0.23 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.57 1xox n ASP 70 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1xox s ASP 71 N 0.00 3.87 -0.15 -2.24 1.01 -1.13 -4.99 116.67 113.04 1xox s ASP 71 Ca 0.00 -2.82 -0.38 0.00 0.71 0.00 0.00 52.55 50.06 1xox s ASP 71 Cb 0.00 -1.24 -0.15 0.00 1.01 0.00 0.00 42.92 42.54 1xox s ASP 71 CO 0.00 -0.24 1.70 0.47 0.21 0.00 0.00 175.17 177.31 1xox n ASP 72 N 3.31 2.57 0.32 0.27 9.92 -1.26 -4.57 116.55 127.11 1xox n ASP 72 Ca 0.08 1.06 -0.16 0.00 -0.53 0.00 0.00 54.79 55.24 1xox n ASP 72 Cb 0.34 -1.22 -0.08 0.00 -0.64 0.00 0.00 41.12 39.52 1xox n ASP 72 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1xox h PRO 73 N 7.19 -0.77 -0.87 -0.24 0.13 -1.84 0.21 132.00 135.81 1xox h PRO 73 Ca -0.47 0.05 0.16 0.00 -0.87 0.00 0.00 66.00 64.87 1xox h PRO 73 Cb 1.31 0.17 -0.10 0.00 0.13 0.00 0.00 31.00 32.51 1xox h PRO 73 CO 0.92 -0.47 0.46 0.82 -0.23 0.00 0.00 178.00 179.50 1xox h ILE 74 N -0.95 0.71 0.00 -3.56 2.04 -1.88 0.23 117.51 114.11 1xox h ILE 74 Ca -0.08 -0.22 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 1xox h ILE 74 Cb 0.66 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1xox h ILE 74 CO 0.13 0.11 -0.59 -0.08 0.00 0.00 0.00 178.15 177.73 1xox h GLU 75 N 0.63 0.00 0.46 2.37 4.81 -1.92 -2.74 114.58 118.18 1xox h GLU 75 Ca 0.48 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.69 1xox h GLU 75 Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1xox h GLU 75 CO -0.38 0.59 -0.22 1.49 -0.73 0.00 0.00 179.01 179.77 1xox h GLU 76 N 0.00 -0.59 0.07 1.92 4.57 0.27 0.10 114.58 120.91 1xox h GLU 76 Ca -0.01 0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.24 1xox h GLU 76 Cb 1.11 0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 29.79 1xox h GLU 76 CO 0.08 -0.40 -0.37 1.25 -1.18 0.00 0.00 179.01 178.39 1xox h HIS 77 N -0.78 -1.04 -0.61 0.92 2.76 -1.31 -2.08 115.15 113.02 1xox h HIS 77 Ca -0.06 0.03 0.10 0.00 -2.20 0.00 0.00 60.37 58.24 1xox h HIS 77 Cb 0.47 0.45 -0.08 0.00 1.55 0.00 0.00 27.41 29.80 1xox h HIS 77 CO 0.07 -0.47 0.20 -0.22 -1.30 0.00 0.00 177.93 176.21 1xox h LYS 78 N -0.57 0.35 -0.87 5.26 3.64 -1.18 0.89 116.57 124.09 1xox h LYS 78 Ca 0.04 -0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.60 1xox h LYS 78 Cb 0.63 -0.08 -0.12 0.00 -0.41 0.00 0.00 32.23 32.25 1xox h LYS 78 CO -0.25 0.23 0.38 -0.22 -2.27 0.00 0.00 179.45 177.31 1xox h LYS 79 N 0.36 0.41 0.02 1.90 3.64 -0.11 -0.86 116.57 121.93 1xox h LYS 79 Ca 0.31 -0.02 -0.28 0.00 -1.27 0.00 0.00 60.65 59.39 1xox h LYS 79 Cb 0.41 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 1xox h LYS 79 CO -0.34 0.27 -1.57 0.45 -2.27 0.00 0.00 179.45 176.00 1xox h HIS 80 N 0.42 0.07 -1.14 1.91 3.86 -0.76 -3.49 115.15 116.02 1xox h HIS 80 Ca 0.53 -0.05 0.19 0.00 -1.16 0.00 0.00 60.37 59.88 1xox h HIS 80 Cb 0.95 -0.00 -0.30 0.00 1.06 0.00 0.00 27.41 29.12 1xox h HIS 80 CO -0.14 1.08 0.85 -1.12 0.86 0.00 0.00 177.93 179.46 1xox s SER 81 N -6.35 -0.10 -0.52 2.45 0.01 0.30 -5.03 113.70 104.45 1xox s SER 81 Ca -0.05 0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.37 1xox s SER 81 Cb 0.08 0.15 0.41 0.00 0.21 0.00 0.00 66.02 66.88 1xox s SER 81 CO 0.82 -0.06 1.98 -0.24 0.41 0.00 0.00 173.24 176.16 1xox n SER 82 N 1.22 6.58 0.21 2.44 2.88 -1.25 -2.51 113.62 123.19 1xox n SER 82 Ca -0.07 -3.52 0.18 0.00 -1.33 0.00 0.00 58.87 54.13 1xox n SER 82 Cb 0.58 -0.96 0.84 0.00 -0.75 0.00 0.00 64.21 63.92 1xox n SER 82 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1xox h GLY 83 N 2.03 0.00 -7.21 0.46 0.00 -1.88 -3.36 103.07 93.10 1xox h GLY 83 Ca 0.52 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 47.17 1xox h GLY 83 CO 1.26 0.00 0.12 0.00 0.00 0.00 0.00 176.54 177.92 1xox n ALA 85 N 6.35 2.39 0.19 0.00 0.00 -1.26 -2.87 120.51 125.32 1xox n ALA 85 Ca -0.05 -0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.36 1xox n ALA 85 Cb 0.46 -1.44 0.03 0.00 0.00 0.00 0.00 19.45 18.50 1xox n ALA 85 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1xox h PHE 86 N 0.00 0.00 -0.57 0.00 -0.00 -1.94 -3.37 116.94 111.07 1xox h PHE 86 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.97 58.08 1xox h PHE 86 Cb 0.16 0.00 -0.11 0.00 -0.00 0.00 0.00 35.95 36.00 1xox h PHE 86 CO 0.00 0.00 -0.23 -0.07 -0.00 0.00 0.00 178.31 178.01 1xox h LEU 87 N 0.00 -0.81 -0.62 2.10 3.38 -1.84 0.25 115.31 117.77 1xox h LEU 87 Ca 0.00 0.20 -0.14 0.00 0.09 0.00 0.00 57.88 58.03 1xox h LEU 87 Cb 0.95 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 1xox h LEU 87 CO 0.00 -0.25 -0.36 0.28 0.09 0.00 0.00 178.44 178.19 1xox h SER 88 N -0.09 0.72 -1.54 -0.43 0.02 -1.81 -3.44 113.55 106.97 1xox h SER 88 Ca 0.26 -0.31 -0.73 0.00 -0.84 0.00 0.00 61.79 60.17 1xox h SER 88 Cb 0.50 -0.20 0.03 0.00 0.14 0.00 0.00 62.40 62.87 1xox h SER 88 CO -0.63 1.01 0.68 0.52 -1.14 0.00 0.00 176.83 177.28 1xox n VAL 89 N -4.05 0.16 -2.43 2.27 0.31 0.07 -4.87 118.33 109.79 1xox n VAL 89 Ca -0.01 -0.03 -0.13 0.00 -0.01 0.00 0.00 64.34 64.16 1xox n VAL 89 Cb 0.51 -0.98 0.03 0.00 -0.91 0.00 0.00 33.84 32.49 1xox n VAL 89 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1xox n LYS 90 N 4.03 2.66 -4.20 5.55 5.02 -1.26 -4.99 118.16 124.97 1xox n LYS 90 Ca 0.23 -3.85 -0.25 0.00 -2.02 0.00 0.00 58.31 52.42 1xox n LYS 90 Cb 0.14 -1.94 -0.17 0.00 -0.02 0.00 0.00 35.03 33.05 1xox n LYS 90 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1xox s LYS 91 N -3.67 1.49 0.92 1.97 3.01 -1.26 -5.06 119.74 117.13 1xox s LYS 91 Ca 0.39 -0.29 -0.15 0.00 -1.01 0.00 0.00 55.97 54.92 1xox s LYS 91 Cb 0.37 -1.41 -0.04 0.00 -1.01 0.00 0.00 37.83 35.74 1xox s LYS 91 CO -0.01 -0.13 0.04 1.04 0.51 0.00 0.00 175.35 176.81 1xox n GLN 92 N 4.40 -0.11 -0.27 1.68 1.13 -1.26 -4.25 117.38 118.70 1xox n GLN 92 Ca -0.18 -0.00 0.09 0.00 -1.94 0.00 0.00 57.00 54.96 1xox n GLN 92 Cb 0.51 -1.57 0.22 0.00 0.11 0.00 0.00 30.24 29.51 1xox n GLN 92 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1xox h PHE 93 N -1.18 0.31 -0.30 1.08 3.04 -1.96 0.78 116.94 118.72 1xox h PHE 93 Ca -0.44 0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.56 1xox h PHE 93 Cb 1.30 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 39.80 1xox h PHE 93 CO 0.32 -0.13 0.00 0.39 -2.02 0.00 0.00 178.31 176.88 1xox n GLU 94 N -5.18 2.90 -0.06 1.11 4.71 -1.26 -4.06 120.64 118.80 1xox n GLU 94 Ca 0.17 -1.60 -0.11 0.00 -0.01 0.00 0.00 57.16 55.61 1xox n GLU 94 Cb 0.55 -1.84 -0.05 0.00 -1.01 0.00 0.00 31.44 29.09 1xox n GLU 94 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1xox n GLU 95 N 0.35 0.27 -0.75 3.49 1.02 0.26 -5.04 120.64 120.24 1xox n GLU 95 Ca 0.14 0.10 -0.29 0.00 -0.02 0.00 0.00 57.16 57.09 1xox n GLU 95 Cb 0.70 -1.03 0.24 0.00 -0.02 0.00 0.00 31.44 31.34 1xox n GLU 95 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 1xox s LEU 96 N -6.35 0.54 0.12 -4.62 0.05 -0.76 -4.91 118.68 102.76 1xox s LEU 96 Ca -0.16 1.14 -0.01 0.00 0.05 0.00 0.00 54.13 55.14 1xox s LEU 96 Cb 0.06 -2.97 -0.04 0.00 -2.05 0.00 0.00 46.19 41.18 1xox s LEU 96 CO 0.23 -4.21 0.30 -0.89 -0.55 0.00 0.00 176.35 171.24 1xox s THR 97 N -2.63 5.28 0.20 5.48 2.01 -1.26 -5.01 115.64 119.70 1xox s THR 97 Ca 0.68 -0.28 -0.11 0.00 0.31 0.00 0.00 61.69 62.29 1xox s THR 97 Cb -0.19 -3.66 0.14 0.00 0.01 0.00 0.00 72.50 68.80 1xox s THR 97 CO 0.60 0.02 1.71 -0.07 -0.69 0.00 0.00 174.62 176.20 1xox h LEU 98 N 2.70 0.01 -1.00 4.42 -0.00 -1.96 -0.90 115.31 118.57 1xox h LEU 98 Ca -0.46 0.10 0.25 0.00 -0.00 0.00 0.00 57.88 57.77 1xox h LEU 98 Cb 1.17 0.14 -0.13 0.00 -0.00 0.00 0.00 40.66 41.84 1xox h LEU 98 CO 0.73 0.02 0.58 1.23 -0.00 0.00 0.00 178.44 181.00 1xox h GLY 99 N 0.26 1.92 1.91 0.83 0.00 -2.00 0.42 103.07 106.40 1xox h GLY 99 Ca 0.29 -0.30 -0.16 0.00 0.00 0.00 0.00 47.33 47.16 1xox h GLY 99 CO -0.37 -0.28 -0.75 -2.09 0.00 0.00 0.00 176.54 173.05 1xox h GLU 100 N 0.54 0.09 0.33 4.80 4.57 -1.59 -2.53 114.58 120.80 1xox h GLU 100 Ca 0.65 -0.08 -0.02 0.00 -1.18 0.00 0.00 59.36 58.74 1xox h GLU 100 Cb 1.28 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1xox h GLU 100 CO -0.50 0.80 -0.16 0.35 -1.18 0.00 0.00 179.01 178.32 1xox h PHE 101 N 0.05 -0.42 -0.64 0.92 3.57 0.39 -2.96 116.94 117.86 1xox h PHE 101 Ca -0.02 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 1xox h PHE 101 Cb 1.32 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.17 1xox h PHE 101 CO 0.01 -0.12 0.33 -0.07 -2.23 0.00 0.00 178.31 176.24 1xox h LEU 102 N -0.70 0.81 -1.96 0.59 -0.00 -1.28 -2.10 115.31 110.67 1xox h LEU 102 Ca -0.05 -0.11 0.26 0.00 -0.00 0.00 0.00 57.88 57.98 1xox h LEU 102 Cb 0.49 -0.21 -0.04 0.00 -0.00 0.00 0.00 40.66 40.90 1xox h LEU 102 CO 0.08 0.69 0.65 0.50 -0.00 0.00 0.00 178.44 180.35 1xox h LYS 103 N 0.87 0.03 -0.29 1.13 3.64 -1.44 0.11 116.57 120.62 1xox h LYS 103 Ca 0.22 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 1xox h LYS 103 Cb 0.07 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1xox h LYS 103 CO -0.03 0.02 -0.14 -0.07 -2.27 0.00 0.00 179.45 176.96 1xox h LEU 104 N 0.03 0.62 -1.15 5.20 3.38 -1.20 -3.03 115.31 119.15 1xox h LEU 104 Ca 0.43 -0.41 0.27 0.00 0.09 0.00 0.00 57.88 58.27 1xox h LEU 104 Cb 1.69 -0.17 -0.12 0.00 0.09 0.00 0.00 40.66 42.15 1xox h LEU 104 CO -0.02 0.89 0.63 0.44 0.09 0.00 0.00 178.44 180.48 1xox h ASP 105 N 0.35 0.56 -0.57 -0.43 3.32 -0.79 0.38 116.42 119.23 1xox h ASP 105 Ca 0.06 0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 1xox h ASP 105 Cb 0.66 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1xox h ASP 105 CO 0.04 0.06 -0.01 0.03 -1.72 0.00 0.00 179.24 177.64 1xox h ARG 106 N 0.46 1.03 0.25 3.56 -0.00 -1.51 -2.54 114.38 115.64 1xox h ARG 106 Ca 0.65 -0.32 -0.01 0.00 -0.50 0.00 0.00 59.98 59.79 1xox h ARG 106 Cb 1.44 -0.10 0.00 0.00 0.00 0.00 0.00 29.97 31.32 1xox h ARG 106 CO -0.42 1.01 -0.12 0.93 0.00 0.00 0.00 179.97 181.37 1xox h GLU 107 N 0.94 -0.32 0.07 0.04 4.39 -0.29 -1.05 114.58 118.36 1xox h GLU 107 Ca 0.17 0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.91 1xox h GLU 107 Cb 0.55 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.23 1xox h GLU 107 CO 0.03 -0.06 -0.49 -0.09 -1.16 0.00 0.00 179.01 177.24 1xox h ARG 108 N -0.55 -0.66 -0.54 2.33 2.43 -1.24 0.90 114.38 117.05 1xox h ARG 108 Ca -0.03 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.27 1xox h ARG 108 Cb 0.41 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1xox h ARG 108 CO 0.06 -0.44 0.37 0.00 -1.51 0.00 0.00 179.97 178.44 1xox h ALA 109 N -0.34 2.05 -0.16 2.80 0.00 -1.49 -1.80 119.26 120.32 1xox h ALA 109 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1xox h ALA 109 Cb 0.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1xox h ALA 109 CO -0.31 -0.17 -0.00 0.87 0.00 0.00 0.00 179.25 179.64 1xox h LYS 110 N 0.34 0.29 -0.74 0.00 1.57 0.25 -2.87 116.57 115.42 1xox h LYS 110 Ca 0.25 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1xox h LYS 110 Cb 0.53 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.78 1xox h LYS 110 CO -0.06 0.51 0.42 -0.91 -0.57 0.00 0.00 179.45 178.84 1xox h ASN 111 N 0.04 0.90 -0.66 0.86 4.21 -0.09 -2.34 115.58 118.50 1xox h ASN 111 Ca 0.05 -0.06 0.04 0.00 1.21 0.00 0.00 56.30 57.53 1xox h ASN 111 Cb 0.38 -0.23 -0.04 0.00 -1.12 0.00 0.00 38.32 37.31 1xox h ASN 111 CO 0.01 0.72 0.40 0.50 -1.29 0.00 0.00 177.43 177.77 1xox h LYS 112 N 1.03 0.75 -0.57 0.81 1.63 -1.25 -2.26 116.57 116.71 1xox h LYS 112 Ca 0.26 -0.05 -0.09 0.00 -0.85 0.00 0.00 60.65 59.93 1xox h LYS 112 Cb 0.00 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.44 1xox h LYS 112 CO -0.05 0.50 -0.01 0.82 -3.45 0.00 0.00 179.45 177.26 1xox h ILE 113 N 0.77 1.26 -1.00 2.00 2.04 -1.23 -2.90 117.51 118.45 1xox h ILE 113 Ca 0.27 -1.13 0.14 0.00 1.00 0.00 0.00 64.86 65.14 1xox h ILE 113 Cb 0.06 0.84 -0.09 0.00 -0.74 0.00 0.00 36.82 36.89 1xox h ILE 113 CO -0.12 0.41 0.63 0.00 0.00 0.00 0.00 178.15 179.06 1xox h ALA 114 N 1.07 1.57 -0.36 1.87 0.00 -0.90 -1.40 119.26 121.10 1xox h ALA 114 Ca 0.16 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1xox h ALA 114 Cb 0.55 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1xox h ALA 114 CO 0.03 0.15 0.04 0.87 0.00 0.00 0.00 179.25 180.34 1xox h LYS 115 N 0.93 0.15 0.05 0.00 1.57 -1.28 -3.23 116.57 114.75 1xox h LYS 115 Ca 0.52 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.29 1xox h LYS 115 Cb 0.60 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1xox h LYS 115 CO -0.29 0.10 -0.02 0.93 -0.57 0.00 0.00 179.45 179.59 1xox h GLU 116 N 0.15 -0.06 0.00 3.15 5.08 -1.37 -3.53 114.58 118.01 1xox h GLU 116 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1xox h GLU 116 Cb 0.22 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1xox h GLU 116 CO -0.26 -0.04 0.00 0.25 -1.00 0.00 0.00 179.01 177.96