#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4c s VAL 95 N 0.00 5.07 0.30 2.52 1.01 -1.26 -4.97 120.40 123.08 3h4c s VAL 95 Ca 0.00 1.03 -0.16 0.00 0.00 0.00 0.00 61.98 62.85 3h4c s VAL 95 Cb 0.00 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.42 3h4c s VAL 95 CO 0.00 0.15 0.74 -0.76 0.00 0.00 0.00 175.10 175.23 3h4c s LEU 96 N 1.77 4.12 0.30 3.92 1.43 -1.26 -5.04 118.68 123.93 3h4c s LEU 96 Ca 0.25 1.32 -0.30 0.00 -1.03 0.00 0.00 54.13 54.38 3h4c s LEU 96 Cb -0.16 -3.98 -0.11 0.00 0.03 0.00 0.00 46.19 41.98 3h4c s LEU 96 CO 0.10 -0.15 1.53 -2.28 0.23 0.00 0.00 176.35 175.77 3h4c s HIS 97 N -1.88 2.79 0.33 0.29 5.65 -1.26 -4.85 115.29 116.36 3h4c s HIS 97 Ca 0.52 0.94 0.12 0.00 0.25 0.00 0.00 55.06 56.89 3h4c s HIS 97 Cb -0.12 -3.99 1.00 0.00 -1.18 0.00 0.00 32.58 28.29 3h4c s HIS 97 CO 0.18 -3.20 1.69 -1.35 -0.65 0.00 0.00 174.74 171.41 3h4c h PRO 98 N 4.47 0.42 -0.75 2.88 0.11 -1.99 0.17 132.00 137.30 3h4c h PRO 98 Ca -0.48 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 3h4c h PRO 98 Cb 1.22 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3h4c h PRO 98 CO 0.75 0.28 0.26 1.79 -0.21 0.00 0.00 178.00 180.87 3h4c h THR 99 N 0.43 1.26 0.07 -1.15 1.35 -1.98 0.17 112.91 113.05 3h4c h THR 99 Ca 0.69 -0.87 0.02 0.00 -0.55 0.00 0.00 66.41 65.70 3h4c h THR 99 Cb 1.48 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 68.28 3h4c h THR 99 CO -0.55 0.35 -0.16 -0.03 -0.25 0.00 0.00 175.52 174.87 3h4c h MET 100 N 1.10 -0.29 -0.10 4.72 1.85 -1.25 -1.60 114.93 119.36 3h4c h MET 100 Ca 0.25 0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.34 3h4c h MET 100 Cb 0.27 0.07 -0.00 0.00 0.43 0.00 0.00 31.60 32.36 3h4c h MET 100 CO -0.01 -0.19 0.01 -0.07 -0.40 0.00 0.00 176.91 176.24 3h4c h LEU 101 N -0.30 0.17 -0.82 3.39 3.38 -1.17 -2.29 115.31 117.67 3h4c h LEU 101 Ca 0.03 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.76 3h4c h LEU 101 Cb 0.33 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 3h4c h LEU 101 CO -0.11 0.40 0.52 0.78 0.09 0.00 0.00 178.44 180.13 3h4c h ASN 102 N -0.07 0.87 -0.09 -0.43 2.35 -0.69 0.16 115.58 117.68 3h4c h ASN 102 Ca 0.03 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3h4c h ASN 102 Cb 0.31 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 3h4c h ASN 102 CO 0.00 0.59 0.04 0.00 -1.65 0.00 0.00 177.43 176.42 3h4c h MET 104 N 0.02 0.70 -0.37 0.00 1.85 -0.94 -0.66 114.93 115.54 3h4c h MET 104 Ca 0.03 -0.09 -0.03 0.00 -0.61 0.00 0.00 59.70 59.00 3h4c h MET 104 Cb 0.11 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 31.99 3h4c h MET 104 CO -0.00 0.56 0.11 0.00 -0.40 0.00 0.00 176.91 177.17 3h4c h ARG 105 N 0.66 0.58 -0.20 0.39 3.08 -0.92 -0.63 114.38 117.33 3h4c h ARG 105 Ca 0.17 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 3h4c h ARG 105 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3h4c h ARG 105 CO -0.03 0.60 0.10 0.78 -1.07 0.00 0.00 179.97 180.36 3h4c h GLY 106 N 0.45 0.31 1.07 0.04 0.00 -0.95 -0.72 103.07 103.27 3h4c h GLY 106 Ca 0.12 -0.15 -0.10 0.00 0.00 0.00 0.00 47.33 47.20 3h4c h GLY 106 CO -0.00 0.15 -0.03 -2.00 0.00 0.00 0.00 176.54 174.65 3h4c h LEU 107 N 0.21 1.01 -0.78 3.11 5.85 -1.12 -1.85 115.31 121.73 3h4c h LEU 107 Ca 0.07 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 3h4c h LEU 107 Cb 0.11 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 3h4c h LEU 107 CO -0.01 1.08 0.40 -0.74 -0.34 0.00 0.00 178.44 178.83 3h4c h HIS 108 N 0.90 1.10 0.38 1.25 2.76 -0.98 -1.22 115.15 119.34 3h4c h HIS 108 Ca 0.16 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.26 3h4c h HIS 108 Cb 0.59 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.20 3h4c h HIS 108 CO 0.04 0.79 -0.18 -0.22 -1.30 0.00 0.00 177.93 177.06 3h4c h LYS 109 N 1.09 -0.49 0.00 5.26 3.64 -0.97 -2.88 116.57 122.23 3h4c h LYS 109 Ca 0.27 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.66 3h4c h LYS 109 Cb 0.08 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3h4c h LYS 109 CO -0.04 -0.27 -0.12 0.87 -2.27 0.00 0.00 179.45 177.62 3h4c h LYS 110 N -0.59 0.00 0.00 1.90 1.57 -1.24 -1.07 116.57 117.14 3h4c h LYS 110 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3h4c h LYS 110 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3h4c h LYS 110 CO 0.08 0.12 0.00 0.00 -0.57 0.00 0.00 179.45 179.09 3h4c n ALA 111 N -2.36 2.26 -3.17 3.86 0.00 -0.47 -4.92 120.51 115.71 3h4c n ALA 111 Ca -0.02 -0.05 -0.23 0.00 0.00 0.00 0.00 53.44 53.14 3h4c n ALA 111 Cb 0.22 -1.46 0.04 0.00 0.00 0.00 0.00 19.45 18.25 3h4c n ALA 111 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h4c n VAL 112 N -1.91 -2.19 -2.61 0.00 0.31 -0.41 -4.99 118.33 106.53 3h4c n VAL 112 Ca 0.06 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.07 3h4c n VAL 112 Cb 0.38 -3.54 -0.04 0.00 -0.91 0.00 0.00 33.84 29.73 3h4c n VAL 112 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3h4c s LEU 113 N -6.83 3.75 0.45 7.52 1.43 -1.13 -5.03 118.68 118.83 3h4c s LEU 113 Ca 0.37 1.47 -0.25 0.00 -1.03 0.00 0.00 54.13 54.69 3h4c s LEU 113 Cb -0.17 -4.37 -0.08 0.00 0.03 0.00 0.00 46.19 41.61 3h4c s LEU 113 CO 0.46 -0.49 1.30 -2.84 0.23 0.00 0.00 176.35 175.01 3h4c s PRO 114 N -3.82 3.75 0.20 1.29 0.02 -1.26 -4.92 135.00 130.26 3h4c s PRO 114 Ca 0.57 2.12 -0.20 0.00 0.02 0.00 0.00 61.00 63.51 3h4c s PRO 114 Cb -0.10 -2.59 0.15 0.00 0.02 0.00 0.00 34.50 31.98 3h4c s PRO 114 CO 0.28 -0.66 1.57 1.49 -0.33 0.00 0.00 177.00 179.34 3h4c h GLU 115 N 2.30 -0.10 0.00 5.54 4.57 -1.98 -1.48 114.58 123.43 3h4c h GLU 115 Ca -0.50 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3h4c h GLU 115 Cb 1.26 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3h4c h GLU 115 CO 0.61 -0.06 0.00 -2.30 -1.18 0.00 0.00 179.01 176.07 3h4c n PRO 116 N -5.44 0.11 -0.09 0.92 -0.02 -1.26 -0.56 135.00 128.66 3h4c n PRO 116 Ca 0.06 0.57 -0.14 0.00 -2.02 0.00 0.00 63.50 61.97 3h4c n PRO 116 Cb 0.37 -1.83 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 3h4c n PRO 116 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3h4c h VAL 117 N 0.00 1.29 -0.31 -1.45 2.07 -1.63 -1.85 116.25 114.38 3h4c h VAL 117 Ca 0.00 -1.55 0.01 0.00 0.82 0.00 0.00 66.70 65.98 3h4c h VAL 117 Cb 0.06 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3h4c h VAL 117 CO 0.00 0.50 0.19 0.25 0.02 0.00 0.00 177.57 178.53 3h4c h LEU 118 N 0.53 0.31 -0.76 2.57 5.85 -0.88 -0.54 115.31 122.40 3h4c h LEU 118 Ca 0.04 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3h4c h LEU 118 Cb 0.96 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 3h4c h LEU 118 CO 0.09 0.23 0.47 0.44 -0.34 0.00 0.00 178.44 179.32 3h4c h ASP 119 N 0.39 0.75 -0.64 1.25 3.32 -1.46 0.55 116.42 120.57 3h4c h ASP 119 Ca 0.12 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 3h4c h ASP 119 Cb -0.02 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3h4c h ASP 119 CO -0.05 0.50 0.12 -0.09 -1.72 0.00 0.00 179.24 178.00 3h4c h ARG 120 N 0.89 1.05 -0.92 3.56 9.65 -1.15 -1.74 114.38 125.73 3h4c h ARG 120 Ca 0.32 -0.28 0.04 0.00 -1.10 0.00 0.00 59.98 58.96 3h4c h ARG 120 Cb 0.08 -0.13 -0.06 0.00 -1.39 0.00 0.00 29.97 28.48 3h4c h ARG 120 CO -0.14 0.97 0.59 0.78 2.80 0.00 0.00 179.97 184.97 3h4c h GLY 121 N 0.97 1.35 0.90 2.80 0.00 -0.23 -1.33 103.07 107.53 3h4c h GLY 121 Ca 0.20 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 3h4c h GLY 121 CO 0.01 0.37 0.06 -2.22 0.00 0.00 0.00 176.54 174.76 3h4c h ILE 122 N 1.14 1.23 -0.47 2.60 1.08 -0.64 -2.47 117.51 119.98 3h4c h ILE 122 Ca 0.37 -0.80 0.03 0.00 -0.39 0.00 0.00 64.86 64.08 3h4c h ILE 122 Cb 0.04 1.12 -0.03 0.00 -3.07 0.00 0.00 36.82 34.87 3h4c h ILE 122 CO -0.13 0.27 0.26 -0.08 -0.69 0.00 0.00 178.15 177.78 3h4c h GLU 123 N 0.38 0.51 -0.66 2.37 4.81 -1.00 -0.82 114.58 120.16 3h4c h GLU 123 Ca 0.10 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 3h4c h GLU 123 Cb 0.33 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3h4c h GLU 123 CO 0.00 0.34 0.14 -0.07 -0.73 0.00 0.00 179.01 178.70 3h4c h LEU 124 N 0.52 1.01 -0.42 1.64 3.38 -1.23 -2.34 115.31 117.88 3h4c h LEU 124 Ca 0.20 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 3h4c h LEU 124 Cb 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3h4c h LEU 124 CO -0.11 0.98 -0.15 0.00 0.09 0.00 0.00 178.44 179.25 3h4c h ALA 125 N 1.14 0.59 -0.72 1.53 0.00 -1.15 -1.17 119.26 119.48 3h4c h ALA 125 Ca 0.21 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3h4c h ALA 125 Cb 0.38 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3h4c h ALA 125 CO 0.00 0.51 0.31 0.00 0.00 0.00 0.00 179.25 180.08 3h4c h ARG 126 N 0.67 1.07 -0.31 0.00 3.08 -1.04 0.15 114.38 118.00 3h4c h ARG 126 Ca 0.10 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 59.89 3h4c h ARG 126 Cb 0.70 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 3h4c h ARG 126 CO 0.05 0.86 -0.11 0.00 -1.07 0.00 0.00 179.97 179.70 3h4c h ALA 127 N 1.15 0.43 -0.05 0.04 0.00 -1.35 0.15 119.26 119.63 3h4c h ALA 127 Ca 0.24 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3h4c h ALA 127 Cb 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3h4c h ALA 127 CO -0.02 0.29 0.00 0.35 0.00 0.00 0.00 179.25 179.86 3h4c h PHE 128 N 0.38 0.11 -0.43 0.00 3.57 -1.06 -0.50 116.94 119.00 3h4c h PHE 128 Ca 0.07 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 3h4c h PHE 128 Cb 0.62 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 3h4c h PHE 128 CO 0.06 0.37 0.09 0.28 -2.23 0.00 0.00 178.31 176.88 3h4c h VAL 129 N -0.19 1.24 -0.86 1.41 2.07 -0.74 -1.44 116.25 117.73 3h4c h VAL 129 Ca 0.02 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 3h4c h VAL 129 Cb 0.33 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3h4c h VAL 129 CO 0.00 0.30 0.52 1.23 0.02 0.00 0.00 177.57 179.64 3h4c h GLY 130 N 0.56 1.25 1.00 2.17 0.00 -0.70 -0.57 103.07 106.79 3h4c h GLY 130 Ca 0.13 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 3h4c h GLY 130 CO 0.01 0.50 -0.10 -1.33 0.00 0.00 0.00 176.54 175.62 3h4c h GLY 131 N 1.20 -0.30 0.96 4.60 0.00 -0.77 -2.43 103.07 106.34 3h4c h GLY 131 Ca 0.31 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.74 3h4c h GLY 131 CO -0.06 -0.11 0.20 3.21 0.00 0.00 0.00 176.54 179.79 3h4c h ARG 132 N -0.29 0.53 -0.69 4.80 2.47 -0.97 -2.65 114.38 117.59 3h4c h ARG 132 Ca -0.03 -0.06 0.04 0.00 -1.26 0.00 0.00 59.98 58.67 3h4c h ARG 132 Cb 0.22 -0.10 -0.05 0.00 -1.65 0.00 0.00 29.97 28.39 3h4c h ARG 132 CO 0.05 0.44 0.42 0.00 0.56 0.00 0.00 179.97 181.44 3h4c h ARG 133 N 0.48 0.78 0.00 0.04 3.08 -1.14 0.80 114.38 118.43 3h4c h ARG 133 Ca 0.13 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 3h4c h ARG 133 Cb 0.07 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 3h4c h ARG 133 CO -0.02 0.52 -0.10 0.00 -1.07 0.00 0.00 179.97 179.30 3h4c h ALA 134 N 1.31 1.22 -0.35 0.04 0.00 -1.20 -2.19 119.26 118.09 3h4c h ALA 134 Ca 0.29 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3h4c h ALA 134 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3h4c h ALA 134 CO -0.13 0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.78 3h4c n ARG 135 N -3.52 2.32 -2.11 0.00 1.74 -0.84 -4.97 116.66 109.27 3h4c n ARG 135 Ca -0.02 -2.13 -0.13 0.00 -0.77 0.00 0.00 57.85 54.81 3h4c n ARG 135 Cb 0.24 -1.44 -0.01 0.00 -1.02 0.00 0.00 32.46 30.22 3h4c n ARG 135 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h4c n GLY 136 N 1.23 0.07 3.79 -0.13 0.00 -0.54 -5.01 105.19 104.60 3h4c n GLY 136 Ca 0.17 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 3h4c n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h4c s GLN 137 N -4.41 4.03 0.33 1.61 -0.21 0.16 -5.01 119.66 116.16 3h4c s GLN 137 Ca 0.00 0.21 -0.29 0.00 0.02 0.00 0.00 55.36 55.30 3h4c s GLN 137 Cb 0.00 -3.32 -0.10 0.00 1.00 0.00 0.00 33.01 30.58 3h4c s GLN 137 CO 0.00 0.47 1.37 0.50 -2.12 0.00 0.00 175.29 175.51 3h4c s ARG 138 N -0.27 4.28 -0.50 2.91 3.52 -1.26 -4.23 118.95 123.41 3h4c s ARG 138 Ca 0.20 2.32 -0.17 0.00 -0.13 0.00 0.00 55.73 57.95 3h4c s ARG 138 Cb -0.14 -3.05 0.08 0.00 -1.56 0.00 0.00 34.95 30.27 3h4c s ARG 138 CO 0.08 -0.31 0.49 0.08 -0.81 0.00 0.00 175.30 174.82 3h4c s VAL 139 N -0.93 5.11 0.32 7.11 1.01 -1.26 -5.05 120.40 126.70 3h4c s VAL 139 Ca 0.52 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 3h4c s VAL 139 Cb -0.42 -4.22 -0.07 0.00 0.00 0.00 0.00 36.38 31.68 3h4c s VAL 139 CO 0.54 -0.70 0.67 -1.61 0.00 0.00 0.00 175.10 174.00 3h4c s GLU 140 N 1.97 3.81 -0.99 2.72 2.02 -1.26 -4.61 118.70 122.37 3h4c s GLU 140 Ca 0.07 0.38 -0.13 0.00 0.02 0.00 0.00 54.97 55.31 3h4c s GLU 140 Cb -0.23 -2.51 0.00 0.00 0.10 0.00 0.00 34.13 31.49 3h4c s GLU 140 CO 0.08 0.14 0.70 0.54 0.02 0.00 0.00 175.26 176.74 3h4c n ARG 141 N -0.74 -1.17 -0.28 1.61 5.12 -1.26 -4.71 116.66 115.23 3h4c n ARG 141 Ca 0.01 0.65 0.07 0.00 -1.93 0.00 0.00 57.85 56.66 3h4c n ARG 141 Cb 0.53 -3.54 0.29 0.00 -1.16 0.00 0.00 32.46 28.58 3h4c n ARG 141 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 3h4c h GLN 142 N -1.14 0.87 -0.39 5.56 4.20 -1.98 -1.27 115.11 120.95 3h4c h GLN 142 Ca -0.56 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.07 3h4c h GLN 142 Cb 1.32 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.89 3h4c h GLN 142 CO 0.42 0.58 0.11 -1.35 -0.67 0.00 0.00 178.83 177.92 3h4c h PRO 143 N 0.90 0.57 -0.19 1.46 0.11 -1.90 -1.24 132.00 131.71 3h4c h PRO 143 Ca 0.40 -0.09 -0.19 0.00 0.11 0.00 0.00 66.00 66.24 3h4c h PRO 143 Cb 0.37 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 3h4c h PRO 143 CO -0.17 0.51 -0.63 -0.44 -0.21 0.00 0.00 178.00 177.06 3h4c h ASP 144 N 0.57 0.76 -0.75 -2.05 3.32 -1.61 -1.36 116.42 115.31 3h4c h ASP 144 Ca 0.13 -0.45 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 3h4c h ASP 144 Cb 0.19 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 3h4c h ASP 144 CO -0.01 1.21 0.37 0.58 -1.72 0.00 0.00 179.24 179.67 3h4c h VAL 145 N 0.49 1.24 0.11 -1.35 2.07 -1.19 -1.20 116.25 116.42 3h4c h VAL 145 Ca -0.01 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 3h4c h VAL 145 Cb 1.22 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3h4c h VAL 145 CO 0.13 0.27 -0.05 0.00 0.02 0.00 0.00 177.57 177.93 3h4c h ALA 146 N 1.19 -0.15 -0.67 1.67 0.00 -1.05 -1.41 119.26 118.83 3h4c h ALA 146 Ca 0.26 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.20 3h4c h ALA 146 Cb 0.09 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3h4c h ALA 146 CO -0.04 -0.59 0.37 0.00 0.00 0.00 0.00 179.25 179.00 3h4c h ALA 147 N 0.74 0.91 -0.58 0.00 0.00 -1.05 -1.47 119.26 117.80 3h4c h ALA 147 Ca -0.01 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3h4c h ALA 147 Cb 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3h4c h ALA 147 CO 0.02 0.03 0.12 0.00 0.00 0.00 0.00 179.25 179.43 3h4c h ALA 148 N 1.36 0.77 -0.44 0.00 0.00 -1.05 -0.46 119.26 119.43 3h4c h ALA 148 Ca 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3h4c h ALA 148 Cb 0.21 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3h4c h ALA 148 CO -0.20 0.49 0.25 0.00 0.00 0.00 0.00 179.25 179.80 3h4c h LEU 150 N 0.57 0.90 -0.50 0.00 5.85 -0.89 -1.56 115.31 119.68 3h4c h LEU 150 Ca 0.16 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3h4c h LEU 150 Cb 0.03 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3h4c h LEU 150 CO -0.03 0.64 0.06 0.24 -0.34 0.00 0.00 178.44 179.01 3h4c h MET 151 N 1.06 0.85 -0.21 1.25 2.86 -0.85 0.15 114.93 120.04 3h4c h MET 151 Ca 0.31 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3h4c h MET 151 Cb -0.07 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 3h4c h MET 151 CO -0.08 0.85 0.14 0.82 1.06 0.00 0.00 176.91 179.69 3h4c h ILE 152 N 0.72 1.05 -0.44 -1.22 2.04 -1.17 -0.90 117.51 117.59 3h4c h ILE 152 Ca 0.15 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3h4c h ILE 152 Cb 0.43 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3h4c h ILE 152 CO 0.01 0.05 0.18 0.00 0.00 0.00 0.00 178.15 178.40 3h4c h ALA 153 N 1.08 0.54 -0.66 1.87 0.00 -1.01 -1.21 119.26 119.88 3h4c h ALA 153 Ca 0.08 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3h4c h ALA 153 Cb -0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3h4c h ALA 153 CO -0.02 -0.19 0.23 0.00 0.00 0.00 0.00 179.25 179.26 3h4c h ALA 154 N 1.27 1.17 -0.23 0.00 0.00 -0.40 -2.35 119.26 118.71 3h4c h ALA 154 Ca 0.20 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 3h4c h ALA 154 Cb 0.16 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3h4c h ALA 154 CO -0.18 0.59 -0.51 0.93 0.00 0.00 0.00 179.25 180.08 3h4c h GLU 155 N 0.96 0.65 -0.68 0.00 5.08 -0.75 0.17 114.58 120.00 3h4c h GLU 155 Ca 0.22 -0.39 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 3h4c h GLU 155 Cb 0.24 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 3h4c h GLU 155 CO -0.01 1.00 0.45 0.93 -1.00 0.00 0.00 179.01 180.38 3h4c h GLU 156 N 0.51 0.85 -0.28 2.33 5.08 -1.01 -0.40 114.58 121.66 3h4c h GLU 156 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3h4c h GLU 156 Cb 1.06 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3h4c h GLU 156 CO 0.10 0.56 0.00 0.00 -1.00 0.00 0.00 179.01 178.67 3h4c n ALA 157 N -2.44 2.47 -2.97 3.43 0.00 -0.90 -4.91 120.51 115.18 3h4c n ALA 157 Ca 0.08 -0.53 -0.22 0.00 0.00 0.00 0.00 53.44 52.77 3h4c n ALA 157 Cb 0.08 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.55 3h4c n ALA 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h4c n GLN 158 N 0.36 -4.13 -3.09 0.00 6.02 -0.16 -4.90 117.38 111.48 3h4c n GLN 158 Ca 0.11 0.83 -0.26 0.00 -0.01 0.00 0.00 57.00 57.68 3h4c n GLN 158 Cb 0.27 -5.64 -0.05 0.00 1.02 0.00 0.00 30.24 25.84 3h4c n GLN 158 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3h4c n GLN 159 N -3.80 2.68 -1.74 -1.09 1.13 0.54 -4.89 117.38 110.22 3h4c n GLN 159 Ca -0.12 -4.56 -0.38 0.00 -1.94 0.00 0.00 57.00 50.01 3h4c n GLN 159 Cb 0.62 -2.13 0.06 0.00 0.11 0.00 0.00 30.24 28.90 3h4c n GLN 159 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 3h4c s PRO 160 N -3.03 2.77 -0.45 -1.09 0.02 -1.24 -4.46 135.00 127.53 3h4c s PRO 160 Ca 0.45 2.16 0.03 0.00 0.02 0.00 0.00 61.00 63.66 3h4c s PRO 160 Cb 0.26 -2.01 0.12 0.00 0.02 0.00 0.00 34.50 32.89 3h4c s PRO 160 CO -0.10 -1.46 0.21 -1.17 -0.33 0.00 0.00 177.00 174.15 3h4c s LEU 161 N -4.03 3.75 0.80 -5.54 2.96 -1.26 -4.94 118.68 110.41 3h4c s LEU 161 Ca 0.78 -2.65 -0.10 0.00 -0.22 0.00 0.00 54.13 51.94 3h4c s LEU 161 Cb -0.39 -1.40 0.07 0.00 0.50 0.00 0.00 46.19 44.97 3h4c s LEU 161 CO 0.44 -0.28 1.10 -2.16 -1.32 0.00 0.00 176.35 174.13 3h4c s PRO 162 N 0.25 2.01 0.34 0.98 0.04 -1.26 -4.82 135.00 132.53 3h4c s PRO 162 Ca 0.16 1.23 0.02 0.00 0.04 0.00 0.00 61.00 62.45 3h4c s PRO 162 Cb -0.24 -1.86 0.60 0.00 0.04 0.00 0.00 34.50 33.04 3h4c s PRO 162 CO -0.03 -1.84 1.97 1.25 0.04 0.00 0.00 177.00 178.39 3h4c h LEU 163 N -1.27 0.70 -1.02 -3.56 5.85 -1.99 -2.28 115.31 111.73 3h4c h LEU 163 Ca -0.43 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.27 3h4c h LEU 163 Cb 1.24 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.03 3h4c h LEU 163 CO 0.50 0.56 0.65 0.00 -0.34 0.00 0.00 178.44 179.81 3h4c h ALA 164 N 1.56 1.34 -0.25 1.25 0.00 -1.97 -0.48 119.26 120.70 3h4c h ALA 164 Ca 0.21 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3h4c h ALA 164 Cb 0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3h4c h ALA 164 CO -0.04 0.56 0.01 1.49 0.00 0.00 0.00 179.25 181.28 3h4c h GLU 165 N 1.27 0.44 -0.56 0.00 4.81 -1.62 -2.21 114.58 116.71 3h4c h GLU 165 Ca 0.39 -0.13 0.08 0.00 -0.13 0.00 0.00 59.36 59.57 3h4c h GLU 165 Cb -0.01 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.26 3h4c h GLU 165 CO -0.12 0.60 0.22 0.28 -0.73 0.00 0.00 179.01 179.26 3h4c h VAL 166 N 0.23 0.82 -0.13 0.32 2.07 -0.95 0.21 116.25 118.81 3h4c h VAL 166 Ca 0.07 -0.14 -0.08 0.00 0.82 0.00 0.00 66.70 67.37 3h4c h VAL 166 Cb 0.39 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3h4c h VAL 166 CO 0.01 0.08 -0.28 0.03 0.02 0.00 0.00 177.57 177.43 3h4c h ARG 167 N 0.41 0.25 -0.04 1.57 3.08 -1.07 0.38 114.38 118.97 3h4c h ARG 167 Ca 0.27 -0.09 -0.24 0.00 0.07 0.00 0.00 59.98 60.00 3h4c h ARG 167 Cb 0.30 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.34 3h4c h ARG 167 CO -0.26 0.52 -0.93 0.00 -1.07 0.00 0.00 179.97 178.23 3h4c h LEU 169 N 0.36 0.49 -6.80 0.00 3.38 -0.40 -3.41 115.31 108.93 3h4c h LEU 169 Ca -0.09 -0.28 -0.46 0.00 0.09 0.00 0.00 57.88 57.13 3h4c h LEU 169 Cb 1.56 -0.14 -0.39 0.00 0.09 0.00 0.00 40.66 41.78 3h4c h LEU 169 CO 0.18 0.98 -0.74 -0.62 0.09 0.00 0.00 178.44 178.33 3h4c s ASP 170 N -6.93 2.80 0.00 -0.43 -1.08 0.11 -5.02 116.67 106.12 3h4c s ASP 170 Ca -0.06 -0.96 0.19 0.00 -0.52 0.00 0.00 52.55 51.20 3h4c s ASP 170 Cb 0.11 -0.13 0.87 0.00 -1.46 0.00 0.00 42.92 42.32 3h4c s ASP 170 CO 0.83 -0.40 1.62 -0.24 0.52 0.00 0.00 175.17 177.49 3h4c n SER 171 N 5.27 0.00 0.07 -0.34 2.88 -1.10 -3.09 113.62 117.31 3h4c n SER 171 Ca -0.06 0.36 0.12 0.00 -1.33 0.00 0.00 58.87 57.96 3h4c n SER 171 Cb 0.45 -0.44 0.11 0.00 -0.75 0.00 0.00 64.21 63.58 3h4c n SER 171 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 3h4c h SER 172 N 0.00 0.00 -3.83 -3.46 4.64 -1.94 -3.48 113.55 105.48 3h4c h SER 172 Ca 0.00 -0.18 -0.52 0.00 -0.47 0.00 0.00 61.79 60.62 3h4c h SER 172 Cb 0.29 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.44 3h4c h SER 172 CO 0.00 0.09 0.65 -0.76 -0.87 0.00 0.00 176.83 175.94 3h4c s LEU 173 N -4.49 4.42 0.00 5.97 1.43 -1.18 -5.02 118.68 119.81 3h4c s LEU 173 Ca 0.04 2.70 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 3h4c s LEU 173 Cb 0.12 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.70 3h4c s LEU 173 CO 0.75 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 177.37 3h4c n GLY 174 N 0.93 0.57 3.34 -3.19 0.00 -1.26 -4.91 105.19 100.67 3h4c n GLY 174 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3h4c n GLY 174 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3h4c n ASP 175 N 0.00 4.19 -0.15 1.61 4.64 -1.26 -4.74 116.55 120.84 3h4c n ASP 175 Ca 0.00 -2.85 -0.08 0.00 -1.38 0.00 0.00 54.79 50.48 3h4c n ASP 175 Cb 0.00 -1.68 0.07 0.00 -1.04 0.00 0.00 41.12 38.47 3h4c n ASP 175 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 3h4c h VAL 176 N 5.20 1.26 -0.99 5.18 2.07 -1.91 -3.07 116.25 123.99 3h4c h VAL 176 Ca 0.44 -1.22 0.05 0.00 0.82 0.00 0.00 66.70 66.80 3h4c h VAL 176 Cb 0.81 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 3h4c h VAL 176 CO 1.57 0.43 0.65 -0.33 0.02 0.00 0.00 177.57 179.90 3h4c h GLU 177 N 0.83 1.16 -0.37 1.57 5.08 -1.93 -0.36 114.58 120.57 3h4c h GLU 177 Ca 0.14 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3h4c h GLU 177 Cb 0.63 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 3h4c h GLU 177 CO 0.04 0.77 0.19 1.25 -1.00 0.00 0.00 179.01 180.26 3h4c h LEU 178 N 1.20 0.47 -0.92 1.33 5.85 -1.94 -1.98 115.31 119.32 3h4c h LEU 178 Ca 0.42 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 3h4c h LEU 178 Cb 0.11 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3h4c h LEU 178 CO -0.15 0.45 0.21 0.03 -0.34 0.00 0.00 178.44 178.64 3h4c h ARG 179 N 0.47 1.00 -0.38 1.25 2.47 -1.38 -0.52 114.38 117.29 3h4c h ARG 179 Ca 0.13 -0.20 -0.00 0.00 -1.26 0.00 0.00 59.98 58.65 3h4c h ARG 179 Cb 0.09 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.24 3h4c h ARG 179 CO -0.02 0.85 0.23 -0.09 0.56 0.00 0.00 179.97 181.51 3h4c h ARG 180 N 0.97 0.51 -0.84 0.04 2.43 -0.87 0.00 114.38 116.62 3h4c h ARG 180 Ca 0.22 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 3h4c h ARG 180 Cb 0.27 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 3h4c h ARG 180 CO -0.01 0.37 0.55 0.00 -1.51 0.00 0.00 179.97 179.37 3h4c h ALA 181 N 1.11 1.08 -0.53 2.80 0.00 -0.94 -0.74 119.26 122.04 3h4c h ALA 181 Ca 0.14 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h4c h ALA 181 Cb -0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3h4c h ALA 181 CO -0.03 0.43 0.35 -0.44 0.00 0.00 0.00 179.25 179.56 3h4c h ASP 182 N 1.10 0.59 -0.14 0.00 3.32 -0.56 -1.29 116.42 119.43 3h4c h ASP 182 Ca 0.32 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 3h4c h ASP 182 Cb -0.07 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 3h4c h ASP 182 CO -0.09 0.43 0.03 0.40 -1.72 0.00 0.00 179.24 178.29 3h4c h ILE 183 N 0.70 1.20 -0.29 0.35 2.04 -0.69 -0.96 117.51 119.86 3h4c h ILE 183 Ca 0.20 -0.63 0.05 0.00 1.00 0.00 0.00 64.86 65.48 3h4c h ILE 183 Cb -0.06 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 3h4c h ILE 183 CO -0.05 0.19 0.03 0.58 0.00 0.00 0.00 178.15 178.89 3h4c h VAL 184 N 0.03 0.82 -0.14 1.67 2.07 -1.02 0.05 116.25 119.73 3h4c h VAL 184 Ca 0.04 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3h4c h VAL 184 Cb 0.26 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3h4c h VAL 184 CO 0.00 0.02 0.03 -0.09 0.02 0.00 0.00 177.57 177.55 3h4c h ARG 185 N 0.12 0.22 0.00 1.57 2.43 -1.17 0.13 114.38 117.69 3h4c h ARG 185 Ca 0.14 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.15 3h4c h ARG 185 Cb 0.17 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 3h4c h ARG 185 CO -0.21 0.39 -0.50 0.93 -1.51 0.00 0.00 179.97 179.06 3h4c h GLU 186 N 0.02 0.00 -0.11 0.20 5.08 -0.97 -2.70 114.58 116.10 3h4c h GLU 186 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3h4c h GLU 186 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3h4c h GLU 186 CO 0.00 0.50 0.00 1.28 -1.00 0.00 0.00 179.01 179.79 3h4c n LEU 187 N -3.39 2.41 -3.56 1.33 4.77 -0.01 -4.98 117.00 113.57 3h4c n LEU 187 Ca 0.01 -0.88 -0.21 0.00 -0.03 0.00 0.00 56.01 54.89 3h4c n LEU 187 Cb 0.65 -0.06 0.07 0.00 -2.33 0.00 0.00 43.42 41.76 3h4c n LEU 187 CO 0.40 0.44 0.13 1.41 -1.33 0.00 0.00 177.39 178.44 3h4c n HIS 188 N 0.86 -2.38 -0.99 -1.77 8.25 -0.48 -4.93 115.22 113.78 3h4c n HIS 188 Ca 0.17 0.95 -0.06 0.00 -0.26 0.00 0.00 57.72 58.52 3h4c n HIS 188 Cb 0.48 -4.90 0.31 0.00 1.12 0.00 0.00 29.99 27.00 3h4c n HIS 188 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3h4c n LEU 189 N -4.46 6.07 -0.30 2.41 4.77 0.33 -4.68 117.00 121.14 3h4c n LEU 189 Ca -0.17 -3.16 -0.01 0.00 -0.03 0.00 0.00 56.01 52.64 3h4c n LEU 189 Cb 0.63 -0.75 0.12 0.00 -2.33 0.00 0.00 43.42 41.09 3h4c n LEU 189 CO 0.64 0.79 1.18 -0.33 -1.33 0.00 0.00 177.39 178.35 3h4c h GLU 190 N 2.71 0.94 -0.48 3.23 3.07 -1.92 0.65 114.58 122.77 3h4c h GLU 190 Ca 0.26 -0.06 -0.12 0.00 -0.50 0.00 0.00 59.36 58.94 3h4c h GLU 190 Cb 2.32 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 30.00 3h4c h GLU 190 CO 0.73 0.62 -0.16 -0.44 -1.40 0.00 0.00 179.01 178.36 3h4c h ASP 191 N 0.97 0.93 -0.29 1.42 3.32 -1.98 -1.91 116.42 118.89 3h4c h ASP 191 Ca 0.34 -0.32 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 3h4c h ASP 191 Cb 0.09 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3h4c h ASP 191 CO -0.14 1.08 -0.24 -1.28 -1.72 0.00 0.00 179.24 176.94 3h4c h SER 192 N 0.81 0.70 -0.52 6.45 0.87 -1.82 -3.10 113.55 116.96 3h4c h SER 192 Ca 0.12 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.22 3h4c h SER 192 Cb 0.71 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 3h4c h SER 192 CO 0.05 1.01 0.29 -0.08 -0.53 0.00 0.00 176.83 177.57 3h4c h GLU 193 N 0.41 0.74 -0.49 2.24 4.57 -0.76 -0.04 114.58 121.25 3h4c h GLU 193 Ca 0.05 -0.08 -0.10 0.00 -1.18 0.00 0.00 59.36 58.05 3h4c h GLU 193 Cb 0.79 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 3h4c h GLU 193 CO 0.06 0.55 -0.11 -0.09 -1.18 0.00 0.00 179.01 178.25 3h4c h ARG 194 N 0.75 0.89 -0.33 1.92 2.43 -1.38 -0.87 114.38 117.80 3h4c h ARG 194 Ca 0.19 -0.31 -0.07 0.00 -0.81 0.00 0.00 59.98 58.98 3h4c h ARG 194 Cb 0.03 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 3h4c h ARG 194 CO -0.03 0.95 -0.07 0.00 -1.51 0.00 0.00 179.97 179.31 3h4c h ARG 195 N 0.80 0.63 -0.44 0.20 3.08 -1.28 -2.56 114.38 114.82 3h4c h ARG 195 Ca 0.13 -0.24 0.04 0.00 0.07 0.00 0.00 59.98 59.99 3h4c h ARG 195 Cb 0.63 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 3h4c h ARG 195 CO 0.04 0.80 0.19 -0.07 -1.07 0.00 0.00 179.97 179.87 3h4c h LEU 196 N 0.42 0.25 -1.36 3.04 3.38 -0.88 -2.48 115.31 117.68 3h4c h LEU 196 Ca 0.08 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3h4c h LEU 196 Cb 0.57 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 3h4c h LEU 196 CO 0.03 0.18 0.37 0.03 0.09 0.00 0.00 178.44 179.15 3h4c h ARG 197 N 0.39 0.80 0.00 1.13 3.08 -1.10 -0.97 114.38 117.71 3h4c h ARG 197 Ca 0.20 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 3h4c h ARG 197 Cb 0.14 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3h4c h ARG 197 CO -0.16 0.55 -0.23 -0.44 -1.07 0.00 0.00 179.97 178.62 3h4c h ASP 198 N 0.82 0.00 -0.01 7.04 3.32 -1.11 -3.26 116.42 123.22 3h4c h ASP 198 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3h4c h ASP 198 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3h4c h ASP 198 CO -0.04 0.23 -0.29 0.35 -1.72 0.00 0.00 179.24 177.77 3h4c n THR 199 N -3.31 0.00 -0.11 0.35 -2.24 -0.91 -4.66 114.28 103.40 3h4c n THR 199 Ca 0.01 -0.36 -0.07 0.00 -2.27 0.00 0.00 64.05 61.36 3h4c n THR 199 Cb 0.48 1.16 0.01 0.00 -2.10 0.00 0.00 70.33 69.89 3h4c n THR 199 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3h4c h PHE 200 N 1.55 0.33 -0.26 4.78 3.57 -1.23 -2.05 116.94 123.63 3h4c h PHE 200 Ca 0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 3h4c h PHE 200 Cb 0.47 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3h4c h PHE 200 CO 0.00 0.17 0.08 0.00 -2.23 0.00 0.00 178.31 176.34 3h4c h ALA 201 N 1.20 0.34 -0.38 2.41 0.00 -1.83 -1.50 119.26 119.50 3h4c h ALA 201 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h4c h ALA 201 Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3h4c h ALA 201 CO -0.11 -0.03 0.18 -0.44 0.00 0.00 0.00 179.25 178.85 3h4c h ASP 202 N 0.26 0.50 0.31 0.00 5.19 -1.84 -1.64 116.42 119.19 3h4c h ASP 202 Ca 0.09 -0.13 -0.10 0.00 -0.62 0.00 0.00 57.03 56.26 3h4c h ASP 202 Cb 0.23 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.60 3h4c h ASP 202 CO -0.00 0.49 -0.43 0.78 -3.12 0.00 0.00 179.24 176.96 3h4c h ASN 203 N 0.47 0.17 -0.18 6.45 2.35 -1.26 -0.91 115.58 122.67 3h4c h ASN 203 Ca 0.13 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.66 3h4c h ASN 203 Cb 0.12 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3h4c h ASN 203 CO -0.02 0.58 -0.48 0.25 -1.65 0.00 0.00 177.43 176.11 3h4c h LEU 204 N 0.13 0.74 -0.21 1.61 5.85 -1.19 -2.15 115.31 120.09 3h4c h LEU 204 Ca 0.01 -0.58 0.05 0.00 0.84 0.00 0.00 57.88 58.20 3h4c h LEU 204 Cb 0.81 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 3h4c h LEU 204 CO 0.06 1.18 -0.10 -0.07 -0.34 0.00 0.00 178.44 179.18 3h4c h LEU 205 N 0.33 -0.34 -0.45 2.25 3.38 -0.96 -1.01 115.31 118.51 3h4c h LEU 205 Ca -0.01 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3h4c h LEU 205 Cb 1.10 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 3h4c h LEU 205 CO 0.10 -0.13 0.29 0.58 0.09 0.00 0.00 178.44 179.38 3h4c h VAL 206 N -0.08 1.12 -0.26 1.22 2.07 -1.20 0.10 116.25 119.22 3h4c h VAL 206 Ca 0.11 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.44 3h4c h VAL 206 Cb 0.25 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 3h4c h VAL 206 CO -0.26 0.12 -0.02 0.50 0.02 0.00 0.00 177.57 177.93 3h4c h LYS 207 N 0.61 0.06 -0.46 1.57 3.64 -1.05 -0.61 116.57 120.33 3h4c h LYS 207 Ca 0.17 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.42 3h4c h LYS 207 Cb -0.05 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3h4c h LYS 207 CO -0.03 0.04 -0.20 1.88 -2.27 0.00 0.00 179.45 178.87 3h4c h TYR 208 N 0.06 1.08 -0.58 1.91 0.05 -0.80 -1.95 116.97 116.74 3h4c h TYR 208 Ca 0.13 -0.26 0.03 0.00 0.05 0.00 0.00 58.73 58.68 3h4c h TYR 208 Cb 0.17 -0.25 -0.04 0.00 1.01 0.00 0.00 36.73 37.62 3h4c h TYR 208 CO -0.22 1.07 0.34 0.82 -1.05 0.00 0.00 178.16 179.12 3h4c h ILE 209 N 0.79 1.03 -0.53 -2.88 2.04 -0.54 -1.36 117.51 116.06 3h4c h ILE 209 Ca 0.11 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 3h4c h ILE 209 Cb 0.77 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3h4c h ILE 209 CO 0.06 0.12 -0.06 -0.07 0.00 0.00 0.00 178.15 178.20 3h4c h LEU 210 N 0.66 0.94 -1.15 1.44 3.38 -1.03 -1.39 115.31 118.16 3h4c h LEU 210 Ca 0.24 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 3h4c h LEU 210 Cb 0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3h4c h LEU 210 CO -0.12 1.03 -0.31 0.11 0.09 0.00 0.00 178.44 179.24 3h4c h LYS 211 N 0.86 0.20 -0.12 1.13 1.57 -1.02 -2.84 116.57 116.36 3h4c h LYS 211 Ca 0.15 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3h4c h LYS 211 Cb 0.59 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3h4c h LYS 211 CO 0.04 0.50 0.00 1.28 -0.57 0.00 0.00 179.45 180.69 3h4c n LEU 212 N -4.12 1.08 -1.52 2.94 4.32 -0.54 -4.91 117.00 114.25 3h4c n LEU 212 Ca -0.01 -0.46 -0.14 0.00 -0.02 0.00 0.00 56.01 55.37 3h4c n LEU 212 Cb 0.39 -0.08 -0.02 0.00 -1.62 0.00 0.00 43.42 42.10 3h4c n LEU 212 CO 0.40 0.23 -0.17 0.61 -1.22 0.00 0.00 177.39 177.24 3h4c n GLY 213 N 0.99 0.20 4.00 -0.72 0.00 -1.07 -5.01 105.19 103.58 3h4c n GLY 213 Ca 0.15 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 3h4c n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4c s LEU 214 N -3.94 3.80 -0.44 0.99 1.43 -0.53 -5.05 118.68 114.93 3h4c s LEU 214 Ca 0.00 -0.27 -0.21 0.00 -1.03 0.00 0.00 54.13 52.62 3h4c s LEU 214 Cb 0.00 -2.73 0.03 0.00 0.03 0.00 0.00 46.19 43.52 3h4c s LEU 214 CO 0.00 -0.61 0.65 -1.58 0.23 0.00 0.00 176.35 175.04 3h4c s GLN 215 N -4.28 3.28 0.19 1.70 0.74 -1.26 -4.53 119.66 115.50 3h4c s GLN 215 Ca 0.50 -0.38 -0.12 0.00 0.05 0.00 0.00 55.36 55.41 3h4c s GLN 215 Cb -0.10 -3.96 0.22 0.00 1.10 0.00 0.00 33.01 30.28 3h4c s GLN 215 CO 0.32 -1.03 1.71 0.28 -0.55 0.00 0.00 175.29 176.02 3h4c h VAL 216 N 5.89 0.68 0.00 1.34 2.07 -1.97 -1.79 116.25 122.47 3h4c h VAL 216 Ca -0.25 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3h4c h VAL 216 Cb 1.09 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 3h4c h VAL 216 CO 0.90 0.04 0.00 0.77 0.02 0.00 0.00 177.57 179.30 3h4c h SER 217 N 0.23 0.00 0.00 0.57 4.64 -2.00 0.88 113.55 117.86 3h4c h SER 217 Ca 0.27 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.46 3h4c h SER 217 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 3h4c h SER 217 CO -0.36 0.00 -0.89 0.25 -0.87 0.00 0.00 176.83 174.96 3h4c h LEU 218 N 0.00 0.00 -0.07 5.97 5.85 -1.85 -3.43 115.31 121.78 3h4c h LEU 218 Ca 0.00 -0.31 -0.24 0.00 0.84 0.00 0.00 57.88 58.17 3h4c h LEU 218 Cb 0.22 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 3h4c h LEU 218 CO 0.00 1.16 -1.05 1.88 -0.34 0.00 0.00 178.44 180.08 3h4c h TYR 219 N -1.00 0.49 0.82 1.25 -1.99 -1.05 -3.34 116.97 112.14 3h4c h TYR 219 Ca -0.19 -0.30 -0.04 0.00 2.00 0.00 0.00 58.73 60.20 3h4c h TYR 219 Cb 0.94 -0.04 0.01 0.00 2.00 0.00 0.00 36.73 39.64 3h4c h TYR 219 CO -0.02 1.17 -0.42 1.25 -0.00 0.00 0.00 178.16 180.14 3h4c h LEU 220 N 0.14 -1.00 -1.53 3.88 5.85 -1.07 0.17 115.31 121.75 3h4c h LEU 220 Ca -0.09 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 3h4c h LEU 220 Cb 1.73 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 43.02 3h4c h LEU 220 CO 0.17 -0.69 -0.25 1.55 -0.34 0.00 0.00 178.44 178.89 3h4c h PRO 221 N -1.13 0.00 -0.02 5.25 0.13 -1.78 -0.49 132.00 133.97 3h4c h PRO 221 Ca -0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 3h4c h PRO 221 Cb 0.88 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 3h4c h PRO 221 CO 0.17 0.25 -0.03 1.25 -0.23 0.00 0.00 178.00 179.40 3h4c h HIS 222 N 0.00 0.06 0.00 1.56 -0.00 -1.65 -2.90 115.15 112.22 3h4c h HIS 222 Ca -0.00 -0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.28 3h4c h HIS 222 Cb 0.48 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.87 3h4c h HIS 222 CO 0.00 0.59 -0.30 0.00 -0.00 0.00 0.00 177.93 178.22 3h4c h LYS 224 N 0.00 0.84 -0.25 0.00 1.57 -1.12 0.17 116.57 117.78 3h4c h LYS 224 Ca -0.00 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.58 3h4c h LYS 224 Cb 0.55 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3h4c h LYS 224 CO 0.04 0.56 -0.45 0.00 -0.57 0.00 0.00 179.45 179.03 3h4c h ARG 225 N 0.87 0.64 -0.64 3.15 3.08 -1.01 -2.54 114.38 117.93 3h4c h ARG 225 Ca 0.26 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 3h4c h ARG 225 Cb -0.03 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 3h4c h ARG 225 CO -0.09 0.96 0.40 -0.07 -1.07 0.00 0.00 179.97 180.10 3h4c h LEU 226 N 0.52 0.76 -0.44 3.04 3.38 -0.79 -2.20 115.31 119.57 3h4c h LEU 226 Ca 0.03 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.03 3h4c h LEU 226 Cb 0.98 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 3h4c h LEU 226 CO 0.09 0.58 0.07 -0.07 0.09 0.00 0.00 178.44 179.20 3h4c h LEU 227 N 0.87 -0.03 -0.57 1.67 3.38 -0.40 -0.92 115.31 119.30 3h4c h LEU 227 Ca 0.23 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 3h4c h LEU 227 Cb -0.05 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3h4c h LEU 227 CO -0.05 0.02 0.31 0.74 0.09 0.00 0.00 178.44 179.55 3h4c h THR 228 N 0.20 1.19 -0.60 0.22 2.02 -1.33 -2.86 112.91 111.75 3h4c h THR 228 Ca 0.22 -0.47 0.04 0.00 0.77 0.00 0.00 66.41 66.97 3h4c h THR 228 Cb 0.29 0.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 3h4c h THR 228 CO -0.30 0.20 0.34 0.00 0.37 0.00 0.00 175.52 176.14 3h4c h ALA 229 N 1.14 0.79 -0.66 6.16 0.00 -0.79 -2.84 119.26 123.05 3h4c h ALA 229 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3h4c h ALA 229 Cb 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3h4c h ALA 229 CO -0.03 0.04 0.40 -0.07 0.00 0.00 0.00 179.25 179.59 3h4c h LEU 230 N 0.66 0.79 -0.98 0.00 3.38 -0.97 -1.73 115.31 116.46 3h4c h LEU 230 Ca 0.26 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3h4c h LEU 230 Cb 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3h4c h LEU 230 CO -0.14 0.61 0.00 1.23 0.09 0.00 0.00 178.44 180.23 3h4c h GLY 231 N 0.94 0.00 -2.46 0.83 0.00 -1.31 -2.78 103.07 98.29 3h4c h GLY 231 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 3h4c h GLY 231 CO -0.04 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.04 3h4c n ARG 232 N -2.48 2.61 -3.49 4.80 1.74 -0.65 -4.86 116.66 114.33 3h4c n ARG 232 Ca 0.01 -2.46 -0.42 0.00 -0.77 0.00 0.00 57.85 54.21 3h4c n ARG 232 Cb 0.24 -1.53 -0.10 0.00 -1.02 0.00 0.00 32.46 30.04 3h4c n ARG 232 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h4c s VAL 233 N -1.24 5.10 0.24 1.55 1.01 -1.05 -4.98 120.40 121.03 3h4c s VAL 233 Ca 0.43 -0.71 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 3h4c s VAL 233 Cb 0.24 -3.84 0.21 0.00 0.00 0.00 0.00 36.38 32.98 3h4c s VAL 233 CO 0.32 -0.30 1.74 -0.08 0.00 0.00 0.00 175.10 176.79 3h4c h GLU 234 N 8.58 0.48 0.00 2.72 4.81 -1.89 -0.69 114.58 128.60 3h4c h GLU 234 Ca -0.27 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 3h4c h GLU 234 Cb 1.12 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3h4c h GLU 234 CO 0.72 0.31 0.00 0.00 -0.73 0.00 0.00 179.01 179.31 3h4c h ALA 235 N 1.52 1.00 -0.37 2.92 0.00 -1.95 -2.51 119.26 119.87 3h4c h ALA 235 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3h4c h ALA 235 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3h4c h ALA 235 CO -0.37 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.16 3h4c n LEU 236 N -2.70 3.35 -4.76 0.00 4.77 -0.27 -4.97 117.00 112.43 3h4c n LEU 236 Ca -0.01 -1.51 -0.39 0.00 -0.03 0.00 0.00 56.01 54.07 3h4c n LEU 236 Cb 0.15 -0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 3h4c n LEU 236 CO 0.19 0.73 1.02 0.00 -1.33 0.00 0.00 177.39 178.00 3h4c s ALA 237 N -1.41 3.09 0.00 -1.18 0.00 -0.95 -2.24 121.76 119.07 3h4c s ALA 237 Ca 0.36 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.71 3h4c s ALA 237 Cb 0.21 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.76 3h4c s ALA 237 CO 0.29 -1.21 0.00 0.41 0.00 0.00 0.00 175.76 175.26 3h4c n GLY 238 N 0.63 3.18 3.76 0.00 0.00 -1.26 -5.04 105.19 106.46 3h4c n GLY 238 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3h4c n GLY 238 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4c s LEU 239 N 0.00 4.33 0.78 0.99 1.43 -0.95 -5.01 118.68 120.25 3h4c s LEU 239 Ca 0.00 3.01 -0.12 0.00 -1.03 0.00 0.00 54.13 56.00 3h4c s LEU 239 Cb 0.00 -3.65 0.06 0.00 0.03 0.00 0.00 46.19 42.63 3h4c s LEU 239 CO 0.00 -0.91 1.11 0.42 0.23 0.00 0.00 176.35 177.20 3h4c s THR 240 N -0.55 3.00 0.17 5.49 -4.23 -1.26 -4.86 115.64 113.40 3h4c s THR 240 Ca 0.58 0.33 -0.15 0.00 -1.18 0.00 0.00 61.69 61.27 3h4c s THR 240 Cb -0.47 -3.17 0.08 0.00 1.34 0.00 0.00 72.50 70.27 3h4c s THR 240 CO 0.56 -0.43 1.70 0.58 -0.54 0.00 0.00 174.62 176.50 3h4c h VAL 241 N -0.99 0.72 -0.90 2.29 2.07 -1.99 -0.70 116.25 116.76 3h4c h VAL 241 Ca -0.47 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.06 3h4c h VAL 241 Cb 1.28 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 3h4c h VAL 241 CO 0.62 0.03 0.59 0.00 0.02 0.00 0.00 177.57 178.82 3h4c h ALA 242 N 1.35 1.48 -0.75 1.67 0.00 -1.98 -0.02 119.26 121.01 3h4c h ALA 242 Ca 0.20 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3h4c h ALA 242 Cb 0.28 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3h4c h ALA 242 CO -0.32 0.41 0.28 -0.44 0.00 0.00 0.00 179.25 179.18 3h4c h ASP 243 N 1.07 1.04 -0.11 0.00 3.32 -1.66 -1.53 116.42 118.55 3h4c h ASP 243 Ca 0.37 -0.17 -0.17 0.00 0.02 0.00 0.00 57.03 57.09 3h4c h ASP 243 Cb 0.11 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 3h4c h ASP 243 CO -0.13 0.94 -0.52 0.03 -1.72 0.00 0.00 179.24 177.84 3h4c h ARG 244 N 1.09 0.69 -0.14 3.56 3.08 -0.37 -1.01 114.38 121.28 3h4c h ARG 244 Ca 0.25 -0.42 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 3h4c h ARG 244 Cb 0.24 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3h4c h ARG 244 CO -0.02 1.04 0.07 0.28 -1.07 0.00 0.00 179.97 180.28 3h4c h VAL 245 N 0.54 1.10 -0.57 2.04 2.07 -0.93 0.14 116.25 120.65 3h4c h VAL 245 Ca 0.02 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.31 3h4c h VAL 245 Cb 1.09 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 3h4c h VAL 245 CO 0.11 0.09 0.29 0.74 0.02 0.00 0.00 177.57 178.82 3h4c h THR 246 N 0.12 0.94 -0.11 2.57 2.02 -1.23 -1.73 112.91 115.50 3h4c h THR 246 Ca 0.05 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 3h4c h THR 246 Cb 0.08 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 3h4c h THR 246 CO -0.01 0.10 -0.02 0.74 0.37 0.00 0.00 175.52 176.71 3h4c h THR 247 N 0.55 1.28 -0.57 3.16 2.02 -0.95 -1.19 112.91 117.21 3h4c h THR 247 Ca 0.25 -0.90 0.04 0.00 0.77 0.00 0.00 66.41 66.57 3h4c h THR 247 Cb 0.17 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.20 3h4c h THR 247 CO -0.18 0.26 0.32 0.00 0.37 0.00 0.00 175.52 176.29 3h4c h ALA 248 N 0.71 0.73 -0.10 6.16 0.00 -0.63 0.13 119.26 126.26 3h4c h ALA 248 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3h4c h ALA 248 Cb 0.41 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3h4c h ALA 248 CO 0.01 0.02 -0.02 1.25 0.00 0.00 0.00 179.25 180.51 3h4c h LEU 249 N 0.63 0.20 -0.98 0.00 5.85 -1.26 -1.49 115.31 118.26 3h4c h LEU 249 Ca 0.24 -0.36 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 3h4c h LEU 249 Cb 0.08 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3h4c h LEU 249 CO -0.13 0.51 -0.30 -0.07 -0.34 0.00 0.00 178.44 178.12 3h4c h LEU 250 N -0.12 0.38 -0.59 2.25 3.38 -1.08 -1.01 115.31 118.52 3h4c h LEU 250 Ca 0.03 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 3h4c h LEU 250 Cb 0.43 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3h4c h LEU 250 CO 0.01 0.67 0.22 -0.07 0.09 0.00 0.00 178.44 179.35 3h4c h LEU 251 N 0.33 0.83 -1.40 1.67 3.38 -0.72 0.35 115.31 119.74 3h4c h LEU 251 Ca 0.04 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 3h4c h LEU 251 Cb 0.69 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3h4c h LEU 251 CO 0.05 0.79 -0.30 0.00 0.09 0.00 0.00 178.44 179.07 3h4c h ALA 252 N 1.07 1.36 0.02 1.53 0.00 -0.82 0.13 119.26 122.55 3h4c h ALA 252 Ca 0.19 -0.27 -0.28 0.00 0.00 0.00 0.00 54.91 54.56 3h4c h ALA 252 Cb 0.23 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3h4c h ALA 252 CO -0.01 0.37 -1.54 -0.09 0.00 0.00 0.00 179.25 177.97 3h4c h ARG 253 N 0.00 0.03 0.00 0.00 9.65 -0.99 -3.42 114.38 119.66 3h4c h ARG 253 Ca -0.00 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 3h4c h ARG 253 Cb 0.58 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 3h4c h ARG 253 CO 0.04 0.70 -0.46 0.25 2.80 0.00 0.00 179.97 183.30 3h4c n THR 254 N -3.17 0.00 -0.48 0.20 -2.24 0.10 -4.79 114.28 103.90 3h4c n THR 254 Ca -0.14 -0.22 0.06 0.00 -2.27 0.00 0.00 64.05 61.49 3h4c n THR 254 Cb 1.03 0.72 0.17 0.00 -2.10 0.00 0.00 70.33 70.14 3h4c n THR 254 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h4c n ALA 255 N -1.13 2.43 -3.94 6.98 0.00 0.44 -4.99 120.51 120.31 3h4c n ALA 255 Ca 0.00 -1.61 -0.31 0.00 0.00 0.00 0.00 53.44 51.52 3h4c n ALA 255 Cb 0.00 -0.47 0.01 0.00 0.00 0.00 0.00 19.45 18.98 3h4c n ALA 255 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h4c n GLN 256 N -0.06 -4.62 0.20 0.00 3.00 -1.24 -4.86 117.38 109.79 3h4c n GLN 256 Ca 0.14 0.52 0.14 0.00 -0.01 0.00 0.00 57.00 57.80 3h4c n GLN 256 Cb 0.57 -5.36 0.55 0.00 0.00 0.00 0.00 30.24 26.00 3h4c n GLN 256 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 3h4c h THR 257 N -1.79 0.00 0.00 5.09 1.35 -1.80 -2.84 112.91 112.91 3h4c h THR 257 Ca -0.57 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 64.85 3h4c h THR 257 Cb 1.37 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 69.11 3h4c h THR 257 CO 0.69 0.00 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.84 3h4c h LEU 258 N 0.00 0.00 -0.18 3.87 3.38 -1.89 -1.35 115.31 119.14 3h4c h LEU 258 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h4c h LEU 258 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3h4c h LEU 258 CO 0.00 0.05 0.00 -1.54 0.09 0.00 0.00 178.44 177.04 3h4c n SER 259 N -3.59 0.28 0.26 -0.43 3.41 -1.07 -3.42 113.62 109.06 3h4c n SER 259 Ca -0.02 -1.19 0.16 0.00 -0.26 0.00 0.00 58.87 57.55 3h4c n SER 259 Cb 0.16 -0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.63 3h4c n SER 259 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 3h4c h TRP 260 N 0.42 0.00 0.05 7.33 6.55 -1.43 -3.54 115.95 125.32 3h4c h TRP 260 Ca 0.00 0.00 -0.33 0.00 0.95 0.00 0.00 58.89 59.51 3h4c h TRP 260 Cb 0.09 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.35 3h4c h TRP 260 CO 0.00 0.00 -1.89 0.39 -1.05 0.00 0.00 178.44 175.90 3h4c n GLU 261 N -3.10 0.69 -1.51 0.49 1.02 -1.22 -4.93 120.64 112.08 3h4c n GLU 261 Ca 0.02 0.26 -0.42 0.00 -0.02 0.00 0.00 57.16 56.99 3h4c n GLU 261 Cb 0.37 -1.73 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 3h4c n GLU 261 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h4c n GLY 275 N 1.77 -1.02 0.08 0.62 0.00 -1.26 -5.10 105.19 100.28 3h4c n GLY 275 Ca -0.25 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 3h4c n GLY 275 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3h4c h MET 276 N 1.16 0.11 -0.30 1.61 4.05 -2.03 -1.19 114.93 118.35 3h4c h MET 276 Ca -0.40 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 58.93 3h4c h MET 276 Cb 1.38 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 32.17 3h4c h MET 276 CO 0.54 0.57 0.04 1.49 0.23 0.00 0.00 176.91 179.78 3h4c h GLU 277 N -0.35 0.43 -0.07 0.39 4.81 -2.05 -2.36 114.58 115.39 3h4c h GLU 277 Ca 0.01 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.04 3h4c h GLU 277 Cb 0.55 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 3h4c h GLU 277 CO 0.01 0.43 -0.50 0.00 -0.73 0.00 0.00 179.01 178.23 3h4c h ALA 278 N 1.62 1.03 -0.14 2.92 0.00 -1.96 -0.72 119.26 122.02 3h4c h ALA 278 Ca 0.10 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 3h4c h ALA 278 Cb 0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3h4c h ALA 278 CO 0.00 0.65 -0.22 0.82 0.00 0.00 0.00 179.25 180.50 3h4c h ILE 279 N 0.15 1.37 -0.74 0.00 2.04 -0.74 -1.72 117.51 117.86 3h4c h ILE 279 Ca 0.01 -1.46 -0.04 0.00 1.00 0.00 0.00 64.86 64.36 3h4c h ILE 279 Cb 0.93 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.97 3h4c h ILE 279 CO 0.07 0.43 0.30 1.88 0.00 0.00 0.00 178.15 180.84 3h4c h TYR 280 N -0.00 1.12 -0.62 1.37 -1.99 -1.42 -0.79 116.97 114.64 3h4c h TYR 280 Ca 0.01 -0.08 -0.09 0.00 2.00 0.00 0.00 58.73 60.57 3h4c h TYR 280 Cb 0.80 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 39.17 3h4c h TYR 280 CO 0.10 0.85 0.02 0.00 -0.00 0.00 0.00 178.16 179.13 3h4c h ALA 281 N 1.15 0.87 -0.18 3.88 0.00 -1.15 0.30 119.26 124.14 3h4c h ALA 281 Ca 0.25 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3h4c h ALA 281 Cb 0.20 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3h4c h ALA 281 CO -0.02 0.67 -0.05 -0.97 0.00 0.00 0.00 179.25 178.87 3h4c h ASN 282 N 0.98 0.35 -0.45 0.00 -0.73 -1.13 -1.68 115.58 112.92 3h4c h ASN 282 Ca 0.18 -0.38 0.05 0.00 1.87 0.00 0.00 56.30 58.02 3h4c h ASN 282 Cb 0.53 -0.10 -0.05 0.00 0.27 0.00 0.00 38.32 38.98 3h4c h ASN 282 CO 0.03 0.65 0.18 0.15 -0.37 0.00 0.00 177.43 178.07 3h4c h PHE 283 N 0.05 0.32 -0.63 0.67 3.57 -1.06 -1.60 116.94 118.26 3h4c h PHE 283 Ca 0.04 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3h4c h PHE 283 Cb 0.50 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3h4c h PHE 283 CO 0.06 0.13 0.37 0.77 -2.23 0.00 0.00 178.31 177.41 3h4c h SER 284 N 0.36 0.76 0.05 0.41 0.02 -0.80 0.79 113.55 115.14 3h4c h SER 284 Ca 0.21 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3h4c h SER 284 Cb 0.18 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.52 3h4c h SER 284 CO -0.19 0.60 -0.02 0.28 -1.14 0.00 0.00 176.83 176.36 3h4c h SER 285 N 0.85 -0.06 -0.18 3.07 0.02 -1.15 0.17 113.55 116.27 3h4c h SER 285 Ca 0.23 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3h4c h SER 285 Cb -0.01 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3h4c h SER 285 CO -0.04 0.07 0.04 0.11 -1.14 0.00 0.00 176.83 175.87 3h4c h LYS 286 N -0.18 0.40 -0.00 3.45 1.79 -1.09 -2.49 116.57 118.45 3h4c h LYS 286 Ca -0.01 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3h4c h LYS 286 Cb 0.16 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 3h4c h LYS 286 CO 0.01 0.40 -0.42 0.00 -1.08 0.00 0.00 179.45 178.36 3h4c n ALA 287 N -2.49 3.38 -3.53 3.86 0.00 0.25 -4.97 120.51 117.02 3h4c n ALA 287 Ca 0.01 -0.36 -0.19 0.00 0.00 0.00 0.00 53.44 52.90 3h4c n ALA 287 Cb 0.19 -1.13 0.07 0.00 0.00 0.00 0.00 19.45 18.57 3h4c n ALA 287 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3h4c n HIS 288 N -1.25 -2.09 -4.44 0.00 8.25 -0.32 -4.85 115.22 110.53 3h4c n HIS 288 Ca 0.08 0.90 -0.24 0.00 -0.26 0.00 0.00 57.72 58.19 3h4c n HIS 288 Cb 0.34 -4.80 -0.10 0.00 1.12 0.00 0.00 29.99 26.55 3h4c n HIS 288 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3h4c s LEU 289 N -6.46 2.69 -0.17 2.41 1.43 0.43 -4.36 118.68 114.65 3h4c s LEU 289 Ca 0.01 -0.95 -0.29 0.00 -1.03 0.00 0.00 54.13 51.87 3h4c s LEU 289 Cb -0.00 -1.22 -0.01 0.00 0.03 0.00 0.00 46.19 44.99 3h4c s LEU 289 CO 0.76 0.04 1.17 -1.61 0.23 0.00 0.00 176.35 176.94 3h4c s GLU 290 N -3.51 4.27 0.32 1.70 0.41 -1.26 -4.53 118.70 116.10 3h4c s GLU 290 Ca 0.30 1.55 -0.00 0.00 -0.41 0.00 0.00 54.97 56.41 3h4c s GLU 290 Cb -0.05 -3.69 0.53 0.00 -1.78 0.00 0.00 34.13 29.14 3h4c s GLU 290 CO 0.16 -0.63 1.98 -0.24 -0.49 0.00 0.00 175.26 176.04 3h4c h VAL 291 N 5.40 1.19 -0.35 2.63 3.04 -1.93 -1.97 116.25 124.26 3h4c h VAL 291 Ca -0.25 -0.38 -0.05 0.00 -1.01 0.00 0.00 66.70 65.01 3h4c h VAL 291 Cb 1.10 0.16 -0.02 0.00 -2.01 0.00 0.00 31.29 30.52 3h4c h VAL 291 CO 0.96 0.19 0.02 0.71 -1.01 0.00 0.00 177.57 178.44 3h4c h THR 292 N 0.97 1.19 -0.24 3.17 1.35 -1.99 0.01 112.91 117.37 3h4c h THR 292 Ca 0.26 -0.75 -0.19 0.00 -0.55 0.00 0.00 66.41 65.19 3h4c h THR 292 Cb -0.08 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.24 3h4c h THR 292 CO -0.05 0.26 -0.59 0.11 -0.25 0.00 0.00 175.52 175.00 3h4c h LYS 293 N 0.52 0.78 -0.12 4.72 1.57 -1.78 -2.36 116.57 119.89 3h4c h LYS 293 Ca 0.11 -0.52 -0.01 0.00 -1.87 0.00 0.00 60.65 58.36 3h4c h LYS 293 Cb 0.30 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 3h4c h LYS 293 CO 0.01 1.14 0.04 0.28 -0.57 0.00 0.00 179.45 180.35 3h4c h VAL 294 N 0.59 1.18 -0.59 0.50 2.07 -1.09 -1.76 116.25 117.15 3h4c h VAL 294 Ca 0.00 -0.56 0.12 0.00 0.82 0.00 0.00 66.70 67.07 3h4c h VAL 294 Cb 1.19 1.33 -0.11 0.00 -1.52 0.00 0.00 31.29 32.17 3h4c h VAL 294 CO 0.12 0.17 -0.18 0.78 0.02 0.00 0.00 177.57 178.48 3h4c h ASN 295 N 0.01 -0.66 0.03 0.57 2.35 -1.02 -0.86 115.58 116.00 3h4c h ASN 295 Ca 0.04 0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3h4c h ASN 295 Cb 0.23 0.40 0.00 0.00 0.05 0.00 0.00 38.32 39.00 3h4c h ASN 295 CO -0.00 -0.22 -0.01 0.50 -1.65 0.00 0.00 177.43 176.04 3h4c h LYS 296 N -0.04 -0.04 -0.91 0.81 3.64 -1.26 0.32 116.57 119.09 3h4c h LYS 296 Ca 0.28 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 3h4c h LYS 296 Cb 0.46 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.25 3h4c h LYS 296 CO -0.62 -0.02 0.51 -0.84 -2.27 0.00 0.00 179.45 176.20 3h4c h ILE 297 N -0.05 1.26 -0.20 2.00 3.07 -1.09 -2.05 117.51 120.45 3h4c h ILE 297 Ca -0.00 -0.63 -0.11 0.00 1.55 0.00 0.00 64.86 65.66 3h4c h ILE 297 Cb 0.04 0.02 -0.00 0.00 -0.27 0.00 0.00 36.82 36.61 3h4c h ILE 297 CO 0.01 0.29 -0.29 0.24 -1.05 0.00 0.00 178.15 177.35 3h4c h MET 298 N 1.27 0.56 -0.95 0.16 2.86 -0.93 -1.60 114.93 116.30 3h4c h MET 298 Ca 0.32 -0.33 0.08 0.00 -2.06 0.00 0.00 59.70 57.71 3h4c h MET 298 Cb 0.02 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.63 3h4c h MET 298 CO -0.05 0.93 0.60 1.25 1.06 0.00 0.00 176.91 180.69 3h4c h HIS 299 N 0.23 1.10 -0.39 -0.22 -0.00 -0.81 0.34 115.15 115.41 3h4c h HIS 299 Ca 0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.40 3h4c h HIS 299 Cb 0.87 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 27.90 3h4c h HIS 299 CO 0.09 0.54 0.16 1.25 -0.00 0.00 0.00 177.93 179.97 3h4c h LEU 300 N 1.06 0.53 -0.50 0.26 5.85 -1.27 -2.01 115.31 119.23 3h4c h LEU 300 Ca 0.42 -0.16 -0.15 0.00 0.84 0.00 0.00 57.88 58.84 3h4c h LEU 300 Cb 0.23 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 3h4c h LEU 300 CO -0.19 0.54 -0.38 0.00 -0.34 0.00 0.00 178.44 178.07 3h4c h ALA 301 N 1.01 0.68 -0.40 1.25 0.00 -0.38 -3.07 119.26 118.35 3h4c h ALA 301 Ca 0.13 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 3h4c h ALA 301 Cb 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3h4c h ALA 301 CO -0.01 0.67 -0.24 0.28 0.00 0.00 0.00 179.25 179.95 3h4c h VAL 302 N 0.67 1.27 -0.95 0.00 2.07 -0.37 -2.24 116.25 116.71 3h4c h VAL 302 Ca 0.06 -1.37 0.05 0.00 0.82 0.00 0.00 66.70 66.25 3h4c h VAL 302 Cb 0.94 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 3h4c h VAL 302 CO 0.09 0.46 0.61 0.44 0.02 0.00 0.00 177.57 179.19 3h4c h ASP 303 N 0.70 1.00 -0.72 0.57 3.32 -1.33 -2.57 116.42 117.40 3h4c h ASP 303 Ca 0.09 -0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.96 3h4c h ASP 303 Cb 0.77 -0.22 -0.11 0.00 0.22 0.00 0.00 39.33 39.99 3h4c h ASP 303 CO 0.06 0.67 0.23 1.33 -1.72 0.00 0.00 179.24 179.81 3h4c n VAL 304 N -4.51 2.91 -0.27 -1.35 0.24 -1.06 -4.76 118.33 109.53 3h4c n VAL 304 Ca 0.13 -1.57 0.04 0.00 -2.04 0.00 0.00 64.34 60.90 3h4c n VAL 304 Cb 0.12 -0.35 0.14 0.00 -1.47 0.00 0.00 33.84 32.28 3h4c n VAL 304 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3h4c h LEU 305 N 2.96 -0.54 -1.99 1.34 5.85 -0.98 -0.14 115.31 121.81 3h4c h LEU 305 Ca 0.22 0.22 -0.02 0.00 0.84 0.00 0.00 57.88 59.14 3h4c h LEU 305 Cb 2.29 0.42 -0.00 0.00 0.37 0.00 0.00 40.66 43.74 3h4c h LEU 305 CO 0.70 -0.23 -0.10 -0.65 -0.34 0.00 0.00 178.44 177.82 3h4c h PRO 306 N 0.04 0.00 -0.17 5.25 0.11 -1.87 -1.91 132.00 133.45 3h4c h PRO 306 Ca 0.41 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.32 3h4c h PRO 306 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3h4c h PRO 306 CO -0.75 0.10 -0.68 -0.07 -0.21 0.00 0.00 178.00 176.39 3h4c h LEU 307 N 0.00 0.80 -0.69 2.35 3.38 -1.41 -2.01 115.31 117.73 3h4c h LEU 307 Ca -0.00 -0.49 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 3h4c h LEU 307 Cb 0.25 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 3h4c h LEU 307 CO 0.01 1.26 0.33 0.40 0.09 0.00 0.00 178.44 180.53 3h4c h ILE 308 N 0.49 1.23 -0.16 1.22 2.04 -1.16 -2.05 117.51 119.12 3h4c h ILE 308 Ca -0.02 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 3h4c h ILE 308 Cb 1.28 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3h4c h ILE 308 CO 0.14 0.27 0.06 -0.61 0.00 0.00 0.00 178.15 178.01 3h4c h GLN 309 N 0.96 0.24 -0.72 2.37 4.15 -1.29 0.11 115.11 120.93 3h4c h GLN 309 Ca 0.24 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.60 3h4c h GLN 309 Cb 0.12 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.74 3h4c h GLN 309 CO -0.03 0.33 0.40 0.00 -1.93 0.00 0.00 178.83 177.60 3h4c h ALA 310 N 0.90 1.35 -0.53 3.38 0.00 -1.32 0.57 119.26 123.62 3h4c h ALA 310 Ca 0.05 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 3h4c h ALA 310 Cb 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3h4c h ALA 310 CO -0.00 0.53 -0.08 0.00 0.00 0.00 0.00 179.25 179.70 3h4c h ALA 311 N 1.44 0.84 -0.46 0.00 0.00 -1.09 -3.13 119.26 116.87 3h4c h ALA 311 Ca 0.25 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3h4c h ALA 311 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3h4c h ALA 311 CO -0.04 0.66 -0.13 0.35 0.00 0.00 0.00 179.25 180.08 3h4c h PHE 312 N 0.88 1.02 -0.03 0.00 3.57 0.33 -3.44 116.94 119.27 3h4c h PHE 312 Ca 0.14 -0.23 0.00 0.00 3.53 0.00 0.00 57.97 61.42 3h4c h PHE 312 Cb 0.63 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.12 3h4c h PHE 312 CO 0.04 1.00 0.00 1.04 -2.23 0.00 0.00 178.31 178.16