#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o0c n TYR 2 N 0.00 1.79 -0.04 2.03 4.02 -1.26 -2.48 117.16 121.22 2o0c n TYR 2 Ca 0.00 0.43 0.18 0.00 -0.01 0.00 0.00 57.90 58.50 2o0c n TYR 2 Cb 0.00 -2.26 0.63 0.00 -0.02 0.00 0.00 39.34 37.68 2o0c n TYR 2 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2o0c h GLY 3 N 0.75 0.22 -0.55 2.72 0.00 -0.95 -0.87 103.07 104.38 2o0c h GLY 3 Ca -0.50 -0.06 0.22 0.00 0.00 0.00 0.00 47.33 46.99 2o0c h GLY 3 CO 0.54 0.02 0.08 -2.00 0.00 0.00 0.00 176.54 175.18 2o0c h LEU 4 N 0.14 -0.28 -0.18 3.11 5.85 -1.41 0.53 115.31 123.06 2o0c h LEU 4 Ca 0.27 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 59.20 2o0c h LEU 4 Cb 0.89 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 2o0c h LEU 4 CO -0.04 -0.22 0.08 0.58 -0.34 0.00 0.00 178.44 178.50 2o0c h VAL 5 N 0.11 1.15 -0.38 1.05 2.07 -1.47 -2.09 116.25 116.69 2o0c h VAL 5 Ca 0.50 -0.45 -0.10 0.00 0.82 0.00 0.00 66.70 67.47 2o0c h VAL 5 Cb 0.98 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2o0c h VAL 5 CO -0.73 0.15 -0.18 0.78 0.02 0.00 0.00 177.57 177.61 2o0c h ASN 6 N 0.15 0.72 -0.93 0.57 2.35 -1.26 -1.68 115.58 115.50 2o0c h ASN 6 Ca 0.06 -0.24 0.01 0.00 -0.55 0.00 0.00 56.30 55.58 2o0c h ASN 6 Cb 0.16 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 2o0c h ASN 6 CO -0.01 0.90 0.61 0.11 -1.65 0.00 0.00 177.43 177.40 2o0c h LYS 7 N 0.64 1.21 -0.41 0.81 1.57 0.04 -0.85 116.57 119.59 2o0c h LYS 7 Ca 0.10 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.65 2o0c h LYS 7 Cb 0.66 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2o0c h LYS 7 CO 0.05 0.80 -0.35 0.00 -0.57 0.00 0.00 179.45 179.38 2o0c h ALA 8 N 1.34 0.59 -0.24 3.86 0.00 -0.84 0.22 119.26 124.20 2o0c h ALA 8 Ca 0.34 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2o0c h ALA 8 Cb -0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2o0c h ALA 8 CO -0.08 0.68 0.12 0.82 0.00 0.00 0.00 179.25 180.79 2o0c h ILE 9 N 0.79 1.13 -0.56 0.00 2.04 -1.18 0.30 117.51 120.03 2o0c h ILE 9 Ca 0.07 -0.37 0.09 0.00 1.00 0.00 0.00 64.86 65.65 2o0c h ILE 9 Cb 0.95 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 37.89 2o0c h ILE 9 CO 0.09 0.13 0.18 -0.61 0.00 0.00 0.00 178.15 177.94 2o0c h GLN 10 N 0.27 0.33 -0.39 2.37 4.15 -0.90 -1.50 115.11 119.45 2o0c h GLN 10 Ca 0.08 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 2o0c h GLN 10 Cb 0.10 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 2o0c h GLN 10 CO -0.01 0.22 0.07 0.22 -1.93 0.00 0.00 178.83 177.40 2o0c h ASP 11 N 0.34 0.61 -0.59 -0.69 3.58 -0.08 -1.51 116.42 118.08 2o0c h ASP 11 Ca 0.28 -0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2o0c h ASP 11 Cb 0.36 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 2o0c h ASP 11 CO -0.31 0.71 0.38 -0.03 -2.88 0.00 0.00 179.24 177.11 2o0c h MET 12 N 0.49 0.78 -0.10 0.28 4.05 0.09 -1.61 114.93 118.91 2o0c h MET 12 Ca 0.12 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 2o0c h MET 12 Cb 0.35 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 30.97 2o0c h MET 12 CO 0.01 0.52 -0.00 0.82 0.23 0.00 0.00 176.91 178.49 2o0c h ILE 13 N 0.80 1.25 -0.52 1.77 2.04 -1.10 -2.81 117.51 118.94 2o0c h ILE 13 Ca 0.21 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2o0c h ILE 13 Cb -0.08 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 2o0c h ILE 13 CO -0.05 0.23 0.33 0.28 0.00 0.00 0.00 178.15 178.94 2o0c h SER 14 N -0.11 0.61 -0.28 1.72 0.02 -1.17 0.39 113.55 114.73 2o0c h SER 14 Ca 0.03 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2o0c h SER 14 Cb 0.35 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2o0c h SER 14 CO 0.00 0.47 0.15 0.11 -1.14 0.00 0.00 176.83 176.42 2o0c h LYS 15 N 0.70 0.43 0.00 3.45 6.56 -1.29 0.81 116.57 127.23 2o0c h LYS 15 Ca 0.19 -0.04 -0.29 0.00 -1.06 0.00 0.00 60.65 59.45 2o0c h LYS 15 Cb -0.04 -0.09 -0.05 0.00 -0.57 0.00 0.00 32.23 31.48 2o0c h LYS 15 CO -0.04 0.34 -1.95 0.72 -2.06 0.00 0.00 179.45 176.46 2o0c n HIS 16 N -4.43 0.55 -0.65 -1.35 8.25 -0.95 -4.63 115.22 112.00 2o0c n HIS 16 Ca 0.02 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 2o0c n HIS 16 Cb 0.11 -1.06 0.00 0.00 1.12 0.00 0.00 29.99 30.17 2o0c n HIS 16 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2o0c n HIS 17 N -2.86 0.00 -1.25 4.41 8.25 0.13 -5.10 115.22 118.81 2o0c n HIS 17 Ca -0.21 -0.23 0.16 0.00 -0.26 0.00 0.00 57.72 57.18 2o0c n HIS 17 Cb 1.04 -0.03 -0.06 0.00 1.12 0.00 0.00 29.99 32.06 2o0c n HIS 17 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2o0c n GLY 18 N -0.24 -2.70 0.28 -1.41 0.00 0.28 -3.99 105.19 97.39 2o0c n GLY 18 Ca 0.00 -1.14 0.15 0.00 0.00 0.00 0.00 46.02 45.03 2o0c n GLY 18 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2o0c h GLU 19 N -1.20 0.00 0.60 1.61 4.39 -1.93 -3.03 114.58 115.02 2o0c h GLU 19 Ca -0.09 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 2o0c h GLU 19 Cb 1.18 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2o0c h GLU 19 CO 0.05 0.08 -0.29 -0.44 -1.16 0.00 0.00 179.01 177.25 2o0c h ASP 20 N 0.00 -0.69 -0.93 1.42 3.32 -1.98 -2.46 116.42 115.11 2o0c h ASP 20 Ca -0.00 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.08 2o0c h ASP 20 Cb 0.29 0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 2o0c h ASP 20 CO 0.01 -0.43 0.61 0.74 -1.72 0.00 0.00 179.24 178.45 2o0c h THR 21 N -0.90 1.15 -0.51 0.35 2.02 -1.67 -2.56 112.91 110.81 2o0c h THR 21 Ca -0.08 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 66.71 2o0c h THR 21 Cb 0.65 -0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2o0c h THR 21 CO 0.14 0.21 0.33 -0.25 0.37 0.00 0.00 175.52 176.32 2o0c h TRP 22 N 1.16 0.63 -0.51 3.16 2.91 -1.42 -1.58 115.95 120.29 2o0c h TRP 22 Ca 0.37 0.02 -0.05 0.00 1.13 0.00 0.00 58.89 60.35 2o0c h TRP 22 Cb 0.02 -0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 28.44 2o0c h TRP 22 CO -0.00 0.39 0.11 0.93 -1.03 0.00 0.00 178.44 178.84 2o0c h GLU 23 N 0.68 0.78 0.23 2.65 4.39 -1.15 0.11 114.58 122.27 2o0c h GLU 23 Ca 0.19 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2o0c h GLU 23 Cb -0.07 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2o0c h GLU 23 CO -0.05 0.72 -0.22 0.00 -1.16 0.00 0.00 179.01 178.30 2o0c h ALA 24 N 1.37 -0.45 -0.64 3.43 0.00 -1.04 0.39 119.26 122.31 2o0c h ALA 24 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2o0c h ALA 24 Cb 0.30 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2o0c h ALA 24 CO 0.00 -0.78 0.40 0.82 0.00 0.00 0.00 179.25 179.69 2o0c h ILE 25 N -0.48 1.18 -0.50 0.00 2.04 -1.07 -0.90 117.51 117.78 2o0c h ILE 25 Ca -0.01 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2o0c h ILE 25 Cb 0.44 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2o0c h ILE 25 CO -0.04 0.18 0.33 0.50 0.00 0.00 0.00 178.15 179.12 2o0c h LYS 26 N 0.87 0.66 0.67 2.37 3.64 -0.65 -0.85 116.57 123.28 2o0c h LYS 26 Ca 0.23 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2o0c h LYS 26 Cb -0.06 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 2o0c h LYS 26 CO -0.05 0.44 -0.45 0.37 -2.27 0.00 0.00 179.45 177.50 2o0c h GLN 27 N 0.68 -1.02 -0.16 1.90 5.75 -0.44 -2.52 115.11 119.30 2o0c h GLN 27 Ca 0.18 0.07 0.03 0.00 -0.15 0.00 0.00 58.65 58.78 2o0c h GLN 27 Cb -0.08 0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2o0c h GLN 27 CO -0.04 -0.68 0.11 -0.22 -2.65 0.00 0.00 178.83 175.35 2o0c h LYS 28 N -1.06 0.09 0.00 1.69 3.64 -1.04 -0.82 116.57 119.07 2o0c h LYS 28 Ca -0.08 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2o0c h LYS 28 Cb 0.87 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2o0c h LYS 28 CO 0.06 0.06 0.00 0.00 -2.27 0.00 0.00 179.45 177.30 2o0c n ALA 29 N -2.55 1.77 -2.40 5.00 0.00 -0.34 -4.90 120.51 117.09 2o0c n ALA 29 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 2o0c n ALA 29 Cb 0.18 -1.35 0.02 0.00 0.00 0.00 0.00 19.45 18.30 2o0c n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o0c n GLY 30 N 0.23 0.40 2.52 0.00 0.00 -0.31 -4.83 105.19 103.19 2o0c n GLY 30 Ca 0.03 -0.41 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 2o0c n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o0c n LEU 31 N -1.52 1.94 -0.01 0.99 4.77 -0.96 -4.79 117.00 117.42 2o0c n LEU 31 Ca -0.04 -3.12 0.13 0.00 -0.03 0.00 0.00 56.01 52.95 2o0c n LEU 31 Cb 0.53 0.29 0.37 0.00 -2.33 0.00 0.00 43.42 42.28 2o0c n LEU 31 CO 0.12 1.10 0.61 -1.84 -1.33 0.00 0.00 177.39 176.05 2o0c n GLU 32 N -0.48 0.06 -0.23 3.23 0.28 -1.26 -3.08 120.64 119.16 2o0c n GLU 32 Ca 0.12 -0.03 0.04 0.00 -0.16 0.00 0.00 57.16 57.13 2o0c n GLU 32 Cb 0.86 -1.50 0.29 0.00 1.43 0.00 0.00 31.44 32.53 2o0c n GLU 32 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2o0c h ASP 33 N 0.07 0.78 -3.55 -1.84 5.19 -1.96 -3.42 116.42 111.70 2o0c h ASP 33 Ca 0.00 -0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.79 2o0c h ASP 33 Cb 0.49 -0.17 -0.13 0.00 0.18 0.00 0.00 39.33 39.71 2o0c h ASP 33 CO 0.00 0.52 0.26 -0.63 -3.12 0.00 0.00 179.24 176.27 2o0c s ILE 34 N -5.79 4.80 -0.01 0.35 1.01 -1.18 -4.96 121.20 115.42 2o0c s ILE 34 Ca -0.11 0.68 -0.23 0.00 0.00 0.00 0.00 60.65 60.99 2o0c s ILE 34 Cb 0.19 -4.16 -0.20 0.00 0.01 0.00 0.00 42.46 38.30 2o0c s ILE 34 CO 0.78 -0.41 1.18 -0.78 0.00 0.00 0.00 174.94 175.72 2o0c h ASP 35 N 8.53 0.23 -5.06 3.58 -0.00 -1.87 -3.47 116.42 118.36 2o0c h ASP 35 Ca -0.25 -0.62 -0.07 0.00 -0.00 0.00 0.00 57.03 56.09 2o0c h ASP 35 Cb 1.10 -0.07 -0.15 0.00 -0.00 0.00 0.00 39.33 40.21 2o0c h ASP 35 CO 0.88 0.81 -0.14 0.72 -0.00 0.00 0.00 179.24 181.51 2o0c s PHE 36 N -3.76 -0.19 0.35 0.28 -0.12 -1.26 -5.17 117.98 108.12 2o0c s PHE 36 Ca -0.15 0.01 -0.19 0.00 -0.05 0.00 0.00 56.93 56.55 2o0c s PHE 36 Cb 0.02 0.19 -0.10 0.00 -0.63 0.00 0.00 43.02 42.51 2o0c s PHE 36 CO 0.73 -0.60 0.83 -0.06 -0.05 0.00 0.00 175.22 176.07 2o0c s PHE 37 N -3.05 3.41 -0.25 3.49 0.08 -1.26 -5.06 117.98 115.34 2o0c s PHE 37 Ca -0.02 1.43 -0.06 0.00 0.12 0.00 0.00 56.93 58.41 2o0c s PHE 37 Cb 0.01 -2.70 -0.01 0.00 -0.57 0.00 0.00 43.02 39.75 2o0c s PHE 37 CO -0.06 0.06 0.03 0.08 -0.10 0.00 0.00 175.22 175.22 2o0c s VAL 38 N -1.97 3.85 0.25 -0.44 1.01 -1.26 -4.97 120.40 116.88 2o0c s VAL 38 Ca 0.55 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 62.05 2o0c s VAL 38 Cb -0.11 -2.84 0.25 0.00 0.00 0.00 0.00 36.38 33.68 2o0c s VAL 38 CO 0.17 0.30 1.67 1.23 0.00 0.00 0.00 175.10 178.47 2o0c h GLY 39 N 8.19 1.00 -2.48 4.51 0.00 -1.96 -2.56 103.07 109.77 2o0c h GLY 39 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2o0c h GLY 39 CO 0.59 -0.24 0.00 1.03 0.00 0.00 0.00 176.54 177.92 2o0c n MET 40 N -5.21 3.52 -4.09 4.80 2.81 -1.26 -1.40 117.12 116.28 2o0c n MET 40 Ca 0.15 -2.76 -0.34 0.00 -1.81 0.00 0.00 57.70 52.94 2o0c n MET 40 Cb 0.48 -1.81 -0.07 0.00 -0.71 0.00 0.00 33.22 31.12 2o0c n MET 40 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2o0c s GLU 41 N -1.99 3.15 -0.00 0.03 2.12 -0.96 -4.93 118.70 116.11 2o0c s GLU 41 Ca 0.45 -0.40 -0.29 0.00 0.36 0.00 0.00 54.97 55.09 2o0c s GLU 41 Cb 0.30 -2.92 -0.03 0.00 0.26 0.00 0.00 34.13 31.74 2o0c s GLU 41 CO 0.19 0.68 0.93 0.00 -0.54 0.00 0.00 175.26 176.51 2o0c s ALA 42 N -1.13 3.20 0.32 6.30 0.00 -1.26 -0.90 121.76 128.28 2o0c s ALA 42 Ca 0.21 0.47 0.10 0.00 0.00 0.00 0.00 51.96 52.73 2o0c s ALA 42 Cb -0.12 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.69 2o0c s ALA 42 CO 0.11 -0.18 -0.02 0.71 0.00 0.00 0.00 175.76 176.37 2o0c s TYR 43 N 0.87 2.54 0.22 0.00 2.02 -1.03 -4.94 117.35 117.03 2o0c s TYR 43 Ca 0.49 -0.38 -0.30 0.00 -0.37 0.00 0.00 57.07 56.51 2o0c s TYR 43 Cb -0.21 -1.35 -0.09 0.00 -0.40 0.00 0.00 41.96 39.91 2o0c s TYR 43 CO 0.26 0.54 1.35 0.45 -1.57 0.00 0.00 175.55 176.58 2o0c s SER 44 N -3.68 6.82 0.50 2.29 0.15 -1.26 -1.46 113.70 117.07 2o0c s SER 44 Ca 0.33 2.49 0.27 0.00 0.70 0.00 0.00 55.95 59.74 2o0c s SER 44 Cb -0.02 -2.62 1.35 0.00 -1.71 0.00 0.00 66.02 63.02 2o0c s SER 44 CO 0.19 -0.57 1.88 0.44 1.20 0.00 0.00 173.24 176.37 2o0c h ASP 45 N 5.16 0.13 -0.56 5.45 3.32 -1.99 0.10 116.42 128.03 2o0c h ASP 45 Ca -0.45 0.02 0.13 0.00 0.02 0.00 0.00 57.03 56.74 2o0c h ASP 45 Cb 1.22 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2o0c h ASP 45 CO 0.77 0.05 0.39 0.44 -1.72 0.00 0.00 179.24 179.17 2o0c h ASP 46 N 0.13 0.17 -0.75 6.45 3.32 -1.99 0.85 116.42 124.60 2o0c h ASP 46 Ca 0.44 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.51 2o0c h ASP 46 Cb 1.51 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 41.00 2o0c h ASP 46 CO -0.07 0.09 0.49 0.58 -1.72 0.00 0.00 179.24 178.62 2o0c h VAL 47 N 0.18 1.17 0.01 -1.35 2.07 -1.16 0.16 116.25 117.33 2o0c h VAL 47 Ca 0.27 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 2o0c h VAL 47 Cb 0.81 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2o0c h VAL 47 CO -0.04 0.18 -0.01 0.74 0.02 0.00 0.00 177.57 178.46 2o0c h THR 48 N 0.99 1.40 -0.49 2.57 2.02 -1.00 -1.73 112.91 116.67 2o0c h THR 48 Ca 0.28 -1.24 0.09 0.00 0.77 0.00 0.00 66.41 66.32 2o0c h THR 48 Cb -0.08 2.23 -0.08 0.00 -1.74 0.00 0.00 68.15 68.48 2o0c h THR 48 CO -0.07 0.32 0.01 1.88 0.37 0.00 0.00 175.52 178.03 2o0c h TYR 49 N -0.55 -0.01 -0.39 3.16 0.05 -1.22 -0.32 116.97 117.69 2o0c h TYR 49 Ca -0.00 0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 2o0c h TYR 49 Cb 0.53 0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.33 2o0c h TYR 49 CO 0.11 -0.10 0.15 0.45 -1.05 0.00 0.00 178.16 177.72 2o0c h HIS 50 N 0.13 0.55 -0.06 4.88 3.86 -0.71 0.15 115.15 123.94 2o0c h HIS 50 Ca 0.25 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.44 2o0c h HIS 50 Cb 0.37 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 2o0c h HIS 50 CO -0.30 0.44 0.02 -0.07 0.86 0.00 0.00 177.93 178.88 2o0c h LEU 51 N 0.55 0.09 -0.38 2.43 3.38 -0.31 -0.55 115.31 120.52 2o0c h LEU 51 Ca 0.14 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2o0c h LEU 51 Cb 0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2o0c h LEU 51 CO -0.01 0.26 -0.05 0.58 0.09 0.00 0.00 178.44 179.30 2o0c h VAL 52 N -0.08 1.27 -0.35 1.22 2.07 -0.76 -1.33 116.25 118.30 2o0c h VAL 52 Ca 0.02 -1.09 0.08 0.00 0.82 0.00 0.00 66.70 66.52 2o0c h VAL 52 Cb 0.20 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 31.10 2o0c h VAL 52 CO -0.00 0.36 -0.20 1.23 0.02 0.00 0.00 177.57 178.98 2o0c h GLY 53 N 0.51 0.03 0.84 2.17 0.00 -0.71 -1.22 103.07 104.69 2o0c h GLY 53 Ca 0.10 0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 2o0c h GLY 53 CO 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 176.54 176.33 2o0c h ALA 54 N 1.06 -0.12 -0.40 3.60 0.00 -0.91 -2.63 119.26 119.86 2o0c h ALA 54 Ca 0.18 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2o0c h ALA 54 Cb 0.42 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2o0c h ALA 54 CO -0.44 -0.49 0.27 0.00 0.00 0.00 0.00 179.25 178.59 2o0c h ALA 55 N 0.60 1.98 0.28 0.00 0.00 -1.16 -0.11 119.26 120.85 2o0c h ALA 55 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2o0c h ALA 55 Cb 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2o0c h ALA 55 CO 0.02 -0.05 -0.13 1.03 0.00 0.00 0.00 179.25 180.12 2o0c h SER 56 N 0.31 -0.32 0.16 0.00 0.87 -0.98 -0.36 113.55 113.23 2o0c h SER 56 Ca 0.17 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2o0c h SER 56 Cb 0.29 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 2o0c h SER 56 CO -0.04 -0.16 -0.12 -0.08 -0.53 0.00 0.00 176.83 175.91 2o0c h GLU 57 N -0.46 -0.27 -0.51 2.24 4.81 -0.99 -0.49 114.58 118.91 2o0c h GLU 57 Ca -0.04 0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 2o0c h GLU 57 Cb 0.34 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2o0c h GLU 57 CO 0.06 -0.18 -0.04 0.28 -0.73 0.00 0.00 179.01 178.40 2o0c h VAL 58 N -0.28 1.26 0.00 0.32 2.07 -1.06 -3.19 116.25 115.36 2o0c h VAL 58 Ca -0.01 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.38 2o0c h VAL 58 Cb 0.25 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2o0c h VAL 58 CO -0.00 0.40 -0.81 0.18 0.02 0.00 0.00 177.57 177.36 2o0c n LEU 59 N -4.18 0.68 -0.60 2.57 4.77 -0.15 -4.95 117.00 115.13 2o0c n LEU 59 Ca 0.02 0.15 -0.07 0.00 -0.03 0.00 0.00 56.01 56.08 2o0c n LEU 59 Cb 0.34 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2o0c n LEU 59 CO 0.43 -0.03 -0.07 0.61 -1.33 0.00 0.00 177.39 176.99 2o0c n GLY 60 N 1.33 0.78 3.63 -0.72 0.00 -0.21 -5.04 105.19 104.96 2o0c n GLY 60 Ca 0.02 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 2o0c n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o0c s LYS 61 N -2.94 2.53 0.59 1.61 1.02 -1.12 -5.06 119.74 116.37 2o0c s LYS 61 Ca 0.00 -0.77 -0.18 0.00 0.02 0.00 0.00 55.97 55.03 2o0c s LYS 61 Cb 0.00 -2.51 -0.03 0.00 -0.52 0.00 0.00 37.83 34.77 2o0c s LYS 61 CO 0.00 0.58 1.17 -2.14 -0.92 0.00 0.00 175.35 174.04 2o0c s PRO 62 N -1.75 3.02 0.21 -1.68 0.02 -1.26 -4.39 135.00 129.17 2o0c s PRO 62 Ca 0.20 1.70 -0.09 0.00 0.02 0.00 0.00 61.00 62.83 2o0c s PRO 62 Cb -0.11 -1.95 0.31 0.00 0.02 0.00 0.00 34.50 32.77 2o0c s PRO 62 CO 0.11 -1.14 1.72 0.00 -0.33 0.00 0.00 177.00 177.36 2o0c h ALA 63 N 0.80 0.77 -0.66 -1.55 0.00 -1.92 -1.63 119.26 115.07 2o0c h ALA 63 Ca -0.50 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 2o0c h ALA 63 Cb 1.28 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.18 2o0c h ALA 63 CO 0.55 -0.27 0.39 0.93 0.00 0.00 0.00 179.25 180.85 2o0c h GLU 64 N 0.31 0.89 -0.58 0.00 3.07 -1.96 0.23 114.58 116.54 2o0c h GLU 64 Ca 0.33 -0.08 -0.03 0.00 -0.50 0.00 0.00 59.36 59.08 2o0c h GLU 64 Cb 0.47 -0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 2o0c h GLU 64 CO -0.38 0.63 0.25 1.49 -1.40 0.00 0.00 179.01 179.59 2o0c h GLU 65 N 0.90 0.87 -0.50 2.33 4.81 -1.69 -1.77 114.58 119.53 2o0c h GLU 65 Ca 0.24 -0.15 -0.12 0.00 -0.13 0.00 0.00 59.36 59.20 2o0c h GLU 65 Cb -0.03 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 2o0c h GLU 65 CO -0.04 0.73 -0.15 -0.07 -0.73 0.00 0.00 179.01 178.75 2o0c h LEU 66 N 0.80 0.98 -0.85 1.64 3.38 -0.68 -2.16 115.31 118.43 2o0c h LEU 66 Ca 0.20 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2o0c h LEU 66 Cb 0.18 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2o0c h LEU 66 CO -0.02 1.12 0.53 -0.07 0.09 0.00 0.00 178.44 180.08 2o0c h LEU 67 N 0.86 1.01 -0.10 1.67 3.38 -0.38 0.60 115.31 122.35 2o0c h LEU 67 Ca 0.13 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.05 2o0c h LEU 67 Cb 0.71 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2o0c h LEU 67 CO 0.05 0.77 0.03 0.40 0.09 0.00 0.00 178.44 179.78 2o0c h ILE 68 N 1.16 0.98 -0.25 1.22 2.04 -1.08 0.04 117.51 121.61 2o0c h ILE 68 Ca 0.31 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.14 2o0c h ILE 68 Cb -0.07 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 2o0c h ILE 68 CO -0.06 0.02 0.16 0.00 0.00 0.00 0.00 178.15 178.27 2o0c h ALA 69 N 1.06 0.32 -0.77 1.87 0.00 -1.02 -2.59 119.26 118.12 2o0c h ALA 69 Ca 0.04 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.99 2o0c h ALA 69 Cb 0.02 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 2o0c h ALA 69 CO -0.04 -0.20 0.46 0.35 0.00 0.00 0.00 179.25 179.81 2o0c h PHE 70 N 0.34 0.85 -0.36 0.00 3.57 -0.65 -0.68 116.94 120.00 2o0c h PHE 70 Ca 0.09 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.68 2o0c h PHE 70 Cb -0.03 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 38.38 2o0c h PHE 70 CO -0.06 0.42 -0.01 0.78 -2.23 0.00 0.00 178.31 177.21 2o0c h GLY 71 N 0.84 0.34 1.02 2.40 0.00 -0.74 0.73 103.07 107.65 2o0c h GLY 71 Ca 0.34 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.70 2o0c h GLY 71 CO -0.18 -0.09 0.42 0.83 0.00 0.00 0.00 176.54 177.52 2o0c h GLU 72 N 0.09 1.09 -0.61 4.80 5.08 -0.99 -3.08 114.58 120.95 2o0c h GLU 72 Ca 0.17 -0.13 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 2o0c h GLU 72 Cb 0.24 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2o0c h GLU 72 CO -0.30 0.81 0.11 -0.92 -1.00 0.00 0.00 179.01 177.72 2o0c h TYR 73 N 1.08 1.07 -0.71 4.33 3.20 -0.21 -2.95 116.97 122.79 2o0c h TYR 73 Ca 0.27 -0.15 0.14 0.00 3.14 0.00 0.00 58.73 62.14 2o0c h TYR 73 Cb 0.05 -0.30 -0.05 0.00 1.54 0.00 0.00 36.73 37.98 2o0c h TYR 73 CO 0.00 0.92 0.48 2.35 -1.64 0.00 0.00 178.16 180.27 2o0c h TRP 74 N 0.92 0.45 -0.51 -3.82 2.91 -0.81 -0.35 115.95 114.74 2o0c h TRP 74 Ca 0.19 0.01 -0.09 0.00 1.13 0.00 0.00 58.89 60.14 2o0c h TRP 74 Cb 0.41 -0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 28.90 2o0c h TRP 74 CO 0.03 0.18 -0.02 0.28 -1.03 0.00 0.00 178.44 177.89 2o0c h VAL 75 N 0.39 1.26 -0.09 2.65 2.07 -1.61 -1.85 116.25 119.06 2o0c h VAL 75 Ca 0.34 -1.11 -0.15 0.00 0.82 0.00 0.00 66.70 66.60 2o0c h VAL 75 Cb 0.80 0.97 0.01 0.00 -1.52 0.00 0.00 31.29 31.54 2o0c h VAL 75 CO -0.10 0.39 -0.53 0.74 0.02 0.00 0.00 177.57 178.09 2o0c h THR 76 N 0.77 1.37 -0.16 2.57 2.02 -1.49 -3.28 112.91 114.71 2o0c h THR 76 Ca 0.14 -1.86 -0.01 0.00 0.77 0.00 0.00 66.41 65.45 2o0c h THR 76 Cb 0.54 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 2o0c h THR 76 CO 0.03 0.56 0.06 0.22 0.37 0.00 0.00 175.52 176.75 2o0c h TYR 77 N 0.12 0.24 -0.88 3.16 3.20 -1.00 -2.89 116.97 118.93 2o0c h TYR 77 Ca -0.04 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.86 2o0c h TYR 77 Cb 1.18 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 39.32 2o0c h TYR 77 CO 0.11 0.33 0.56 1.79 -1.64 0.00 0.00 178.16 179.32 2o0c h THR 78 N 0.08 1.10 0.00 1.81 1.35 -1.48 -1.68 112.91 114.08 2o0c h THR 78 Ca 0.05 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 2o0c h THR 78 Cb 0.20 -0.05 0.00 0.00 -1.73 0.00 0.00 68.15 66.56 2o0c h THR 78 CO -0.00 0.19 0.00 0.77 -0.25 0.00 0.00 175.52 176.23 2o0c h SER 79 N 1.06 0.00 -0.01 5.36 4.64 -1.57 -1.25 113.55 121.78 2o0c h SER 79 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2o0c h SER 79 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2o0c h SER 79 CO -0.15 0.00 -0.32 -0.62 -0.87 0.00 0.00 176.83 174.87 2o0c n GLU 80 N -3.02 1.55 -0.14 4.77 1.02 -0.69 -3.50 120.64 120.63 2o0c n GLU 80 Ca -0.01 -1.00 0.08 0.00 -0.02 0.00 0.00 57.16 56.22 2o0c n GLU 80 Cb 0.18 -1.35 0.12 0.00 -0.02 0.00 0.00 31.44 30.37 2o0c n GLU 80 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2o0c n GLU 81 N 0.09 1.09 0.00 3.49 -0.58 -0.87 -4.93 120.64 118.93 2o0c n GLU 81 Ca 0.08 -2.34 0.00 0.00 -0.42 0.00 0.00 57.16 54.48 2o0c n GLU 81 Cb 0.40 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.92 2o0c n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2o0c n GLY 82 N -1.22 0.93 0.15 0.62 0.00 -1.22 -5.02 105.19 99.43 2o0c n GLY 82 Ca 0.14 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.22 2o0c n GLY 82 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2o0c n TYR 83 N 0.00 0.00 -0.17 1.61 4.01 -0.51 -4.75 117.16 117.35 2o0c n TYR 83 Ca 0.00 -0.68 -0.04 0.00 -0.16 0.00 0.00 57.90 57.01 2o0c n TYR 83 Cb 0.00 -0.11 0.05 0.00 -0.31 0.00 0.00 39.34 38.97 2o0c n TYR 83 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2o0c h GLY 84 N 0.00 0.73 0.78 2.72 0.00 -1.64 -1.71 103.07 103.95 2o0c h GLY 84 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.09 2o0c h GLY 84 CO 0.00 0.13 -0.08 0.83 0.00 0.00 0.00 176.54 177.41 2o0c h GLU 85 N 0.53 0.37 -0.81 4.80 4.39 -1.90 -0.66 114.58 121.30 2o0c h GLU 85 Ca 0.23 -0.16 0.09 0.00 0.34 0.00 0.00 59.36 59.86 2o0c h GLU 85 Cb 0.12 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.69 2o0c h GLU 85 CO -0.15 0.67 0.46 1.25 -1.16 0.00 0.00 179.01 180.08 2o0c h LEU 86 N 0.06 0.65 -0.21 1.33 5.85 -1.87 0.71 115.31 121.83 2o0c h LEU 86 Ca 0.04 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 2o0c h LEU 86 Cb 0.56 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 2o0c h LEU 86 CO 0.03 0.37 0.07 -0.07 -0.34 0.00 0.00 178.44 178.50 2o0c h LEU 87 N 0.77 0.30 -1.52 2.25 3.38 -1.06 -2.56 115.31 116.87 2o0c h LEU 87 Ca 0.39 -0.20 0.08 0.00 0.09 0.00 0.00 57.88 58.24 2o0c h LEU 87 Cb 0.36 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2o0c h LEU 87 CO -0.25 0.42 0.42 0.00 0.09 0.00 0.00 178.44 179.12 2o0c h ALA 88 N 0.89 1.86 0.00 1.53 0.00 -0.18 -1.31 119.26 122.05 2o0c h ALA 88 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2o0c h ALA 88 Cb 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2o0c h ALA 88 CO -0.00 0.02 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 2o0c n SER 89 N -4.48 0.00 -0.18 0.00 3.41 0.15 -3.29 113.62 109.23 2o0c n SER 89 Ca 0.10 0.28 0.12 0.00 -0.26 0.00 0.00 58.87 59.11 2o0c n SER 89 Cb 0.29 -0.42 0.31 0.00 -0.26 0.00 0.00 64.21 64.12 2o0c n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2o0c n ALA 90 N -1.42 3.29 0.00 7.33 0.00 -0.49 -5.01 120.51 124.21 2o0c n ALA 90 Ca 0.09 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2o0c n ALA 90 Cb 0.27 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2o0c n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o0c n GLY 91 N 1.39 4.10 1.32 0.00 0.00 -1.21 -3.57 105.19 107.23 2o0c n GLY 91 Ca 0.10 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2o0c n GLY 91 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2o0c n ASP 92 N 0.00 3.34 -3.55 1.61 5.68 -1.26 -4.81 116.55 117.56 2o0c n ASP 92 Ca 0.00 -3.83 -0.11 0.00 -0.50 0.00 0.00 54.79 50.35 2o0c n ASP 92 Cb 0.00 -0.46 -0.05 0.00 -1.14 0.00 0.00 41.12 39.47 2o0c n ASP 92 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2o0c s SER 93 N -3.33 -0.42 0.13 -1.12 1.04 -1.26 -5.06 113.70 103.68 2o0c s SER 93 Ca 0.45 0.37 -0.19 0.00 0.48 0.00 0.00 55.95 57.05 2o0c s SER 93 Cb 0.39 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.85 2o0c s SER 93 CO -0.01 -0.45 1.72 0.25 0.98 0.00 0.00 173.24 175.73 2o0c h LEU 94 N 2.51 -0.10 -1.07 2.42 5.85 -1.92 -0.03 115.31 122.96 2o0c h LEU 94 Ca -0.20 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 2o0c h LEU 94 Cb 1.18 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 2o0c h LEU 94 CO 0.32 -0.02 0.33 1.55 -0.34 0.00 0.00 178.44 180.28 2o0c h PRO 95 N 0.06 0.99 0.11 5.25 0.13 -1.99 -1.00 132.00 135.54 2o0c h PRO 95 Ca 0.10 -0.13 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2o0c h PRO 95 Cb 0.14 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.08 2o0c h PRO 95 CO -0.18 0.77 -0.05 1.49 -0.23 0.00 0.00 178.00 179.79 2o0c h GLU 96 N 0.99 -0.14 -1.00 0.86 4.81 -1.81 -2.34 114.58 115.94 2o0c h GLU 96 Ca 0.24 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.62 2o0c h GLU 96 Cb 0.10 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.43 2o0c h GLU 96 CO -0.03 -0.02 0.62 0.35 -0.73 0.00 0.00 179.01 179.20 2o0c h PHE 97 N -0.23 1.12 -0.51 0.92 3.57 -0.69 -0.99 116.94 120.13 2o0c h PHE 97 Ca -0.02 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2o0c h PHE 97 Cb 0.19 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 2o0c h PHE 97 CO -0.04 0.40 -0.01 0.52 -2.23 0.00 0.00 178.31 176.95 2o0c h MET 98 N 0.94 0.91 -0.90 1.11 2.86 -1.02 -1.47 114.93 117.36 2o0c h MET 98 Ca 0.51 -0.29 0.05 0.00 -2.06 0.00 0.00 59.70 57.91 2o0c h MET 98 Cb 0.58 -0.08 -0.06 0.00 0.06 0.00 0.00 31.60 32.10 2o0c h MET 98 CO -0.29 0.94 0.59 0.93 1.06 0.00 0.00 176.91 180.13 2o0c h GLU 99 N 0.77 1.03 -0.00 1.72 4.39 -0.73 -2.39 114.58 119.37 2o0c h GLU 99 Ca 0.14 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2o0c h GLU 99 Cb 0.54 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2o0c h GLU 99 CO 0.03 0.68 -0.08 0.09 -1.16 0.00 0.00 179.01 178.57 2o0c n ASN 100 N -4.47 0.23 -0.11 1.42 3.02 -0.47 -4.34 115.26 110.53 2o0c n ASN 100 Ca 0.13 -0.24 -0.05 0.00 -0.03 0.00 0.00 54.58 54.39 2o0c n ASN 100 Cb 0.16 -0.19 0.02 0.00 -0.61 0.00 0.00 39.78 39.16 2o0c n ASN 100 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2o0c h LEU 101 N 0.23 -0.09 -0.87 3.41 6.46 -0.73 0.31 115.31 124.02 2o0c h LEU 101 Ca 0.00 0.08 -0.02 0.00 -0.12 0.00 0.00 57.88 57.82 2o0c h LEU 101 Cb 0.36 0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.38 2o0c h LEU 101 CO 0.00 -0.01 0.47 0.44 -0.62 0.00 0.00 178.44 178.72 2o0c h ASP 102 N 0.14 1.10 -0.51 1.25 5.19 -1.80 -1.69 116.42 120.10 2o0c h ASP 102 Ca 0.19 -0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.49 2o0c h ASP 102 Cb 0.25 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 2o0c h ASP 102 CO -0.29 0.88 0.29 0.78 -3.12 0.00 0.00 179.24 177.78 2o0c h ASN 103 N 1.22 0.63 -0.30 6.45 -0.26 -1.62 -1.09 115.58 120.61 2o0c h ASN 103 Ca 0.31 -0.08 0.06 0.00 -0.56 0.00 0.00 56.30 56.02 2o0c h ASN 103 Cb 0.03 -0.16 -0.06 0.00 -1.06 0.00 0.00 38.32 37.08 2o0c h ASN 103 CO -0.05 0.53 -0.08 0.25 -1.06 0.00 0.00 177.43 177.02 2o0c h LEU 104 N 0.68 -0.30 -1.15 1.61 6.46 0.18 -0.85 115.31 121.93 2o0c h LEU 104 Ca 0.18 0.09 -0.09 0.00 -0.12 0.00 0.00 57.88 57.94 2o0c h LEU 104 Cb 0.03 0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.15 2o0c h LEU 104 CO -0.03 -0.11 -0.41 0.45 -0.62 0.00 0.00 178.44 177.72 2o0c h HIS 105 N -0.01 0.03 -0.07 1.25 3.86 -1.08 -1.17 115.15 117.95 2o0c h HIS 105 Ca 0.14 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.37 2o0c h HIS 105 Cb 0.23 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 2o0c h HIS 105 CO -0.29 0.43 -0.06 0.00 0.86 0.00 0.00 177.93 178.87 2o0c h ALA 106 N 1.57 0.00 0.25 2.45 0.00 -0.59 0.61 119.26 123.55 2o0c h ALA 106 Ca -0.00 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2o0c h ALA 106 Cb 0.74 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2o0c h ALA 106 CO 0.05 -0.53 -0.48 0.00 0.00 0.00 0.00 179.25 178.29 2o0c h ARG 107 N -0.07 -0.78 -0.82 0.00 3.08 -0.39 -0.74 114.38 114.67 2o0c h ARG 107 Ca 0.05 0.05 0.20 0.00 0.07 0.00 0.00 59.98 60.35 2o0c h ARG 107 Cb 0.14 0.18 -0.13 0.00 0.08 0.00 0.00 29.97 30.24 2o0c h ARG 107 CO -0.12 -0.52 0.20 0.28 -1.07 0.00 0.00 179.97 178.74 2o0c h VAL 108 N -0.81 0.40 -1.07 2.04 2.07 -1.10 0.35 116.25 118.13 2o0c h VAL 108 Ca -0.02 -0.08 0.31 0.00 0.82 0.00 0.00 66.70 67.73 2o0c h VAL 108 Cb 0.77 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2o0c h VAL 108 CO -0.19 0.04 0.79 1.23 0.02 0.00 0.00 177.57 179.46 2o0c h GLY 109 N 0.24 0.00 0.92 2.17 0.00 0.18 -0.88 103.07 105.69 2o0c h GLY 109 Ca 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.73 2o0c h GLY 109 CO -0.60 0.00 -0.14 1.41 0.00 0.00 0.00 176.54 177.22 2o0c h LEU 110 N 0.00 0.66 -0.56 3.11 3.38 -0.60 -3.08 115.31 118.21 2o0c h LEU 110 Ca 0.51 -0.40 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 2o0c h LEU 110 Cb 2.09 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.65 2o0c h LEU 110 CO -0.01 0.91 -0.51 0.28 0.09 0.00 0.00 178.44 179.20 2o0c h SER 111 N 0.40 0.60 -3.50 -0.43 0.02 -1.35 -3.39 113.55 105.90 2o0c h SER 111 Ca 0.07 -0.31 -0.70 0.00 -0.84 0.00 0.00 61.79 60.01 2o0c h SER 111 Cb 0.66 -0.17 -0.35 0.00 0.14 0.00 0.00 62.40 62.68 2o0c h SER 111 CO 0.04 1.01 -0.14 -0.36 -1.14 0.00 0.00 176.83 176.24 2o0c s PHE 112 N -4.05 3.80 0.52 3.45 0.08 -0.45 -4.96 117.98 116.38 2o0c s PHE 112 Ca -0.07 -2.95 0.23 0.00 0.12 0.00 0.00 56.93 54.25 2o0c s PHE 112 Cb 0.12 -3.24 1.35 0.00 -0.57 0.00 0.00 43.02 40.67 2o0c s PHE 112 CO 0.83 -0.76 2.03 -1.00 -0.10 0.00 0.00 175.22 176.22 2o0c h PRO 113 N 6.23 0.02 -0.51 0.24 0.13 -1.76 -1.75 132.00 134.60 2o0c h PRO 113 Ca 0.13 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2o0c h PRO 113 Cb 0.84 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2o0c h PRO 113 CO 0.82 0.02 0.00 1.04 -0.23 0.00 0.00 178.00 179.65 2o0c n GLN 114 N -4.42 2.25 -1.62 0.86 6.02 -1.26 -4.99 117.38 114.22 2o0c n GLN 114 Ca 0.07 -1.79 -0.46 0.00 -0.01 0.00 0.00 57.00 54.81 2o0c n GLN 114 Cb 0.49 -1.43 -0.03 0.00 1.02 0.00 0.00 30.24 30.29 2o0c n GLN 114 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2o0c n LEU 115 N 0.90 2.25 -3.79 1.08 7.94 -0.66 -4.95 117.00 119.77 2o0c n LEU 115 Ca 0.17 1.15 -0.30 0.00 -1.11 0.00 0.00 56.01 55.92 2o0c n LEU 115 Cb 0.45 -1.32 -0.09 0.00 0.53 0.00 0.00 43.42 42.99 2o0c n LEU 115 CO 0.12 -0.98 0.13 0.54 -1.11 0.00 0.00 177.39 176.10 2o0c n ARG 116 N 1.64 2.35 -1.50 1.96 1.74 -1.26 -5.09 116.66 116.49 2o0c n ARG 116 Ca 0.12 -4.56 -0.32 0.00 -0.77 0.00 0.00 57.85 52.33 2o0c n ARG 116 Cb 0.29 -2.31 0.07 0.00 -1.02 0.00 0.00 32.46 29.48 2o0c n ARG 116 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2o0c s PRO 117 N -1.86 2.59 0.62 5.56 0.04 -1.26 -4.90 135.00 135.78 2o0c s PRO 117 Ca 0.31 1.19 -0.14 0.00 0.04 0.00 0.00 61.00 62.40 2o0c s PRO 117 Cb 0.02 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 2o0c s PRO 117 CO -0.10 -1.39 1.04 -1.25 0.04 0.00 0.00 177.00 175.35 2o0c s PRO 118 N -4.65 3.31 -0.14 0.56 0.04 -1.26 -4.82 135.00 128.03 2o0c s PRO 118 Ca 0.62 1.03 -0.03 0.00 0.04 0.00 0.00 61.00 62.66 2o0c s PRO 118 Cb -0.17 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2o0c s PRO 118 CO 0.51 -0.81 -0.03 0.00 0.04 0.00 0.00 177.00 176.71 2o0c s ALA 119 N -2.77 3.07 -0.06 8.56 0.00 0.06 -4.92 121.76 125.70 2o0c s ALA 119 Ca 0.60 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.77 2o0c s ALA 119 Cb -0.14 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.45 2o0c s ALA 119 CO 0.44 0.30 -0.14 -0.06 0.00 0.00 0.00 175.76 176.30 2o0c s PHE 120 N 0.08 1.55 -0.07 0.00 0.08 -1.26 -0.85 117.98 117.50 2o0c s PHE 120 Ca 0.00 -0.53 0.03 0.00 0.12 0.00 0.00 56.93 56.55 2o0c s PHE 120 Cb -0.13 -1.09 0.01 0.00 -0.57 0.00 0.00 43.02 41.23 2o0c s PHE 120 CO 0.03 -0.24 -0.15 -2.00 -0.10 0.00 0.00 175.22 172.76 2o0c s GLU 121 N 0.43 1.95 -0.22 0.44 2.12 -0.57 -4.72 118.70 118.13 2o0c s GLU 121 Ca -0.11 -0.51 -0.13 0.00 0.36 0.00 0.00 54.97 54.58 2o0c s GLU 121 Cb -0.14 -1.58 -0.05 0.00 0.26 0.00 0.00 34.13 32.63 2o0c s GLU 121 CO 0.03 0.07 0.26 0.00 -0.54 0.00 0.00 175.26 175.08 2o0c s GLN 123 N 1.15 2.95 0.63 0.00 -0.21 -0.22 -5.00 119.66 118.95 2o0c s GLN 123 Ca 0.12 -0.94 -0.14 0.00 0.02 0.00 0.00 55.36 54.43 2o0c s GLN 123 Cb -0.14 -3.25 -0.02 0.00 1.00 0.00 0.00 33.01 30.59 2o0c s GLN 123 CO 0.06 -0.45 1.05 -1.01 -2.12 0.00 0.00 175.29 172.82 2o0c s HIS 124 N 1.43 3.05 0.00 0.91 3.76 -1.26 -0.49 115.29 122.68 2o0c s HIS 124 Ca 0.01 1.48 0.00 0.00 -0.15 0.00 0.00 55.06 56.40 2o0c s HIS 124 Cb -0.17 -2.95 0.00 0.00 1.11 0.00 0.00 32.58 30.56 2o0c s HIS 124 CO 0.00 -1.12 0.00 0.25 -0.85 0.00 0.00 174.74 173.02 2o0c n THR 125 N -2.39 0.00 -4.03 1.30 -2.24 -1.04 -4.83 114.28 101.05 2o0c n THR 125 Ca 0.08 -0.09 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 2o0c n THR 125 Cb 0.53 0.63 0.01 0.00 -2.10 0.00 0.00 70.33 69.40 2o0c n THR 125 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2o0c n SER 126 N -0.38 -1.03 0.00 3.42 3.41 -1.18 -4.94 113.62 112.92 2o0c n SER 126 Ca 0.00 -1.08 0.11 0.00 -0.26 0.00 0.00 58.87 57.64 2o0c n SER 126 Cb 0.00 1.57 0.58 0.00 -0.26 0.00 0.00 64.21 66.10 2o0c n SER 126 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2o0c n SER 127 N -1.00 0.00 -0.05 4.04 3.41 -1.26 -2.96 113.62 115.81 2o0c n SER 127 Ca 0.06 -0.07 0.02 0.00 -0.26 0.00 0.00 58.87 58.62 2o0c n SER 127 Cb 0.56 -0.27 0.03 0.00 -0.26 0.00 0.00 64.21 64.27 2o0c n SER 127 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2o0c n LYS 128 N -1.27 1.93 -3.57 4.33 5.02 -1.26 -4.98 118.16 118.36 2o0c n LYS 128 Ca 0.11 -1.52 -0.15 0.00 -2.02 0.00 0.00 58.31 54.73 2o0c n LYS 128 Cb 0.18 -0.99 -0.06 0.00 -0.02 0.00 0.00 35.03 34.15 2o0c n LYS 128 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2o0c s SER 129 N -1.22 -0.46 -0.04 4.39 1.04 -1.15 -0.55 113.70 115.70 2o0c s SER 129 Ca 0.07 0.26 -0.30 0.00 0.48 0.00 0.00 55.95 56.46 2o0c s SER 129 Cb 0.06 0.49 0.08 0.00 0.10 0.00 0.00 66.02 66.75 2o0c s SER 129 CO 0.01 -0.69 0.74 0.00 0.98 0.00 0.00 173.24 174.28 2o0c s MET 130 N -2.17 0.99 -0.17 4.02 0.23 -0.08 -2.48 119.30 119.63 2o0c s MET 130 Ca -0.07 0.10 -0.20 0.00 -1.03 0.00 0.00 55.69 54.49 2o0c s MET 130 Cb -0.01 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.72 2o0c s MET 130 CO 0.01 -0.34 0.60 -1.21 -2.03 0.00 0.00 175.02 172.04 2o0c s GLU 131 N -1.65 4.25 -0.23 3.16 2.02 0.35 -1.01 118.70 125.60 2o0c s GLU 131 Ca -0.07 0.58 -0.08 0.00 0.02 0.00 0.00 54.97 55.43 2o0c s GLU 131 Cb -0.00 -3.54 -0.04 0.00 0.10 0.00 0.00 34.13 30.65 2o0c s GLU 131 CO 0.04 -0.14 0.08 -1.17 0.02 0.00 0.00 175.26 174.09 2o0c s LEU 132 N 1.56 3.65 -0.21 1.80 2.96 0.12 -1.06 118.68 127.50 2o0c s LEU 132 Ca 0.28 -0.07 -0.09 0.00 -0.22 0.00 0.00 54.13 54.03 2o0c s LEU 132 Cb -0.16 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.53 2o0c s LEU 132 CO 0.11 0.05 0.12 -1.00 -1.32 0.00 0.00 176.35 174.31 2o0c s HIS 133 N 1.13 3.33 -0.16 5.38 3.76 0.96 -0.77 115.29 128.93 2o0c s HIS 133 Ca 0.05 0.21 0.01 0.00 -0.15 0.00 0.00 55.06 55.18 2o0c s HIS 133 Cb -0.14 -2.18 0.02 0.00 1.11 0.00 0.00 32.58 31.39 2o0c s HIS 133 CO 0.04 0.17 -0.15 -0.47 -0.85 0.00 0.00 174.74 173.48 2o0c s TYR 134 N 0.62 2.30 -0.03 1.40 5.04 -0.29 -1.51 117.35 124.88 2o0c s TYR 134 Ca 0.07 -1.33 0.05 0.00 -2.44 0.00 0.00 57.07 53.42 2o0c s TYR 134 Cb -0.12 -1.66 -0.01 0.00 0.35 0.00 0.00 41.96 40.52 2o0c s TYR 134 CO 0.01 -0.70 -0.20 -0.65 -1.34 0.00 0.00 175.55 172.67 2o0c s GLN 135 N 1.44 1.86 0.02 4.97 -0.21 -0.03 -3.15 119.66 124.55 2o0c s GLN 135 Ca 0.04 -0.70 -0.13 0.00 0.02 0.00 0.00 55.36 54.60 2o0c s GLN 135 Cb -0.13 -1.67 0.02 0.00 1.00 0.00 0.00 33.01 32.23 2o0c s GLN 135 CO -0.11 0.34 0.27 0.45 -2.12 0.00 0.00 175.29 174.12 2o0c s SER 136 N -0.19 -0.10 0.00 5.90 0.15 -1.26 -0.76 113.70 117.43 2o0c s SER 136 Ca 0.01 -0.13 0.30 0.00 0.70 0.00 0.00 55.95 56.83 2o0c s SER 136 Cb -0.10 0.31 1.77 0.00 -1.71 0.00 0.00 66.02 66.29 2o0c s SER 136 CO 0.01 -0.53 2.13 0.35 1.20 0.00 0.00 173.24 176.41 2o0c n THR 137 N 0.91 0.01 -4.48 6.45 -2.24 -1.26 -4.89 114.28 108.78 2o0c n THR 137 Ca -0.20 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.34 2o0c n THR 137 Cb 0.58 -0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 68.18 2o0c n THR 137 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2o0c s ARG 138 N -2.09 1.68 -0.02 -0.78 0.52 -1.26 -5.14 118.95 111.85 2o0c s ARG 138 Ca 0.43 -1.79 0.01 0.00 -0.52 0.00 0.00 55.73 53.85 2o0c s ARG 138 Cb 0.21 -1.68 -0.03 0.00 0.52 0.00 0.00 34.95 33.96 2o0c s ARG 138 CO 0.37 0.27 -0.01 0.00 0.02 0.00 0.00 175.30 175.95 2o0c n GLY 140 N 1.62 0.08 0.46 0.00 0.00 -1.26 -4.90 105.19 101.19 2o0c n GLY 140 Ca -0.16 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.64 2o0c n GLY 140 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o0c n LEU 141 N -1.84 1.79 -0.31 0.99 4.77 -1.26 -4.45 117.00 116.68 2o0c n LEU 141 Ca -0.15 -0.62 0.17 0.00 -0.03 0.00 0.00 56.01 55.37 2o0c n LEU 141 Cb 0.59 -0.04 0.35 0.00 -2.33 0.00 0.00 43.42 41.99 2o0c n LEU 141 CO 0.19 0.33 0.97 0.00 -1.33 0.00 0.00 177.39 177.55 2o0c h ALA 142 N 3.90 1.47 -0.70 -1.18 0.00 -1.95 0.34 119.26 121.14 2o0c h ALA 142 Ca 0.00 0.23 0.09 0.00 0.00 0.00 0.00 54.91 55.23 2o0c h ALA 142 Cb 0.69 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2o0c h ALA 142 CO 0.00 -0.53 0.46 -1.35 0.00 0.00 0.00 179.25 177.83 2o0c h PRO 143 N 0.20 0.57 -0.33 0.00 0.11 -1.91 -1.90 132.00 128.73 2o0c h PRO 143 Ca 0.61 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.70 2o0c h PRO 143 Cb 1.31 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2o0c h PRO 143 CO -0.68 0.37 0.19 1.98 -0.21 0.00 0.00 178.00 179.66 2o0c h MET 144 N 0.58 0.38 -0.60 1.05 4.05 -0.48 -2.72 114.93 117.19 2o0c h MET 144 Ca 0.32 -0.02 0.10 0.00 -0.28 0.00 0.00 59.70 59.81 2o0c h MET 144 Cb 0.47 -0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 31.11 2o0c h MET 144 CO -0.11 0.25 0.20 0.28 0.23 0.00 0.00 176.91 177.77 2o0c h VAL 145 N 0.39 0.74 -0.68 -5.77 2.07 -1.11 0.72 116.25 112.61 2o0c h VAL 145 Ca 0.13 -0.13 0.11 0.00 0.82 0.00 0.00 66.70 67.63 2o0c h VAL 145 Cb 0.00 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.03 2o0c h VAL 145 CO -0.06 0.07 0.29 0.25 0.02 0.00 0.00 177.57 178.13 2o0c h LEU 146 N 0.37 0.32 -0.34 2.57 5.85 -1.27 0.25 115.31 123.06 2o0c h LEU 146 Ca 0.31 0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.94 2o0c h LEU 146 Cb 0.40 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2o0c h LEU 146 CO -0.33 0.17 -0.43 1.23 -0.34 0.00 0.00 178.44 178.75 2o0c h GLY 147 N 0.48 0.96 0.67 3.75 0.00 -0.93 -2.50 103.07 105.50 2o0c h GLY 147 Ca 0.35 -1.04 0.06 0.00 0.00 0.00 0.00 47.33 46.70 2o0c h GLY 147 CO -0.32 0.93 0.32 1.41 0.00 0.00 0.00 176.54 178.88 2o0c h LEU 148 N 0.68 0.46 -0.81 3.11 3.38 -0.29 0.27 115.31 122.11 2o0c h LEU 148 Ca 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2o0c h LEU 148 Cb 1.02 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.68 2o0c h LEU 148 CO 0.10 0.30 0.42 -0.07 0.09 0.00 0.00 178.44 179.29 2o0c h LEU 149 N 0.60 1.03 -0.63 1.67 3.38 -0.85 -0.57 115.31 119.95 2o0c h LEU 149 Ca 0.28 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 2o0c h LEU 149 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2o0c h LEU 149 CO -0.18 0.85 -0.33 0.45 0.09 0.00 0.00 178.44 179.32 2o0c h HIS 150 N 1.13 0.84 -0.79 1.13 3.86 -1.04 -1.67 115.15 118.62 2o0c h HIS 150 Ca 0.28 -0.22 0.07 0.00 -1.16 0.00 0.00 60.37 59.34 2o0c h HIS 150 Cb 0.07 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.30 2o0c h HIS 150 CO 0.01 0.95 0.51 0.78 0.86 0.00 0.00 177.93 181.04 2o0c h GLY 151 N 0.97 1.07 1.10 2.45 0.00 -0.29 -0.50 103.07 107.87 2o0c h GLY 151 Ca 0.06 -0.33 -0.22 0.00 0.00 0.00 0.00 47.33 46.84 2o0c h GLY 151 CO 0.07 0.24 -0.82 1.41 0.00 0.00 0.00 176.54 177.44 2o0c h LEU 152 N 0.82 0.84 -0.50 3.11 3.38 -0.78 0.03 115.31 122.22 2o0c h LEU 152 Ca 0.34 -0.69 0.10 0.00 0.09 0.00 0.00 57.88 57.73 2o0c h LEU 152 Cb 0.28 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.68 2o0c h LEU 152 CO -0.12 1.41 -0.10 1.23 0.09 0.00 0.00 178.44 180.94 2o0c h GLY 153 N 0.36 0.39 1.09 0.83 0.00 -0.85 0.20 103.07 105.09 2o0c h GLY 153 Ca -0.08 0.15 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 2o0c h GLY 153 CO 0.16 -0.18 0.41 1.70 0.00 0.00 0.00 176.54 178.63 2o0c h LYS 154 N 0.02 1.18 -0.13 4.80 3.64 -0.92 -0.37 116.57 124.78 2o0c h LYS 154 Ca 0.24 -0.16 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2o0c h LYS 154 Cb 0.37 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2o0c h LYS 154 CO -0.50 0.89 0.07 -0.09 -2.27 0.00 0.00 179.45 177.55 2o0c h ARG 155 N 1.17 0.15 -0.86 1.90 2.43 0.20 -3.09 114.38 116.27 2o0c h ARG 155 Ca 0.29 -0.01 -0.25 0.00 -0.81 0.00 0.00 59.98 59.20 2o0c h ARG 155 Cb 0.09 -0.03 -0.15 0.00 -0.42 0.00 0.00 29.97 29.46 2o0c h ARG 155 CO -0.04 0.10 0.32 1.19 -1.51 0.00 0.00 179.97 180.03 2o0c n PHE 156 N -5.02 2.22 -4.10 2.20 3.72 0.59 -4.90 117.46 112.16 2o0c n PHE 156 Ca -0.04 -1.20 -0.30 0.00 -0.05 0.00 0.00 57.45 55.85 2o0c n PHE 156 Cb 0.04 -0.67 -0.07 0.00 -0.94 0.00 0.00 39.48 37.84 2o0c n PHE 156 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2o0c n GLN 157 N -0.29 -0.82 -4.69 -1.08 1.13 -0.73 -4.92 117.38 105.98 2o0c n GLN 157 Ca 0.39 0.06 -0.24 0.00 -1.94 0.00 0.00 57.00 55.27 2o0c n GLN 157 Cb 1.30 -2.95 -0.16 0.00 0.11 0.00 0.00 30.24 28.54 2o0c n GLN 157 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2o0c s THR 158 N -4.13 1.20 -0.06 5.09 2.01 -0.23 -5.04 115.64 114.47 2o0c s THR 158 Ca 0.08 -0.62 -0.28 0.00 0.31 0.00 0.00 61.69 61.18 2o0c s THR 158 Cb -0.05 -1.02 -0.02 0.00 0.01 0.00 0.00 72.50 71.42 2o0c s THR 158 CO 0.88 0.35 0.94 -0.54 -0.69 0.00 0.00 174.62 175.55 2o0c s LYS 159 N -0.12 4.47 0.01 4.92 1.02 -1.26 -4.35 119.74 124.43 2o0c s LYS 159 Ca 0.01 1.29 0.05 0.00 0.02 0.00 0.00 55.97 57.34 2o0c s LYS 159 Cb -0.08 -3.50 -0.02 0.00 -0.52 0.00 0.00 37.83 33.71 2o0c s LYS 159 CO 0.01 -0.16 -0.16 0.14 -0.92 0.00 0.00 175.35 174.26 2o0c s VAL 160 N 1.45 1.25 -0.12 3.17 -7.23 -1.26 -1.36 120.40 116.30 2o0c s VAL 160 Ca 0.47 -0.85 0.01 0.00 -1.81 0.00 0.00 61.98 59.80 2o0c s VAL 160 Cb -0.19 -1.08 -0.01 0.00 0.56 0.00 0.00 36.38 35.66 2o0c s VAL 160 CO 0.21 0.21 -0.16 -1.61 -0.31 0.00 0.00 175.10 173.45 2o0c s GLU 161 N -0.73 3.30 -0.10 4.82 2.02 0.14 -4.98 118.70 123.16 2o0c s GLU 161 Ca 0.05 -0.74 0.02 0.00 0.02 0.00 0.00 54.97 54.32 2o0c s GLU 161 Cb -0.07 -2.55 0.01 0.00 0.10 0.00 0.00 34.13 31.62 2o0c s GLU 161 CO 0.00 0.20 -0.16 0.08 0.02 0.00 0.00 175.26 175.40 2o0c s VAL 162 N 0.37 1.51 -0.05 2.63 1.01 -1.26 -1.23 120.40 123.38 2o0c s VAL 162 Ca -0.13 -0.66 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 2o0c s VAL 162 Cb -0.16 -1.37 0.03 0.00 0.00 0.00 0.00 36.38 34.87 2o0c s VAL 162 CO 0.06 0.44 -0.01 0.42 0.00 0.00 0.00 175.10 176.01 2o0c s THR 163 N 0.88 0.39 -0.03 3.92 -4.23 -0.39 -5.00 115.64 111.17 2o0c s THR 163 Ca -0.09 0.03 -0.30 0.00 -1.18 0.00 0.00 61.69 60.15 2o0c s THR 163 Cb -0.15 -0.48 -0.05 0.00 1.34 0.00 0.00 72.50 73.16 2o0c s THR 163 CO 0.00 0.22 1.33 -1.58 -0.54 0.00 0.00 174.62 174.06 2o0c s GLN 164 N 1.38 4.30 -0.01 3.99 0.74 -1.26 -0.56 119.66 128.24 2o0c s GLN 164 Ca -0.04 1.86 0.17 0.00 0.05 0.00 0.00 55.36 57.39 2o0c s GLN 164 Cb -0.13 -3.58 -0.22 0.00 1.10 0.00 0.00 33.01 30.18 2o0c s GLN 164 CO -0.02 -0.54 0.53 0.25 -0.55 0.00 0.00 175.29 174.95 2o0c n THR 165 N 4.69 0.00 -3.85 -0.34 -2.24 -0.29 -4.93 114.28 107.32 2o0c n THR 165 Ca 0.12 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.54 2o0c n THR 165 Cb 0.44 0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 69.12 2o0c n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2o0c s ALA 166 N -2.85 -0.34 -0.07 6.98 0.00 -1.17 -4.96 121.76 119.34 2o0c s ALA 166 Ca -0.00 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2o0c s ALA 166 Cb 0.12 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.17 2o0c s ALA 166 CO 0.68 -0.13 -0.05 -0.06 0.00 0.00 0.00 175.76 176.20 2o0c s PHE 167 N -0.60 1.01 0.33 0.00 0.08 -1.26 -2.41 117.98 115.12 2o0c s PHE 167 Ca -0.07 -0.38 0.09 0.00 0.12 0.00 0.00 56.93 56.68 2o0c s PHE 167 Cb -0.04 -0.91 0.96 0.00 -0.57 0.00 0.00 43.02 42.46 2o0c s PHE 167 CO 0.01 -0.33 1.58 0.00 -0.10 0.00 0.00 175.22 176.38 2o0c h ARG 168 N 7.79 0.03 -0.24 0.44 3.08 -1.78 -1.55 114.38 122.14 2o0c h ARG 168 Ca -0.29 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 2o0c h ARG 168 Cb 1.14 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 2o0c h ARG 168 CO 0.39 0.02 0.09 0.93 -1.07 0.00 0.00 179.97 180.32 2o0c h GLU 169 N 0.03 0.34 0.00 0.04 5.08 -1.95 -0.75 114.58 117.37 2o0c h GLU 169 Ca 0.69 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 59.01 2o0c h GLU 169 Cb 1.58 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2o0c h GLU 169 CO -0.84 0.29 0.00 1.79 -1.00 0.00 0.00 179.01 179.25 2o0c h THR 170 N 0.34 0.00 0.00 1.13 1.35 -1.70 -3.47 112.91 110.56 2o0c h THR 170 Ca 0.09 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2o0c h THR 170 Cb 0.09 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 2o0c h THR 170 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 2o0c n GLY 171 N 0.80 1.04 3.77 5.82 0.00 -0.29 -5.07 105.19 111.26 2o0c n GLY 171 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2o0c n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o0c s GLU 172 N -0.02 2.47 0.13 1.61 0.41 -1.13 -4.97 118.70 117.21 2o0c s GLU 172 Ca 0.00 1.28 -0.21 0.00 -0.41 0.00 0.00 54.97 55.63 2o0c s GLU 172 Cb 0.00 -1.92 -0.01 0.00 -1.78 0.00 0.00 34.13 30.42 2o0c s GLU 172 CO 0.00 -1.49 1.68 -0.44 -0.49 0.00 0.00 175.26 174.52 2o0c h ASP 173 N -0.61 -0.39 -5.10 -0.19 3.32 -1.92 -3.37 116.42 108.16 2o0c h ASP 173 Ca -0.45 0.08 -0.07 0.00 0.02 0.00 0.00 57.03 56.62 2o0c h ASP 173 Cb 1.24 0.20 -0.14 0.00 0.22 0.00 0.00 39.33 40.85 2o0c h ASP 173 CO 0.52 -0.16 -0.18 -1.38 -1.72 0.00 0.00 179.24 176.32 2o0c s HIS 174 N -6.17 -0.08 0.30 4.55 -3.43 -1.26 -4.84 115.29 104.36 2o0c s HIS 174 Ca -0.14 -0.24 -0.29 0.00 -0.80 0.00 0.00 55.06 53.59 2o0c s HIS 174 Cb 0.11 0.14 -0.10 0.00 -1.43 0.00 0.00 32.58 31.29 2o0c s HIS 174 CO 0.68 -0.63 1.42 -0.51 -2.00 0.00 0.00 174.74 173.70 2o0c s ASP 175 N -2.72 6.61 -0.01 7.38 1.01 -1.19 -4.48 116.67 123.28 2o0c s ASP 175 Ca 0.02 2.77 0.03 0.00 0.71 0.00 0.00 52.55 56.08 2o0c s ASP 175 Cb 0.02 -2.64 -0.00 0.00 1.01 0.00 0.00 42.92 41.31 2o0c s ASP 175 CO -0.11 -0.70 -0.09 -0.63 0.21 0.00 0.00 175.17 173.85 2o0c s ILE 176 N -0.56 0.74 -0.06 0.77 1.01 -1.01 -1.14 121.20 120.94 2o0c s ILE 176 Ca 0.55 -0.39 0.05 0.00 0.00 0.00 0.00 60.65 60.86 2o0c s ILE 176 Cb -0.43 -0.63 -0.00 0.00 0.01 0.00 0.00 42.46 41.41 2o0c s ILE 176 CO 0.50 0.21 -0.21 -0.36 0.00 0.00 0.00 174.94 175.08 2o0c s PHE 177 N -0.13 2.16 -0.09 3.97 0.08 0.05 -1.14 117.98 122.89 2o0c s PHE 177 Ca 0.02 -0.70 -0.15 0.00 0.12 0.00 0.00 56.93 56.23 2o0c s PHE 177 Cb -0.05 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.91 2o0c s PHE 177 CO -0.00 -0.24 0.36 0.45 -0.10 0.00 0.00 175.22 175.69 2o0c s SER 178 N 0.05 6.63 -0.03 1.36 0.15 0.28 0.15 113.70 122.28 2o0c s SER 178 Ca -0.07 0.75 0.02 0.00 0.70 0.00 0.00 55.95 57.34 2o0c s SER 178 Cb -0.14 -2.22 0.01 0.00 -1.71 0.00 0.00 66.02 61.96 2o0c s SER 178 CO 0.04 0.19 -0.08 -0.63 1.20 0.00 0.00 173.24 173.96 2o0c s ILE 179 N -0.21 0.76 -0.01 6.45 1.01 -0.18 -1.27 121.20 127.76 2o0c s ILE 179 Ca 0.21 -0.31 0.07 0.00 0.00 0.00 0.00 60.65 60.62 2o0c s ILE 179 Cb -0.15 -0.70 -0.02 0.00 0.01 0.00 0.00 42.46 41.60 2o0c s ILE 179 CO 0.09 0.25 -0.24 -0.54 0.00 0.00 0.00 174.94 174.50 2o0c s LYS 180 N 0.43 1.88 0.02 2.79 1.02 -0.36 -0.90 119.74 124.61 2o0c s LYS 180 Ca -0.07 -0.88 -0.06 0.00 0.02 0.00 0.00 55.97 54.99 2o0c s LYS 180 Cb -0.11 -1.85 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 2o0c s LYS 180 CO 0.01 0.50 0.10 1.52 -0.92 0.00 0.00 175.35 176.56 2o0c s TYR 181 N -0.59 0.13 -0.80 3.18 -0.85 0.29 -0.68 117.35 118.04 2o0c s TYR 181 Ca 0.09 -0.33 0.00 0.00 -0.52 0.00 0.00 57.07 56.31 2o0c s TYR 181 Cb -0.09 -0.10 0.00 0.00 0.38 0.00 0.00 41.96 42.15 2o0c s TYR 181 CO -0.00 -0.31 0.20 -1.91 -1.52 0.00 0.00 175.55 172.00