#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hho h TYR 3 N 0.00 0.72 0.88 1.20 -1.99 -1.98 0.19 116.97 115.98 3hho h TYR 3 Ca 0.00 0.02 -0.04 0.00 2.00 0.00 0.00 58.73 60.71 3hho h TYR 3 Cb 0.00 -0.22 0.01 0.00 2.00 0.00 0.00 36.73 38.51 3hho h TYR 3 CO 0.00 0.36 -0.42 0.74 -0.00 0.00 0.00 178.16 178.84 3hho h PHE 4 N 0.73 -1.09 -0.66 4.88 0.04 -1.96 -2.72 116.94 116.16 3hho h PHE 4 Ca 0.29 -0.03 0.09 0.00 2.80 0.00 0.00 57.97 61.13 3hho h PHE 4 Cb 0.14 0.36 -0.10 0.00 2.20 0.00 0.00 35.95 38.55 3hho h PHE 4 CO -0.07 -0.68 -0.29 0.39 -0.60 0.00 0.00 178.31 177.06 3hho n GLU 5 N -5.52 -0.19 0.26 1.51 1.02 -1.04 -0.53 120.64 116.17 3hho n GLU 5 Ca -0.15 1.01 0.17 0.00 -0.02 0.00 0.00 57.16 58.17 3hho n GLU 5 Cb 0.46 -1.50 0.79 0.00 -0.02 0.00 0.00 31.44 31.17 3hho n GLU 5 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hho h LEU 6 N 0.00 0.00 -2.92 -4.62 4.07 -0.31 1.14 115.31 112.67 3hho h LEU 6 Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.16 3hho h LEU 6 Cb 0.36 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.10 3hho h LEU 6 CO -0.65 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 177.20 3hho n PHE 7 N -3.13 0.54 -0.75 1.13 3.72 0.31 -4.93 117.46 114.36 3hho n PHE 7 Ca 0.01 -0.54 0.00 0.00 -0.05 0.00 0.00 57.45 56.87 3hho n PHE 7 Cb 0.46 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 3hho n PHE 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hho n GLY 8 N 0.46 0.21 3.81 1.37 0.00 0.39 -4.86 105.19 106.57 3hho n GLY 8 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 3hho n GLY 8 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hho s LEU 9 N 0.00 3.63 0.28 0.99 1.43 -0.98 -4.92 118.68 119.12 3hho s LEU 9 Ca 0.00 1.78 -0.25 0.00 -1.03 0.00 0.00 54.13 54.63 3hho s LEU 9 Cb 0.00 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.59 3hho s LEU 9 CO 0.00 -0.90 0.88 -2.16 0.23 0.00 0.00 176.35 174.40 3hho s PRO 10 N -3.82 4.52 -0.30 1.29 0.04 -1.26 -3.79 135.00 131.68 3hho s PRO 10 Ca 0.63 1.22 -0.28 0.00 0.04 0.00 0.00 61.00 62.61 3hho s PRO 10 Cb -0.14 -2.88 -0.02 0.00 0.04 0.00 0.00 34.50 31.49 3hho s PRO 10 CO 0.30 0.34 1.85 0.42 0.04 0.00 0.00 177.00 179.95 3hho s ILE 11 N -1.54 3.42 0.10 0.56 1.01 -1.26 -4.92 121.20 118.57 3hho s ILE 11 Ca 0.47 0.43 -0.27 0.00 0.00 0.00 0.00 60.65 61.28 3hho s ILE 11 Cb -0.19 -3.55 0.08 0.00 0.01 0.00 0.00 42.46 38.82 3hho s ILE 11 CO 0.24 -0.34 1.07 -1.10 0.00 0.00 0.00 174.94 174.81 3hho s GLN 12 N 5.67 0.93 0.32 2.79 -0.21 -1.26 -4.96 119.66 122.93 3hho s GLN 12 Ca 0.83 -0.52 0.17 0.00 0.02 0.00 0.00 55.36 55.86 3hho s GLN 12 Cb -0.24 0.31 0.14 0.00 1.00 0.00 0.00 33.01 34.22 3hho s GLN 12 CO 0.34 -0.42 1.49 0.35 -2.12 0.00 0.00 175.29 174.92 3hho h PHE 13 N 2.00 0.00 -2.78 0.91 3.57 -1.93 -3.43 116.94 115.28 3hho h PHE 13 Ca -0.26 0.00 -0.55 0.00 3.53 0.00 0.00 57.97 60.69 3hho h PHE 13 Cb 1.22 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.91 3hho h PHE 13 CO 0.39 0.38 1.17 -1.21 -2.23 0.00 0.00 178.31 176.81 3hho s GLU 14 N -3.03 3.27 -0.04 1.11 8.01 -1.26 -4.97 118.70 121.79 3hho s GLU 14 Ca 0.05 0.80 0.04 0.00 0.01 0.00 0.00 54.97 55.87 3hho s GLU 14 Cb 0.07 -4.15 -0.00 0.00 -4.31 0.00 0.00 34.13 25.73 3hho s GLU 14 CO 0.73 -1.95 -0.16 -1.17 0.01 0.00 0.00 175.26 172.72 3hho s LEU 15 N 6.54 1.91 -0.46 1.80 2.96 -1.26 -4.93 118.68 125.23 3hho s LEU 15 Ca 0.63 -0.32 -0.23 0.00 -0.22 0.00 0.00 54.13 53.99 3hho s LEU 15 Cb -0.14 -0.90 0.03 0.00 0.50 0.00 0.00 46.19 45.68 3hho s LEU 15 CO 0.28 0.14 0.77 -0.62 -1.32 0.00 0.00 176.35 175.60 3hho s ASP 16 N 0.02 6.38 0.00 3.68 2.15 -1.26 -4.99 116.67 122.65 3hho s ASP 16 Ca -0.03 -0.23 0.00 0.00 0.43 0.00 0.00 52.55 52.73 3hho s ASP 16 Cb -0.11 -2.37 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 3hho s ASP 16 CO 0.02 -0.92 0.85 0.61 -0.17 0.00 0.00 175.17 175.55 3hho n GLY 17 N 5.02 -2.46 0.49 2.66 0.00 -1.26 -1.80 105.19 107.84 3hho n GLY 17 Ca 0.01 0.00 0.34 0.00 0.00 0.00 0.00 46.02 46.37 3hho n GLY 17 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hho h SER 18 N 0.00 0.23 -0.43 1.61 0.02 -1.99 0.36 113.55 113.35 3hho h SER 18 Ca 0.00 0.08 -0.11 0.00 -0.84 0.00 0.00 61.79 60.92 3hho h SER 18 Cb 0.00 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3hho h SER 18 CO 0.00 -0.04 -0.14 0.25 -1.14 0.00 0.00 176.83 175.76 3hho h LEU 19 N 0.15 0.91 0.16 5.07 6.46 -1.97 -2.52 115.31 123.57 3hho h LEU 19 Ca 0.71 -0.30 -0.01 0.00 -0.12 0.00 0.00 57.88 58.16 3hho h LEU 19 Cb 2.31 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 41.99 3hho h LEU 19 CO -0.25 1.05 -0.08 0.25 -0.62 0.00 0.00 178.44 178.79 3hho h LEU 20 N 0.80 -0.18 -1.75 2.25 5.85 0.48 0.27 115.31 123.04 3hho h LEU 20 Ca 0.12 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.52 3hho h LEU 20 Cb 0.67 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 3hho h LEU 20 CO 0.05 0.30 0.44 0.28 -0.34 0.00 0.00 178.44 179.17 3hho h SER 21 N -0.73 0.00 0.08 1.25 0.02 -1.37 1.02 113.55 113.82 3hho h SER 21 Ca -0.02 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.61 3hho h SER 21 Cb 0.51 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 3hho h SER 21 CO 0.04 0.00 -1.76 -1.54 -1.14 0.00 0.00 176.83 172.42 3hho n SER 22 N -2.95 2.03 -0.25 3.07 3.41 -0.95 -1.97 113.62 116.01 3hho n SER 22 Ca -0.00 0.28 0.14 0.00 -0.26 0.00 0.00 58.87 59.03 3hho n SER 22 Cb 0.50 -0.89 0.42 0.00 -0.26 0.00 0.00 64.21 63.98 3hho n SER 22 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3hho h GLN 23 N -0.32 0.57 0.13 4.33 1.08 0.25 0.19 115.11 121.34 3hho h GLN 23 Ca -0.41 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 56.75 3hho h GLN 23 Cb 1.77 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 29.08 3hho h GLN 23 CO -0.03 0.38 -0.06 0.35 -0.95 0.00 0.00 178.83 178.52 3hho h PHE 24 N 0.59 -0.17 -0.93 2.96 3.57 0.84 -0.82 116.94 122.98 3hho h PHE 24 Ca 0.45 -0.00 0.26 0.00 3.53 0.00 0.00 57.97 62.21 3hho h PHE 24 Cb 0.85 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.61 3hho h PHE 24 CO -0.00 -0.10 0.66 0.00 -2.23 0.00 0.00 178.31 176.64 3hho h ARG 25 N -0.29 0.05 -0.48 1.11 3.08 -1.32 2.83 114.38 119.36 3hho h ARG 25 Ca -0.02 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 3hho h ARG 25 Cb 0.14 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3hho h ARG 25 CO 0.03 0.03 -0.13 0.00 -1.07 0.00 0.00 179.97 178.83 3hho h ALA 26 N 1.54 0.87 0.13 0.04 0.00 -0.58 -2.52 119.26 118.74 3hho h ALA 26 Ca 0.45 -0.34 -0.30 0.00 0.00 0.00 0.00 54.91 54.72 3hho h ALA 26 Cb 1.72 -0.18 0.03 0.00 0.00 0.00 0.00 17.79 19.35 3hho h ALA 26 CO -0.03 0.64 -1.26 -0.07 0.00 0.00 0.00 179.25 178.53 3hho h LEU 27 N 0.79 0.78 0.00 0.00 3.38 0.21 -3.08 115.31 117.39 3hho h LEU 27 Ca 0.12 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.35 3hho h LEU 27 Cb 0.66 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3hho h LEU 27 CO 0.05 1.56 0.02 0.00 0.09 0.00 0.00 178.44 180.16 3hho n GLN 28 N -3.74 0.00 -0.01 1.13 6.02 0.88 -1.23 117.38 120.43 3hho n GLN 28 Ca -0.13 0.29 0.01 0.00 -0.01 0.00 0.00 57.00 57.16 3hho n GLN 28 Cb 1.00 -1.52 -0.04 0.00 1.02 0.00 0.00 30.24 30.69 3hho n GLN 28 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3hho n LYS 29 N -1.27 1.03 0.07 -1.09 5.02 -0.97 -4.21 118.16 116.74 3hho n LYS 29 Ca 0.00 -0.04 -0.20 0.00 -2.02 0.00 0.00 58.31 56.06 3hho n LYS 29 Cb 0.02 -1.13 -0.15 0.00 -0.02 0.00 0.00 35.03 33.76 3hho n LYS 29 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3hho h ARG 30 N 0.00 0.32 -0.32 1.97 2.43 -1.08 -3.38 114.38 114.32 3hho h ARG 30 Ca -0.04 -0.55 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 3hho h ARG 30 Cb 0.56 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3hho h ARG 30 CO 0.00 1.21 0.00 1.19 -1.51 0.00 0.00 179.97 180.86 3hho n PHE 31 N -3.52 0.65 -1.56 2.20 3.01 -0.55 -5.01 117.46 112.68 3hho n PHE 31 Ca -0.20 -0.63 -0.48 0.00 1.01 0.00 0.00 57.45 57.15 3hho n PHE 31 Cb 1.06 -0.13 -0.05 0.00 -0.01 0.00 0.00 39.48 40.35 3hho n PHE 31 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 3hho n HIS 32 N 0.17 1.93 -0.33 1.38 -0.00 -1.26 -4.53 115.22 112.58 3hho n HIS 32 Ca 0.15 0.06 0.20 0.00 0.46 0.00 0.00 57.72 58.60 3hho n HIS 32 Cb 0.60 -2.63 0.42 0.00 -0.12 0.00 0.00 29.99 28.25 3hho n HIS 32 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3hho h PRO 33 N 12.37 0.36 -1.09 1.57 0.11 -1.94 -1.03 132.00 142.35 3hho h PRO 33 Ca -0.38 -0.02 0.30 0.00 0.11 0.00 0.00 66.00 66.01 3hho h PRO 33 Cb 1.28 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 3hho h PRO 33 CO 0.98 0.24 0.73 0.22 -0.21 0.00 0.00 178.00 179.96 3hho h ASP 34 N 0.37 0.26 -0.01 -2.05 1.82 -1.98 0.35 116.42 115.17 3hho h ASP 34 Ca 0.68 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 57.38 3hho h ASP 34 Cb 1.47 0.01 -0.00 0.00 0.68 0.00 0.00 39.33 41.49 3hho h ASP 34 CO -0.58 0.04 0.14 0.78 -1.61 0.00 0.00 179.24 178.01 3hho h ASN 35 N 0.22 0.00 -0.14 2.28 2.35 -1.56 -1.85 115.58 116.88 3hho h ASN 35 Ca 0.58 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.33 3hho h ASN 35 Cb 1.81 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.18 3hho h ASN 35 CO -0.18 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.09 3hho n PHE 36 N -3.08 0.47 0.61 1.19 3.72 0.12 -4.69 117.46 115.80 3hho n PHE 36 Ca -0.02 -0.89 0.06 0.00 -0.05 0.00 0.00 57.45 56.55 3hho n PHE 36 Cb 0.20 -0.21 0.31 0.00 -0.94 0.00 0.00 39.48 38.84 3hho n PHE 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hho n ALA 37 N -0.84 1.79 -0.74 4.37 0.00 -0.70 -2.73 120.51 121.67 3hho n ALA 37 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3hho n ALA 37 Cb 0.72 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3hho n ALA 37 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hho n THR 38 N -1.15 0.24 -1.90 0.00 -2.24 -1.26 -5.10 114.28 102.87 3hho n THR 38 Ca 0.07 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 3hho n THR 38 Cb 0.06 0.94 0.07 0.00 -2.10 0.00 0.00 70.33 69.30 3hho n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hho n ALA 39 N -0.12 -0.26 -0.64 6.98 0.00 -1.10 -5.05 120.51 120.31 3hho n ALA 39 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 53.44 52.38 3hho n ALA 39 Cb 0.41 0.05 0.18 0.00 0.00 0.00 0.00 19.45 20.10 3hho n ALA 39 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hho n SER 40 N -3.15 -0.02 0.09 0.00 3.41 -1.26 -4.77 113.62 107.93 3hho n SER 40 Ca 0.07 0.33 -0.04 0.00 -0.26 0.00 0.00 58.87 58.97 3hho n SER 40 Cb 0.24 -1.44 -0.01 0.00 -0.26 0.00 0.00 64.21 62.74 3hho n SER 40 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3hho h GLU 41 N -2.02 0.00 0.00 4.33 4.81 -1.96 -0.41 114.58 119.33 3hho h GLU 41 Ca -0.46 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.78 3hho h GLU 41 Cb 1.28 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 3hho h GLU 41 CO 0.42 0.84 -0.07 -0.09 -0.73 0.00 0.00 179.01 179.38 3hho h ARG 42 N 0.00 -0.11 0.48 1.92 2.43 -1.99 -1.63 114.38 115.47 3hho h ARG 42 Ca -0.01 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3hho h ARG 42 Cb 1.52 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 31.08 3hho h ARG 42 CO 0.11 -0.08 -0.40 -0.44 -1.51 0.00 0.00 179.97 177.65 3hho h ASP 43 N -0.12 -1.06 -0.95 -3.80 5.19 -1.90 -2.89 116.42 110.89 3hho h ASP 43 Ca 0.03 0.08 0.20 0.00 -0.62 0.00 0.00 57.03 56.72 3hho h ASP 43 Cb 0.15 0.34 -0.08 0.00 0.18 0.00 0.00 39.33 39.92 3hho h ASP 43 CO -0.07 -0.57 0.61 -0.09 -3.12 0.00 0.00 179.24 176.00 3hho h ARG 44 N -0.87 0.54 -1.45 3.56 2.43 -0.98 -2.03 114.38 115.58 3hho h ARG 44 Ca -0.05 -0.03 -0.22 0.00 -0.81 0.00 0.00 59.98 58.86 3hho h ARG 44 Cb 0.75 -0.12 -0.11 0.00 -0.42 0.00 0.00 29.97 30.07 3hho h ARG 44 CO -0.02 0.36 0.29 1.28 -1.51 0.00 0.00 179.97 180.37 3hho n LEU 45 N -4.61 5.64 0.00 3.80 4.77 -0.62 -2.50 117.00 123.48 3hho n LEU 45 Ca 0.21 -2.83 0.00 0.00 -0.03 0.00 0.00 56.01 53.36 3hho n LEU 45 Cb 0.65 -0.94 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 3hho n LEU 45 CO 0.27 1.03 0.00 0.00 -1.33 0.00 0.00 177.39 177.36 3hho n ALA 47 N 0.42 0.00 -0.03 -1.18 0.00 -0.76 0.87 120.51 119.83 3hho n ALA 47 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.52 3hho n ALA 47 Cb 0.66 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.01 3hho n ALA 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hho h VAL 48 N 0.00 1.48 -0.80 0.00 2.07 -1.75 -0.89 116.25 116.36 3hho h VAL 48 Ca 0.00 -1.64 0.08 0.00 0.82 0.00 0.00 66.70 65.97 3hho h VAL 48 Cb 0.00 2.48 -0.07 0.00 -1.52 0.00 0.00 31.29 32.18 3hho h VAL 48 CO 0.00 0.45 0.46 1.56 0.02 0.00 0.00 177.57 180.06 3hho h GLN 49 N -0.44 0.78 -0.27 1.57 4.20 0.17 -2.18 115.11 118.95 3hho h GLN 49 Ca -0.01 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 3hho h GLN 49 Cb 0.80 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 3hho h GLN 49 CO 0.03 0.52 -0.02 0.37 -0.67 0.00 0.00 178.83 179.05 3hho h GLN 50 N 0.80 0.49 -0.53 1.46 5.75 -1.79 -2.88 115.11 118.41 3hho h GLN 50 Ca 0.38 -0.17 0.05 0.00 -0.15 0.00 0.00 58.65 58.76 3hho h GLN 50 Cb 0.30 -0.04 -0.05 0.00 1.07 0.00 0.00 27.48 28.77 3hho h GLN 50 CO -0.23 0.67 0.26 0.00 -2.65 0.00 0.00 178.83 176.89 3hho h ALA 51 N 0.80 0.68 0.00 3.38 0.00 -0.88 -2.25 119.26 121.00 3hho h ALA 51 Ca 0.07 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hho h ALA 51 Cb 0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hho h ALA 51 CO 0.02 -0.09 -0.29 0.00 0.00 0.00 0.00 179.25 178.89 3hho h ALA 52 N 1.29 1.15 0.05 0.00 0.00 -1.42 -2.28 119.26 118.06 3hho h ALA 52 Ca 0.24 -0.27 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 3hho h ALA 52 Cb 0.16 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.92 3hho h ALA 52 CO -0.17 0.37 -1.09 0.37 0.00 0.00 0.00 179.25 178.73 3hho h GLN 53 N 0.00 0.49 -0.71 0.00 4.15 -1.19 0.67 115.11 118.53 3hho h GLN 53 Ca -0.00 -0.60 -0.02 0.00 0.77 0.00 0.00 58.65 58.79 3hho h GLN 53 Cb 0.69 0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.54 3hho h GLN 53 CO 0.04 1.23 0.35 0.82 -1.93 0.00 0.00 178.83 179.34 3hho h ILE 54 N 0.24 1.23 -0.45 2.39 5.03 -1.32 0.42 117.51 125.06 3hho h ILE 54 Ca -0.13 -0.63 0.07 0.00 -0.12 0.00 0.00 64.86 64.06 3hho h ILE 54 Cb 1.75 0.34 -0.06 0.00 -3.03 0.00 0.00 36.82 35.82 3hho h ILE 54 CO 0.20 0.26 0.08 0.78 -0.68 0.00 0.00 178.15 178.79 3hho h ASN 55 N 0.98 -0.01 -0.42 1.72 2.35 -1.36 0.79 115.58 119.63 3hho h ASN 55 Ca 0.24 0.08 0.08 0.00 -0.55 0.00 0.00 56.30 56.16 3hho h ASN 55 Cb 0.10 0.11 -0.08 0.00 0.05 0.00 0.00 38.32 38.51 3hho h ASN 55 CO -0.03 0.03 -0.07 0.44 -1.65 0.00 0.00 177.43 176.14 3hho h ASP 56 N 0.21 -0.33 0.68 5.81 3.32 0.96 -2.80 116.42 124.27 3hho h ASP 56 Ca 0.22 0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 3hho h ASP 56 Cb 0.28 0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.08 3hho h ASP 56 CO -0.30 -0.12 -0.33 0.00 -1.72 0.00 0.00 179.24 176.78 3hho h ALA 57 N 1.40 -0.91 -0.85 3.45 0.00 0.26 -2.91 119.26 119.71 3hho h ALA 57 Ca 0.20 -0.22 0.21 0.00 0.00 0.00 0.00 54.91 55.11 3hho h ALA 57 Cb 0.31 0.35 -0.15 0.00 0.00 0.00 0.00 17.79 18.30 3hho h ALA 57 CO -0.41 -0.90 0.09 -0.92 0.00 0.00 0.00 179.25 177.11 3hho h TYR 58 N -1.14 0.09 -0.51 0.00 3.20 -0.81 0.18 116.97 117.98 3hho h TYR 58 Ca -0.09 0.06 -0.11 0.00 3.14 0.00 0.00 58.73 61.72 3hho h TYR 58 Cb 0.73 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 3hho h TYR 58 CO 0.00 -0.27 -0.12 1.96 -1.64 0.00 0.00 178.16 178.10 3hho h GLN 59 N 0.12 0.96 0.40 1.82 1.08 -1.49 0.21 115.11 118.20 3hho h GLN 59 Ca 0.50 -0.35 -0.02 0.00 -1.45 0.00 0.00 58.65 57.33 3hho h GLN 59 Cb 0.96 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.33 3hho h GLN 59 CO -0.71 1.01 -0.19 1.15 -0.95 0.00 0.00 178.83 179.14 3hho h THR 60 N 0.85 0.56 0.13 -0.54 2.02 -0.81 -3.19 112.91 111.95 3hho h THR 60 Ca 0.13 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 3hho h THR 60 Cb 0.66 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3hho h THR 60 CO 0.05 0.08 -0.06 -0.07 0.37 0.00 0.00 175.52 175.88 3hho h LEU 61 N -0.81 -0.15 -0.94 2.58 4.07 -1.20 -1.19 115.31 117.67 3hho h LEU 61 Ca -0.05 -0.04 0.19 0.00 0.08 0.00 0.00 57.88 58.06 3hho h LEU 61 Cb 0.54 0.04 -0.18 0.00 1.08 0.00 0.00 40.66 42.14 3hho h LEU 61 CO 0.09 -0.06 -0.24 0.50 -1.08 0.00 0.00 178.44 177.65 3hho h LYS 62 N -0.23 -0.00 -5.08 1.13 1.63 -0.67 -3.38 116.57 109.97 3hho h LYS 62 Ca -0.02 0.00 -0.63 0.00 -0.85 0.00 0.00 60.65 59.15 3hho h LYS 62 Cb 0.18 0.00 -0.15 0.00 -0.60 0.00 0.00 32.23 31.66 3hho h LYS 62 CO 0.03 -0.00 -0.30 0.34 -3.45 0.00 0.00 179.45 176.07 3hho s ASP 63 N -5.26 6.20 0.21 4.20 2.15 -1.20 -5.00 116.67 117.97 3hho s ASP 63 Ca -0.15 0.17 -0.14 0.00 0.43 0.00 0.00 52.55 52.86 3hho s ASP 63 Cb 0.26 -2.19 0.22 0.00 -0.30 0.00 0.00 42.92 40.91 3hho s ASP 63 CO 0.77 -0.18 1.63 1.55 -0.17 0.00 0.00 175.17 178.78 3hho h PRO 64 N 8.25 0.00 -0.78 4.34 0.13 -1.83 0.67 132.00 142.78 3hho h PRO 64 Ca -0.32 -0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.82 3hho h PRO 64 Cb 1.17 -0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 3hho h PRO 64 CO 0.63 0.00 0.51 -0.07 -0.23 0.00 0.00 178.00 178.84 3hho h LEU 65 N 0.00 0.88 -0.33 1.56 4.07 -1.95 0.42 115.31 119.97 3hho h LEU 65 Ca 0.29 -0.02 -0.19 0.00 0.08 0.00 0.00 57.88 58.04 3hho h LEU 65 Cb 0.44 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 3hho h LEU 65 CO -0.62 0.63 -0.83 0.03 -1.08 0.00 0.00 178.44 176.57 3hho h ARG 66 N 1.04 0.28 -0.24 1.13 3.08 -1.52 -1.83 114.38 116.33 3hho h ARG 66 Ca 0.29 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 3hho h ARG 66 Cb -0.10 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3hho h ARG 66 CO -0.07 0.96 -0.16 -0.09 -1.07 0.00 0.00 179.97 179.54 3hho h ARG 67 N 0.17 0.41 -0.05 0.04 2.43 0.16 -1.99 114.38 115.55 3hho h ARG 67 Ca -0.04 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 58.99 3hho h ARG 67 Cb 1.43 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.94 3hho h ARG 67 CO 0.13 0.57 -0.03 0.00 -1.51 0.00 0.00 179.97 179.13 3hho h ALA 68 N 1.46 0.07 -0.15 2.80 0.00 0.00 -1.89 119.26 121.55 3hho h ALA 68 Ca 0.07 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.78 3hho h ALA 68 Cb 0.51 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 3hho h ALA 68 CO 0.03 -0.18 -0.18 0.93 0.00 0.00 0.00 179.25 179.86 3hho h GLU 69 N -0.31 -0.21 -0.26 0.00 5.08 -1.26 -1.70 114.58 115.92 3hho h GLU 69 Ca 0.01 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 3hho h GLU 69 Cb 0.49 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 3hho h GLU 69 CO 0.01 -0.14 0.01 -0.92 -1.00 0.00 0.00 179.01 176.97 3hho h TYR 70 N -0.21 0.01 -0.01 4.33 3.20 -1.33 0.99 116.97 123.94 3hho h TYR 70 Ca 0.10 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.00 3hho h TYR 70 Cb 0.37 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.64 3hho h TYR 70 CO -0.30 -0.03 -0.29 -0.07 -1.64 0.00 0.00 178.16 175.83 3hho h LEU 71 N 0.10 -0.91 -0.88 2.82 3.38 -1.17 0.37 115.31 119.02 3hho h LEU 71 Ca 0.13 0.10 0.13 0.00 0.09 0.00 0.00 57.88 58.33 3hho h LEU 71 Cb 0.16 0.35 -0.14 0.00 0.09 0.00 0.00 40.66 41.11 3hho h LEU 71 CO -0.20 -0.28 -0.36 0.18 0.09 0.00 0.00 178.44 177.87 3hho n LEU 72 N -4.11 -0.60 -0.30 1.67 4.32 -0.66 0.14 117.00 117.46 3hho n LEU 72 Ca -0.04 1.53 0.10 0.00 -0.02 0.00 0.00 56.01 57.58 3hho n LEU 72 Cb 0.22 -0.34 0.22 0.00 -1.62 0.00 0.00 43.42 41.90 3hho n LEU 72 CO 0.06 -1.37 0.83 -1.28 -1.22 0.00 0.00 177.39 174.41 3hho h SER 73 N 0.00 -0.37 0.85 -1.43 0.87 0.29 0.38 113.55 114.15 3hho h SER 73 Ca 0.29 0.23 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 3hho h SER 73 Cb 0.51 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 3hho h SER 73 CO -0.87 -0.24 0.00 -0.07 -0.53 0.00 0.00 176.83 175.12 3hho h LEU 74 N 0.08 0.00 -0.04 2.23 3.38 0.52 0.18 115.31 121.66 3hho h LEU 74 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.47 3hho h LEU 74 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3hho h LEU 74 CO -0.77 0.00 0.00 0.00 0.09 0.00 0.00 178.44 177.76 3hho n GLN 75 N -3.03 1.03 -2.15 1.13 1.13 0.13 -4.84 117.38 110.78 3hho n GLN 75 Ca 0.00 -0.04 -0.08 0.00 -1.94 0.00 0.00 57.00 54.94 3hho n GLN 75 Cb 0.27 -1.02 -0.00 0.00 0.11 0.00 0.00 30.24 29.59 3hho n GLN 75 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hho n GLY 76 N 0.53 0.04 3.13 1.08 0.00 0.63 -5.03 105.19 105.57 3hho n GLY 76 Ca 0.01 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 3hho n GLY 76 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hho s ILE 77 N -2.41 2.54 0.43 -0.61 1.01 -1.03 -5.01 121.20 116.13 3hho s ILE 77 Ca 0.00 -1.37 0.07 0.00 0.00 0.00 0.00 60.65 59.35 3hho s ILE 77 Cb 0.00 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 40.04 3hho s ILE 77 CO 0.00 0.05 0.32 -1.61 0.00 0.00 0.00 174.94 173.70 3hho s GLU 78 N 1.21 2.39 -0.37 2.79 8.01 -1.26 -3.05 118.70 128.43 3hho s GLU 78 Ca -0.05 -1.70 0.06 0.00 0.01 0.00 0.00 54.97 53.29 3hho s GLU 78 Cb -0.19 -2.21 0.19 0.00 -4.31 0.00 0.00 34.13 27.61 3hho s GLU 78 CO -0.04 -0.23 0.64 1.21 0.01 0.00 0.00 175.26 176.84 3hho s ASN 80 N -4.08 -1.50 0.00 -0.19 3.84 -1.26 -5.13 114.94 106.61 3hho s ASN 80 Ca 0.44 -0.45 0.00 0.00 0.21 0.00 0.00 52.86 53.06 3hho s ASN 80 Cb -0.01 1.92 0.00 0.00 -0.55 0.00 0.00 41.25 42.61 3hho s ASN 80 CO 0.25 -0.20 0.42 0.00 -2.79 0.00 0.00 177.10 174.78 3hho n ALA 81 N 4.71 2.20 -0.06 1.71 0.00 -1.26 -1.84 120.51 125.96 3hho n ALA 81 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 3hho n ALA 81 Cb 0.56 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 3hho n ALA 81 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3hho n GLU 82 N 0.07 0.30 0.00 0.00 0.00 -1.26 -4.40 120.64 115.35 3hho n GLU 82 Ca 0.00 0.13 0.13 0.00 0.00 0.00 0.00 57.16 57.42 3hho n GLU 82 Cb 0.19 -1.00 0.48 0.00 0.00 0.00 0.00 31.44 31.10 3hho n GLU 82 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 3hho n GLN 83 N -3.71 0.74 0.12 3.44 7.27 -1.17 -0.70 117.38 123.37 3hho n GLN 83 Ca -0.24 -0.36 0.06 0.00 0.07 0.00 0.00 57.00 56.52 3hho n GLN 83 Cb 0.61 -1.49 0.02 0.00 2.41 0.00 0.00 30.24 31.79 3hho n GLN 83 CO 0.00 0.00 0.00 0.37 0.07 0.00 0.00 177.06 177.50 3hho h GLN 84 N 0.89 0.00 0.00 3.69 4.15 -1.65 -3.23 115.11 118.97 3hho h GLN 84 Ca 0.00 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.09 3hho h GLN 84 Cb 0.44 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.07 3hho h GLN 84 CO 0.00 0.23 -2.03 -2.37 -1.93 0.00 0.00 178.83 172.72 3hho n THR 85 N -2.98 1.51 0.33 2.39 5.66 -0.92 -3.37 114.28 116.89 3hho n THR 85 Ca -0.01 -0.82 0.21 0.00 -3.05 0.00 0.00 64.05 60.37 3hho n THR 85 Cb 0.68 -0.78 1.12 0.00 -1.55 0.00 0.00 70.33 69.80 3hho n THR 85 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 3hho h LEU 86 N 0.00 0.00 -1.09 1.09 4.07 -1.06 0.17 115.31 118.48 3hho h LEU 86 Ca -0.41 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.55 3hho h LEU 86 Cb 2.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.86 3hho h LEU 86 CO 0.05 0.01 0.00 -0.61 -1.08 0.00 0.00 178.44 176.81 3hho h GLN 87 N 0.00 0.00 -2.60 1.13 4.15 -1.57 -3.35 115.11 112.88 3hho h GLN 87 Ca -0.00 0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.81 3hho h GLN 87 Cb 0.05 0.00 -0.42 0.00 0.21 0.00 0.00 27.48 27.33 3hho h GLN 87 CO 0.00 0.00 -0.64 -3.47 -1.93 0.00 0.00 178.83 172.79 3hho n ASP 88 N -2.96 2.93 -2.07 -0.69 4.64 0.59 -5.08 116.55 113.90 3hho n ASP 88 Ca 0.01 -3.22 -0.08 0.00 -1.38 0.00 0.00 54.79 50.12 3hho n ASP 88 Cb 0.34 -0.70 -0.11 0.00 -1.04 0.00 0.00 41.12 39.60 3hho n ASP 88 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3hho n PRO 89 N 1.51 1.41 0.00 -0.67 -0.02 -1.26 -2.60 135.00 133.37 3hho n PRO 89 Ca 0.25 -0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 3hho n PRO 89 Cb 0.39 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3hho n PRO 89 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3hho n PHE 91 N 2.52 0.00 0.00 6.00 7.35 -1.26 -4.66 117.46 127.41 3hho n PHE 91 Ca 0.29 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.98 3hho n PHE 91 Cb 0.65 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.48 3hho n PHE 91 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 3hho n LEU 92 N 0.00 0.00 0.00 -2.13 4.77 -1.07 0.23 117.00 118.80 3hho n LEU 92 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3hho n LEU 92 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3hho n LEU 92 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.27 3hho n GLU 94 N 0.39 0.00 0.00 3.23 2.13 -1.26 -4.67 120.64 120.46 3hho n GLU 94 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3hho n GLU 94 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 3hho n GLU 94 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hho n GLN 95 N 0.00 0.00 0.00 5.31 6.02 0.14 -2.21 117.38 126.64 3hho n GLN 95 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3hho n GLN 95 Cb 0.00 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.07 3hho n GLN 95 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3hho n GLU 97 N 0.81 0.00 -0.02 -1.09 1.02 -1.26 -1.01 120.64 119.09 3hho n GLU 97 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 3hho n GLU 97 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 3hho n GLU 97 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hho h LEU 98 N 0.00 0.29 -0.73 -4.62 3.38 -1.84 -2.20 115.31 109.59 3hho h LEU 98 Ca 0.00 -0.81 0.05 0.00 0.09 0.00 0.00 57.88 57.22 3hho h LEU 98 Cb 0.00 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 3hho h LEU 98 CO 0.00 1.59 0.43 0.03 0.09 0.00 0.00 178.44 180.58 3hho h ARG 99 N -0.43 0.78 -0.09 1.13 3.08 -1.36 0.62 114.38 118.12 3hho h ARG 99 Ca -0.31 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.70 3hho h ARG 99 Cb 1.66 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.53 3hho h ARG 99 CO 0.01 0.52 -0.06 1.49 -1.07 0.00 0.00 179.97 180.86 3hho h GLU 100 N 0.80 -0.01 -0.42 0.04 4.81 -1.78 -0.57 114.58 117.46 3hho h GLU 100 Ca 0.32 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.64 3hho h GLU 100 Cb 0.15 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.44 3hho h GLU 100 CO -0.17 -0.01 -0.25 1.49 -0.73 0.00 0.00 179.01 179.35 3hho h GLU 101 N -0.01 -0.17 -0.93 1.92 4.81 -0.92 -0.95 114.58 118.34 3hho h GLU 101 Ca 0.01 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.39 3hho h GLU 101 Cb 0.05 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.39 3hho h GLU 101 CO -0.09 -0.11 0.59 1.25 -0.73 0.00 0.00 179.01 179.93 3hho h LEU 102 N -0.17 0.75 -1.45 1.64 5.85 -0.48 1.12 115.31 122.57 3hho h LEU 102 Ca 0.20 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3hho h LEU 102 Cb 0.48 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3hho h LEU 102 CO -0.52 0.38 0.00 -0.33 -0.34 0.00 0.00 178.44 177.63 3hho h GLU 103 N 0.79 0.00 0.00 1.25 4.39 0.27 -2.94 114.58 118.35 3hho h GLU 103 Ca 0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.17 3hho h GLU 103 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3hho h GLU 103 CO -0.23 0.00 -1.14 0.43 -1.16 0.00 0.00 179.01 176.90 3hho n SER 104 N -2.79 0.58 -0.02 1.42 7.64 0.38 -3.91 113.62 116.91 3hho n SER 104 Ca 0.00 -0.17 -0.10 0.00 1.01 0.00 0.00 58.87 59.62 3hho n SER 104 Cb 0.24 0.92 -0.04 0.00 -1.01 0.00 0.00 64.21 64.32 3hho n SER 104 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3hho h VAL 105 N 0.00 0.94 -0.49 0.44 2.07 -1.08 -1.50 116.25 116.63 3hho h VAL 105 Ca 0.00 -0.04 0.14 0.00 0.82 0.00 0.00 66.70 67.62 3hho h VAL 105 Cb 0.78 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 3hho h VAL 105 CO 0.00 0.02 0.35 0.74 0.02 0.00 0.00 177.57 178.70 3hho h THR 106 N 0.11 0.75 -0.04 2.57 2.02 -1.71 -2.87 112.91 113.74 3hho h THR 106 Ca 0.07 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.11 3hho h THR 106 Cb 0.06 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3hho h THR 106 CO -0.09 0.00 -0.62 0.00 0.37 0.00 0.00 175.52 175.19 3hho h ALA 107 N 1.75 0.89 -3.18 6.16 0.00 -1.42 -3.47 119.26 120.00 3hho h ALA 107 Ca 0.23 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3hho h ALA 107 Cb 0.93 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3hho h ALA 107 CO -0.00 0.75 0.00 0.00 0.00 0.00 0.00 179.25 180.00 3hho s ALA 109 N -3.64 2.63 -1.19 0.00 0.00 -1.26 -4.59 121.76 113.71 3hho s ALA 109 Ca 0.00 -1.64 -0.08 0.00 0.00 0.00 0.00 51.96 50.25 3hho s ALA 109 Cb 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 3hho s ALA 109 CO 0.00 0.42 0.79 -0.25 0.00 0.00 0.00 175.76 176.72 3hho n ASP 110 N 0.13 -3.73 0.00 0.00 8.00 -1.26 -4.91 116.55 114.79 3hho n ASP 110 Ca -0.11 -0.84 0.12 0.00 0.71 0.00 0.00 54.79 54.67 3hho n ASP 110 Cb 0.56 -4.19 0.33 0.00 -0.02 0.00 0.00 41.12 37.80 3hho n ASP 110 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3hho n PRO 111 N -3.99 0.01 0.05 -0.24 -0.02 -1.26 -3.15 135.00 126.40 3hho n PRO 111 Ca -0.18 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.30 3hho n PRO 111 Cb 0.64 -1.51 -0.07 0.00 -0.02 0.00 0.00 33.50 32.54 3hho n PRO 111 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hho h GLU 112 N 0.00 0.00 0.00 -0.52 5.08 -1.90 -1.18 114.58 116.05 3hho h GLU 112 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3hho h GLU 112 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 3hho h GLU 112 CO 0.00 0.35 -0.19 0.00 -1.00 0.00 0.00 179.01 178.17 3hho h ALA 113 N 1.41 0.88 0.05 3.43 0.00 -1.97 -3.16 119.26 119.90 3hho h ALA 113 Ca -0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 3hho h ALA 113 Cb 1.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3hho h ALA 113 CO 0.05 0.24 -0.03 0.00 0.00 0.00 0.00 179.25 179.52 3hho h ALA 114 N 1.81 -0.07 -0.67 0.00 0.00 -1.46 -2.66 119.26 116.20 3hho h ALA 114 Ca -0.00 -0.20 0.14 0.00 0.00 0.00 0.00 54.91 54.85 3hho h ALA 114 Cb 1.14 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.85 3hho h ALA 114 CO 0.03 -0.34 0.11 1.25 0.00 0.00 0.00 179.25 180.29 3hho h LEU 115 N -0.47 -0.09 -1.33 0.00 5.85 -1.29 0.64 115.31 118.62 3hho h LEU 115 Ca -0.01 0.14 0.24 0.00 0.84 0.00 0.00 57.88 59.10 3hho h LEU 115 Cb 0.42 0.22 -0.09 0.00 0.37 0.00 0.00 40.66 41.57 3hho h LEU 115 CO 0.01 -0.06 0.65 0.58 -0.34 0.00 0.00 178.44 179.28 3hho h VAL 116 N 0.21 0.58 -0.04 1.05 2.07 -1.49 0.14 116.25 118.77 3hho h VAL 116 Ca 0.37 -0.16 -0.21 0.00 0.82 0.00 0.00 66.70 67.52 3hho h VAL 116 Cb 0.60 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3hho h VAL 116 CO -0.50 0.08 -0.84 0.00 0.02 0.00 0.00 177.57 176.34 3hho h ALA 117 N 1.63 0.47 0.03 1.67 0.00 0.60 -2.95 119.26 120.70 3hho h ALA 117 Ca 0.57 -0.66 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hho h ALA 117 Cb 1.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3hho h ALA 117 CO -0.29 0.79 -0.01 0.35 0.00 0.00 0.00 179.25 180.08 3hho h PHE 118 N 0.27 -0.04 -0.81 0.00 3.57 -0.13 -3.20 116.94 116.60 3hho h PHE 118 Ca -0.05 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.57 3hho h PHE 118 Cb 1.44 0.01 -0.09 0.00 2.79 0.00 0.00 35.95 40.11 3hho h PHE 118 CO 0.05 0.46 0.41 0.22 -2.23 0.00 0.00 178.31 177.23 3hho h ASP 119 N -0.55 0.52 -0.04 0.41 3.58 -0.86 -1.89 116.42 117.59 3hho h ASP 119 Ca -0.00 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 3hho h ASP 119 Cb 0.51 -0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.55 3hho h ASP 119 CO 0.01 0.25 0.01 0.74 -2.88 0.00 0.00 179.24 177.37 3hho h THR 120 N 0.63 1.17 0.02 2.25 2.02 -1.59 -0.64 112.91 116.78 3hho h THR 120 Ca 0.43 -0.51 0.02 0.00 0.77 0.00 0.00 66.41 67.11 3hho h THR 120 Cb 0.55 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.37 3hho h THR 120 CO -0.33 0.14 -0.13 0.50 0.37 0.00 0.00 175.52 176.07 3hho h LYS 121 N -0.13 -0.22 0.25 6.66 3.64 -1.44 1.29 116.57 126.62 3hho h LYS 121 Ca 0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3hho h LYS 121 Cb 0.21 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 3hho h LYS 121 CO -0.00 -0.15 -0.25 0.28 -2.27 0.00 0.00 179.45 177.06 3hho h VAL 122 N -0.23 0.46 -0.50 2.00 2.07 -1.32 -1.29 116.25 117.45 3hho h VAL 122 Ca 0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.64 3hho h VAL 122 Cb 0.27 0.46 -0.10 0.00 -1.52 0.00 0.00 31.29 30.40 3hho h VAL 122 CO -0.11 0.00 -0.41 0.74 0.02 0.00 0.00 177.57 177.81 3hho h THR 123 N -0.54 0.12 0.00 2.57 2.02 -0.88 1.24 112.91 117.44 3hho h THR 123 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3hho h THR 123 Cb 0.50 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3hho h THR 123 CO -0.05 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.84 3hho n ALA 124 N -3.11 0.53 0.00 6.16 0.00 0.44 -0.13 120.51 124.41 3hho n ALA 124 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3hho n ALA 124 Cb 0.35 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.30 3hho n ALA 124 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3hho n GLN 126 N 0.19 0.00 -0.13 0.00 7.27 0.43 -2.76 117.38 122.38 3hho n GLN 126 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.02 3hho n GLN 126 Cb 0.00 0.00 0.04 0.00 2.41 0.00 0.00 30.24 32.69 3hho n GLN 126 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hho h ARG 127 N 0.00 0.25 -0.57 3.69 3.08 -0.76 -2.23 114.38 117.84 3hho h ARG 127 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3hho h ARG 127 Cb 0.00 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3hho h ARG 127 CO 0.00 0.17 0.22 1.25 -1.07 0.00 0.00 179.97 180.54 3hho h HIS 128 N 0.26 0.87 -0.56 3.04 2.76 -1.77 0.12 115.15 119.88 3hho h HIS 128 Ca 0.20 -0.07 -0.06 0.00 -2.20 0.00 0.00 60.37 58.25 3hho h HIS 128 Cb 0.22 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 28.90 3hho h HIS 128 CO -0.18 0.71 0.12 1.88 -1.30 0.00 0.00 177.93 179.15 3hho h TYR 129 N 0.78 0.90 0.08 5.26 0.05 -1.83 0.35 116.97 122.56 3hho h TYR 129 Ca 0.19 -0.09 0.01 0.00 0.05 0.00 0.00 58.73 58.88 3hho h TYR 129 Cb 0.21 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 3hho h TYR 129 CO 0.01 0.76 -0.09 -0.07 -1.05 0.00 0.00 178.16 177.72 3hho h LEU 130 N 0.83 -0.24 -0.34 3.88 3.38 -0.86 0.69 115.31 122.66 3hho h LEU 130 Ca 0.18 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.24 3hho h LEU 130 Cb 0.33 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 3hho h LEU 130 CO 0.00 -0.14 -0.09 0.00 0.09 0.00 0.00 178.44 178.30 3hho h ALA 131 N 0.72 0.21 -0.39 1.53 0.00 -0.19 0.25 119.26 121.39 3hho h ALA 131 Ca 0.01 0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 3hho h ALA 131 Cb 0.19 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3hho h ALA 131 CO -0.03 -0.47 -0.18 1.96 0.00 0.00 0.00 179.25 180.53 3hho h GLN 132 N -0.01 0.73 -0.58 0.00 1.08 -0.18 -2.85 115.11 113.30 3hho h GLN 132 Ca 0.16 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 3hho h GLN 132 Cb 0.26 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 3hho h GLN 132 CO -0.35 0.86 0.34 1.25 -0.95 0.00 0.00 178.83 179.98 3hho h LEU 133 N 0.65 0.71 0.80 1.46 5.85 0.12 -2.60 115.31 122.31 3hho h LEU 133 Ca 0.10 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3hho h LEU 133 Cb 0.66 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.52 3hho h LEU 133 CO 0.05 0.58 -0.38 -0.61 -0.34 0.00 0.00 178.44 177.73 3hho h GLN 134 N 0.79 -1.04 0.00 1.25 4.15 -0.88 -0.77 115.11 118.62 3hho h GLN 134 Ca 0.21 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.70 3hho h GLN 134 Cb 0.01 0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.93 3hho h GLN 134 CO -0.04 -0.69 0.06 0.41 -1.93 0.00 0.00 178.83 176.65 3hho n GLY 135 N -1.01 -0.35 0.12 2.39 0.00 -1.09 0.14 105.19 105.40 3hho n GLY 135 Ca -0.13 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 3hho n GLY 135 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3hho n GLN 136 N -1.34 0.68 0.07 1.61 -0.06 -0.98 -3.79 117.38 113.58 3hho n GLN 136 Ca 0.00 0.08 -0.05 0.00 -2.00 0.00 0.00 57.00 55.03 3hho n GLN 136 Cb 0.06 -1.51 -0.09 0.00 -4.06 0.00 0.00 30.24 24.64 3hho n GLN 136 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 3hho h LEU 137 N 0.00 0.00 -0.59 1.69 3.38 0.52 0.53 115.31 120.84 3hho h LEU 137 Ca -0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.41 3hho h LEU 137 Cb 2.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.77 3hho h LEU 137 CO -0.04 0.90 0.00 0.00 0.09 0.00 0.00 178.44 179.38 3hho n ALA 138 N -2.34 2.53 -1.70 1.53 0.00 0.38 -2.65 120.51 118.27 3hho n ALA 138 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3hho n ALA 138 Cb 0.90 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.35 3hho n ALA 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3hho n GLN 139 N -0.20 0.00 -2.54 0.00 6.02 -1.24 -4.95 117.38 114.48 3hho n GLN 139 Ca 0.02 -0.23 -0.11 0.00 -0.01 0.00 0.00 57.00 56.67 3hho n GLN 139 Cb 0.15 -0.19 0.01 0.00 1.02 0.00 0.00 30.24 31.24 3hho n GLN 139 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3hho n SER 140 N 0.00 -3.78 -4.45 1.08 7.64 -1.08 -4.99 113.62 108.04 3hho n SER 140 Ca 0.00 -0.11 -0.44 0.00 1.01 0.00 0.00 58.87 59.33 3hho n SER 140 Cb 0.52 -2.76 -0.01 0.00 -1.01 0.00 0.00 64.21 60.94 3hho n SER 140 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3hho s GLU 141 N -4.98 3.81 0.26 1.43 8.01 0.18 -4.84 118.70 122.58 3hho s GLU 141 Ca 0.12 -2.15 0.26 0.00 0.01 0.00 0.00 54.97 53.20 3hho s GLU 141 Cb -0.05 -4.94 0.78 0.00 -4.31 0.00 0.00 34.13 25.61 3hho s GLU 141 CO 0.14 -1.74 1.75 -1.49 0.01 0.00 0.00 175.26 173.94 3hho h TRP 142 N 8.07 0.00 0.00 1.61 4.06 -1.94 0.50 115.95 128.25 3hho h TRP 142 Ca 0.22 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.17 3hho h TRP 142 Cb 0.96 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 3hho h TRP 142 CO 1.13 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 177.29 3hho n LEU 143 N -2.42 0.62 -0.29 -4.49 4.77 -1.26 -2.99 117.00 110.94 3hho n LEU 143 Ca 0.05 0.40 0.25 0.00 -0.03 0.00 0.00 56.01 56.68 3hho n LEU 143 Cb 0.41 -0.39 0.46 0.00 -2.33 0.00 0.00 43.42 41.57 3hho n LEU 143 CO 0.29 -0.39 0.89 0.00 -1.33 0.00 0.00 177.39 176.85 3hho n ALA 144 N -1.68 0.80 0.02 -1.18 0.00 -1.21 0.58 120.51 117.84 3hho n ALA 144 Ca 0.00 0.93 -0.08 0.00 0.00 0.00 0.00 53.44 54.28 3hho n ALA 144 Cb 0.00 -0.86 0.07 0.00 0.00 0.00 0.00 19.45 18.66 3hho n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hho h ALA 145 N 1.79 0.74 -0.13 0.00 0.00 -1.07 -2.75 119.26 117.84 3hho h ALA 145 Ca 0.70 -0.51 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3hho h ALA 145 Cb 1.78 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 3hho h ALA 145 CO -0.73 0.69 0.20 0.00 0.00 0.00 0.00 179.25 179.41 3hho h ALA 146 N 1.02 1.60 0.27 0.00 0.00 0.24 -2.15 119.26 120.24 3hho h ALA 146 Ca 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hho h ALA 146 Cb 1.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3hho h ALA 146 CO 0.10 -0.27 -0.13 -0.44 0.00 0.00 0.00 179.25 178.51 3hho h ASP 147 N 0.00 -0.31 -0.95 0.00 3.45 -1.25 -2.54 116.42 114.83 3hho h ASP 147 Ca 0.06 -0.16 0.14 0.00 0.43 0.00 0.00 57.03 57.49 3hho h ASP 147 Cb 0.46 0.08 -0.08 0.00 -0.56 0.00 0.00 39.33 39.23 3hho h ASP 147 CO -0.00 0.18 0.60 1.56 -1.57 0.00 0.00 179.24 180.02 3hho h GLN 148 N -1.00 0.82 -0.75 3.56 7.50 -1.49 1.18 115.11 124.93 3hho h GLN 148 Ca -0.04 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 59.07 3hho h GLN 148 Cb 0.45 -0.18 -0.04 0.00 0.05 0.00 0.00 27.48 27.76 3hho h GLN 148 CO 0.06 0.54 0.48 0.82 -1.50 0.00 0.00 178.83 179.23 3hho h ILE 149 N 0.84 1.20 -0.18 2.54 2.04 -1.47 0.99 117.51 123.47 3hho h ILE 149 Ca 0.48 -0.39 -0.17 0.00 1.00 0.00 0.00 64.86 65.78 3hho h ILE 149 Cb 0.62 0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3hho h ILE 149 CO -0.24 0.20 -0.56 -0.09 0.00 0.00 0.00 178.15 177.45 3hho h ARG 150 N 1.02 0.70 -0.24 2.37 2.43 -0.03 0.15 114.38 120.78 3hho h ARG 150 Ca 0.27 -0.51 -0.06 0.00 -0.81 0.00 0.00 59.98 58.87 3hho h ARG 150 Cb -0.09 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3hho h ARG 150 CO -0.06 1.13 -0.07 0.87 -1.51 0.00 0.00 179.97 180.33 3hho h LYS 151 N 0.40 0.47 -0.40 0.20 1.57 0.14 -2.93 116.57 116.03 3hho h LYS 151 Ca -0.02 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 3hho h LYS 151 Cb 1.19 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 3hho h LYS 151 CO 0.12 0.71 0.03 -0.07 -0.57 0.00 0.00 179.45 179.67 3hho h LEU 152 N 0.20 0.58 -0.99 2.94 3.38 0.10 0.40 115.31 121.92 3hho h LEU 152 Ca 0.06 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3hho h LEU 152 Cb 0.55 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3hho h LEU 152 CO 0.03 0.63 0.28 0.11 0.09 0.00 0.00 178.44 179.57 3hho h LYS 153 N 0.59 1.00 -0.22 1.13 1.57 -0.63 0.40 116.57 120.41 3hho h LYS 153 Ca 0.13 -0.16 -0.17 0.00 -1.87 0.00 0.00 60.65 58.57 3hho h LYS 153 Cb 0.33 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 3hho h LYS 153 CO 0.01 0.81 -0.54 0.35 -0.57 0.00 0.00 179.45 179.50 3hho h PHE 154 N 0.98 0.83 -0.15 -1.35 3.57 -1.30 -3.03 116.94 116.49 3hho h PHE 154 Ca 0.23 -0.29 0.04 0.00 3.53 0.00 0.00 57.97 61.48 3hho h PHE 154 Cb 0.18 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 3hho h PHE 154 CO 0.01 1.06 -0.13 0.82 -2.23 0.00 0.00 178.31 177.84 3hho h ILE 155 N 0.51 0.63 -0.44 1.41 1.08 0.15 -0.53 117.51 120.32 3hho h ILE 155 Ca 0.01 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.57 3hho h ILE 155 Cb 1.11 0.63 -0.08 0.00 -3.07 0.00 0.00 36.82 35.41 3hho h ILE 155 CO 0.11 0.00 -0.05 0.00 -0.69 0.00 0.00 178.15 177.52 3hho h ALA 156 N 0.94 0.35 0.00 1.87 0.00 -0.30 -1.65 119.26 120.48 3hho h ALA 156 Ca 0.10 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3hho h ALA 156 Cb 0.30 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3hho h ALA 156 CO -0.24 -0.42 -0.11 0.87 0.00 0.00 0.00 179.25 179.35 3hho h LYS 157 N 0.05 0.00 0.05 0.00 1.79 -1.19 -2.46 116.57 114.81 3hho h LYS 157 Ca 0.22 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.46 3hho h LYS 157 Cb 0.32 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 3hho h LYS 157 CO -0.41 0.11 -1.05 1.25 -1.08 0.00 0.00 179.45 178.27 3hho h LEU 158 N 0.00 0.23 -0.76 2.94 5.85 -0.21 -2.62 115.31 120.73 3hho h LEU 158 Ca -0.00 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3hho h LEU 158 Cb 0.24 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 3hho h LEU 158 CO 0.01 1.13 0.48 0.11 -0.34 0.00 0.00 178.44 179.84 3hho h LYS 159 N 0.06 1.02 -0.47 1.25 1.57 -0.93 0.05 116.57 119.12 3hho h LYS 159 Ca -0.07 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3hho h LYS 159 Cb 1.77 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 33.83 3hho h LYS 159 CO 0.16 0.70 0.30 -0.91 -0.57 0.00 0.00 179.45 179.13 3hho h ASN 160 N 1.04 0.50 -0.98 0.86 2.35 -1.51 0.73 115.58 118.57 3hho h ASN 160 Ca 0.28 -0.00 0.19 0.00 -0.55 0.00 0.00 56.30 56.21 3hho h ASN 160 Cb -0.07 -0.11 -0.11 0.00 0.05 0.00 0.00 38.32 38.08 3hho h ASN 160 CO -0.06 0.35 0.58 -0.33 -1.65 0.00 0.00 177.43 176.33 3hho h GLU 161 N 0.60 0.69 0.00 0.81 5.08 -1.00 0.99 114.58 121.75 3hho h GLU 161 Ca 0.18 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 3hho h GLU 161 Cb -0.02 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3hho h GLU 161 CO -0.06 0.46 -0.37 0.28 -1.00 0.00 0.00 179.01 178.31 3hho h VAL 162 N 0.71 0.66 -0.17 3.13 2.07 0.70 -2.56 116.25 120.79 3hho h VAL 162 Ca 0.57 -1.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3hho h VAL 162 Cb 0.90 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 3hho h VAL 162 CO -0.40 0.36 0.06 -0.08 0.02 0.00 0.00 177.57 177.53 3hho h GLU 163 N 0.00 0.26 -0.13 1.57 4.57 0.26 -2.27 114.58 118.85 3hho h GLU 163 Ca -0.00 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 3hho h GLU 163 Cb 1.22 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.76 3hho h GLU 163 CO 0.05 0.38 -0.01 0.00 -1.18 0.00 0.00 179.01 178.25 3hho h ARG 164 N 0.10 0.18 -0.06 1.92 3.08 -0.71 -0.29 114.38 118.60 3hho h ARG 164 Ca 0.06 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 3hho h ARG 164 Cb 0.22 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3hho h ARG 164 CO -0.00 0.21 -0.14 0.28 -1.07 0.00 0.00 179.97 179.24 3hho h VAL 165 N 0.18 1.42 -0.44 2.04 2.07 -1.40 -2.82 116.25 117.30 3hho h VAL 165 Ca 0.04 -1.48 0.07 0.00 0.82 0.00 0.00 66.70 66.15 3hho h VAL 165 Cb 0.14 2.25 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 3hho h VAL 165 CO 0.00 0.41 0.07 -0.08 0.02 0.00 0.00 177.57 178.00 3hho h GLU 166 N -0.29 0.20 -0.01 1.57 4.81 -0.92 0.07 114.58 120.01 3hho h GLU 166 Ca -0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3hho h GLU 166 Cb 0.74 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 3hho h GLU 166 CO 0.03 0.13 0.01 -0.44 -0.73 0.00 0.00 179.01 178.01 3hho h ASP 167 N 0.20 0.00 0.14 1.04 5.19 -1.11 -1.08 116.42 120.80 3hho h ASP 167 Ca 0.22 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.33 3hho h ASP 167 Cb 0.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.79 3hho h ASP 167 CO -0.29 0.00 -1.49 -0.61 -3.12 0.00 0.00 179.24 173.72 3hho h GLN 168 N 0.00 0.29 0.00 3.56 4.15 -0.88 -3.37 115.11 118.86 3hho h GLN 168 Ca 0.00 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 58.93 3hho h GLN 168 Cb 0.03 0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.90 3hho h GLN 168 CO -0.00 1.24 0.00 -0.07 -1.93 0.00 0.00 178.83 178.07 3hho h LEU 169 N -0.19 0.00 -0.49 -2.39 3.38 -0.50 -3.52 115.31 111.61 3hho h LEU 169 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3hho h LEU 169 Cb 1.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.61 3hho h LEU 169 CO 0.10 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.63