#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hws s ALA 63 N 0.00 2.83 -0.07 7.33 0.00 -1.26 -5.10 121.76 125.49 3hws s ALA 63 Ca 0.00 -1.16 -0.29 0.00 0.00 0.00 0.00 51.96 50.51 3hws s ALA 63 Cb 0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 3hws s ALA 63 CO 0.00 0.61 0.95 -1.17 0.00 0.00 0.00 175.76 176.15 3hws s LEU 64 N -1.69 4.29 0.15 0.00 2.96 -1.26 -5.00 118.68 118.13 3hws s LEU 64 Ca 0.17 1.52 -0.31 0.00 -0.22 0.00 0.00 54.13 55.29 3hws s LEU 64 Cb -0.11 -3.49 -0.11 0.00 0.50 0.00 0.00 46.19 42.98 3hws s LEU 64 CO 0.09 -0.34 1.78 -2.16 -1.32 0.00 0.00 176.35 174.39 3hws s PRO 65 N 1.53 4.14 0.67 0.98 0.04 -1.26 -4.98 135.00 136.13 3hws s PRO 65 Ca 0.48 2.58 -0.16 0.00 0.04 0.00 0.00 61.00 63.93 3hws s PRO 65 Cb -0.19 -3.42 0.01 0.00 0.04 0.00 0.00 34.50 30.93 3hws s PRO 65 CO 0.21 -0.80 1.19 0.95 0.04 0.00 0.00 177.00 178.59 3hws s THR 66 N 2.21 2.58 0.38 1.26 -4.23 -1.26 -4.75 115.64 111.83 3hws s THR 66 Ca 0.78 0.31 0.13 0.00 -1.18 0.00 0.00 61.69 61.73 3hws s THR 66 Cb -0.47 -2.93 0.35 0.00 1.34 0.00 0.00 72.50 70.80 3hws s THR 66 CO 0.35 -0.13 1.83 -0.65 -0.54 0.00 0.00 174.62 175.47 3hws h PRO 67 N 0.13 0.52 -0.40 3.99 0.11 -1.94 0.70 132.00 135.12 3hws h PRO 67 Ca -0.48 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.66 3hws h PRO 67 Cb 1.29 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3hws h PRO 67 CO 0.52 0.35 0.07 0.45 -0.21 0.00 0.00 178.00 179.18 3hws h HIS 68 N 0.54 0.11 -0.04 0.65 3.86 -1.95 -0.66 115.15 117.66 3hws h HIS 68 Ca 0.51 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.74 3hws h HIS 68 Cb 1.08 0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.56 3hws h HIS 68 CO -0.00 -0.00 0.02 0.93 0.86 0.00 0.00 177.93 179.73 3hws h GLU 69 N 0.19 0.06 -0.48 2.45 5.08 -1.27 -2.81 114.58 117.80 3hws h GLU 69 Ca 0.19 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.64 3hws h GLU 69 Cb 0.24 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.39 3hws h GLU 69 CO -0.26 0.20 -0.05 0.82 -1.00 0.00 0.00 179.01 178.71 3hws h ILE 70 N -0.10 0.58 -0.35 3.13 2.04 -0.67 -1.79 117.51 120.35 3hws h ILE 70 Ca 0.01 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3hws h ILE 70 Cb 0.16 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 3hws h ILE 70 CO -0.00 0.01 0.23 -0.09 0.00 0.00 0.00 178.15 178.30 3hws h ARG 71 N 0.06 0.47 -0.88 2.37 2.43 -1.11 -2.00 114.38 115.72 3hws h ARG 71 Ca 0.24 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.42 3hws h ARG 71 Cb 0.36 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 3hws h ARG 71 CO -0.44 0.31 0.58 -0.91 -1.51 0.00 0.00 179.97 177.99 3hws h ASN 72 N 0.48 0.92 -0.63 -3.80 2.35 -1.08 0.19 115.58 114.01 3hws h ASN 72 Ca 0.13 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 3hws h ASN 72 Cb -0.06 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.08 3hws h ASN 72 CO -0.03 0.62 0.14 0.45 -1.65 0.00 0.00 177.43 176.96 3hws h HIS 73 N 1.06 1.07 -0.19 1.19 3.86 -0.96 -2.38 115.15 118.79 3hws h HIS 73 Ca 0.36 -0.13 -0.06 0.00 -1.16 0.00 0.00 60.37 59.38 3hws h HIS 73 Cb 0.09 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 3hws h HIS 73 CO -0.00 0.90 -0.14 -0.07 0.86 0.00 0.00 177.93 179.48 3hws h LEU 74 N 0.93 0.30 -2.27 2.43 3.38 -0.54 -2.62 115.31 116.92 3hws h LEU 74 Ca 0.20 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3hws h LEU 74 Cb 0.38 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hws h LEU 74 CO 0.00 0.47 -0.00 0.44 0.09 0.00 0.00 178.44 179.44 3hws h ASP 75 N 0.30 0.00 1.42 -0.43 3.32 -0.46 0.20 116.42 120.76 3hws h ASP 75 Ca 0.06 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 3hws h ASP 75 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 3hws h ASP 75 CO 0.02 0.00 -0.48 0.44 -1.72 0.00 0.00 179.24 177.51 3hws h ASP 76 N 0.00 0.00 0.00 6.45 3.32 -1.40 -3.33 116.42 121.45 3hws h ASP 76 Ca -0.00 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.85 3hws h ASP 76 Cb 0.01 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 3hws h ASP 76 CO 0.00 0.48 -1.99 -1.22 -1.72 0.00 0.00 179.24 174.79 3hws n TYR 77 N -3.26 0.00 -4.89 4.55 4.02 -0.71 -1.15 117.16 115.72 3hws n TYR 77 Ca 0.02 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.64 3hws n TYR 77 Cb 0.70 -0.66 -0.16 0.00 -0.02 0.00 0.00 39.34 39.20 3hws n TYR 77 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3hws s VAL 78 N -2.62 1.51 -0.08 -0.72 1.01 0.62 -4.88 120.40 115.24 3hws s VAL 78 Ca -0.07 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 3hws s VAL 78 Cb 0.07 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 3hws s VAL 78 CO 0.67 0.43 0.36 -0.63 0.00 0.00 0.00 175.10 175.93 3hws s ILE 79 N 0.06 5.19 0.00 2.22 -1.09 -1.26 -4.33 121.20 121.98 3hws s ILE 79 Ca -0.05 0.71 0.00 0.00 -2.23 0.00 0.00 60.65 59.08 3hws s ILE 79 Cb -0.12 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.08 3hws s ILE 79 CO 0.03 0.48 0.00 0.61 -1.23 0.00 0.00 174.94 174.83 3hws n GLY 80 N 2.56 0.37 3.20 6.18 0.00 -1.26 -4.91 105.19 111.33 3hws n GLY 80 Ca -0.13 -0.87 -0.23 0.00 0.00 0.00 0.00 46.02 44.79 3hws n GLY 80 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hws n GLN 81 N 0.00 -4.69 -0.27 1.61 1.13 -1.26 -4.86 117.38 109.04 3hws n GLN 81 Ca 0.00 0.76 0.06 0.00 -1.94 0.00 0.00 57.00 55.88 3hws n GLN 81 Cb 0.00 -5.60 0.29 0.00 0.11 0.00 0.00 30.24 25.04 3hws n GLN 81 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3hws h GLU 82 N -1.38 0.89 -0.10 -1.09 4.39 -1.96 -1.55 114.58 113.77 3hws h GLU 82 Ca -0.51 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.12 3hws h GLU 82 Cb 1.34 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3hws h GLU 82 CO 0.56 0.59 -0.01 1.96 -1.16 0.00 0.00 179.01 180.95 3hws h GLN 83 N 0.91 0.19 -0.82 2.33 1.08 -1.92 -1.92 115.11 114.97 3hws h GLN 83 Ca 0.38 -0.07 0.02 0.00 -1.45 0.00 0.00 58.65 57.54 3hws h GLN 83 Cb 0.29 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 3hws h GLN 83 CO -0.15 0.46 0.54 0.00 -0.95 0.00 0.00 178.83 178.74 3hws h ALA 84 N 0.72 1.46 -0.48 3.87 0.00 -1.64 -2.01 119.26 121.19 3hws h ALA 84 Ca 0.03 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3hws h ALA 84 Cb 0.38 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3hws h ALA 84 CO 0.01 0.47 -0.19 0.87 0.00 0.00 0.00 179.25 180.41 3hws h LYS 85 N 1.05 0.95 -0.24 0.00 1.57 -1.17 0.02 116.57 118.75 3hws h LYS 85 Ca 0.31 -0.39 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 3hws h LYS 85 Cb -0.04 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3hws h LYS 85 CO -0.08 1.05 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.63 3hws h LYS 86 N 0.83 0.07 0.74 3.15 3.64 -0.86 0.48 116.57 124.62 3hws h LYS 86 Ca 0.11 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3hws h LYS 86 Cb 0.75 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3hws h LYS 86 CO 0.06 0.04 -0.42 0.28 -2.27 0.00 0.00 179.45 177.15 3hws h VAL 87 N 0.07 0.15 -0.79 2.00 2.07 -1.04 -2.19 116.25 116.52 3hws h VAL 87 Ca 0.11 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.76 3hws h VAL 87 Cb 0.15 0.15 -0.09 0.00 -1.52 0.00 0.00 31.29 29.99 3hws h VAL 87 CO -0.20 0.00 0.40 -0.07 0.02 0.00 0.00 177.57 177.72 3hws h LEU 88 N -1.08 0.49 -0.43 2.57 4.07 -0.94 -0.33 115.31 119.65 3hws h LEU 88 Ca -0.10 0.08 0.08 0.00 0.08 0.00 0.00 57.88 58.02 3hws h LEU 88 Cb 0.85 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.53 3hws h LEU 88 CO 0.12 0.23 0.04 0.00 -1.08 0.00 0.00 178.44 177.75 3hws h ALA 89 N 1.51 0.43 -0.11 1.53 0.00 -0.70 0.96 119.26 122.88 3hws h ALA 89 Ca 0.42 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.40 3hws h ALA 89 Cb 0.54 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hws h ALA 89 CO -0.33 -0.36 -0.09 0.28 0.00 0.00 0.00 179.25 178.75 3hws h VAL 90 N 0.15 1.34 -0.17 0.00 2.07 -0.62 -1.01 116.25 118.02 3hws h VAL 90 Ca 0.21 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.58 3hws h VAL 90 Cb 0.30 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3hws h VAL 90 CO -0.33 0.34 -0.07 0.00 0.02 0.00 0.00 177.57 177.53 3hws h ALA 91 N 0.61 0.08 0.08 1.67 0.00 -0.90 -0.25 119.26 120.54 3hws h ALA 91 Ca 0.02 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hws h ALA 91 Cb 0.59 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3hws h ALA 91 CO 0.02 -0.51 -0.04 0.28 0.00 0.00 0.00 179.25 179.01 3hws h VAL 92 N -0.05 0.96 0.13 0.00 2.07 -0.82 -1.14 116.25 117.40 3hws h VAL 92 Ca 0.09 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.50 3hws h VAL 92 Cb 0.19 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.96 3hws h VAL 92 CO -0.21 0.03 -0.37 0.22 0.02 0.00 0.00 177.57 177.26 3hws h TYR 93 N -0.16 -1.03 -0.73 1.57 3.20 -1.01 -2.09 116.97 116.73 3hws h TYR 93 Ca -0.01 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.00 3hws h TYR 93 Cb 0.13 0.43 -0.08 0.00 1.54 0.00 0.00 36.73 38.76 3hws h TYR 93 CO -0.05 -0.48 0.32 -0.91 -1.64 0.00 0.00 178.16 175.40 3hws h ASN 94 N -0.61 0.37 0.11 -2.11 2.35 -1.01 0.11 115.58 114.80 3hws h ASN 94 Ca 0.02 0.08 0.02 0.00 -0.55 0.00 0.00 56.30 55.87 3hws h ASN 94 Cb 0.64 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 39.01 3hws h ASN 94 CO -0.21 0.18 -0.21 -0.74 -1.65 0.00 0.00 177.43 174.81 3hws h HIS 95 N 0.52 -0.55 0.00 1.19 -0.00 -0.69 -0.39 115.15 115.23 3hws h HIS 95 Ca 0.38 0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.67 3hws h HIS 95 Cb 0.49 0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 28.11 3hws h HIS 95 CO -0.14 -0.30 -0.42 1.88 -0.00 0.00 0.00 177.93 178.95 3hws h TYR 96 N -0.39 0.00 0.00 5.26 -1.99 -1.09 -1.99 116.97 116.77 3hws h TYR 96 Ca 0.03 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 3hws h TYR 96 Cb 0.41 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.14 3hws h TYR 96 CO -0.20 0.42 -0.07 -0.22 -0.00 0.00 0.00 178.16 178.09 3hws h LYS 97 N 0.00 0.00 0.21 4.88 1.63 -0.38 -2.82 116.57 120.08 3hws h LYS 97 Ca -0.00 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 59.46 3hws h LYS 97 Cb 1.06 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.71 3hws h LYS 97 CO 0.05 0.07 -1.61 -0.09 -3.45 0.00 0.00 179.45 174.43 3hws h ARG 98 N 0.00 0.44 -0.33 1.90 2.43 -0.33 -3.17 114.38 115.32 3hws h ARG 98 Ca -0.00 -0.75 -0.03 0.00 -0.81 0.00 0.00 59.98 58.39 3hws h ARG 98 Cb 0.55 0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 3hws h ARG 98 CO 0.01 1.35 0.11 -0.07 -1.51 0.00 0.00 179.97 179.86 3hws h LEU 99 N 0.12 0.48 -0.23 3.80 3.38 -1.37 0.30 115.31 121.78 3hws h LEU 99 Ca -0.29 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3hws h LEU 99 Cb 2.12 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.73 3hws h LEU 99 CO 0.22 0.55 0.15 0.03 0.09 0.00 0.00 178.44 179.48 3hws h ARG 100 N 0.38 0.31 -0.27 1.13 3.08 -1.64 -3.00 114.38 114.35 3hws h ARG 100 Ca 0.11 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 59.95 3hws h ARG 100 Cb 0.24 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3hws h ARG 100 CO -0.00 0.22 -0.57 -0.97 -1.07 0.00 0.00 179.97 177.57 3hws h ASN 101 N 0.30 0.96 -4.81 7.04 -0.73 -1.51 -3.50 115.58 113.33 3hws h ASN 101 Ca 0.08 -0.53 0.00 0.00 1.87 0.00 0.00 56.30 57.73 3hws h ASN 101 Cb -0.02 -0.28 0.00 0.00 0.27 0.00 0.00 38.32 38.30 3hws h ASN 101 CO -0.02 1.32 0.00 0.61 -0.37 0.00 0.00 177.43 178.98 3hws n GLY 102 N 0.39 3.49 0.14 1.57 0.00 0.10 -4.90 105.19 105.98 3hws n GLY 102 Ca -0.05 -1.86 -0.07 0.00 0.00 0.00 0.00 46.02 44.04 3hws n GLY 102 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3hws h ASP 103 N 0.00 0.08 -3.06 1.61 1.82 -1.86 -3.41 116.42 111.61 3hws h ASP 103 Ca 0.00 0.04 -0.62 0.00 -0.39 0.00 0.00 57.03 56.06 3hws h ASP 103 Cb 0.00 0.04 -0.09 0.00 0.68 0.00 0.00 39.33 39.95 3hws h ASP 103 CO 0.00 0.08 -0.42 0.28 -1.61 0.00 0.00 179.24 177.57 3hws s THR 104 N -6.17 5.38 -0.21 2.25 -1.32 -1.26 -2.45 115.64 111.86 3hws s THR 104 Ca -0.13 0.34 -0.03 0.00 -1.21 0.00 0.00 61.69 60.65 3hws s THR 104 Cb 0.11 -3.51 0.07 0.00 -1.51 0.00 0.00 72.50 67.66 3hws s THR 104 CO 0.70 0.50 0.06 -0.55 -2.21 0.00 0.00 174.62 173.12 3hws s SER 105 N -0.17 2.90 -0.77 8.08 0.15 -0.15 -4.87 113.70 118.88 3hws s SER 105 Ca 0.14 -0.87 -0.04 0.00 0.70 0.00 0.00 55.95 55.88 3hws s SER 105 Cb -0.12 -0.50 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 3hws s SER 105 CO 0.03 -0.34 0.50 -3.20 1.20 0.00 0.00 173.24 171.43 3hws n ASN 106 N 5.11 -4.19 0.00 5.45 5.15 -1.26 -2.82 115.26 122.69 3hws n ASN 106 Ca -0.08 -0.23 0.00 0.00 -0.60 0.00 0.00 54.58 53.67 3hws n ASN 106 Cb 0.47 -2.90 0.00 0.00 -0.53 0.00 0.00 39.78 36.82 3hws n ASN 106 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hws n GLY 107 N -1.25 0.74 3.04 8.20 0.00 -1.26 -5.01 105.19 109.65 3hws n GLY 107 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 3hws n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hws s VAL 108 N -2.93 1.19 -0.18 1.61 1.01 -1.13 -5.11 120.40 114.86 3hws s VAL 108 Ca 0.00 -0.51 -0.28 0.00 0.00 0.00 0.00 61.98 61.19 3hws s VAL 108 Cb 0.00 -1.08 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 3hws s VAL 108 CO 0.00 0.37 0.97 -0.70 0.00 0.00 0.00 175.10 175.74 3hws s GLU 109 N 0.61 4.31 0.43 2.72 -6.30 -1.26 -0.98 118.70 118.22 3hws s GLU 109 Ca -0.14 1.27 -0.22 0.00 -2.50 0.00 0.00 54.97 53.38 3hws s GLU 109 Cb -0.16 -3.60 -0.10 0.00 0.00 0.00 0.00 34.13 30.28 3hws s GLU 109 CO 0.04 -0.46 0.99 -0.51 0.02 0.00 0.00 175.26 175.34 3hws s LEU 110 N 2.59 4.01 -0.15 2.70 1.43 -1.03 -4.98 118.68 123.25 3hws s LEU 110 Ca 0.43 1.84 -0.18 0.00 -1.03 0.00 0.00 54.13 55.19 3hws s LEU 110 Cb -0.16 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 3hws s LEU 110 CO 0.11 -0.47 0.50 -0.83 0.23 0.00 0.00 176.35 175.90 3hws s GLY 111 N -1.93 2.28 0.19 -3.19 0.00 -1.26 -4.97 107.32 98.43 3hws s GLY 111 Ca 0.61 -0.26 -0.31 0.00 0.00 0.00 0.00 44.72 44.76 3hws s GLY 111 CO 0.19 0.91 1.59 0.54 0.00 0.00 0.00 173.10 176.32 3hws s LYS 112 N 1.02 4.20 -0.79 2.90 1.02 -1.26 -4.96 119.74 121.86 3hws s LYS 112 Ca 0.26 2.42 0.02 0.00 0.02 0.00 0.00 55.97 58.69 3hws s LYS 112 Cb -0.15 -3.12 0.22 0.00 -0.52 0.00 0.00 37.83 34.25 3hws s LYS 112 CO 0.10 -0.62 0.74 -1.13 -0.92 0.00 0.00 175.35 173.53 3hws n SER 113 N 3.67 3.91 -4.78 2.83 3.41 -1.26 -4.85 113.62 116.55 3hws n SER 113 Ca 0.13 -3.26 -0.31 0.00 -0.26 0.00 0.00 58.87 55.17 3hws n SER 113 Cb 0.38 -0.88 0.08 0.00 -0.26 0.00 0.00 64.21 63.53 3hws n SER 113 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3hws s ASN 114 N -1.28 4.65 -0.02 4.04 0.01 -1.26 -4.82 114.94 116.26 3hws s ASN 114 Ca 0.30 1.66 0.07 0.00 -0.71 0.00 0.00 52.86 54.19 3hws s ASN 114 Cb 0.00 -2.42 -0.02 0.00 0.41 0.00 0.00 41.25 39.22 3hws s ASN 114 CO -0.09 -1.92 -0.24 -0.63 -1.51 0.00 0.00 177.10 172.71 3hws s ILE 115 N -2.98 2.22 -0.25 0.60 1.01 -0.71 -2.57 121.20 118.53 3hws s ILE 115 Ca 0.60 -1.09 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 3hws s ILE 115 Cb -0.16 -1.80 0.03 0.00 0.01 0.00 0.00 42.46 40.54 3hws s ILE 115 CO 0.56 0.55 -0.07 -0.22 0.00 0.00 0.00 174.94 175.77 3hws s LEU 116 N -0.71 3.19 -0.23 2.97 2.96 0.14 -0.54 118.68 126.45 3hws s LEU 116 Ca 0.10 -0.90 -0.15 0.00 -0.22 0.00 0.00 54.13 52.97 3hws s LEU 116 Cb -0.10 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 3hws s LEU 116 CO -0.00 -0.13 0.37 -0.76 -1.32 0.00 0.00 176.35 174.51 3hws s LEU 117 N 1.31 4.11 -0.25 -0.68 1.43 0.29 -0.71 118.68 124.17 3hws s LEU 117 Ca -0.00 0.40 0.03 0.00 -1.03 0.00 0.00 54.13 53.53 3hws s LEU 117 Cb -0.17 -2.45 0.06 0.00 0.03 0.00 0.00 46.19 43.66 3hws s LEU 117 CO -0.05 -0.11 -0.11 -0.63 0.23 0.00 0.00 176.35 175.68 3hws s ILE 118 N 1.57 2.10 0.10 -0.59 1.01 0.75 -1.18 121.20 124.95 3hws s ILE 118 Ca 0.17 -1.53 -0.26 0.00 0.00 0.00 0.00 60.65 59.03 3hws s ILE 118 Cb -0.15 -2.19 0.08 0.00 0.01 0.00 0.00 42.46 40.21 3hws s ILE 118 CO 0.08 0.02 0.76 -0.83 0.00 0.00 0.00 174.94 174.97 3hws s GLY 119 N 1.15 -0.49 0.99 6.18 0.00 -0.84 -0.92 107.32 113.38 3hws s GLY 119 Ca -0.07 0.64 -0.11 0.00 0.00 0.00 0.00 44.72 45.18 3hws s GLY 119 CO -0.06 0.21 1.09 -4.14 0.00 0.00 0.00 173.10 170.21 3hws s PRO 120 N -3.45 0.48 0.24 2.90 0.02 -1.26 -3.64 135.00 130.28 3hws s PRO 120 Ca 0.04 1.18 -0.30 0.00 0.02 0.00 0.00 61.00 61.94 3hws s PRO 120 Cb -0.01 -1.69 -0.10 0.00 0.02 0.00 0.00 34.50 32.72 3hws s PRO 120 CO -0.09 -2.88 1.38 0.99 -0.33 0.00 0.00 177.00 176.07 3hws s THR 121 N -2.65 2.83 -0.38 0.99 2.01 -1.26 -2.86 115.64 114.32 3hws s THR 121 Ca 0.66 0.71 0.00 0.00 0.31 0.00 0.00 61.69 63.38 3hws s THR 121 Cb -0.22 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 68.83 3hws s THR 121 CO 0.60 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 3hws n GLY 122 N 2.08 0.30 0.01 4.40 0.00 -1.26 -4.66 105.19 106.06 3hws n GLY 122 Ca 0.06 -0.75 0.11 0.00 0.00 0.00 0.00 46.02 45.44 3hws n GLY 122 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hws n SER 123 N 1.22 0.31 0.00 1.61 3.41 -1.14 -3.43 113.62 115.60 3hws n SER 123 Ca -0.05 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 3hws n SER 123 Cb 0.46 1.62 0.00 0.00 -0.26 0.00 0.00 64.21 66.03 3hws n SER 123 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hws n GLY 124 N 1.32 0.98 0.49 5.00 0.00 -1.26 -4.93 105.19 106.80 3hws n GLY 124 Ca -0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 3hws n GLY 124 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hws h LYS 125 N 0.00 -0.88 -0.62 1.61 1.57 -1.94 0.92 116.57 117.23 3hws h LYS 125 Ca 0.00 0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 3hws h LYS 125 Cb 0.00 0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 3hws h LYS 125 CO 0.00 -0.59 0.28 1.15 -0.57 0.00 0.00 179.45 179.72 3hws h THR 126 N -0.92 1.22 -0.66 -0.16 2.02 -1.99 -2.36 112.91 110.06 3hws h THR 126 Ca -0.04 -0.66 0.02 0.00 0.77 0.00 0.00 66.41 66.50 3hws h THR 126 Cb 0.83 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 3hws h THR 126 CO -0.14 0.26 0.42 0.25 0.37 0.00 0.00 175.52 176.68 3hws h LEU 127 N 0.86 0.69 -0.70 2.58 5.85 -1.95 -1.06 115.31 121.57 3hws h LEU 127 Ca 0.21 -0.00 0.07 0.00 0.84 0.00 0.00 57.88 59.00 3hws h LEU 127 Cb 0.16 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 3hws h LEU 127 CO -0.02 0.49 0.39 -0.07 -0.34 0.00 0.00 178.44 178.88 3hws h LEU 128 N 0.83 0.57 0.22 2.25 3.38 -0.40 0.15 115.31 122.30 3hws h LEU 128 Ca 0.26 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 3hws h LEU 128 Cb -0.01 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3hws h LEU 128 CO -0.09 0.35 -0.11 0.00 0.09 0.00 0.00 178.44 178.69 3hws h ALA 129 N 1.38 -0.30 -0.44 1.53 0.00 -0.89 -2.08 119.26 118.46 3hws h ALA 129 Ca 0.32 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.17 3hws h ALA 129 Cb 0.23 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 3hws h ALA 129 CO -0.20 -0.59 0.16 0.93 0.00 0.00 0.00 179.25 179.54 3hws h GLU 130 N -0.44 0.32 -0.64 0.00 5.08 -0.88 -2.77 114.58 115.25 3hws h GLU 130 Ca -0.03 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3hws h GLU 130 Cb 0.33 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3hws h GLU 130 CO 0.05 0.21 0.29 1.15 -1.00 0.00 0.00 179.01 179.72 3hws h THR 131 N 0.33 1.21 -0.10 1.13 2.02 -0.61 -1.53 112.91 115.36 3hws h THR 131 Ca 0.20 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.78 3hws h THR 131 Cb 0.19 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3hws h THR 131 CO -0.20 0.26 0.02 -0.07 0.37 0.00 0.00 175.52 175.89 3hws h LEU 132 N 0.91 0.00 -0.51 2.58 3.38 -1.10 -1.36 115.31 119.21 3hws h LEU 132 Ca 0.22 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.24 3hws h LEU 132 Cb 0.12 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 3hws h LEU 132 CO -0.03 0.02 0.28 0.00 0.09 0.00 0.00 178.44 178.80 3hws h ALA 133 N 1.07 0.65 -0.61 1.53 0.00 -1.27 -2.21 119.26 118.41 3hws h ALA 133 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3hws h ALA 133 Cb 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3hws h ALA 133 CO -0.06 -0.04 0.39 -0.09 0.00 0.00 0.00 179.25 179.45 3hws h ARG 134 N 0.56 0.75 0.00 0.00 2.43 -0.96 0.80 114.38 117.96 3hws h ARG 134 Ca 0.21 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3hws h ARG 134 Cb 0.07 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3hws h ARG 134 CO -0.12 0.49 0.00 1.47 -1.51 0.00 0.00 179.97 180.30 3hws n LEU 135 N -4.71 0.33 -0.47 3.80 -0.00 -0.54 -2.45 117.00 112.95 3hws n LEU 135 Ca 0.05 0.54 0.09 0.00 -0.00 0.00 0.00 56.01 56.70 3hws n LEU 135 Cb 0.06 -0.45 0.01 0.00 -0.00 0.00 0.00 43.42 43.04 3hws n LEU 135 CO 0.34 -0.14 0.32 0.18 -0.00 0.00 0.00 177.39 178.09 3hws n LEU 136 N -1.81 1.93 -3.75 1.47 4.77 -0.78 -4.99 117.00 113.84 3hws n LEU 136 Ca 0.06 -0.79 -0.24 0.00 -0.03 0.00 0.00 56.01 55.01 3hws n LEU 136 Cb 0.34 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.45 3hws n LEU 136 CO 0.26 0.36 -0.11 0.47 -1.33 0.00 0.00 177.39 177.04 3hws n ASP 137 N 0.07 -1.76 -4.17 -1.43 8.00 0.16 -4.99 116.55 112.43 3hws n ASP 137 Ca 0.08 -0.90 -0.26 0.00 0.71 0.00 0.00 54.79 54.43 3hws n ASP 137 Cb 0.41 -3.73 -0.16 0.00 -0.02 0.00 0.00 41.12 37.63 3hws n ASP 137 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hws s VAL 138 N -3.71 1.45 0.19 2.53 1.01 -0.54 -5.05 120.40 116.30 3hws s VAL 138 Ca 0.09 -0.77 -0.33 0.00 0.00 0.00 0.00 61.98 60.97 3hws s VAL 138 Cb -0.03 -1.22 -0.14 0.00 0.00 0.00 0.00 36.38 34.99 3hws s VAL 138 CO 0.84 0.41 1.34 -0.81 0.00 0.00 0.00 175.10 176.88 3hws n PRO 139 N 2.75 1.68 -4.65 2.72 -0.04 -1.26 -4.56 135.00 131.64 3hws n PRO 139 Ca -0.16 0.60 -0.24 0.00 -0.04 0.00 0.00 63.50 63.67 3hws n PRO 139 Cb 0.53 -2.22 -0.16 0.00 -0.04 0.00 0.00 33.50 31.62 3hws n PRO 139 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3hws s PHE 140 N 0.07 1.41 0.02 0.54 5.36 -1.26 -0.92 117.98 123.20 3hws s PHE 140 Ca 0.73 -0.40 0.02 0.00 -0.96 0.00 0.00 56.93 56.32 3hws s PHE 140 Cb -0.75 -0.97 -0.02 0.00 -0.34 0.00 0.00 43.02 40.95 3hws s PHE 140 CO 0.49 -0.15 -0.06 -0.08 -1.46 0.00 0.00 175.22 173.96 3hws s THR 141 N 0.14 0.45 0.14 0.12 -1.32 -0.87 -4.98 115.64 109.32 3hws s THR 141 Ca -0.04 -0.73 0.07 0.00 -1.21 0.00 0.00 61.69 59.78 3hws s THR 141 Cb -0.11 -0.48 -0.04 0.00 -1.51 0.00 0.00 72.50 70.37 3hws s THR 141 CO 0.02 -0.20 -0.05 -0.32 -2.21 0.00 0.00 174.62 171.86 3hws s MET 142 N -1.00 2.29 0.07 7.08 1.75 -1.26 -1.72 119.30 126.50 3hws s MET 142 Ca -0.06 -1.06 -0.06 0.00 -1.25 0.00 0.00 55.69 53.26 3hws s MET 142 Cb -0.07 -2.34 -0.01 0.00 2.84 0.00 0.00 34.83 35.25 3hws s MET 142 CO 0.00 0.48 0.12 0.00 -0.65 0.00 0.00 175.02 174.97 3hws s ALA 143 N -1.49 -0.02 -0.15 4.11 0.00 0.71 -4.92 121.76 120.00 3hws s ALA 143 Ca 0.25 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3hws s ALA 143 Cb -0.10 0.37 0.01 0.00 0.00 0.00 0.00 23.12 23.40 3hws s ALA 143 CO 0.16 -0.43 -0.19 0.34 0.00 0.00 0.00 175.76 175.64 3hws s ASP 144 N -2.69 3.31 0.48 0.00 -1.08 -1.26 -0.93 116.67 114.50 3hws s ASP 144 Ca 0.03 -0.57 0.18 0.00 -0.52 0.00 0.00 52.55 51.67 3hws s ASP 144 Cb 0.04 -1.50 1.18 0.00 -1.46 0.00 0.00 42.92 41.19 3hws s ASP 144 CO -0.09 0.06 2.05 0.00 0.52 0.00 0.00 175.17 177.71 3hws h ALA 145 N 7.47 1.68 -0.01 3.66 0.00 -1.58 -2.84 119.26 127.64 3hws h ALA 145 Ca -0.35 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 3hws h ALA 145 Cb 1.18 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3hws h ALA 145 CO 0.58 0.16 -0.56 1.79 0.00 0.00 0.00 179.25 181.22 3hws h THR 146 N 0.00 1.40 -0.28 0.00 1.35 -1.82 -2.82 112.91 110.74 3hws h THR 146 Ca -0.00 -1.91 -0.08 0.00 -0.55 0.00 0.00 66.41 63.86 3hws h THR 146 Cb 0.24 2.02 -0.02 0.00 -1.73 0.00 0.00 68.15 68.67 3hws h THR 146 CO 0.02 0.55 -0.18 0.71 -0.25 0.00 0.00 175.52 176.37 3hws h THR 147 N 0.03 1.24 -0.05 6.82 1.35 -1.91 -3.20 112.91 117.20 3hws h THR 147 Ca -0.00 -1.12 -0.04 0.00 -0.55 0.00 0.00 66.41 64.70 3hws h THR 147 Cb 1.00 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 3hws h THR 147 CO 0.07 0.36 -0.11 -0.07 -0.25 0.00 0.00 175.52 175.53 3hws h LEU 148 N 0.45 0.18-10.27 3.87 3.38 -1.59 -3.47 115.31 107.86 3hws h LEU 148 Ca 0.08 -0.58 -0.52 0.00 0.09 0.00 0.00 57.88 56.94 3hws h LEU 148 Cb 0.57 -0.05 0.20 0.00 0.09 0.00 0.00 40.66 41.46 3hws h LEU 148 CO 0.04 0.73 0.21 1.07 0.09 0.00 0.00 178.44 180.58 3hws n THR 149 N -4.66 0.00 -1.51 0.22 5.66 -1.08 -3.76 114.28 109.15 3hws n THR 149 Ca -0.08 -0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.83 3hws n THR 149 Cb 0.36 -1.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.12 3hws n THR 149 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 3hws n GLU 150 N -4.26 -0.60 -3.72 1.09 4.71 -1.26 -5.00 120.64 111.59 3hws n GLU 150 Ca 0.12 0.67 -0.12 0.00 -0.01 0.00 0.00 57.16 57.82 3hws n GLU 150 Cb 0.52 -4.56 -0.07 0.00 -1.01 0.00 0.00 31.44 26.32 3hws n GLU 150 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3hws s ALA 151 N -2.34 -0.81 -0.33 0.62 0.00 -1.25 -5.02 121.76 112.63 3hws s ALA 151 Ca 0.00 0.14 0.22 0.00 0.00 0.00 0.00 51.96 52.32 3hws s ALA 151 Cb 0.00 0.31 0.18 0.00 0.00 0.00 0.00 23.12 23.61 3hws s ALA 151 CO 0.00 -0.42 1.38 0.78 0.00 0.00 0.00 175.76 177.50 3hws h GLY 152 N 3.18 0.00 -0.33 0.00 0.00 -1.95 -3.29 103.07 100.68 3hws h GLY 152 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3hws h GLY 152 CO 0.45 0.00 0.00 1.58 0.00 0.00 0.00 176.54 178.57 3hws n TYR 153 N -2.98 0.16 -0.27 5.60 4.11 -1.26 -3.85 117.16 118.67 3hws n TYR 153 Ca 0.02 -0.08 -0.05 0.00 -0.00 0.00 0.00 57.90 57.79 3hws n TYR 153 Cb 0.58 0.00 0.06 0.00 -0.00 0.00 0.00 39.34 39.98 3hws n TYR 153 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.86 176.62 3hws h VAL 154 N 0.98 1.21 -0.78 -3.48 3.04 -1.75 -1.23 116.25 114.24 3hws h VAL 154 Ca 0.00 -0.49 0.03 0.00 -1.01 0.00 0.00 66.70 65.22 3hws h VAL 154 Cb 0.22 0.22 -0.04 0.00 -2.01 0.00 0.00 31.29 29.67 3hws h VAL 154 CO 0.00 0.23 0.51 1.23 -1.01 0.00 0.00 177.57 178.53 3hws h GLY 155 N 1.00 1.09 1.52 3.17 0.00 -1.87 -0.64 103.07 107.34 3hws h GLY 155 Ca 0.26 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 47.07 3hws h GLY 155 CO -0.05 0.34 -0.47 1.05 0.00 0.00 0.00 176.54 177.42 3hws h GLU 156 N 0.98 0.52 0.00 4.80 4.11 -1.69 -2.86 114.58 120.43 3hws h GLU 156 Ca 0.30 -0.29 -0.03 0.00 0.07 0.00 0.00 59.36 59.41 3hws h GLU 156 Cb 0.01 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3hws h GLU 156 CO -0.08 0.88 -0.16 0.38 0.07 0.00 0.00 179.01 180.09 3hws h ASP 157 N 0.41 0.00 -0.52 3.06 -0.00 -0.03 -1.76 116.42 117.58 3hws h ASP 157 Ca 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.04 3hws h ASP 157 Cb 0.98 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.28 3hws h ASP 157 CO 0.09 0.16 0.29 0.58 -0.00 0.00 0.00 179.24 180.35 3hws h VAL 158 N 0.00 1.18 -0.09 4.15 2.07 -0.93 0.61 116.25 123.23 3hws h VAL 158 Ca -0.00 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.02 3hws h VAL 158 Cb 0.55 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3hws h VAL 158 CO 0.02 0.19 -0.21 -0.33 0.02 0.00 0.00 177.57 177.26 3hws h GLU 159 N 0.69 0.15 -0.60 1.57 5.08 -1.43 -2.34 114.58 117.71 3hws h GLU 159 Ca 0.18 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 3hws h GLU 159 Cb 0.04 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3hws h GLU 159 CO -0.03 0.37 0.25 -0.91 -1.00 0.00 0.00 179.01 177.69 3hws h ASN 160 N 0.14 0.79 -0.48 1.42 2.35 -0.30 -0.03 115.58 119.48 3hws h ASN 160 Ca 0.03 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 3hws h ASN 160 Cb 0.46 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 3hws h ASN 160 CO 0.03 0.70 0.11 0.40 -1.65 0.00 0.00 177.43 177.01 3hws h ILE 161 N 0.86 1.24 -0.84 2.81 2.04 -0.41 -0.93 117.51 122.28 3hws h ILE 161 Ca 0.21 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 3hws h ILE 161 Cb 0.15 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3hws h ILE 161 CO -0.02 0.30 0.43 0.40 0.00 0.00 0.00 178.15 179.26 3hws h ILE 162 N 0.65 1.25 -0.32 -0.67 1.08 -1.18 -1.83 117.51 116.50 3hws h ILE 162 Ca 0.15 -0.68 0.02 0.00 -0.39 0.00 0.00 64.86 63.96 3hws h ILE 162 Cb 0.34 0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 3hws h ILE 162 CO 0.00 0.30 0.17 -0.61 -0.69 0.00 0.00 178.15 177.32 3hws h GLN 163 N 1.18 0.34 -0.93 2.37 4.15 -0.70 -1.48 115.11 120.04 3hws h GLN 163 Ca 0.29 -0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.78 3hws h GLN 163 Cb 0.08 -0.08 -0.07 0.00 0.21 0.00 0.00 27.48 27.62 3hws h GLN 163 CO -0.04 0.22 0.58 0.87 -1.93 0.00 0.00 178.83 178.53 3hws h LYS 164 N 0.35 0.96 -0.21 1.69 1.57 -0.69 -0.62 116.57 119.62 3hws h LYS 164 Ca 0.13 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 3hws h LYS 164 Cb 0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 3hws h LYS 164 CO -0.08 0.64 -0.30 1.25 -0.57 0.00 0.00 179.45 180.39 3hws h LEU 165 N 0.99 0.42 -0.57 2.94 5.85 -0.90 -2.84 115.31 121.20 3hws h LEU 165 Ca 0.43 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.86 3hws h LEU 165 Cb 0.31 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3hws h LEU 165 CO -0.22 0.71 -0.41 -0.07 -0.34 0.00 0.00 178.44 178.11 3hws h LEU 166 N 0.36 0.73 0.50 2.25 3.38 -0.12 -2.26 115.31 120.15 3hws h LEU 166 Ca 0.05 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3hws h LEU 166 Cb 0.71 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3hws h LEU 166 CO 0.05 1.05 -0.37 -0.61 0.09 0.00 0.00 178.44 178.65 3hws h GLN 167 N 0.56 -0.82 0.00 1.13 4.15 -0.95 0.90 115.11 120.07 3hws h GLN 167 Ca 0.04 0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3hws h GLN 167 Cb 0.94 0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.82 3hws h GLN 167 CO 0.09 -0.55 0.00 -0.22 -1.93 0.00 0.00 178.83 176.22 3hws h LYS 168 N -0.85 0.00 -0.01 1.69 1.63 -1.59 -2.01 116.57 115.43 3hws h LYS 168 Ca -0.05 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 3hws h LYS 168 Cb 0.72 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 3hws h LYS 168 CO 0.02 0.00 -0.19 0.00 -3.45 0.00 0.00 179.45 175.82 3hws n ASP 170 N -0.62 -2.95 -0.54 0.00 9.92 -0.24 -2.93 116.55 119.18 3hws n ASP 170 Ca 0.14 0.00 -0.06 0.00 -0.53 0.00 0.00 54.79 54.34 3hws n ASP 170 Cb 0.33 -0.95 -0.01 0.00 -0.64 0.00 0.00 41.12 39.85 3hws n ASP 170 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 3hws n TYR 171 N -2.68 -0.13 -2.82 1.24 4.02 0.30 -4.98 117.16 112.10 3hws n TYR 171 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 3hws n TYR 171 Cb 0.08 -1.56 -0.04 0.00 -0.02 0.00 0.00 39.34 37.80 3hws n TYR 171 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3hws s ASP 172 N -2.84 6.17 0.27 7.72 -1.08 -1.15 -4.92 116.67 120.84 3hws s ASP 172 Ca 0.00 -0.92 0.01 0.00 -0.52 0.00 0.00 52.55 51.12 3hws s ASP 172 Cb 0.00 -2.44 0.59 0.00 -1.46 0.00 0.00 42.92 39.62 3hws s ASP 172 CO 0.00 -1.49 1.77 0.58 0.52 0.00 0.00 175.17 176.55 3hws h VAL 173 N 5.98 0.73 -0.47 1.11 2.07 -1.94 -0.11 116.25 123.61 3hws h VAL 173 Ca -0.29 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 3hws h VAL 173 Cb 1.07 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3hws h VAL 173 CO 1.19 0.12 0.17 1.56 0.02 0.00 0.00 177.57 180.64 3hws h GLN 174 N 0.68 0.72 -0.14 1.57 7.50 -1.99 -1.33 115.11 122.12 3hws h GLN 174 Ca 0.50 -0.14 -0.07 0.00 0.50 0.00 0.00 58.65 59.44 3hws h GLN 174 Cb 0.72 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 28.12 3hws h GLN 174 CO -0.37 0.66 -0.23 0.87 -1.50 0.00 0.00 178.83 178.26 3hws h LYS 175 N 0.63 0.25 -0.23 1.46 1.79 -1.57 -2.82 116.57 116.07 3hws h LYS 175 Ca 0.16 -0.08 -0.15 0.00 -2.18 0.00 0.00 60.65 58.40 3hws h LYS 175 Cb 0.22 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3hws h LYS 175 CO -0.01 0.47 -0.49 0.00 -1.08 0.00 0.00 179.45 178.35 3hws h ALA 176 N 1.54 0.72 0.00 3.86 0.00 -0.61 -2.63 119.26 122.14 3hws h ALA 176 Ca 0.04 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 3hws h ALA 176 Cb 0.54 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3hws h ALA 176 CO 0.04 0.67 -0.03 1.96 0.00 0.00 0.00 179.25 181.89 3hws h GLN 177 N 0.48 0.00 -0.00 0.00 4.20 -1.03 -1.58 115.11 117.18 3hws h GLN 177 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3hws h GLN 177 Cb 1.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.81 3hws h GLN 177 CO 0.10 0.03 -0.35 0.54 -0.67 0.00 0.00 178.83 178.47 3hws n ARG 178 N -3.13 0.42 -0.66 1.46 1.74 -1.08 -2.26 116.66 113.16 3hws n ARG 178 Ca 0.01 -0.24 -0.30 0.00 -0.77 0.00 0.00 57.85 56.55 3hws n ARG 178 Cb 0.36 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.57 3hws n ARG 178 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3hws s GLY 179 N -2.74 1.49 -0.03 -0.13 0.00 -0.59 -4.78 107.32 100.53 3hws s GLY 179 Ca 0.18 -0.79 0.05 0.00 0.00 0.00 0.00 44.72 44.16 3hws s GLY 179 CO 0.60 0.14 -0.16 -0.42 0.00 0.00 0.00 173.10 173.26 3hws s ILE 180 N -2.57 1.33 -0.10 0.90 1.01 -0.10 -2.78 121.20 118.89 3hws s ILE 180 Ca 0.69 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 60.69 3hws s ILE 180 Cb -0.13 -1.12 0.00 0.00 0.01 0.00 0.00 42.46 41.22 3hws s ILE 180 CO 0.58 0.38 -0.23 -0.69 0.00 0.00 0.00 174.94 174.98 3hws s VAL 181 N -0.18 2.00 -0.20 2.92 1.01 -0.56 -2.05 120.40 123.34 3hws s VAL 181 Ca 0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 3hws s VAL 181 Cb -0.09 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 3hws s VAL 181 CO 0.01 0.55 -0.06 -0.47 0.00 0.00 0.00 175.10 175.12 3hws s TYR 182 N 0.42 2.93 -0.27 5.22 5.04 -0.70 -0.56 117.35 129.43 3hws s TYR 182 Ca -0.17 -0.91 -0.08 0.00 -2.44 0.00 0.00 57.07 53.46 3hws s TYR 182 Cb -0.18 -2.05 -0.02 0.00 0.35 0.00 0.00 41.96 40.06 3hws s TYR 182 CO 0.07 -0.50 0.10 0.42 -1.34 0.00 0.00 175.55 174.31 3hws s ILE 183 N 1.26 4.40 0.26 3.14 1.09 0.35 -0.21 121.20 131.49 3hws s ILE 183 Ca 0.03 -0.29 -0.04 0.00 -1.10 0.00 0.00 60.65 59.25 3hws s ILE 183 Cb -0.14 -3.14 -0.05 0.00 -1.06 0.00 0.00 42.46 38.07 3hws s ILE 183 CO -0.02 0.23 0.51 -0.62 -0.10 0.00 0.00 174.94 174.94 3hws s ASP 184 N 1.61 6.45 -1.08 3.58 2.15 -0.11 -0.87 116.67 128.39 3hws s ASP 184 Ca 0.05 0.66 -0.07 0.00 0.43 0.00 0.00 52.55 53.63 3hws s ASP 184 Cb -0.16 -2.12 0.01 0.00 -0.30 0.00 0.00 42.92 40.35 3hws s ASP 184 CO 0.05 -0.15 0.90 0.00 -0.17 0.00 0.00 175.17 175.80 3hws n GLN 185 N -0.78 -6.12 -0.10 4.34 6.02 -0.54 -1.69 117.38 118.52 3hws n GLN 185 Ca -0.02 0.66 -0.01 0.00 -0.01 0.00 0.00 57.00 57.62 3hws n GLN 185 Cb 0.54 -5.17 0.25 0.00 1.02 0.00 0.00 30.24 26.88 3hws n GLN 185 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3hws h ILE 186 N -2.06 1.20 -0.04 5.09 1.08 -1.62 -2.30 117.51 118.85 3hws h ILE 186 Ca -0.45 -0.66 0.01 0.00 -0.39 0.00 0.00 64.86 63.37 3hws h ILE 186 Cb 1.29 0.63 -0.00 0.00 -3.07 0.00 0.00 36.82 35.67 3hws h ILE 186 CO 0.44 0.25 0.03 -2.24 -0.69 0.00 0.00 178.15 175.95 3hws h ASP 187 N 0.73 0.00 0.74 1.72 2.03 -1.91 -2.45 116.42 117.29 3hws h ASP 187 Ca 0.17 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.41 3hws h ASP 187 Cb 0.20 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.69 3hws h ASP 187 CO -0.01 0.00 -0.30 0.11 -1.03 0.00 0.00 179.24 178.01 3hws h LYS 188 N 0.00 0.00 0.00 4.15 1.79 -1.79 -3.15 116.57 117.56 3hws h LYS 188 Ca 0.02 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.43 3hws h LYS 188 Cb 0.09 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 3hws h LYS 188 CO -0.00 0.30 -0.25 -0.84 -1.08 0.00 0.00 179.45 177.57 3hws h ILE 189 N 0.00 0.48 -3.97 1.86 3.07 -1.56 -3.44 117.51 113.95 3hws h ILE 189 Ca -0.00 -1.47 -0.45 0.00 1.55 0.00 0.00 64.86 64.48 3hws h ILE 189 Cb 0.75 2.07 -0.02 0.00 -0.27 0.00 0.00 36.82 39.35 3hws h ILE 189 CO 0.04 0.25 0.29 -0.94 -1.05 0.00 0.00 178.15 176.74 3hws s SER 190 N -6.27 6.95 0.00 2.16 1.04 -1.19 -3.35 113.70 113.04 3hws s SER 190 Ca 0.04 1.62 0.00 0.00 0.48 0.00 0.00 55.95 58.09 3hws s SER 190 Cb 0.08 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.69 3hws s SER 190 CO 0.68 -0.29 0.00 -1.14 0.98 0.00 0.00 173.24 173.47 3hws n ARG 191 N -0.44 0.00 0.00 4.02 0.63 -1.26 -5.00 116.66 114.61 3hws n ARG 191 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 3hws n ARG 191 Cb 0.53 -1.09 0.00 0.00 0.45 0.00 0.00 32.46 32.35 3hws n ARG 191 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3hws n GLU 205 N 1.26 0.00 0.11 -0.14 1.02 -1.21 -5.11 120.64 116.56 3hws n GLU 205 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 3hws n GLU 205 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.49 3hws n GLU 205 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3hws h GLY 206 N 0.00 0.00 2.00 0.62 0.00 -1.99 -1.94 103.07 101.75 3hws h GLY 206 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3hws h GLY 206 CO 0.00 0.00 -0.15 -2.08 0.00 0.00 0.00 176.54 174.31 3hws h VAL 207 N 0.00 0.45 -0.26 4.60 2.07 -1.95 -0.93 116.25 120.23 3hws h VAL 207 Ca -0.01 -0.81 -0.13 0.00 0.82 0.00 0.00 66.70 66.57 3hws h VAL 207 Cb 1.34 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 3hws h VAL 207 CO 0.10 0.15 -0.38 1.56 0.02 0.00 0.00 177.57 179.02 3hws h GLN 208 N 0.00 0.60 -0.46 1.57 4.20 -1.76 1.01 115.11 120.28 3hws h GLN 208 Ca -0.00 -0.29 -0.08 0.00 0.06 0.00 0.00 58.65 58.33 3hws h GLN 208 Cb 0.56 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 3hws h GLN 208 CO 0.02 0.88 -0.02 1.96 -0.67 0.00 0.00 178.83 181.00 3hws h GLN 209 N 0.50 0.83 -0.31 1.46 1.08 -0.93 0.42 115.11 118.16 3hws h GLN 209 Ca 0.05 -0.27 -0.14 0.00 -1.45 0.00 0.00 58.65 56.83 3hws h GLN 209 Cb 0.88 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.24 3hws h GLN 209 CO 0.08 0.89 -0.37 0.00 -0.95 0.00 0.00 178.83 178.48 3hws h ALA 210 N 0.91 0.46 -0.57 3.87 0.00 -0.89 -1.40 119.26 121.63 3hws h ALA 210 Ca 0.13 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 3hws h ALA 210 Cb 0.53 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3hws h ALA 210 CO 0.03 0.54 0.11 -0.07 0.00 0.00 0.00 179.25 179.86 3hws h LEU 211 N 0.56 0.90 0.44 0.00 4.07 0.11 -1.78 115.31 119.60 3hws h LEU 211 Ca 0.04 -0.25 -0.01 0.00 0.08 0.00 0.00 57.88 57.74 3hws h LEU 211 Cb 0.96 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.44 3hws h LEU 211 CO 0.09 0.92 -0.39 0.25 -1.08 0.00 0.00 178.44 178.23 3hws h LEU 212 N 0.84 -1.03 -1.14 1.67 5.85 -0.01 0.69 115.31 122.18 3hws h LEU 212 Ca 0.18 0.08 0.18 0.00 0.84 0.00 0.00 57.88 59.16 3hws h LEU 212 Cb 0.39 0.34 -0.09 0.00 0.37 0.00 0.00 40.66 41.66 3hws h LEU 212 CO 0.01 -0.55 0.61 0.50 -0.34 0.00 0.00 178.44 178.67 3hws h LYS 213 N -0.83 0.69 -0.21 1.25 3.64 -1.21 0.69 116.57 120.60 3hws h LYS 213 Ca -0.04 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 3hws h LYS 213 Cb 0.72 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 3hws h LYS 213 CO -0.03 0.46 -0.14 1.25 -2.27 0.00 0.00 179.45 178.71 3hws h LEU 214 N 0.71 0.49 -0.40 5.20 5.85 -0.63 -2.68 115.31 123.86 3hws h LEU 214 Ca 0.53 -0.44 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3hws h LEU 214 Cb 0.89 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3hws h LEU 214 CO -0.30 0.82 0.15 0.40 -0.34 0.00 0.00 178.44 179.17 3hws h ILE 215 N 0.16 1.20 -0.23 4.05 1.08 0.23 -3.13 117.51 120.88 3hws h ILE 215 Ca 0.04 -0.63 0.06 0.00 -0.39 0.00 0.00 64.86 63.94 3hws h ILE 215 Cb 0.66 0.87 -0.06 0.00 -3.07 0.00 0.00 36.82 35.21 3hws h ILE 215 CO 0.04 0.23 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.20 3hws h GLU 216 N 0.50 -0.19 0.00 2.37 4.39 0.30 -3.44 114.58 118.50 3hws h GLU 216 Ca 0.13 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3hws h GLU 216 Cb 0.21 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3hws h GLU 216 CO -0.01 -0.13 0.00 0.41 -1.16 0.00 0.00 179.01 178.12 3hws n GLY 217 N -1.34 3.02 0.00 -3.84 0.00 -1.01 -4.56 105.19 97.45 3hws n GLY 217 Ca -0.01 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3hws n GLY 217 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hws n THR 218 N 1.00 0.00 -2.40 2.61 -2.24 -1.26 -4.75 114.28 107.24 3hws n THR 218 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 3hws n THR 218 Cb 0.00 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.21 3hws n THR 218 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3hws s ARG 228 N 0.95 3.85 -0.10 -0.78 3.52 -1.26 -4.40 118.95 120.73 3hws s ARG 228 Ca 0.00 1.21 -0.04 0.00 -0.13 0.00 0.00 55.73 56.77 3hws s ARG 228 Cb 0.00 -3.91 0.05 0.00 -1.56 0.00 0.00 34.95 29.53 3hws s ARG 228 CO 0.00 -1.21 0.21 0.15 -0.81 0.00 0.00 175.30 173.64 3hws s LYS 229 N 4.32 0.11 0.24 5.12 1.02 -1.26 -5.02 119.74 124.27 3hws s LYS 229 Ca 0.58 0.59 -0.06 0.00 0.02 0.00 0.00 55.97 57.10 3hws s LYS 229 Cb -0.16 -0.16 0.25 0.00 -0.52 0.00 0.00 37.83 37.24 3hws s LYS 229 CO 0.25 -0.26 1.87 1.12 -0.92 0.00 0.00 175.35 177.41 3hws h HIS 230 N 8.00 1.20 -1.74 3.18 -0.00 -2.09 -3.44 115.15 120.26 3hws h HIS 230 Ca -0.22 -0.03 -0.14 0.00 -0.00 0.00 0.00 60.37 59.98 3hws h HIS 230 Cb 1.12 -0.38 0.08 0.00 -0.00 0.00 0.00 27.41 28.23 3hws h HIS 230 CO 0.40 0.83 -0.06 -0.35 -0.00 0.00 0.00 177.93 178.74 3hws n PRO 231 N -4.33 -3.08 0.07 5.12 -0.04 -1.26 -4.87 135.00 126.61 3hws n PRO 231 Ca 0.09 -0.55 0.10 0.00 -0.04 0.00 0.00 63.50 63.10 3hws n PRO 231 Cb 0.10 -0.72 0.43 0.00 -0.04 0.00 0.00 33.50 33.27 3hws n PRO 231 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3hws n GLN 232 N -3.44 0.12 0.00 0.54 6.02 -1.26 -4.92 117.38 114.44 3hws n GLN 232 Ca 0.05 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 3hws n GLN 232 Cb 0.23 -1.71 0.00 0.00 1.02 0.00 0.00 30.24 29.78 3hws n GLN 232 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hws n GLN 233 N -1.93 0.00 -1.83 -1.09 -0.00 -1.26 -1.54 117.38 109.73 3hws n GLN 233 Ca 0.03 0.00 -0.42 0.00 -0.00 0.00 0.00 57.00 56.62 3hws n GLN 233 Cb 0.24 0.00 -0.00 0.00 -0.00 0.00 0.00 30.24 30.48 3hws n GLN 233 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 3hws n GLU 234 N 12.16 3.28 0.22 2.61 -0.58 -1.26 -4.68 120.64 132.39 3hws n GLU 234 Ca 0.00 -2.83 0.10 0.00 -0.42 0.00 0.00 57.16 54.02 3hws n GLU 234 Cb 0.00 -3.08 0.66 0.00 -0.57 0.00 0.00 31.44 28.45 3hws n GLU 234 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 3hws h PHE 235 N 5.69 0.00 -0.09 -0.32 -0.00 -1.68 -1.80 116.94 118.74 3hws h PHE 235 Ca 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.55 3hws h PHE 235 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.51 3hws h PHE 235 CO 1.48 0.00 0.00 -0.11 -0.00 0.00 0.00 178.31 179.68 3hws n LEU 236 N -4.48 1.33 0.24 2.10 7.94 -1.26 -3.72 117.00 119.15 3hws n LEU 236 Ca -0.01 -0.51 0.18 0.00 -1.11 0.00 0.00 56.01 54.56 3hws n LEU 236 Cb 0.18 -0.05 0.88 0.00 0.53 0.00 0.00 43.42 44.95 3hws n LEU 236 CO 0.34 0.26 1.15 1.56 -1.11 0.00 0.00 177.39 179.59 3hws h GLN 237 N 1.89 0.00 -6.09 1.96 7.50 -1.71 -3.39 115.11 115.26 3hws h GLN 237 Ca 0.00 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 3hws h GLN 237 Cb 0.41 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.89 3hws h GLN 237 CO 0.00 0.00 0.26 0.54 -1.50 0.00 0.00 178.83 178.13 3hws s VAL 238 N -4.50 4.95 0.06 -0.54 0.11 -1.24 -5.07 120.40 114.17 3hws s VAL 238 Ca -0.05 1.65 0.01 0.00 -2.93 0.00 0.00 61.98 60.67 3hws s VAL 238 Cb 0.14 -4.14 -0.04 0.00 -1.53 0.00 0.00 36.38 30.81 3hws s VAL 238 CO 0.49 0.15 0.16 1.51 -3.33 0.00 0.00 175.10 174.09 3hws s ASP 239 N 0.97 6.07 0.00 3.54 -4.77 -1.26 -5.00 116.67 116.21 3hws s ASP 239 Ca 0.41 0.18 0.29 0.00 -3.30 0.00 0.00 52.55 50.14 3hws s ASP 239 Cb -0.18 -1.80 1.36 0.00 -1.09 0.00 0.00 42.92 41.21 3hws s ASP 239 CO 0.18 0.18 1.95 0.35 0.70 0.00 0.00 175.17 178.53 3hws n THR 240 N 0.42 0.00 -0.14 2.11 -2.24 -1.26 -3.87 114.28 109.31 3hws n THR 240 Ca -0.07 -0.03 -0.05 0.00 -2.27 0.00 0.00 64.05 61.63 3hws n THR 240 Cb 0.51 -0.27 0.03 0.00 -2.10 0.00 0.00 70.33 68.50 3hws n THR 240 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3hws h SER 241 N 0.30 0.27 0.70 3.42 0.87 -1.83 -2.90 113.55 114.38 3hws h SER 241 Ca 0.00 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.48 3hws h SER 241 Cb 0.32 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 3hws h SER 241 CO 0.00 0.20 -0.52 0.11 -0.53 0.00 0.00 176.83 176.09 3hws h LYS 242 N 0.40 0.00 -6.95 2.24 1.79 -1.80 -3.45 116.57 108.80 3hws h LYS 242 Ca 0.19 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.15 3hws h LYS 242 Cb 0.13 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 30.84 3hws h LYS 242 CO -0.15 0.52 0.53 0.42 -1.08 0.00 0.00 179.45 179.68 3hws s ILE 243 N -3.62 3.02 -0.25 1.86 1.01 -0.96 -4.67 121.20 117.59 3hws s ILE 243 Ca -0.01 0.86 -0.17 0.00 0.00 0.00 0.00 60.65 61.33 3hws s ILE 243 Cb 0.12 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 3hws s ILE 243 CO 0.73 0.08 0.45 -0.22 0.00 0.00 0.00 174.94 175.98 3hws s LEU 244 N -2.54 4.07 -0.23 2.97 2.96 -1.12 -5.00 118.68 119.80 3hws s LEU 244 Ca 0.58 0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 54.87 3hws s LEU 244 Cb -0.32 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.76 3hws s LEU 244 CO 0.41 -0.21 0.09 -0.36 -1.32 0.00 0.00 176.35 174.96 3hws s PHE 245 N 2.00 3.19 -0.17 5.38 0.40 -1.26 -1.49 117.98 126.03 3hws s PHE 245 Ca 0.19 -0.09 -0.02 0.00 -0.60 0.00 0.00 56.93 56.42 3hws s PHE 245 Cb -0.15 -2.20 -0.01 0.00 0.51 0.00 0.00 43.02 41.17 3hws s PHE 245 CO 0.09 -0.09 -0.10 0.42 0.70 0.00 0.00 175.22 176.25 3hws s ILE 246 N 1.08 3.15 -0.20 0.64 1.01 0.28 -1.74 121.20 125.42 3hws s ILE 246 Ca 0.05 -0.60 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 3hws s ILE 246 Cb -0.14 -2.37 0.00 0.00 0.01 0.00 0.00 42.46 39.97 3hws s ILE 246 CO 0.04 0.49 -0.12 0.00 0.00 0.00 0.00 174.94 175.34 3hws s GLY 248 N 1.35 1.98 -0.11 0.00 0.00 -0.05 0.10 107.32 110.59 3hws s GLY 248 Ca 0.05 -1.03 -0.30 0.00 0.00 0.00 0.00 44.72 43.44 3hws s GLY 248 CO -0.07 -0.99 0.87 -0.32 0.00 0.00 0.00 173.10 172.59 3hws s GLY 249 N -2.24 -0.39 0.07 0.20 0.00 -0.32 -1.47 107.32 103.17 3hws s GLY 249 Ca 0.27 1.72 0.09 0.00 0.00 0.00 0.00 44.72 46.80 3hws s GLY 249 CO 0.19 0.98 1.08 0.00 0.00 0.00 0.00 173.10 175.35 3hws h ALA 250 N 2.70 0.50 -6.55 3.20 0.00 -1.87 -2.24 119.26 115.01 3hws h ALA 250 Ca -0.22 -1.08 -0.47 0.00 0.00 0.00 0.00 54.91 53.15 3hws h ALA 250 Cb 1.16 0.06 0.02 0.00 0.00 0.00 0.00 17.79 19.02 3hws h ALA 250 CO 0.34 1.34 -0.93 1.19 0.00 0.00 0.00 179.25 181.19 3hws n PHE 251 N -3.24 -1.87 -0.31 0.00 3.01 -1.26 -4.56 117.46 109.23 3hws n PHE 251 Ca -0.05 0.49 -0.01 0.00 1.01 0.00 0.00 57.45 58.89 3hws n PHE 251 Cb 0.97 -3.07 0.11 0.00 -0.01 0.00 0.00 39.48 37.48 3hws n PHE 251 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hws h ALA 252 N 1.21 1.13 0.00 4.37 0.00 -1.97 -2.25 119.26 121.76 3hws h ALA 252 Ca -0.62 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.24 3hws h ALA 252 Cb 1.36 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hws h ALA 252 CO 0.44 0.38 -0.10 0.78 0.00 0.00 0.00 179.25 180.75 3hws h GLY 253 N 1.06 0.00 1.61 0.00 0.00 -2.01 -3.32 103.07 100.42 3hws h GLY 253 Ca 0.34 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.71 3hws h GLY 253 CO -0.12 0.00 0.18 -2.00 0.00 0.00 0.00 176.54 174.60 3hws h LEU 254 N 0.00 0.16 -1.63 3.11 5.85 -1.75 -1.79 115.31 119.26 3hws h LEU 254 Ca -0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hws h LEU 254 Cb 1.02 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3hws h LEU 254 CO 0.01 0.11 0.22 -2.24 -0.34 0.00 0.00 178.44 176.20 3hws h ASP 255 N 0.18 0.41 0.02 1.25 3.04 -1.68 -2.40 116.42 117.24 3hws h ASP 255 Ca 0.11 -0.01 -0.18 0.00 -3.24 0.00 0.00 57.03 53.71 3hws h ASP 255 Cb 0.22 -0.10 0.02 0.00 -1.04 0.00 0.00 39.33 38.42 3hws h ASP 255 CO -0.02 0.31 -0.71 0.11 -2.04 0.00 0.00 179.24 176.89 3hws h LYS 256 N 0.48 0.45 -0.72 4.15 1.57 -1.58 -3.03 116.57 117.89 3hws h LYS 256 Ca 0.13 -0.51 0.07 0.00 -1.87 0.00 0.00 60.65 58.47 3hws h LYS 256 Cb -0.03 0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.39 3hws h LYS 256 CO -0.03 1.16 0.47 0.28 -0.57 0.00 0.00 179.45 180.77 3hws h VAL 257 N -0.05 1.00 -0.17 0.50 2.07 -1.40 -0.96 116.25 117.24 3hws h VAL 257 Ca -0.09 -0.25 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 3hws h VAL 257 Cb 1.43 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3hws h VAL 257 CO 0.14 0.13 -0.57 0.40 0.02 0.00 0.00 177.57 177.69 3hws h ILE 258 N 0.72 1.33 -0.20 4.57 2.04 -1.49 -3.10 117.51 121.38 3hws h ILE 258 Ca 0.31 -1.83 -0.11 0.00 1.00 0.00 0.00 64.86 64.23 3hws h ILE 258 Cb 0.30 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 3hws h ILE 258 CO -0.11 0.57 -0.36 0.28 0.00 0.00 0.00 178.15 178.54 3hws h SER 259 N 0.42 0.44 0.61 1.72 0.02 -1.12 -2.59 113.55 113.06 3hws h SER 259 Ca 0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3hws h SER 259 Cb 1.12 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3hws h SER 259 CO 0.11 0.77 0.00 0.45 -1.14 0.00 0.00 176.83 177.01 3hws h HIS 260 N 0.36 0.00 0.00 3.45 3.86 -1.15 -2.56 115.15 119.12 3hws h HIS 260 Ca 0.04 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.08 3hws h HIS 260 Cb 0.80 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.23 3hws h HIS 260 CO 0.02 0.00 -2.11 2.89 0.86 0.00 0.00 177.93 179.60 3hws n ARG 261 N -2.93 0.67 0.05 2.45 1.85 -1.05 -4.38 116.66 113.31 3hws n ARG 261 Ca -0.00 -0.08 -0.20 0.00 -1.00 0.00 0.00 57.85 56.57 3hws n ARG 261 Cb 0.21 -1.55 -0.10 0.00 -1.05 0.00 0.00 32.46 29.97 3hws n ARG 261 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 3hws h VAL 262 N 0.00 1.29 -4.05 8.89 2.07 -1.24 -3.45 116.25 119.76 3hws h VAL 262 Ca -0.25 -2.27 -0.55 0.00 0.82 0.00 0.00 66.70 64.45 3hws h VAL 262 Cb 1.58 2.39 0.14 0.00 -1.52 0.00 0.00 31.29 33.88 3hws h VAL 262 CO 0.02 0.70 0.61 -1.61 0.02 0.00 0.00 177.57 177.31 3hws s GLU 263 N -3.31 3.16 -0.01 1.57 8.01 -0.98 -5.12 118.70 122.03 3hws s GLU 263 Ca -0.09 2.24 0.03 0.00 0.01 0.00 0.00 54.97 57.15 3hws s GLU 263 Cb 0.07 -2.27 0.10 0.00 -4.31 0.00 0.00 34.13 27.71 3hws s GLU 263 CO 0.92 -1.17 1.02 2.41 0.01 0.00 0.00 175.26 178.44 3hws n THR 264 N -1.00 0.18 0.00 3.63 -1.04 -1.26 -5.00 114.28 109.79 3hws n THR 264 Ca 0.10 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 3hws n THR 264 Cb 0.45 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 3hws n THR 264 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hws n ALA 281 N -0.15 0.00 -0.05 2.41 0.00 -1.26 -5.23 120.51 116.22 3hws n ALA 281 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.47 3hws n ALA 281 Cb 0.13 0.00 0.27 0.00 0.00 0.00 0.00 19.45 19.85 3hws n ALA 281 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hws h SER 282 N 0.00 0.60 -0.62 0.00 0.87 -2.01 -1.21 113.55 111.19 3hws h SER 282 Ca 0.00 -0.10 -0.08 0.00 -1.23 0.00 0.00 61.79 60.38 3hws h SER 282 Cb 0.00 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 3hws h SER 282 CO 0.00 0.61 0.07 -0.08 -0.53 0.00 0.00 176.83 176.91 3hws h GLU 283 N 0.63 1.06 -0.62 2.24 4.81 -2.00 -2.98 114.58 117.72 3hws h GLU 283 Ca 0.14 -0.29 0.06 0.00 -0.13 0.00 0.00 59.36 59.14 3hws h GLU 283 Cb 0.26 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 3hws h GLU 283 CO -0.00 0.99 0.41 0.78 -0.73 0.00 0.00 179.01 180.46 3hws h GLY 284 N 1.03 0.75 2.00 1.92 0.00 -1.56 0.08 103.07 107.29 3hws h GLY 284 Ca 0.19 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 3hws h GLY 284 CO 0.02 0.18 -0.17 0.83 0.00 0.00 0.00 176.54 177.40 3hws h GLU 285 N 0.59 0.00 0.12 4.80 5.08 -1.28 -0.34 114.58 123.55 3hws h GLU 285 Ca 0.27 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.35 3hws h GLU 285 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3hws h GLU 285 CO -0.08 0.17 -1.29 1.25 -1.00 0.00 0.00 179.01 178.06 3hws h LEU 286 N 0.00 0.39 -0.74 1.33 5.85 -1.07 -3.31 115.31 117.76 3hws h LEU 286 Ca -0.00 -0.44 -0.08 0.00 0.84 0.00 0.00 57.88 58.19 3hws h LEU 286 Cb 0.43 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3hws h LEU 286 CO 0.02 1.35 -0.40 -0.07 -0.34 0.00 0.00 178.44 179.00 3hws h LEU 287 N 0.07 0.00 -1.54 2.25 3.38 -0.34 -2.99 115.31 116.14 3hws h LEU 287 Ca -0.15 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 3hws h LEU 287 Cb 1.97 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.71 3hws h LEU 287 CO 0.19 0.40 -0.22 0.00 0.09 0.00 0.00 178.44 178.89 3hws h ALA 288 N 1.60 1.62 -0.04 1.53 0.00 -1.19 -1.95 119.26 120.84 3hws h ALA 288 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3hws h ALA 288 Cb 1.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3hws h ALA 288 CO 0.05 0.29 0.00 1.04 0.00 0.00 0.00 179.25 180.63 3hws n GLN 289 N -4.27 1.17 -1.81 0.00 1.13 -1.13 -4.91 117.38 107.57 3hws n GLN 289 Ca -0.02 -0.26 -0.41 0.00 -1.94 0.00 0.00 57.00 54.36 3hws n GLN 289 Cb 0.28 -1.33 -0.01 0.00 0.11 0.00 0.00 30.24 29.30 3hws n GLN 289 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3hws s VAL 290 N -1.95 2.10 0.11 5.09 0.11 -0.74 -5.03 120.40 120.09 3hws s VAL 290 Ca 0.30 0.09 0.04 0.00 -2.93 0.00 0.00 61.98 59.48 3hws s VAL 290 Cb 0.14 -3.06 -0.04 0.00 -1.53 0.00 0.00 36.38 31.90 3hws s VAL 290 CO 0.23 0.02 -0.11 -1.61 -3.33 0.00 0.00 175.10 170.30 3hws s GLU 291 N -1.35 0.91 0.39 1.54 0.41 -1.26 -5.04 118.70 114.30 3hws s GLU 291 Ca 0.57 -1.21 0.18 0.00 -0.41 0.00 0.00 54.97 54.10 3hws s GLU 291 Cb -0.47 -0.64 1.08 0.00 -1.78 0.00 0.00 34.13 32.33 3hws s GLU 291 CO 0.56 0.10 1.77 -1.35 -0.49 0.00 0.00 175.26 175.85 3hws h PRO 292 N 3.47 0.40 -0.72 0.39 0.11 -1.98 0.22 132.00 133.89 3hws h PRO 292 Ca -0.38 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.80 3hws h PRO 292 Cb 1.19 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 3hws h PRO 292 CO 0.53 0.26 0.47 1.05 -0.21 0.00 0.00 178.00 180.11 3hws h GLU 293 N 0.41 0.60 -0.44 1.05 4.11 -1.99 -0.64 114.58 117.68 3hws h GLU 293 Ca 0.60 -0.04 -0.15 0.00 0.07 0.00 0.00 59.36 59.85 3hws h GLU 293 Cb 1.48 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 3hws h GLU 293 CO -0.31 0.40 -0.30 -0.44 0.07 0.00 0.00 179.01 178.43 3hws h ASP 294 N 0.62 1.01 0.15 3.06 3.32 -0.95 -2.30 116.42 121.34 3hws h ASP 294 Ca 0.33 -0.42 -0.09 0.00 0.02 0.00 0.00 57.03 56.87 3hws h ASP 294 Cb 0.46 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3hws h ASP 294 CO -0.11 1.22 -0.31 -0.07 -1.72 0.00 0.00 179.24 178.25 3hws h LEU 295 N 0.81 0.25 0.12 1.55 -0.00 -1.15 -1.53 115.31 115.37 3hws h LEU 295 Ca 0.09 -0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 57.88 3hws h LEU 295 Cb 0.88 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 3hws h LEU 295 CO 0.08 0.56 -0.06 0.40 -0.00 0.00 0.00 178.44 179.42 3hws h ILE 296 N 0.22 0.92 -0.09 1.22 1.08 -0.94 -1.76 117.51 118.16 3hws h ILE 296 Ca 0.03 -0.15 -0.00 0.00 -0.39 0.00 0.00 64.86 64.34 3hws h ILE 296 Cb 0.66 1.02 -0.00 0.00 -3.07 0.00 0.00 36.82 35.43 3hws h ILE 296 CO 0.05 0.04 0.04 0.11 -0.69 0.00 0.00 178.15 177.69 3hws h LYS 297 N -0.23 0.12 0.00 2.37 1.79 -1.16 -2.11 116.57 117.35 3hws h LYS 297 Ca -0.02 -0.01 -0.10 0.00 -2.18 0.00 0.00 60.65 58.35 3hws h LYS 297 Cb 0.18 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 3hws h LYS 297 CO 0.03 0.10 -0.46 0.35 -1.08 0.00 0.00 179.45 178.39 3hws h PHE 298 N 0.12 0.00 0.00 -1.35 3.57 -0.90 -3.46 116.94 114.91 3hws h PHE 298 Ca 0.03 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3hws h PHE 298 Cb 0.03 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.77 3hws h PHE 298 CO 0.00 0.46 0.00 0.41 -2.23 0.00 0.00 178.31 176.95 3hws n GLY 299 N -0.06 0.73 3.73 2.40 0.00 -0.79 -4.57 105.19 106.62 3hws n GLY 299 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3hws n GLY 299 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hws s LEU 300 N 0.00 4.42 0.38 0.99 1.02 -0.70 -4.67 118.68 120.12 3hws s LEU 300 Ca 0.00 2.22 -0.26 0.00 0.02 0.00 0.00 54.13 56.11 3hws s LEU 300 Cb 0.00 -3.60 -0.09 0.00 0.02 0.00 0.00 46.19 42.52 3hws s LEU 300 CO 0.00 -0.45 1.13 0.27 0.02 0.00 0.00 176.35 177.32 3hws s ILE 301 N 0.36 3.33 0.32 -0.59 -4.36 -1.26 -4.06 121.20 114.95 3hws s ILE 301 Ca 0.56 1.13 0.06 0.00 -0.26 0.00 0.00 60.65 62.14 3hws s ILE 301 Cb -0.33 -3.64 0.31 0.00 1.25 0.00 0.00 42.46 40.05 3hws s ILE 301 CO 0.34 0.12 1.83 -0.65 0.24 0.00 0.00 174.94 176.82 3hws h PRO 302 N 2.81 0.78 0.00 0.37 0.11 -1.94 -0.05 132.00 134.07 3hws h PRO 302 Ca -0.48 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 3hws h PRO 302 Cb 1.23 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3hws h PRO 302 CO 0.63 0.52 -0.30 1.49 -0.21 0.00 0.00 178.00 180.12 3hws h GLU 303 N 0.80 0.00 -0.02 1.05 4.57 -1.99 -2.15 114.58 116.85 3hws h GLU 303 Ca 0.51 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.55 3hws h GLU 303 Cb 0.73 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.33 3hws h GLU 303 CO -0.28 0.30 -0.53 0.35 -1.18 0.00 0.00 179.01 177.68 3hws h PHE 304 N 0.00 0.56 -0.04 0.92 3.57 -1.37 -3.25 116.94 117.33 3hws h PHE 304 Ca -0.00 -0.30 -0.08 0.00 3.53 0.00 0.00 57.97 61.12 3hws h PHE 304 Cb 0.69 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 3hws h PHE 304 CO 0.00 1.10 -0.35 0.82 -2.23 0.00 0.00 178.31 177.65 3hws h ILE 305 N -0.13 1.27 0.00 1.41 2.04 -1.27 -2.13 117.51 118.69 3hws h ILE 305 Ca -0.06 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.52 3hws h ILE 305 Cb 1.24 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 3hws h ILE 305 CO 0.11 0.37 0.00 1.23 0.00 0.00 0.00 178.15 179.86 3hws h GLY 306 N 1.10 0.00 0.81 5.37 0.00 -1.45 -1.30 103.07 107.60 3hws h GLY 306 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hws h GLY 306 CO 0.05 0.00 -0.48 0.54 0.00 0.00 0.00 176.54 176.64 3hws n ARG 307 N -2.90 0.15 -3.41 4.80 5.12 -0.81 -4.34 116.66 115.27 3hws n ARG 307 Ca -0.00 -0.09 -0.28 0.00 -1.93 0.00 0.00 57.85 55.55 3hws n ARG 307 Cb 0.22 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 29.95 3hws n ARG 307 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3hws n LEU 308 N -1.35 3.97 0.23 0.55 7.99 -0.49 -4.12 117.00 123.78 3hws n LEU 308 Ca 0.07 -5.42 0.11 0.00 -0.01 0.00 0.00 56.01 50.75 3hws n LEU 308 Cb 0.34 -0.73 0.51 0.00 -0.11 0.00 0.00 43.42 43.43 3hws n LEU 308 CO 0.34 2.01 0.83 -0.65 -1.51 0.00 0.00 177.39 178.41 3hws h PRO 309 N 4.35 0.00 -4.73 3.23 0.11 -1.68 -3.42 132.00 129.86 3hws h PRO 309 Ca 0.20 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.63 3hws h PRO 309 Cb 0.66 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 31.58 3hws h PRO 309 CO 0.88 0.20 -0.45 0.08 -0.21 0.00 0.00 178.00 178.50 3hws s VAL 310 N -3.73 5.27 -0.13 3.15 1.01 -1.06 -5.04 120.40 119.87 3hws s VAL 310 Ca 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.79 3hws s VAL 310 Cb 0.11 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.75 3hws s VAL 310 CO 0.63 -0.04 -0.20 -0.69 0.00 0.00 0.00 175.10 174.80 3hws s VAL 311 N 1.76 2.31 0.13 2.92 1.01 -1.26 0.23 120.40 127.50 3hws s VAL 311 Ca 0.07 -0.90 0.10 0.00 0.00 0.00 0.00 61.98 61.25 3hws s VAL 311 Cb -0.17 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3hws s VAL 311 CO 0.11 0.54 -0.25 0.00 0.00 0.00 0.00 175.10 175.49 3hws s ALA 312 N 0.67 2.26 0.09 5.51 0.00 0.11 -4.96 121.76 125.43 3hws s ALA 312 Ca -0.10 -1.43 0.09 0.00 0.00 0.00 0.00 51.96 50.52 3hws s ALA 312 Cb -0.16 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 3hws s ALA 312 CO 0.02 0.49 -0.22 0.95 0.00 0.00 0.00 175.76 177.00 3hws s THR 313 N -1.12 1.83 0.12 0.00 -4.23 -1.26 -0.18 115.64 110.80 3hws s THR 313 Ca 0.13 -1.48 0.09 0.00 -1.18 0.00 0.00 61.69 59.25 3hws s THR 313 Cb -0.10 -1.63 -0.04 0.00 1.34 0.00 0.00 72.50 72.07 3hws s THR 313 CO 0.06 0.07 -0.19 -0.76 -0.54 0.00 0.00 174.62 173.26 3hws s LEU 314 N -1.69 2.66 0.27 4.79 1.02 -0.10 -4.25 118.68 121.37 3hws s LEU 314 Ca 0.08 -0.59 -0.04 0.00 0.02 0.00 0.00 54.13 53.61 3hws s LEU 314 Cb -0.10 -1.50 -0.05 0.00 0.02 0.00 0.00 46.19 44.56 3hws s LEU 314 CO 0.04 0.18 0.51 0.20 0.02 0.00 0.00 176.35 177.29 3hws s ASN 315 N -2.15 6.42 0.57 2.29 0.01 -1.26 -4.45 114.94 116.36 3hws s ASN 315 Ca 0.18 0.62 -0.20 0.00 -0.71 0.00 0.00 52.86 52.74 3hws s ASN 315 Cb -0.10 -2.10 -0.04 0.00 0.41 0.00 0.00 41.25 39.41 3hws s ASN 315 CO 0.10 -0.16 1.27 -0.70 -1.51 0.00 0.00 177.10 176.10 3hws s GLU 316 N -3.51 3.07 -0.26 -0.60 2.12 -1.26 -4.83 118.70 113.43 3hws s GLU 316 Ca 0.42 2.02 -0.26 0.00 0.36 0.00 0.00 54.97 57.51 3hws s GLU 316 Cb -0.11 -2.11 0.00 0.00 0.26 0.00 0.00 34.13 32.18 3hws s GLU 316 CO 0.30 -1.18 0.89 -0.51 -0.54 0.00 0.00 175.26 174.22 3hws s LEU 317 N -3.77 4.07 1.04 2.70 1.43 -1.26 -4.47 118.68 118.42 3hws s LEU 317 Ca 0.74 1.04 -0.15 0.00 -1.03 0.00 0.00 54.13 54.72 3hws s LEU 317 Cb -0.35 -3.28 0.21 0.00 0.03 0.00 0.00 46.19 42.80 3hws s LEU 317 CO 0.40 -0.61 1.15 -0.94 0.23 0.00 0.00 176.35 176.59 3hws s SER 318 N 1.40 2.35 0.19 2.29 1.04 -1.26 -4.87 113.70 114.84 3hws s SER 318 Ca 0.37 0.75 -0.04 0.00 0.48 0.00 0.00 55.95 57.51 3hws s SER 318 Cb -0.15 -1.12 0.10 0.00 0.10 0.00 0.00 66.02 64.95 3hws s SER 318 CO 0.09 -3.25 1.52 -0.08 0.98 0.00 0.00 173.24 172.49 3hws h GLU 319 N -1.98 0.63 -0.07 4.02 4.81 -1.96 -2.52 114.58 117.50 3hws h GLU 319 Ca -0.48 -0.37 -0.08 0.00 -0.13 0.00 0.00 59.36 58.30 3hws h GLU 319 Cb 1.30 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 3hws h GLU 319 CO 0.47 0.98 -0.30 1.49 -0.73 0.00 0.00 179.01 180.91 3hws h GLU 320 N 0.50 0.13 -0.09 1.92 4.22 -2.00 -2.44 114.58 116.83 3hws h GLU 320 Ca 0.02 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 3hws h GLU 320 Cb 1.04 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 3hws h GLU 320 CO 0.10 0.43 -0.00 0.00 -2.18 0.00 0.00 179.01 177.36 3hws h ALA 321 N 1.57 0.12 -0.61 2.92 0.00 -1.86 -1.50 119.26 119.90 3hws h ALA 321 Ca 0.02 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.78 3hws h ALA 321 Cb 0.60 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3hws h ALA 321 CO 0.04 -0.20 0.35 -0.07 0.00 0.00 0.00 179.25 179.38 3hws h LEU 322 N -0.14 0.55 -0.48 0.00 4.07 -1.30 0.73 115.31 118.74 3hws h LEU 322 Ca 0.02 0.02 0.03 0.00 0.08 0.00 0.00 57.88 58.03 3hws h LEU 322 Cb 0.36 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.96 3hws h LEU 322 CO 0.01 0.37 0.26 0.40 -1.08 0.00 0.00 178.44 178.40 3hws h ILE 323 N 0.68 1.00 -0.81 1.22 2.04 -1.37 -1.39 117.51 118.88 3hws h ILE 323 Ca 0.26 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.96 3hws h ILE 323 Cb 0.09 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 3hws h ILE 323 CO -0.14 0.09 0.53 -0.61 0.00 0.00 0.00 178.15 178.03 3hws h GLN 324 N 0.52 1.03 -0.03 2.37 4.15 -0.52 -2.24 115.11 120.38 3hws h GLN 324 Ca 0.20 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 59.52 3hws h GLN 324 Cb 0.08 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 3hws h GLN 324 CO -0.12 0.68 -0.18 0.82 -1.93 0.00 0.00 178.83 178.10 3hws h ILE 325 N 1.07 1.15 0.00 2.39 2.04 -0.15 0.18 117.51 124.18 3hws h ILE 325 Ca 0.31 -0.70 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 3hws h ILE 325 Cb -0.07 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3hws h ILE 325 CO -0.08 0.20 -0.32 -0.07 0.00 0.00 0.00 178.15 177.88 3hws h LEU 326 N 0.05 0.00 0.00 1.44 3.38 -0.64 -3.39 115.31 116.14 3hws h LEU 326 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hws h LEU 326 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3hws h LEU 326 CO 0.02 0.32 -0.87 2.29 0.09 0.00 0.00 178.44 180.30 3hws n LYS 327 N -3.63 1.22 0.09 1.13 2.85 -1.02 -2.46 118.16 116.34 3hws n LYS 327 Ca -0.01 0.00 -0.23 0.00 -1.05 0.00 0.00 58.31 57.02 3hws n LYS 327 Cb 0.44 -0.93 -0.15 0.00 -0.65 0.00 0.00 35.03 33.74 3hws n LYS 327 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 3hws h GLU 328 N 0.00 0.43 -6.82 -1.58 5.08 -1.16 -3.45 114.58 107.08 3hws h GLU 328 Ca 0.00 -0.73 -0.53 0.00 -1.00 0.00 0.00 59.36 57.10 3hws h GLU 328 Cb 0.87 0.27 0.21 0.00 0.50 0.00 0.00 28.75 30.60 3hws h GLU 328 CO 0.00 1.35 -0.53 -2.30 -1.00 0.00 0.00 179.01 176.53 3hws n PRO 329 N -3.71 -0.35 -0.01 2.33 -0.02 -1.26 -4.87 135.00 127.11 3hws n PRO 329 Ca -0.21 -0.06 -0.03 0.00 -2.02 0.00 0.00 63.50 61.18 3hws n PRO 329 Cb 1.05 -1.89 0.22 0.00 -0.02 0.00 0.00 33.50 32.86 3hws n PRO 329 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hws h LYS 330 N -1.61 0.56 -0.72 -0.52 1.57 -1.48 -2.84 116.57 111.54 3hws h LYS 330 Ca -0.44 -0.17 -0.34 0.00 -1.87 0.00 0.00 60.65 57.83 3hws h LYS 330 Cb 1.28 -0.05 -0.20 0.00 0.08 0.00 0.00 32.23 33.33 3hws h LYS 330 CO 0.35 0.68 0.33 0.27 -0.57 0.00 0.00 179.45 180.51 3hws n ASN 331 N -4.18 3.46 -4.55 0.86 0.23 -1.26 -4.93 115.26 104.88 3hws n ASN 331 Ca 0.01 -3.60 -0.40 0.00 -0.53 0.00 0.00 54.58 50.06 3hws n ASN 331 Cb 0.34 -0.75 0.03 0.00 -2.08 0.00 0.00 39.78 37.32 3hws n ASN 331 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hws n ALA 332 N -0.98 -0.39 -0.03 -2.53 0.00 -1.07 -4.75 120.51 110.75 3hws n ALA 332 Ca 0.47 0.11 -0.09 0.00 0.00 0.00 0.00 53.44 53.93 3hws n ALA 332 Cb 1.39 -1.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 3hws n ALA 332 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3hws h LEU 333 N 0.87 -0.15 -0.35 0.00 3.38 -1.77 -1.36 115.31 115.93 3hws h LEU 333 Ca -0.45 0.05 0.06 0.00 0.09 0.00 0.00 57.88 57.63 3hws h LEU 333 Cb 1.37 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.17 3hws h LEU 333 CO 0.52 -0.05 0.00 0.71 0.09 0.00 0.00 178.44 179.71 3hws h THR 334 N 0.01 0.74 -0.72 0.22 1.35 -1.83 -0.93 112.91 111.74 3hws h THR 334 Ca 0.09 -0.03 0.05 0.00 -0.55 0.00 0.00 66.41 65.96 3hws h THR 334 Cb 0.13 0.63 -0.05 0.00 -1.73 0.00 0.00 68.15 67.12 3hws h THR 334 CO -0.18 0.02 0.43 0.11 -0.25 0.00 0.00 175.52 175.65 3hws h LYS 335 N 0.10 0.78 -0.18 4.72 1.57 -1.71 0.77 116.57 122.62 3hws h LYS 335 Ca 0.17 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3hws h LYS 335 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3hws h LYS 335 CO -0.29 0.52 0.10 1.96 -0.57 0.00 0.00 179.45 181.17 3hws h GLN 336 N 0.80 0.25 -0.49 3.15 4.20 -0.19 -1.48 115.11 121.35 3hws h GLN 336 Ca 0.31 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.88 3hws h GLN 336 Cb 0.14 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 3hws h GLN 336 CO -0.16 0.25 -0.15 1.88 -0.67 0.00 0.00 178.83 179.98 3hws h TYR 337 N 0.19 1.06 -0.85 2.96 -1.99 -1.00 -1.93 116.97 115.41 3hws h TYR 337 Ca 0.06 -0.23 0.06 0.00 2.00 0.00 0.00 58.73 60.62 3hws h TYR 337 Cb 0.07 -0.26 -0.05 0.00 2.00 0.00 0.00 36.73 38.49 3hws h TYR 337 CO -0.04 1.02 0.56 1.96 -0.00 0.00 0.00 178.16 181.66 3hws h GLN 338 N 0.84 0.96 -0.32 4.88 4.20 -0.65 0.18 115.11 125.19 3hws h GLN 338 Ca 0.13 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 3hws h GLN 338 Cb 0.70 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 3hws h GLN 338 CO 0.05 0.63 -0.23 0.00 -0.67 0.00 0.00 178.83 178.62 3hws h ALA 339 N 1.53 1.01 0.11 3.87 0.00 -0.96 -0.49 119.26 124.33 3hws h ALA 339 Ca 0.36 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3hws h ALA 339 Cb 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3hws h ALA 339 CO -0.12 0.59 -0.05 1.25 0.00 0.00 0.00 179.25 180.91 3hws h LEU 340 N 0.55 -0.13 -2.62 0.00 5.85 -0.24 -2.27 115.31 116.44 3hws h LEU 340 Ca 0.08 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3hws h LEU 340 Cb 0.68 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.75 3hws h LEU 340 CO 0.05 0.25 0.00 -0.26 -0.34 0.00 0.00 178.44 178.14 3hws h PHE 341 N -0.52 0.00 -0.05 1.25 -1.00 -0.72 -2.40 116.94 113.49 3hws h PHE 341 Ca -0.02 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.61 3hws h PHE 341 Cb 0.42 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.97 3hws h PHE 341 CO 0.05 0.00 -0.67 -0.97 -1.61 0.00 0.00 178.31 175.10 3hws h ASN 342 N 0.00 0.28 0.17 2.17 -1.24 -0.51 -1.35 115.58 115.10 3hws h ASN 342 Ca 0.00 -0.17 -0.02 0.00 0.71 0.00 0.00 56.30 56.82 3hws h ASN 342 Cb 0.12 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 39.09 3hws h ASN 342 CO 0.00 0.87 -0.08 -0.07 -1.29 0.00 0.00 177.43 176.86 3hws h LEU 343 N 0.17 0.00 -0.44 0.34 3.38 -1.11 -0.34 115.31 117.31 3hws h LEU 343 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3hws h LEU 343 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3hws h LEU 343 CO 0.10 0.08 -0.07 -0.62 0.09 0.00 0.00 178.44 178.03 3hws n GLU 344 N -3.94 1.06 -1.01 1.13 -0.58 -1.02 -4.89 120.64 111.39 3hws n GLU 344 Ca -0.02 -0.44 -0.00 0.00 -0.42 0.00 0.00 57.16 56.27 3hws n GLU 344 Cb 0.17 -1.49 -0.00 0.00 -0.57 0.00 0.00 31.44 29.55 3hws n GLU 344 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hws n GLY 345 N 1.20 0.46 3.78 0.62 0.00 -0.14 -5.00 105.19 106.12 3hws n GLY 345 Ca 0.17 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 3hws n GLY 345 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hws s VAL 346 N -2.00 4.64 -0.32 1.61 1.01 -0.54 -4.87 120.40 119.93 3hws s VAL 346 Ca 0.00 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 3hws s VAL 346 Cb 0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 3hws s VAL 346 CO 0.00 0.21 0.19 -0.62 0.00 0.00 0.00 175.10 174.88 3hws s ASP 347 N -2.15 5.76 -0.14 3.32 -1.08 -0.95 -3.44 116.67 117.99 3hws s ASP 347 Ca 0.27 -0.49 -0.17 0.00 -0.52 0.00 0.00 52.55 51.64 3hws s ASP 347 Cb -0.12 -2.06 -0.04 0.00 -1.46 0.00 0.00 42.92 39.24 3hws s ASP 347 CO 0.19 -0.21 0.42 -0.22 0.52 0.00 0.00 175.17 175.87 3hws s LEU 348 N 1.66 4.24 -0.08 -1.34 2.96 -1.26 -0.21 118.68 124.64 3hws s LEU 348 Ca 0.05 0.69 0.02 0.00 -0.22 0.00 0.00 54.13 54.67 3hws s LEU 348 Cb -0.17 -2.59 0.01 0.00 0.50 0.00 0.00 46.19 43.94 3hws s LEU 348 CO 0.08 0.01 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.37 3hws s GLU 349 N 0.73 1.97 -0.26 1.98 2.02 0.31 -4.89 118.70 120.56 3hws s GLU 349 Ca 0.22 -0.49 -0.09 0.00 0.02 0.00 0.00 54.97 54.64 3hws s GLU 349 Cb -0.14 -1.64 -0.04 0.00 0.10 0.00 0.00 34.13 32.40 3hws s GLU 349 CO 0.08 -0.00 0.12 -0.06 0.02 0.00 0.00 175.26 175.42 3hws s PHE 350 N 0.80 3.16 0.42 1.61 0.40 -1.26 -0.56 117.98 122.55 3hws s PHE 350 Ca -0.11 -0.14 -0.23 0.00 -0.60 0.00 0.00 56.93 55.85 3hws s PHE 350 Cb -0.16 -2.28 -0.08 0.00 0.51 0.00 0.00 43.02 41.01 3hws s PHE 350 CO 0.02 -0.22 1.09 1.03 0.70 0.00 0.00 175.22 177.84 3hws s ARG 351 N 1.55 4.00 0.28 0.44 0.52 -0.82 -4.91 118.95 120.02 3hws s ARG 351 Ca 0.06 1.60 0.02 0.00 -0.52 0.00 0.00 55.73 56.89 3hws s ARG 351 Cb -0.15 -2.47 0.59 0.00 0.52 0.00 0.00 34.95 33.43 3hws s ARG 351 CO 0.06 -0.30 1.80 -0.44 0.02 0.00 0.00 175.30 176.45 3hws h ASP 352 N 2.30 0.81 0.10 0.23 3.32 -1.98 0.20 116.42 121.39 3hws h ASP 352 Ca -0.49 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 3hws h ASP 352 Cb 1.23 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 3hws h ASP 352 CO 0.61 0.38 -0.06 1.05 -1.72 0.00 0.00 179.24 179.50 3hws h GLU 353 N 0.86 0.00 -0.04 3.56 4.11 -1.94 -1.43 114.58 119.70 3hws h GLU 353 Ca 0.51 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.86 3hws h GLU 353 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3hws h GLU 353 CO -0.31 0.06 -0.28 0.00 0.07 0.00 0.00 179.01 178.55 3hws h ALA 354 N 1.94 0.08 -0.78 1.06 0.00 -0.90 -1.79 119.26 118.87 3hws h ALA 354 Ca -0.00 -0.44 0.07 0.00 0.00 0.00 0.00 54.91 54.54 3hws h ALA 354 Cb 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3hws h ALA 354 CO 0.01 0.13 0.45 -0.07 0.00 0.00 0.00 179.25 179.77 3hws h LEU 355 N -0.31 0.68 -0.65 0.00 3.38 -0.94 -0.69 115.31 116.79 3hws h LEU 355 Ca -0.02 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3hws h LEU 355 Cb 0.96 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 3hws h LEU 355 CO 0.06 0.43 0.38 0.44 0.09 0.00 0.00 178.44 179.84 3hws h ASP 356 N 0.81 0.79 -0.38 -0.43 5.19 -1.28 -2.05 116.42 119.07 3hws h ASP 356 Ca 0.35 -0.07 -0.03 0.00 -0.62 0.00 0.00 57.03 56.66 3hws h ASP 356 Cb 0.22 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 3hws h ASP 356 CO -0.20 0.63 0.16 0.00 -3.12 0.00 0.00 179.24 176.71 3hws h ALA 357 N 1.19 1.47 -0.14 3.45 0.00 -0.32 -1.07 119.26 123.84 3hws h ALA 357 Ca 0.23 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3hws h ALA 357 Cb -0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3hws h ALA 357 CO -0.04 0.40 -0.07 0.82 0.00 0.00 0.00 179.25 180.36 3hws h ILE 358 N 0.62 1.31 0.06 0.00 2.04 -0.79 -2.65 117.51 118.10 3hws h ILE 358 Ca 0.15 -1.10 0.02 0.00 1.00 0.00 0.00 64.86 64.93 3hws h ILE 358 Cb 0.15 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 3hws h ILE 358 CO -0.01 0.32 -0.23 0.00 0.00 0.00 0.00 178.15 178.23 3hws h ALA 359 N 0.67 -0.34 -0.48 1.87 0.00 -0.90 -0.27 119.26 119.81 3hws h ALA 359 Ca 0.03 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.02 3hws h ALA 359 Cb 0.54 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 18.61 3hws h ALA 359 CO 0.02 -0.74 -0.28 0.87 0.00 0.00 0.00 179.25 179.12 3hws h LYS 360 N -0.39 -0.17 -0.44 0.00 1.79 -1.24 0.89 116.57 117.01 3hws h LYS 360 Ca 0.04 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 3hws h LYS 360 Cb 0.44 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 3hws h LYS 360 CO -0.16 -0.11 0.28 -0.22 -1.08 0.00 0.00 179.45 178.15 3hws h LYS 361 N -0.17 0.58 -0.17 3.15 3.64 -1.09 -1.67 116.57 120.85 3hws h LYS 361 Ca 0.21 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.43 3hws h LYS 361 Cb 0.51 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 3hws h LYS 361 CO -0.58 0.40 -0.40 0.00 -2.27 0.00 0.00 179.45 176.60 3hws h ALA 362 N 1.71 1.00 -0.00 5.00 0.00 0.91 -3.00 119.26 124.87 3hws h ALA 362 Ca 0.16 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 3hws h ALA 362 Cb -0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3hws h ALA 362 CO -0.03 0.61 -0.75 0.52 0.00 0.00 0.00 179.25 179.61 3hws h MET 363 N 0.32 0.03 -0.07 0.00 2.86 -0.17 -2.33 114.93 115.56 3hws h MET 363 Ca 0.03 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3hws h MET 363 Cb 0.85 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 3hws h MET 363 CO 0.07 0.76 -0.25 0.00 1.06 0.00 0.00 176.91 178.55 3hws h ALA 364 N 1.23 1.45 0.00 6.32 0.00 -1.28 -2.46 119.26 124.52 3hws h ALA 364 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hws h ALA 364 Cb 1.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hws h ALA 364 CO 0.10 0.40 -0.62 2.89 0.00 0.00 0.00 179.25 182.02 3hws n ARG 365 N -4.20 0.22 -2.00 0.00 1.85 -1.14 -4.94 116.66 106.45 3hws n ARG 365 Ca -0.01 0.06 -0.15 0.00 -1.00 0.00 0.00 57.85 56.75 3hws n ARG 365 Cb 0.33 -1.64 -0.03 0.00 -1.05 0.00 0.00 32.46 30.08 3hws n ARG 365 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 3hws n LYS 366 N -1.96 -1.76 0.22 2.89 4.81 -0.89 -4.81 118.16 116.66 3hws n LYS 366 Ca 0.04 0.78 0.12 0.00 -0.87 0.00 0.00 58.31 58.38 3hws n LYS 366 Cb 0.41 -5.25 0.19 0.00 0.02 0.00 0.00 35.03 30.40 3hws n LYS 366 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 3hws h THR 367 N 0.00 0.00 0.00 3.15 1.35 -1.87 -3.50 112.91 112.04 3hws h THR 367 Ca -0.33 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 3hws h THR 367 Cb 1.13 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 3hws h THR 367 CO 0.42 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 3hws n GLY 368 N 1.06 -0.16 0.20 5.82 0.00 -1.26 -3.73 105.19 107.12 3hws n GLY 368 Ca 0.04 -1.17 0.14 0.00 0.00 0.00 0.00 46.02 45.03 3hws n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hws h ALA 369 N 0.00 1.00 -0.34 4.61 0.00 -1.90 -3.14 119.26 119.50 3hws h ALA 369 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hws h ALA 369 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3hws h ALA 369 CO 0.00 0.00 0.20 0.00 0.00 0.00 0.00 179.25 179.45 3hws h ARG 370 N 0.00 0.46 0.00 0.00 3.08 -1.84 -2.59 114.38 113.49 3hws h ARG 370 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3hws h ARG 370 Cb 0.47 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3hws h ARG 370 CO 0.00 0.36 0.00 0.41 -1.07 0.00 0.00 179.97 179.67 3hws n GLY 371 N -1.06 -1.00 0.12 0.04 0.00 -1.19 -3.75 105.19 98.35 3hws n GLY 371 Ca -0.01 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 3hws n GLY 371 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hws h LEU 372 N 0.00 -0.14 -0.68 0.99 3.38 -1.60 -3.15 115.31 114.09 3hws h LEU 372 Ca 0.00 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.62 3hws h LEU 372 Cb 0.00 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 3hws h LEU 372 CO 0.00 0.38 0.39 -0.09 0.09 0.00 0.00 178.44 179.22 3hws h ARG 373 N -0.74 0.71 -0.00 1.13 2.43 -1.76 -1.36 114.38 114.80 3hws h ARG 373 Ca -0.02 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 3hws h ARG 373 Cb 0.54 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3hws h ARG 373 CO 0.03 0.47 -0.21 0.66 -1.51 0.00 0.00 179.97 179.41 3hws h SER 374 N 0.74 0.00 -0.11 -3.80 4.64 -1.78 0.10 113.55 113.34 3hws h SER 374 Ca 0.30 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.47 3hws h SER 374 Cb 0.15 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.25 3hws h SER 374 CO -0.17 0.21 -0.51 0.40 -0.87 0.00 0.00 176.83 175.89 3hws h ILE 375 N 0.00 1.36 -0.26 0.95 2.04 -1.24 -2.97 117.51 117.39 3hws h ILE 375 Ca -0.00 -1.83 -0.09 0.00 1.00 0.00 0.00 64.86 63.94 3hws h ILE 375 Cb 0.37 2.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 3hws h ILE 375 CO 0.03 0.55 -0.17 0.58 0.00 0.00 0.00 178.15 179.14 3hws h VAL 376 N 0.14 1.30 -0.81 1.67 2.07 -0.91 -2.74 116.25 116.97 3hws h VAL 376 Ca -0.03 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 3hws h VAL 376 Cb 1.16 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 3hws h VAL 376 CO 0.11 0.41 0.45 -0.08 0.02 0.00 0.00 177.57 178.48 3hws h GLU 377 N 0.31 1.12 -0.43 1.57 4.81 -0.90 -1.61 114.58 119.45 3hws h GLU 377 Ca 0.05 -0.12 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 3hws h GLU 377 Cb 0.70 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 3hws h GLU 377 CO 0.05 0.81 -0.10 0.00 -0.73 0.00 0.00 179.01 179.04 3hws h ALA 378 N 1.37 1.03 0.00 2.92 0.00 -1.52 0.19 119.26 123.25 3hws h ALA 378 Ca 0.29 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3hws h ALA 378 Cb 0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3hws h ALA 378 CO -0.05 0.59 -0.34 0.00 0.00 0.00 0.00 179.25 179.45 3hws h ALA 379 N 1.20 1.15 -0.01 0.00 0.00 -1.01 -3.21 119.26 117.39 3hws h ALA 379 Ca 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3hws h ALA 379 Cb 0.56 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3hws h ALA 379 CO 0.03 0.43 -0.38 1.28 0.00 0.00 0.00 179.25 180.61 3hws n LEU 380 N -3.72 1.42 0.12 0.00 4.77 -0.71 -4.70 117.00 114.17 3hws n LEU 380 Ca -0.01 -0.72 -0.13 0.00 -0.03 0.00 0.00 56.01 55.12 3hws n LEU 380 Cb 0.44 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 3hws n LEU 380 CO 0.36 0.28 0.51 0.25 -1.33 0.00 0.00 177.39 177.47 3hws h LEU 381 N 1.40 -1.14 -0.54 2.23 7.12 -0.63 0.15 115.31 123.89 3hws h LEU 381 Ca 0.00 0.11 0.11 0.00 0.13 0.00 0.00 57.88 58.23 3hws h LEU 381 Cb 0.49 0.41 -0.10 0.00 -0.53 0.00 0.00 40.66 40.93 3hws h LEU 381 CO 0.00 -0.44 -0.10 0.44 -0.13 0.00 0.00 178.44 178.22 3hws h ASP 382 N -0.61 -0.43 -0.59 1.25 3.45 -1.84 -1.09 116.42 116.56 3hws h ASP 382 Ca -0.02 0.15 0.01 0.00 0.43 0.00 0.00 57.03 57.60 3hws h ASP 382 Cb 0.59 0.31 -0.03 0.00 -0.56 0.00 0.00 39.33 39.64 3hws h ASP 382 CO -0.17 -0.16 0.39 0.74 -1.57 0.00 0.00 179.24 178.48 3hws h THR 383 N 0.03 1.15 0.00 0.35 2.02 -1.75 -1.90 112.91 112.81 3hws h THR 383 Ca 0.27 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 3hws h THR 383 Cb 0.41 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 3hws h THR 383 CO -0.53 0.15 -0.20 0.24 0.37 0.00 0.00 175.52 175.54 3hws h MET 384 N 0.80 0.00 -0.04 6.66 2.86 0.13 -0.64 114.93 124.70 3hws h MET 384 Ca 0.22 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.79 3hws h MET 384 Cb -0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.57 3hws h MET 384 CO -0.05 0.20 -0.23 -0.92 1.06 0.00 0.00 176.91 176.98 3hws h TYR 385 N 0.00 0.31 -0.40 -0.22 3.20 -0.43 -3.32 116.97 116.11 3hws h TYR 385 Ca -0.00 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.73 3hws h TYR 385 Cb 0.51 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.73 3hws h TYR 385 CO 0.00 0.87 0.00 -0.40 -1.64 0.00 0.00 178.16 176.99 3hws n ASP 386 N -4.52 3.49 0.12 -2.11 5.68 -1.00 -4.48 116.55 113.73 3hws n ASP 386 Ca -0.09 -1.99 -0.14 0.00 -0.50 0.00 0.00 54.79 52.07 3hws n ASP 386 Cb 0.46 -0.26 -0.08 0.00 -1.14 0.00 0.00 41.12 40.10 3hws n ASP 386 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3hws h LEU 387 N 4.46 -0.22 0.00 -2.12 5.85 -1.21 -3.10 115.31 118.97 3hws h LEU 387 Ca 0.00 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3hws h LEU 387 Cb 0.99 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.08 3hws h LEU 387 CO 0.00 -0.05 0.00 -2.65 -0.34 0.00 0.00 178.44 175.40 3hws n PRO 388 N -5.15 0.05 -0.23 5.25 -0.02 -1.26 -1.53 135.00 132.11 3hws n PRO 388 Ca -0.09 0.30 0.07 0.00 -2.02 0.00 0.00 63.50 61.75 3hws n PRO 388 Cb 0.17 -1.50 0.18 0.00 -0.02 0.00 0.00 33.50 32.33 3hws n PRO 388 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3hws n SER 389 N -1.35 3.16 -4.16 2.55 7.64 -1.17 -4.99 113.62 115.29 3hws n SER 389 Ca 0.02 -2.09 -0.10 0.00 1.01 0.00 0.00 58.87 57.71 3hws n SER 389 Cb 0.04 -0.29 -0.10 0.00 -1.01 0.00 0.00 64.21 62.85 3hws n SER 389 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hws s MET 390 N -1.17 0.84 -0.57 1.43 0.23 -0.58 -5.12 119.30 114.35 3hws s MET 390 Ca 0.28 -1.36 -0.05 0.00 -1.03 0.00 0.00 55.69 53.53 3hws s MET 390 Cb 0.16 -0.02 0.15 0.00 -1.53 0.00 0.00 34.83 33.59 3hws s MET 390 CO 0.17 -0.11 0.41 -1.21 -2.03 0.00 0.00 175.02 172.25 3hws s GLU 391 N -3.91 2.53 0.13 3.16 0.41 -1.26 -4.96 118.70 114.80 3hws s GLU 391 Ca 0.15 -2.25 0.08 0.00 -0.41 0.00 0.00 54.97 52.53 3hws s GLU 391 Cb 0.07 -3.80 -0.04 0.00 -1.78 0.00 0.00 34.13 28.58 3hws s GLU 391 CO -0.04 -1.17 -0.08 -0.51 -0.49 0.00 0.00 175.26 172.97 3hws s ASP 392 N 1.38 4.41 -0.08 -0.19 1.11 -1.26 -4.62 116.67 117.43 3hws s ASP 392 Ca 0.13 -0.44 -0.25 0.00 0.18 0.00 0.00 52.55 52.18 3hws s ASP 392 Cb -0.21 -0.83 -0.29 0.00 1.07 0.00 0.00 42.92 42.66 3hws s ASP 392 CO -0.04 0.14 0.85 1.62 1.18 0.00 0.00 175.17 178.92 3hws h VAL 393 N 3.00 1.63 -3.22 -1.27 3.04 -0.66 -3.42 116.25 115.34 3hws h VAL 393 Ca -0.48 -2.47 -0.01 0.00 -1.01 0.00 0.00 66.70 62.73 3hws h VAL 393 Cb 1.18 3.28 -0.10 0.00 -2.01 0.00 0.00 31.29 33.64 3hws h VAL 393 CO 0.53 0.68 0.08 -1.83 -1.01 0.00 0.00 177.57 176.02 3hws s GLU 394 N -2.35 1.37 -0.03 4.17 -1.05 -1.13 -2.23 118.70 117.45 3hws s GLU 394 Ca -0.16 -0.78 0.03 0.00 -0.15 0.00 0.00 54.97 53.91 3hws s GLU 394 Cb -0.01 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 3hws s GLU 394 CO 0.78 -0.59 -0.11 0.15 0.95 0.00 0.00 175.26 176.44 3hws s LYS 395 N -3.85 1.22 -0.18 -4.83 3.01 0.70 -1.59 119.74 114.23 3hws s LYS 395 Ca 0.07 -0.38 0.00 0.00 -1.01 0.00 0.00 55.97 54.66 3hws s LYS 395 Cb -0.01 -1.10 0.01 0.00 -1.01 0.00 0.00 37.83 35.72 3hws s LYS 395 CO -0.05 0.13 -0.17 0.08 0.51 0.00 0.00 175.35 175.85 3hws s VAL 396 N 0.24 2.39 -0.29 3.17 1.01 -0.48 -0.53 120.40 125.91 3hws s VAL 396 Ca -0.05 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 3hws s VAL 396 Cb -0.10 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 3hws s VAL 396 CO 0.01 0.52 0.30 -0.69 0.00 0.00 0.00 175.10 175.24 3hws s VAL 397 N 1.20 5.22 0.37 2.92 1.01 0.27 -1.42 120.40 129.97 3hws s VAL 397 Ca 0.02 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.35 3hws s VAL 397 Cb -0.14 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 3hws s VAL 397 CO -0.08 0.12 0.32 0.27 0.00 0.00 0.00 175.10 175.73 3hws s ILE 398 N 1.94 3.19 0.48 2.22 -4.36 -1.26 -1.95 121.20 121.45 3hws s ILE 398 Ca 0.11 -1.36 0.16 0.00 -0.26 0.00 0.00 60.65 59.30 3hws s ILE 398 Cb -0.16 -3.11 0.23 0.00 1.25 0.00 0.00 42.46 40.67 3hws s ILE 398 CO 0.11 -0.11 2.07 -2.24 0.24 0.00 0.00 174.94 175.01 3hws h ASP 399 N 1.16 0.00 0.27 4.36 2.03 -1.88 -0.77 116.42 121.60 3hws h ASP 399 Ca -0.43 0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 55.82 3hws h ASP 399 Cb 1.26 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.75 3hws h ASP 399 CO 0.58 0.11 -0.23 -0.33 -1.03 0.00 0.00 179.24 178.33 3hws h GLU 400 N 0.00 0.00 0.03 4.15 5.08 -1.95 -1.74 114.58 120.15 3hws h GLU 400 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 3hws h GLU 400 Cb 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3hws h GLU 400 CO 0.01 0.23 -1.03 1.03 -1.00 0.00 0.00 179.01 178.26 3hws h SER 401 N 0.00 0.15 0.00 1.42 0.87 -1.34 -3.08 113.55 111.57 3hws h SER 401 Ca -0.00 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 3hws h SER 401 Cb 0.43 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 3hws h SER 401 CO 0.03 1.08 0.00 0.52 -0.53 0.00 0.00 176.83 177.93 3hws n VAL 402 N -3.47 0.00 -0.14 2.23 0.31 -1.00 -3.06 118.33 113.20 3hws n VAL 402 Ca -0.03 0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 64.70 3hws n VAL 402 Cb 0.93 -1.49 -0.01 0.00 -0.91 0.00 0.00 33.84 32.36 3hws n VAL 402 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 3hws h ILE 403 N 0.00 1.25 0.18 2.52 2.10 -1.55 -3.15 117.51 118.87 3hws h ILE 403 Ca 0.00 -0.94 -0.32 0.00 1.08 0.00 0.00 64.86 64.68 3hws h ILE 403 Cb 0.00 1.06 0.03 0.00 -1.09 0.00 0.00 36.82 36.83 3hws h ILE 403 CO 0.00 0.32 -1.36 0.44 -1.08 0.00 0.00 178.15 176.47 3hws h ASP 404 N 0.54 0.88 0.00 2.19 5.19 -1.68 -3.47 116.42 120.07 3hws h ASP 404 Ca 0.12 -0.87 0.00 0.00 -0.62 0.00 0.00 57.03 55.66 3hws h ASP 404 Cb 0.42 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.65 3hws h ASP 404 CO 0.01 1.67 0.00 0.61 -3.12 0.00 0.00 179.24 178.41 3hws n GLY 405 N 1.54 0.43 0.18 2.75 0.00 -1.17 -4.84 105.19 104.09 3hws n GLY 405 Ca -0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.72 3hws n GLY 405 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3hws h GLN 406 N 1.24 0.58 -5.88 1.61 -0.00 -1.81 -3.45 115.11 107.41 3hws h GLN 406 Ca 0.00 -0.40 -0.63 0.00 -0.00 0.00 0.00 58.65 57.62 3hws h GLN 406 Cb 0.00 0.06 -0.05 0.00 -0.00 0.00 0.00 27.48 27.50 3hws h GLN 406 CO 0.00 1.02 -0.47 -1.54 -0.00 0.00 0.00 178.83 177.84 3hws s SER 407 N -6.62 6.39 0.41 0.06 1.04 -1.25 -5.08 113.70 108.65 3hws s SER 407 Ca -0.13 0.37 -0.10 0.00 0.48 0.00 0.00 55.95 56.57 3hws s SER 407 Cb 0.07 -2.01 -0.06 0.00 0.10 0.00 0.00 66.02 64.12 3hws s SER 407 CO 0.83 0.22 0.77 -1.83 0.98 0.00 0.00 173.24 174.21 3hws s GLU 408 N -2.14 3.76 0.71 4.02 -1.05 -1.26 -4.31 118.70 118.43 3hws s GLU 408 Ca 0.31 0.45 -0.16 0.00 -0.15 0.00 0.00 54.97 55.42 3hws s GLU 408 Cb -0.13 -2.39 -0.01 0.00 -0.44 0.00 0.00 34.13 31.17 3hws s GLU 408 CO 0.22 -0.05 0.89 -2.30 0.95 0.00 0.00 175.26 174.97 3hws n PRO 409 N -1.37 0.51 -2.53 -4.83 -0.02 -1.26 -4.92 135.00 120.59 3hws n PRO 409 Ca 0.02 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 3hws n PRO 409 Cb 0.54 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 3hws n PRO 409 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3hws s LEU 410 N -2.51 4.39 -0.22 2.45 2.96 -0.51 -4.87 118.68 120.37 3hws s LEU 410 Ca 0.72 1.91 -0.06 0.00 -0.22 0.00 0.00 54.13 56.49 3hws s LEU 410 Cb -0.35 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.73 3hws s LEU 410 CO 0.51 -0.37 0.03 -0.76 -1.32 0.00 0.00 176.35 174.44 3hws s LEU 411 N 0.85 3.32 -0.16 -0.68 1.02 -1.26 -1.38 118.68 120.39 3hws s LEU 411 Ca 0.55 -0.20 -0.04 0.00 0.02 0.00 0.00 54.13 54.46 3hws s LEU 411 Cb -0.27 -1.86 -0.03 0.00 0.02 0.00 0.00 46.19 44.05 3hws s LEU 411 CO 0.30 0.03 -0.03 -0.63 0.02 0.00 0.00 176.35 176.03 3hws s ILE 412 N 1.23 3.93 0.16 -0.59 1.09 -0.62 -5.04 121.20 121.36 3hws s ILE 412 Ca 0.04 -0.34 0.04 0.00 -1.10 0.00 0.00 60.65 59.28 3hws s ILE 412 Cb -0.15 -2.72 -0.04 0.00 -1.06 0.00 0.00 42.46 38.49 3hws s ILE 412 CO 0.02 0.49 0.22 -0.31 -0.10 0.00 0.00 174.94 175.26 3hws s TYR 413 N 0.35 3.33 0.00 3.97 1.51 -1.26 0.05 117.35 125.30 3hws s TYR 413 Ca -0.04 0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 3hws s TYR 413 Cb -0.14 -1.59 0.00 0.00 -0.11 0.00 0.00 41.96 40.11 3hws s TYR 413 CO 0.03 0.52 0.23 0.41 -1.11 0.00 0.00 175.55 175.63