#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gu1 s ASP 94 N 0.00 6.22 0.07 1.61 3.68 -1.26 -5.05 116.67 121.94 3gu1 s ASP 94 Ca 0.00 -0.98 -0.02 0.00 2.13 0.00 0.00 52.55 53.68 3gu1 s ASP 94 Cb 0.00 -2.30 -0.04 0.00 -1.45 0.00 0.00 42.92 39.13 3gu1 s ASP 94 CO 0.00 -0.95 0.25 0.00 0.13 0.00 0.00 175.17 174.60 3gu1 s ALA 95 N 2.71 3.94 0.54 3.66 0.00 -1.26 -4.90 121.76 126.45 3gu1 s ALA 95 Ca 0.15 -0.74 -0.20 0.00 0.00 0.00 0.00 51.96 51.17 3gu1 s ALA 95 Cb -0.20 -1.93 -0.08 0.00 0.00 0.00 0.00 23.12 20.91 3gu1 s ALA 95 CO 0.11 0.77 0.76 -2.30 0.00 0.00 0.00 175.76 175.10 3gu1 n PRO 96 N 0.37 0.80 -3.62 0.00 -0.02 -1.26 -4.89 135.00 126.38 3gu1 n PRO 96 Ca -0.05 0.30 -0.16 0.00 -2.02 0.00 0.00 63.50 61.57 3gu1 n PRO 96 Cb 0.51 -1.90 -0.14 0.00 -0.02 0.00 0.00 33.50 31.96 3gu1 n PRO 96 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3gu1 s GLY 97 N -1.09 -0.03 0.00 -1.23 0.00 -1.26 -5.10 107.32 98.61 3gu1 s GLY 97 Ca 0.69 0.66 0.00 0.00 0.00 0.00 0.00 44.72 46.07 3gu1 s GLY 97 CO 0.53 1.91 0.00 0.61 0.00 0.00 0.00 173.10 176.15 3gu1 n GLY 98 N 5.34 0.73 3.64 0.20 0.00 -1.26 -4.94 105.19 108.90 3gu1 n GLY 98 Ca -0.05 -2.06 -0.35 0.00 0.00 0.00 0.00 46.02 43.55 3gu1 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gu1 n ALA 99 N -1.00 -0.03 -3.57 4.61 0.00 -1.26 -4.95 120.51 114.30 3gu1 n ALA 99 Ca 0.00 -0.19 -0.15 0.00 0.00 0.00 0.00 53.44 53.10 3gu1 n ALA 99 Cb 0.00 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.22 3gu1 n ALA 99 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3gu1 s HIS 100 N -1.81 -0.66 0.04 0.00 5.04 -1.18 -3.23 115.29 113.49 3gu1 s HIS 100 Ca 0.74 1.35 0.05 0.00 -1.54 0.00 0.00 55.06 55.67 3gu1 s HIS 100 Cb -0.34 0.36 -0.02 0.00 0.04 0.00 0.00 32.58 32.62 3gu1 s HIS 100 CO 0.49 -0.47 -0.14 -1.64 -2.34 0.00 0.00 174.74 170.64 3gu1 s MET 101 N -0.52 0.93 0.63 2.88 -1.94 -1.23 -4.95 119.30 115.09 3gu1 s MET 101 Ca -0.05 -0.75 -0.18 0.00 -1.71 0.00 0.00 55.69 52.99 3gu1 s MET 101 Cb -0.02 -0.94 -0.02 0.00 2.01 0.00 0.00 34.83 35.86 3gu1 s MET 101 CO 0.05 0.23 1.25 0.95 -0.01 0.00 0.00 175.02 177.49 3gu1 s THR 102 N -0.85 2.30 -0.22 2.05 -4.23 -1.26 -4.84 115.64 108.59 3gu1 s THR 102 Ca 0.01 0.19 -0.41 0.00 -1.18 0.00 0.00 61.69 60.31 3gu1 s THR 102 Cb -0.08 -3.07 -0.17 0.00 1.34 0.00 0.00 72.50 70.53 3gu1 s THR 102 CO 0.01 -0.04 1.59 0.00 -0.54 0.00 0.00 174.62 175.64 3gu1 n ALA 103 N -1.79 -0.79 -2.63 3.99 0.00 -1.21 -4.77 120.51 113.31 3gu1 n ALA 103 Ca 0.15 0.45 -0.37 0.00 0.00 0.00 0.00 53.44 53.66 3gu1 n ALA 103 Cb 0.49 -2.11 -0.10 0.00 0.00 0.00 0.00 19.45 17.73 3gu1 n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3gu1 s GLN 104 N 2.59 4.02 0.52 0.00 -1.52 -1.26 -0.65 119.66 123.35 3gu1 s GLN 104 Ca 0.96 -0.28 0.06 0.00 -1.95 0.00 0.00 55.36 54.15 3gu1 s GLN 104 Cb -1.13 -3.59 0.03 0.00 -0.22 0.00 0.00 33.01 28.09 3gu1 s GLN 104 CO 0.64 -0.05 0.38 0.95 -0.25 0.00 0.00 175.29 176.97 3gu1 s THR 105 N 1.37 1.79 -0.48 -0.19 -4.23 0.96 -3.59 115.64 111.28 3gu1 s THR 105 Ca 0.08 -1.49 0.22 0.00 -1.18 0.00 0.00 61.69 59.31 3gu1 s THR 105 Cb -0.15 -2.29 0.23 0.00 1.34 0.00 0.00 72.50 71.64 3gu1 s THR 105 CO 0.07 0.00 1.67 1.33 -0.54 0.00 0.00 174.62 177.16 3gu1 n VAL 106 N -1.70 0.90 -0.47 2.29 0.24 0.63 -1.43 118.33 118.78 3gu1 n VAL 106 Ca -0.01 0.32 0.07 0.00 -2.04 0.00 0.00 64.34 62.68 3gu1 n VAL 106 Cb 0.64 -1.25 0.22 0.00 -1.47 0.00 0.00 33.84 31.98 3gu1 n VAL 106 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3gu1 n THR 107 N -2.18 1.47 0.00 3.34 -2.24 -1.26 -4.80 114.28 108.61 3gu1 n THR 107 Ca 0.02 -1.27 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 3gu1 n THR 107 Cb 0.19 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3gu1 n THR 107 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gu1 n GLY 108 N 0.37 0.28 3.76 3.38 0.00 -0.51 -5.06 105.19 107.41 3gu1 n GLY 108 Ca 0.17 -2.30 -0.40 0.00 0.00 0.00 0.00 46.02 43.48 3gu1 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gu1 s ALA 109 N -1.63 3.38 -0.01 4.61 0.00 -1.26 -0.02 121.76 126.83 3gu1 s ALA 109 Ca 0.00 0.98 0.03 0.00 0.00 0.00 0.00 51.96 52.97 3gu1 s ALA 109 Cb 0.00 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.75 3gu1 s ALA 109 CO 0.00 -0.32 -0.09 0.08 0.00 0.00 0.00 175.76 175.43 3gu1 s VAL 110 N -1.21 0.70 0.45 0.00 1.01 0.17 -4.91 120.40 116.62 3gu1 s VAL 110 Ca 0.48 -0.35 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 3gu1 s VAL 110 Cb -0.33 -0.61 -0.08 0.00 0.00 0.00 0.00 36.38 35.36 3gu1 s VAL 110 CO 0.43 0.21 1.12 0.00 0.00 0.00 0.00 175.10 176.86 3gu1 s ALA 111 N -0.03 2.97 0.36 5.51 0.00 -1.26 -3.32 121.76 125.99 3gu1 s ALA 111 Ca 0.01 0.84 0.13 0.00 0.00 0.00 0.00 51.96 52.93 3gu1 s ALA 111 Cb -0.05 -3.34 0.95 0.00 0.00 0.00 0.00 23.12 20.67 3gu1 s ALA 111 CO -0.00 -0.52 1.79 0.00 0.00 0.00 0.00 175.76 177.02 3gu1 h ALA 112 N 2.06 1.98 0.00 0.00 0.00 -1.89 0.27 119.26 121.69 3gu1 h ALA 112 Ca -0.49 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3gu1 h ALA 112 Cb 1.24 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 3gu1 h ALA 112 CO 0.60 -0.36 -0.12 0.00 0.00 0.00 0.00 179.25 179.38 3gu1 h ALA 113 N 1.64 1.36 -0.01 0.00 0.00 -1.91 -2.51 119.26 117.83 3gu1 h ALA 113 Ca 0.57 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.37 3gu1 h ALA 113 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3gu1 h ALA 113 CO -0.32 0.14 -0.25 1.04 0.00 0.00 0.00 179.25 179.87 3gu1 n GLN 114 N -3.74 0.66 -0.24 0.00 1.13 0.95 -4.12 117.38 112.01 3gu1 n GLN 114 Ca -0.02 -0.35 -0.07 0.00 -1.94 0.00 0.00 57.00 54.63 3gu1 n GLN 114 Cb 0.22 -1.49 0.07 0.00 0.11 0.00 0.00 30.24 29.15 3gu1 n GLN 114 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3gu1 h LEU 115 N 0.84 1.05 0.00 1.08 3.38 -1.36 -3.48 115.31 116.81 3gu1 h LEU 115 Ca 0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3gu1 h LEU 115 Cb 0.47 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3gu1 h LEU 115 CO 0.00 1.00 0.00 0.61 0.09 0.00 0.00 178.44 180.14 3gu1 n GLY 116 N -0.69 0.29 3.76 0.83 0.00 -1.26 -3.80 105.19 104.32 3gu1 n GLY 116 Ca 0.05 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 3gu1 n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gu1 s ALA 117 N -1.96 3.59 0.01 4.61 0.00 -1.26 -4.69 121.76 122.06 3gu1 s ALA 117 Ca 0.00 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.38 3gu1 s ALA 117 Cb 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 3gu1 s ALA 117 CO 0.00 -0.83 -0.05 0.99 0.00 0.00 0.00 175.76 175.87 3gu1 s THR 118 N -0.60 0.38 -0.40 0.00 2.01 -0.89 -1.17 115.64 114.96 3gu1 s THR 118 Ca 0.55 -0.45 -0.12 0.00 0.31 0.00 0.00 61.69 61.99 3gu1 s THR 118 Cb -0.43 -0.37 0.05 0.00 0.01 0.00 0.00 72.50 71.75 3gu1 s THR 118 CO 0.52 -0.06 0.25 -0.76 -0.69 0.00 0.00 174.62 173.88 3gu1 s LEU 119 N -0.55 4.99 0.00 4.42 1.43 -0.61 -4.90 118.68 123.45 3gu1 s LEU 119 Ca -0.02 -1.15 0.20 0.00 -1.03 0.00 0.00 54.13 52.13 3gu1 s LEU 119 Cb -0.04 -2.05 1.02 0.00 0.03 0.00 0.00 46.19 45.15 3gu1 s LEU 119 CO -0.00 -0.46 1.64 -0.81 0.23 0.00 0.00 176.35 176.94 3gu1 n PRO 120 N 5.02 0.28 -3.24 1.29 -0.04 -1.26 -0.42 135.00 136.62 3gu1 n PRO 120 Ca -0.11 0.10 -0.04 0.00 -0.04 0.00 0.00 63.50 63.40 3gu1 n PRO 120 Cb 0.45 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.38 3gu1 n PRO 120 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3gu1 s HIS 121 N -2.59 -1.33 0.22 0.54 2.46 -1.24 -4.60 115.29 108.75 3gu1 s HIS 121 Ca 0.19 0.41 -0.05 0.00 0.47 0.00 0.00 55.06 56.07 3gu1 s HIS 121 Cb 0.14 0.05 -0.03 0.00 -0.13 0.00 0.00 32.58 32.61 3gu1 s HIS 121 CO 0.31 -1.05 0.27 -1.21 -2.47 0.00 0.00 174.74 170.58 3gu1 s GLU 122 N 2.37 1.34 -0.17 2.88 0.41 -0.88 -1.26 118.70 123.40 3gu1 s GLU 122 Ca 0.12 -1.49 -0.02 0.00 -0.41 0.00 0.00 54.97 53.17 3gu1 s GLU 122 Cb -0.10 0.35 0.05 0.00 -1.78 0.00 0.00 34.13 32.64 3gu1 s GLU 122 CO -0.21 -0.49 -0.01 -1.01 -0.49 0.00 0.00 175.26 173.05 3gu1 s HIS 123 N -4.09 1.33 0.06 1.61 3.76 0.53 -1.49 115.29 117.00 3gu1 s HIS 123 Ca 0.33 -0.92 -0.28 0.00 -0.15 0.00 0.00 55.06 54.03 3gu1 s HIS 123 Cb 0.04 -1.14 -0.17 0.00 1.11 0.00 0.00 32.58 32.42 3gu1 s HIS 123 CO 0.11 -0.59 1.54 0.28 -0.85 0.00 0.00 174.74 175.23 3gu1 h VAL 124 N 6.46 0.62 -3.51 -0.90 2.07 -1.94 -0.46 116.25 118.60 3gu1 h VAL 124 Ca -0.19 -0.18 -0.46 0.00 0.82 0.00 0.00 66.70 66.68 3gu1 h VAL 124 Cb 1.11 0.71 -0.18 0.00 -1.52 0.00 0.00 31.29 31.41 3gu1 h VAL 124 CO 0.35 0.04 -0.77 0.27 0.02 0.00 0.00 177.57 177.48 3gu1 s ILE 125 N -5.68 1.53 -0.11 4.57 -4.36 -1.26 -0.84 121.20 115.06 3gu1 s ILE 125 Ca -0.15 -1.77 -0.24 0.00 -0.26 0.00 0.00 60.65 58.23 3gu1 s ILE 125 Cb 0.04 -1.64 0.06 0.00 1.25 0.00 0.00 42.46 42.16 3gu1 s ILE 125 CO 0.61 -0.35 0.57 0.12 0.24 0.00 0.00 174.94 176.13 3gu1 s PHE 126 N -2.02 -0.56 -0.04 1.37 2.19 -1.07 -4.85 117.98 113.00 3gu1 s PHE 126 Ca 0.11 1.12 -0.01 0.00 0.33 0.00 0.00 56.93 58.48 3gu1 s PHE 126 Cb -0.06 0.27 0.03 0.00 -1.31 0.00 0.00 43.02 41.96 3gu1 s PHE 126 CO 0.04 -0.45 0.08 0.20 1.83 0.00 0.00 175.22 176.92 3gu1 s GLY 127 N -0.66 0.03 0.40 13.12 0.00 -0.37 -0.08 107.32 119.76 3gu1 s GLY 127 Ca -0.07 0.42 -0.25 0.00 0.00 0.00 0.00 44.72 44.81 3gu1 s GLY 127 CO 0.05 0.71 1.19 -0.19 0.00 0.00 0.00 173.10 174.86 3gu1 s TYR 128 N 0.93 3.02 -0.11 1.90 4.12 -1.26 -4.11 117.35 121.85 3gu1 s TYR 128 Ca -0.07 1.53 -0.38 0.00 0.02 0.00 0.00 57.07 58.17 3gu1 s TYR 128 Cb -0.10 -3.44 -0.15 0.00 -1.52 0.00 0.00 41.96 36.75 3gu1 s TYR 128 CO -0.04 -1.45 1.63 -2.30 0.02 0.00 0.00 175.55 173.42 3gu1 n PRO 129 N 0.08 1.37 0.00 -1.71 -0.02 -1.26 -1.39 135.00 132.07 3gu1 n PRO 129 Ca 0.04 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3gu1 n PRO 129 Cb 0.46 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 3gu1 n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gu1 n GLY 130 N 3.67 2.07 0.37 -1.23 0.00 -1.26 -4.98 105.19 103.84 3gu1 n GLY 130 Ca 0.23 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.39 3gu1 n GLY 130 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3gu1 h TYR 131 N 0.00 0.45 0.00 1.61 -0.00 -1.57 0.59 116.97 118.04 3gu1 h TYR 131 Ca 0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 58.73 58.74 3gu1 h TYR 131 Cb 0.00 -0.14 -0.00 0.00 -0.00 0.00 0.00 36.73 36.59 3gu1 h TYR 131 CO 0.00 0.18 -0.01 0.00 -0.00 0.00 0.00 178.16 178.33 3gu1 h ALA 132 N 1.66 1.01 0.00 0.10 0.00 -1.94 -1.51 119.26 118.58 3gu1 h ALA 132 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3gu1 h ALA 132 Cb 0.76 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3gu1 h ALA 132 CO -0.10 0.01 0.00 0.78 0.00 0.00 0.00 179.25 179.94 3gu1 h GLY 133 N 1.70 0.00 -3.64 0.00 0.00 -1.29 -3.08 103.07 96.76 3gu1 h GLY 133 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 3gu1 h GLY 133 CO 0.00 0.00 0.52 1.34 0.00 0.00 0.00 176.54 178.40 3gu1 n ASP 134 N -2.35 4.34 0.04 0.19 2.03 -0.57 -4.68 116.55 115.55 3gu1 n ASP 134 Ca 0.03 -3.69 0.02 0.00 0.52 0.00 0.00 54.79 51.68 3gu1 n ASP 134 Cb 0.33 -0.81 0.36 0.00 -0.72 0.00 0.00 41.12 40.27 3gu1 n ASP 134 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 3gu1 h VAL 135 N 1.04 1.17 0.05 5.18 3.04 -1.64 0.28 116.25 125.36 3gu1 h VAL 135 Ca 0.55 -0.63 -0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3gu1 h VAL 135 Cb 2.21 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 32.41 3gu1 h VAL 135 CO 1.07 0.22 -0.02 0.74 -1.01 0.00 0.00 177.57 178.56 3gu1 h THR 136 N 0.42 1.06 0.00 3.17 2.02 -1.89 -2.66 112.91 115.02 3gu1 h THR 136 Ca 0.10 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.94 3gu1 h THR 136 Cb 0.25 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 3gu1 h THR 136 CO 0.00 0.09 -0.76 0.18 0.37 0.00 0.00 175.52 175.40 3gu1 n LEU 137 N -5.05 0.72 -2.92 2.58 4.77 -1.21 -4.46 117.00 111.43 3gu1 n LEU 137 Ca -0.08 -0.21 -0.22 0.00 -0.03 0.00 0.00 56.01 55.47 3gu1 n LEU 137 Cb 0.12 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 3gu1 n LEU 137 CO 0.33 0.17 -0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3gu1 n GLY 138 N 1.49 4.50 3.80 -0.72 0.00 0.97 -4.77 105.19 110.45 3gu1 n GLY 138 Ca 0.04 -2.23 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 3gu1 n GLY 138 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gu1 s PRO 139 N -3.10 2.83 -0.21 1.61 0.04 -1.01 -3.67 135.00 131.50 3gu1 s PRO 139 Ca 0.43 1.09 -0.25 0.00 0.04 0.00 0.00 61.00 62.31 3gu1 s PRO 139 Cb 0.34 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.90 3gu1 s PRO 139 CO -0.11 -1.19 0.83 0.12 0.04 0.00 0.00 177.00 176.69 3gu1 s PHE 140 N -2.85 3.37 -0.65 0.56 5.99 -1.26 -4.81 117.98 118.32 3gu1 s PHE 140 Ca 0.60 1.19 -0.18 0.00 0.00 0.00 0.00 56.93 58.55 3gu1 s PHE 140 Cb -0.16 -3.03 0.13 0.00 0.00 0.00 0.00 43.02 39.96 3gu1 s PHE 140 CO 0.51 -0.32 0.73 0.34 -0.00 0.00 0.00 175.22 176.48 3gu1 s ASP 141 N 1.24 6.31 0.12 6.13 -1.08 -1.26 -4.93 116.67 123.20 3gu1 s ASP 141 Ca 0.36 -1.71 -0.22 0.00 -0.52 0.00 0.00 52.55 50.46 3gu1 s ASP 141 Cb -0.16 -2.29 -0.04 0.00 -1.46 0.00 0.00 42.92 38.97 3gu1 s ASP 141 CO 0.10 -1.01 1.68 -0.74 0.52 0.00 0.00 175.17 175.72 3gu1 h HIS 142 N 8.93 -0.32 -0.66 -5.34 -0.00 -1.99 -0.08 115.15 115.68 3gu1 h HIS 142 Ca -0.20 0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.23 3gu1 h HIS 142 Cb 1.08 0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 28.60 3gu1 h HIS 142 CO 0.88 -0.19 0.40 0.00 -0.00 0.00 0.00 177.93 179.02 3gu1 h ALA 143 N 0.86 0.87 -0.44 5.26 0.00 -1.99 0.30 119.26 124.13 3gu1 h ALA 143 Ca 0.07 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3gu1 h ALA 143 Cb 0.28 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3gu1 h ALA 143 CO -0.19 0.13 0.07 0.00 0.00 0.00 0.00 179.25 179.25 3gu1 h ALA 144 N 1.31 0.58 -0.35 0.00 0.00 -1.93 -1.23 119.26 117.65 3gu1 h ALA 144 Ca 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3gu1 h ALA 144 Cb 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3gu1 h ALA 144 CO -0.13 0.31 0.04 0.00 0.00 0.00 0.00 179.25 179.47 3gu1 h ALA 145 N 0.94 0.47 -0.73 0.00 0.00 -0.68 -1.85 119.26 117.41 3gu1 h ALA 145 Ca 0.13 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3gu1 h ALA 145 Cb 0.39 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3gu1 h ALA 145 CO 0.01 0.18 0.44 1.25 0.00 0.00 0.00 179.25 181.14 3gu1 h LEU 146 N 0.42 0.88 -0.01 0.00 5.85 -0.89 0.20 115.31 121.75 3gu1 h LEU 146 Ca 0.10 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3gu1 h LEU 146 Cb 0.38 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 3gu1 h LEU 146 CO 0.01 0.68 0.01 0.00 -0.34 0.00 0.00 178.44 178.79 3gu1 h ALA 147 N 1.23 0.02 -0.40 1.25 0.00 -1.10 -0.97 119.26 119.28 3gu1 h ALA 147 Ca 0.26 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3gu1 h ALA 147 Cb -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3gu1 h ALA 147 CO -0.05 -0.39 0.18 1.03 0.00 0.00 0.00 179.25 180.01 3gu1 h SER 148 N -0.15 0.54 -0.19 0.00 0.87 -1.13 -1.94 113.55 111.55 3gu1 h SER 148 Ca 0.00 -0.15 -0.13 0.00 -1.23 0.00 0.00 61.79 60.29 3gu1 h SER 148 Cb 0.17 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 3gu1 h SER 148 CO -0.00 0.54 -0.33 0.00 -0.53 0.00 0.00 176.83 176.51 3gu1 h THR 150 N 0.59 1.31 -0.50 0.00 1.35 -1.09 -0.06 112.91 114.51 3gu1 h THR 150 Ca 0.06 -1.52 -0.05 0.00 -0.55 0.00 0.00 66.41 64.35 3gu1 h THR 150 Cb 0.85 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 68.99 3gu1 h THR 150 CO 0.07 0.45 0.12 -0.08 -0.25 0.00 0.00 175.52 175.83 3gu1 h GLU 151 N 0.12 0.81 -0.47 4.72 4.81 -1.02 0.27 114.58 123.82 3gu1 h GLU 151 Ca 0.01 -0.20 -0.11 0.00 -0.13 0.00 0.00 59.36 58.94 3gu1 h GLU 151 Cb 0.80 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 3gu1 h GLU 151 CO 0.06 0.78 -0.12 1.15 -0.73 0.00 0.00 179.01 180.15 3gu1 h THR 152 N 0.70 1.27 -0.74 0.32 2.02 -0.96 -1.69 112.91 113.83 3gu1 h THR 152 Ca 0.16 -1.25 0.04 0.00 0.77 0.00 0.00 66.41 66.13 3gu1 h THR 152 Cb 0.33 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.79 3gu1 h THR 152 CO 0.00 0.43 0.45 0.00 0.37 0.00 0.00 175.52 176.77 3gu1 h ALA 153 N 0.88 0.99 -0.32 6.16 0.00 -0.66 -0.45 119.26 125.85 3gu1 h ALA 153 Ca 0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3gu1 h ALA 153 Cb 0.67 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3gu1 h ALA 153 CO 0.05 0.20 -0.23 0.00 0.00 0.00 0.00 179.25 179.27 3gu1 h ARG 154 N 0.86 0.63 -0.40 0.00 3.08 -0.74 -1.11 114.38 116.69 3gu1 h ARG 154 Ca 0.31 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 3gu1 h ARG 154 Cb 0.10 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3gu1 h ARG 154 CO -0.14 0.80 -0.10 0.00 -1.07 0.00 0.00 179.97 179.47 3gu1 h ALA 155 N 1.20 1.08 -0.34 0.04 0.00 -0.56 -1.73 119.26 118.96 3gu1 h ALA 155 Ca 0.08 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 3gu1 h ALA 155 Cb 0.69 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3gu1 h ALA 155 CO 0.05 0.57 -0.15 -0.07 0.00 0.00 0.00 179.25 179.65 3gu1 h LEU 156 N 0.64 0.72 -1.66 0.00 3.38 -0.71 -2.86 115.31 114.82 3gu1 h LEU 156 Ca 0.11 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 3gu1 h LEU 156 Cb 0.54 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3gu1 h LEU 156 CO 0.03 0.96 0.01 -0.07 0.09 0.00 0.00 178.44 179.46 3gu1 h LEU 157 N 0.48 0.20 -1.41 1.67 3.38 -0.97 -0.05 115.31 118.61 3gu1 h LEU 157 Ca 0.08 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3gu1 h LEU 157 Cb 0.68 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3gu1 h LEU 157 CO 0.05 0.24 -0.28 0.00 0.09 0.00 0.00 178.44 178.54 3gu1 h ALA 158 N 1.80 1.51 -0.26 1.53 0.00 -1.10 -0.89 119.26 121.84 3gu1 h ALA 158 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3gu1 h ALA 158 Cb 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3gu1 h ALA 158 CO 0.00 0.36 0.00 0.54 0.00 0.00 0.00 179.25 180.15 3gu1 n ARG 159 N -4.20 1.65 -0.78 0.00 1.74 -0.10 -4.89 116.66 110.08 3gu1 n ARG 159 Ca -0.02 -1.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.05 3gu1 n ARG 159 Cb 0.33 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 3gu1 n ARG 159 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gu1 n GLY 160 N 0.98 0.67 3.65 -0.13 0.00 -0.34 -5.02 105.19 105.00 3gu1 n GLY 160 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 3gu1 n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gu1 s ILE 161 N -2.34 4.85 -0.21 -0.61 1.01 -0.79 -4.25 121.20 118.86 3gu1 s ILE 161 Ca 0.00 1.57 0.21 0.00 0.00 0.00 0.00 60.65 62.43 3gu1 s ILE 161 Cb 0.00 -4.11 -0.31 0.00 0.01 0.00 0.00 42.46 38.04 3gu1 s ILE 161 CO 0.00 -0.04 0.55 0.00 0.00 0.00 0.00 174.94 175.45 3gu1 n GLN 162 N 5.80 0.55 -3.89 2.79 6.02 -0.32 -3.64 117.38 124.70 3gu1 n GLN 162 Ca 0.05 -0.16 -0.11 0.00 -0.01 0.00 0.00 57.00 56.77 3gu1 n GLN 162 Cb 0.48 -1.51 -0.13 0.00 1.02 0.00 0.00 30.24 30.10 3gu1 n GLN 162 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3gu1 s THR 163 N -3.39 0.03 -0.03 5.09 2.01 -0.96 -1.29 115.64 117.10 3gu1 s THR 163 Ca -0.05 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 61.75 3gu1 s THR 163 Cb 0.14 -0.12 -0.01 0.00 0.01 0.00 0.00 72.50 72.52 3gu1 s THR 163 CO 0.89 -0.14 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.83 3gu1 s VAL 164 N -0.40 1.28 -0.38 3.82 1.01 0.11 -1.57 120.40 124.28 3gu1 s VAL 164 Ca -0.04 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.15 3gu1 s VAL 164 Cb -0.03 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.28 3gu1 s VAL 164 CO -0.00 0.37 0.23 -0.69 0.00 0.00 0.00 175.10 175.01 3gu1 s VAL 165 N -0.15 4.84 -0.33 2.92 1.01 0.44 -1.73 120.40 127.40 3gu1 s VAL 165 Ca 0.01 -0.71 -0.26 0.00 0.00 0.00 0.00 61.98 61.02 3gu1 s VAL 165 Cb -0.09 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.64 3gu1 s VAL 165 CO 0.01 -0.21 0.95 -0.62 0.00 0.00 0.00 175.10 175.22 3gu1 s ASP 166 N 1.61 6.78 -0.20 3.32 2.15 0.91 -2.07 116.67 129.17 3gu1 s ASP 166 Ca 0.03 0.80 0.13 0.00 0.43 0.00 0.00 52.55 53.95 3gu1 s ASP 166 Cb -0.19 -2.48 0.73 0.00 -0.30 0.00 0.00 42.92 40.69 3gu1 s ASP 166 CO 0.08 -0.79 1.62 0.00 -0.17 0.00 0.00 175.17 175.91 3gu1 n ALA 167 N 6.64 3.65 -2.04 3.66 0.00 -0.55 -2.76 120.51 129.11 3gu1 n ALA 167 Ca 0.08 -1.69 -0.42 0.00 0.00 0.00 0.00 53.44 51.41 3gu1 n ALA 167 Cb 0.48 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 3gu1 n ALA 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3gu1 s THR 168 N -2.47 3.36 0.71 0.00 2.01 -1.26 -4.91 115.64 113.07 3gu1 s THR 168 Ca 0.49 0.73 -0.14 0.00 0.31 0.00 0.00 61.69 63.07 3gu1 s THR 168 Cb 0.37 -3.47 0.03 0.00 0.01 0.00 0.00 72.50 69.43 3gu1 s THR 168 CO 0.16 -0.02 1.14 -2.84 -0.69 0.00 0.00 174.62 172.37 3gu1 s PRO 169 N 2.85 2.44 0.53 4.92 0.02 -1.26 -4.56 135.00 139.95 3gu1 s PRO 169 Ca 0.71 1.50 0.25 0.00 0.02 0.00 0.00 61.00 63.48 3gu1 s PRO 169 Cb -0.36 -1.90 1.40 0.00 0.02 0.00 0.00 34.50 33.67 3gu1 s PRO 169 CO 0.30 -1.55 1.99 -0.91 -0.33 0.00 0.00 177.00 176.51 3gu1 h ASN 170 N -0.28 0.00 -0.61 2.53 4.21 -0.32 -1.40 115.58 119.72 3gu1 h ASN 170 Ca -0.47 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.04 3gu1 h ASN 170 Cb 1.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 3gu1 h ASN 170 CO 0.52 0.00 0.00 -0.90 -1.29 0.00 0.00 177.43 175.76 3gu1 n ASP 171 N -4.36 3.80 -2.11 5.81 5.75 -1.26 -4.33 116.55 119.85 3gu1 n ASP 171 Ca 0.10 -2.18 -0.16 0.00 -0.01 0.00 0.00 54.79 52.53 3gu1 n ASP 171 Cb 0.61 -0.48 0.04 0.00 -1.03 0.00 0.00 41.12 40.25 3gu1 n ASP 171 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3gu1 n GLY 173 N -0.69 0.50 3.61 0.00 0.00 -1.26 -1.24 105.19 106.12 3gu1 n GLY 173 Ca 0.34 -0.63 -0.46 0.00 0.00 0.00 0.00 46.02 45.27 3gu1 n GLY 173 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3gu1 n ARG 174 N -2.86 1.52 -3.20 1.61 0.63 -1.24 -4.80 116.66 108.33 3gu1 n ARG 174 Ca 0.00 0.54 -0.16 0.00 -0.92 0.00 0.00 57.85 57.31 3gu1 n ARG 174 Cb 0.00 -2.03 -0.06 0.00 0.45 0.00 0.00 32.46 30.83 3gu1 n ARG 174 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3gu1 s ASN 175 N -0.19 0.40 0.32 6.15 3.84 -1.26 -5.01 114.94 119.20 3gu1 s ASN 175 Ca 0.65 -2.09 0.05 0.00 0.21 0.00 0.00 52.86 51.68 3gu1 s ASN 175 Cb -0.72 0.67 0.67 0.00 -0.55 0.00 0.00 41.25 41.31 3gu1 s ASN 175 CO 0.56 -0.17 1.87 -0.65 -2.79 0.00 0.00 177.10 175.92 3gu1 h PRO 176 N 6.01 0.84 -0.62 0.43 0.11 -1.98 -2.02 132.00 134.77 3gu1 h PRO 176 Ca 0.13 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 3gu1 h PRO 176 Cb 1.03 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.92 3gu1 h PRO 176 CO 0.20 0.55 0.34 0.00 -0.21 0.00 0.00 178.00 178.88 3gu1 h ALA 177 N 1.56 0.79 -0.48 -0.75 0.00 -1.97 -0.17 119.26 118.24 3gu1 h ALA 177 Ca 0.45 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 3gu1 h ALA 177 Cb 0.52 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3gu1 h ALA 177 CO -0.21 0.30 0.15 0.35 0.00 0.00 0.00 179.25 179.84 3gu1 h PHE 178 N 0.84 0.77 -0.99 0.00 3.57 -1.85 -1.82 116.94 117.45 3gu1 h PHE 178 Ca 0.22 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.70 3gu1 h PHE 178 Cb 0.04 -0.22 -0.07 0.00 2.79 0.00 0.00 35.95 38.49 3gu1 h PHE 178 CO -0.01 0.68 0.64 -0.07 -2.23 0.00 0.00 178.31 177.32 3gu1 h LEU 179 N 0.63 1.03 -0.87 0.59 4.07 -1.00 -0.98 115.31 118.79 3gu1 h LEU 179 Ca 0.15 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 58.04 3gu1 h LEU 179 Cb 0.27 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.78 3gu1 h LEU 179 CO -0.00 0.66 -0.08 -0.09 -1.08 0.00 0.00 178.44 177.85 3gu1 h ARG 180 N 1.17 0.75 -0.60 1.13 2.43 -0.49 -1.30 114.38 117.48 3gu1 h ARG 180 Ca 0.42 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3gu1 h ARG 180 Cb 0.16 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 3gu1 h ARG 180 CO -0.16 0.82 0.37 0.93 -1.51 0.00 0.00 179.97 180.41 3gu1 h GLU 181 N 0.69 0.80 -0.54 0.20 5.08 -0.39 0.15 114.58 120.58 3gu1 h GLU 181 Ca 0.12 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 3gu1 h GLU 181 Cb 0.54 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 3gu1 h GLU 181 CO 0.03 0.56 0.13 0.28 -1.00 0.00 0.00 179.01 179.01 3gu1 h VAL 182 N 0.81 1.25 -0.48 3.13 2.07 -0.94 -1.68 116.25 120.41 3gu1 h VAL 182 Ca 0.22 -0.88 -0.13 0.00 0.82 0.00 0.00 66.70 66.73 3gu1 h VAL 182 Cb -0.04 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3gu1 h VAL 182 CO -0.04 0.32 -0.19 -1.28 0.02 0.00 0.00 177.57 176.40 3gu1 h SER 183 N 0.76 1.00 0.67 0.57 0.87 -1.00 -2.82 113.55 113.60 3gu1 h SER 183 Ca 0.17 -0.39 -0.10 0.00 -1.23 0.00 0.00 61.79 60.24 3gu1 h SER 183 Cb 0.35 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3gu1 h SER 183 CO 0.00 1.17 -0.48 -0.33 -0.53 0.00 0.00 176.83 176.66 3gu1 h GLU 184 N 0.83 0.00 0.00 2.24 5.08 -0.87 0.23 114.58 122.09 3gu1 h GLU 184 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3gu1 h GLU 184 Cb 0.77 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.02 3gu1 h GLU 184 CO 0.06 0.48 -0.02 0.00 -1.00 0.00 0.00 179.01 178.54 3gu1 h ALA 185 N 1.52 0.99 0.00 3.43 0.00 -1.23 -3.38 119.26 120.58 3gu1 h ALA 185 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3gu1 h ALA 185 Cb 0.95 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3gu1 h ALA 185 CO 0.06 0.02 -0.87 0.25 0.00 0.00 0.00 179.25 178.72 3gu1 n THR 186 N -3.11 0.00 -0.01 0.00 -2.24 -1.07 -5.03 114.28 102.82 3gu1 n THR 186 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3gu1 n THR 186 Cb 0.54 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 3gu1 n THR 186 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gu1 n GLY 187 N 2.40 0.92 3.74 3.38 0.00 0.79 -4.98 105.19 111.44 3gu1 n GLY 187 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3gu1 n GLY 187 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gu1 s LEU 188 N 0.00 4.41 0.04 0.99 2.96 -1.25 -4.99 118.68 120.85 3gu1 s LEU 188 Ca 0.00 2.42 -0.23 0.00 -0.22 0.00 0.00 54.13 56.11 3gu1 s LEU 188 Cb 0.00 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 43.02 3gu1 s LEU 188 CO 0.00 -0.54 0.68 -1.10 -1.32 0.00 0.00 176.35 174.07 3gu1 s GLN 189 N -0.15 4.40 -0.06 1.98 -0.21 -0.41 -4.40 119.66 120.81 3gu1 s GLN 189 Ca 0.57 0.90 0.00 0.00 0.02 0.00 0.00 55.36 56.86 3gu1 s GLN 189 Cb -0.37 -3.34 0.02 0.00 1.00 0.00 0.00 33.01 30.33 3gu1 s GLN 189 CO 0.39 0.37 -0.05 0.42 -2.12 0.00 0.00 175.29 174.30 3gu1 s ILE 190 N -0.29 0.63 -0.05 1.08 1.01 -1.26 -0.71 121.20 121.61 3gu1 s ILE 190 Ca 0.34 -0.13 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 3gu1 s ILE 190 Cb -0.20 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 3gu1 s ILE 190 CO 0.20 0.27 0.15 -0.76 0.00 0.00 0.00 174.94 174.80 3gu1 s LEU 191 N 1.24 4.32 0.39 2.97 1.02 -0.71 -0.27 118.68 127.64 3gu1 s LEU 191 Ca -0.06 0.37 0.08 0.00 0.02 0.00 0.00 54.13 54.55 3gu1 s LEU 191 Cb -0.14 -2.35 -0.06 0.00 0.02 0.00 0.00 46.19 43.66 3gu1 s LEU 191 CO -0.02 0.33 0.05 0.00 0.02 0.00 0.00 176.35 176.72 3gu1 s ALA 193 N -2.62 3.86 -0.05 0.00 0.00 -1.11 -0.83 121.76 121.00 3gu1 s ALA 193 Ca 0.36 -1.86 0.01 0.00 0.00 0.00 0.00 51.96 50.48 3gu1 s ALA 193 Cb 0.05 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.28 3gu1 s ALA 193 CO 0.19 -0.13 -0.06 -0.08 0.00 0.00 0.00 175.76 175.68 3gu1 s THR 194 N -2.45 0.71 0.00 0.00 -1.32 -0.76 -4.83 115.64 106.99 3gu1 s THR 194 Ca 0.44 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.71 3gu1 s THR 194 Cb -0.03 -0.71 0.00 0.00 -1.51 0.00 0.00 72.50 70.26 3gu1 s THR 194 CO 0.26 0.27 0.00 0.61 -2.21 0.00 0.00 174.62 173.55 3gu1 n GLY 195 N 4.07 1.78 3.52 6.08 0.00 -1.26 -4.39 105.19 114.99 3gu1 n GLY 195 Ca -0.23 -1.34 -0.26 0.00 0.00 0.00 0.00 46.02 44.19 3gu1 n GLY 195 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gu1 s PHE 196 N -1.93 2.48 1.06 1.61 0.40 -1.26 0.46 117.98 120.80 3gu1 s PHE 196 Ca 0.00 -0.28 -0.18 0.00 -0.60 0.00 0.00 56.93 55.87 3gu1 s PHE 196 Cb 0.00 -1.17 0.24 0.00 0.51 0.00 0.00 43.02 42.60 3gu1 s PHE 196 CO 0.00 0.57 1.26 -0.46 0.70 0.00 0.00 175.22 177.29 3gu1 s TRP 197 N -1.96 1.10 0.79 0.36 -0.00 -1.26 -4.37 118.94 113.60 3gu1 s TRP 197 Ca 0.26 0.33 -0.11 0.00 -0.00 0.00 0.00 56.10 56.58 3gu1 s TRP 197 Cb -0.07 -3.95 0.07 0.00 -0.00 0.00 0.00 33.47 29.52 3gu1 s TRP 197 CO 0.14 -3.14 1.09 1.52 -0.00 0.00 0.00 176.95 176.56 3gu1 s TYR 198 N -3.62 2.71 0.40 5.86 -0.85 -1.26 -4.65 117.35 115.92 3gu1 s TYR 198 Ca 0.74 1.33 0.07 0.00 -0.52 0.00 0.00 57.07 58.69 3gu1 s TYR 198 Cb -0.05 -3.06 0.82 0.00 0.38 0.00 0.00 41.96 40.05 3gu1 s TYR 198 CO 0.54 -1.81 2.03 1.49 -1.52 0.00 0.00 175.55 176.27 3gu1 h GLU 199 N -1.13 0.60 -0.87 -3.49 4.81 -1.91 0.18 114.58 112.77 3gu1 h GLU 199 Ca -0.46 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 58.78 3gu1 h GLU 199 Cb 1.25 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 30.44 3gu1 h GLU 199 CO 0.56 0.40 0.57 0.78 -0.73 0.00 0.00 179.01 180.59 3gu1 h GLY 200 N 0.62 1.24 0.00 1.92 0.00 -1.95 -3.34 103.07 101.56 3gu1 h GLY 200 Ca 0.21 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3gu1 h GLY 200 CO -0.05 0.34 0.00 1.18 0.00 0.00 0.00 176.54 178.01 3gu1 n GLU 201 N -4.46 0.10 -1.55 4.80 1.02 -1.15 -5.10 120.64 114.31 3gu1 n GLU 201 Ca 0.12 -0.17 -0.30 0.00 -0.02 0.00 0.00 57.16 56.79 3gu1 n GLU 201 Cb 0.14 -0.62 0.21 0.00 -0.02 0.00 0.00 31.44 31.14 3gu1 n GLU 201 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3gu1 s GLY 202 N -0.06 1.69 -1.07 0.62 0.00 0.63 -4.50 107.32 104.62 3gu1 s GLY 202 Ca 0.00 -1.07 -0.14 0.00 0.00 0.00 0.00 44.72 43.51 3gu1 s GLY 202 CO 0.00 -0.26 1.20 0.00 0.00 0.00 0.00 173.10 174.05 3gu1 s ALA 203 N -3.49 3.99 -0.63 3.20 0.00 -1.26 -4.85 121.76 118.72 3gu1 s ALA 203 Ca 0.72 -3.29 0.24 0.00 0.00 0.00 0.00 51.96 49.63 3gu1 s ALA 203 Cb -0.07 -3.92 0.33 0.00 0.00 0.00 0.00 23.12 19.46 3gu1 s ALA 203 CO 0.54 -2.66 1.30 0.25 0.00 0.00 0.00 175.76 175.20 3gu1 n THR 204 N 4.40 0.35 -0.20 0.00 -2.24 -1.26 -4.39 114.28 110.94 3gu1 n THR 204 Ca 0.28 -0.28 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 3gu1 n THR 204 Cb 0.44 -0.12 0.08 0.00 -2.10 0.00 0.00 70.33 68.64 3gu1 n THR 204 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3gu1 h THR 205 N 0.00 0.93 0.62 4.28 2.02 -1.99 -1.92 112.91 116.84 3gu1 h THR 205 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 3gu1 h THR 205 Cb 0.75 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3gu1 h THR 205 CO 0.00 0.10 -0.40 0.22 0.37 0.00 0.00 175.52 175.81 3gu1 h TYR 206 N 0.57 -1.07 0.00 3.16 3.20 -2.01 -1.50 116.97 119.32 3gu1 h TYR 206 Ca 0.27 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.11 3gu1 h TYR 206 Cb 0.20 0.39 -0.00 0.00 1.54 0.00 0.00 36.73 38.85 3gu1 h TYR 206 CO -0.10 -0.60 -0.13 0.74 -1.64 0.00 0.00 178.16 176.43 3gu1 h PHE 207 N -0.97 0.00 -0.49 -3.82 -1.00 -1.83 -1.28 116.94 107.56 3gu1 h PHE 207 Ca -0.08 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.60 3gu1 h PHE 207 Cb 0.79 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.34 3gu1 h PHE 207 CO -0.12 0.13 -0.11 0.87 -1.61 0.00 0.00 178.31 177.47 3gu1 h LYS 208 N 0.00 0.90 -0.23 1.51 1.57 -1.19 0.54 116.57 119.67 3gu1 h LYS 208 Ca -0.00 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.40 3gu1 h LYS 208 Cb 0.79 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 3gu1 h LYS 208 CO 0.02 0.96 -0.11 0.35 -0.57 0.00 0.00 179.45 180.10 3gu1 h PHE 209 N 0.81 0.54 -0.67 -1.35 3.57 -0.88 -1.15 116.94 117.81 3gu1 h PHE 209 Ca 0.13 -0.13 0.08 0.00 3.53 0.00 0.00 57.97 61.58 3gu1 h PHE 209 Cb 0.64 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.18 3gu1 h PHE 209 CO 0.04 0.75 0.34 -0.09 -2.23 0.00 0.00 178.31 177.11 3gu1 h ARG 210 N 0.19 0.57 0.00 1.11 9.65 -1.10 -1.37 114.38 123.43 3gu1 h ARG 210 Ca 0.05 -0.03 -0.09 0.00 -1.10 0.00 0.00 59.98 58.80 3gu1 h ARG 210 Cb 0.60 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.04 3gu1 h ARG 210 CO 0.03 0.38 -0.45 0.00 2.80 0.00 0.00 179.97 182.73 3gu1 h ALA 211 N 1.40 1.03 0.00 2.80 0.00 -0.71 -2.26 119.26 121.52 3gu1 h ALA 211 Ca 0.32 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3gu1 h ALA 211 Cb 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3gu1 h ALA 211 CO -0.25 0.56 -0.37 0.66 0.00 0.00 0.00 179.25 179.86 3gu1 h SER 212 N 0.00 0.00 0.25 0.00 4.64 -0.08 -3.21 113.55 115.14 3gu1 h SER 212 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gu1 h SER 212 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 3gu1 h SER 212 CO 0.06 0.37 -0.95 0.18 -0.87 0.00 0.00 176.83 175.62 3gu1 n LEU 213 N -3.82 0.71 0.00 5.97 4.77 -0.98 -5.07 117.00 118.57 3gu1 n LEU 213 Ca -0.01 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 3gu1 n LEU 213 Cb 0.44 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3gu1 n LEU 213 CO 0.37 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3gu1 n GLY 214 N 1.45 -0.64 3.58 -0.72 0.00 -0.87 -5.06 105.19 102.92 3gu1 n GLY 214 Ca 0.03 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 3gu1 n GLY 214 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gu1 s ASP 215 N -4.00 6.79 0.33 1.61 2.15 -1.26 -4.47 116.67 117.81 3gu1 s ASP 215 Ca 0.00 -2.30 0.06 0.00 0.43 0.00 0.00 52.55 50.74 3gu1 s ASP 215 Cb 0.00 -2.58 0.56 0.00 -0.30 0.00 0.00 42.92 40.61 3gu1 s ASP 215 CO 0.00 -1.22 1.80 0.00 -0.17 0.00 0.00 175.17 175.59 3gu1 h ALA 216 N 7.90 1.27 -0.36 3.66 0.00 -1.85 -2.96 119.26 126.93 3gu1 h ALA 216 Ca 0.41 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 55.09 3gu1 h ALA 216 Cb 0.89 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3gu1 h ALA 216 CO 1.45 0.48 0.03 1.49 0.00 0.00 0.00 179.25 182.71 3gu1 h GLU 217 N 0.34 0.14 -0.06 0.00 4.81 -1.86 -0.66 114.58 117.29 3gu1 h GLU 217 Ca 0.06 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 3gu1 h GLU 217 Cb 0.54 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 3gu1 h GLU 217 CO 0.04 0.09 -0.30 0.77 -0.73 0.00 0.00 179.01 178.88 3gu1 h SER 218 N 0.14 0.11 -0.09 1.04 0.02 -1.89 0.37 113.55 113.25 3gu1 h SER 218 Ca 0.17 -0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.96 3gu1 h SER 218 Cb 0.22 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 3gu1 h SER 218 CO -0.26 0.41 -0.37 -0.33 -1.14 0.00 0.00 176.83 175.14 3gu1 h GLU 219 N 0.10 0.60 -0.30 3.45 5.08 -1.17 -0.49 114.58 121.84 3gu1 h GLU 219 Ca 0.01 -0.29 -0.18 0.00 -1.00 0.00 0.00 59.36 57.90 3gu1 h GLU 219 Cb 0.59 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 3gu1 h GLU 219 CO 0.04 0.88 -0.51 0.82 -1.00 0.00 0.00 179.01 179.25 3gu1 h ILE 220 N 0.50 1.28 -0.42 3.13 2.04 -0.72 -2.27 117.51 121.04 3gu1 h ILE 220 Ca 0.05 -1.69 -0.00 0.00 1.00 0.00 0.00 64.86 64.21 3gu1 h ILE 220 Cb 0.87 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 3gu1 h ILE 220 CO 0.08 0.55 0.25 0.22 0.00 0.00 0.00 178.15 179.25 3gu1 h TYR 221 N 0.67 0.56 -0.80 1.37 3.20 -0.74 -0.67 116.97 120.57 3gu1 h TYR 221 Ca 0.03 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 3gu1 h TYR 221 Cb 1.11 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.16 3gu1 h TYR 221 CO 0.07 0.41 0.39 1.49 -1.64 0.00 0.00 178.16 178.87 3gu1 h GLU 222 N 0.56 1.14 0.31 1.82 4.57 -0.99 -0.25 114.58 121.74 3gu1 h GLU 222 Ca 0.15 -0.16 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 3gu1 h GLU 222 Cb 0.02 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 3gu1 h GLU 222 CO -0.03 0.88 -0.15 1.98 -1.18 0.00 0.00 179.01 180.51 3gu1 h MET 223 N 1.12 -0.40 -0.33 1.92 4.05 -1.12 -0.41 114.93 119.76 3gu1 h MET 223 Ca 0.27 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.76 3gu1 h MET 223 Cb 0.11 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 30.96 3gu1 h MET 223 CO -0.04 -0.17 0.11 0.52 0.23 0.00 0.00 176.91 177.56 3gu1 h MET 224 N -0.57 0.24 -0.57 0.39 2.86 -0.99 0.73 114.93 117.02 3gu1 h MET 224 Ca -0.04 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 3gu1 h MET 224 Cb 0.42 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 3gu1 h MET 224 CO 0.07 0.16 0.19 -0.09 1.06 0.00 0.00 176.91 178.30 3gu1 h ARG 225 N 0.24 0.87 -0.47 1.72 2.43 -1.03 -1.24 114.38 116.92 3gu1 h ARG 225 Ca 0.15 -0.18 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 3gu1 h ARG 225 Cb 0.13 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 3gu1 h ARG 225 CO -0.16 0.78 0.04 1.15 -1.51 0.00 0.00 179.97 180.27 3gu1 h THR 226 N 0.79 1.25 0.00 0.20 2.02 -0.76 0.07 112.91 116.48 3gu1 h THR 226 Ca 0.18 -0.98 -0.06 0.00 0.77 0.00 0.00 66.41 66.32 3gu1 h THR 226 Cb 0.26 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 3gu1 h THR 226 CO -0.01 0.34 -0.31 -0.33 0.37 0.00 0.00 175.52 175.59 3gu1 h GLU 227 N 0.65 0.00 0.17 6.66 5.08 -0.58 0.24 114.58 126.80 3gu1 h GLU 227 Ca 0.14 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.16 3gu1 h GLU 227 Cb 0.44 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.70 3gu1 h GLU 227 CO 0.02 0.31 -1.66 0.28 -1.00 0.00 0.00 179.01 176.95 3gu1 h VAL 228 N 0.00 1.03 0.00 3.13 2.07 -1.06 -0.05 116.25 121.37 3gu1 h VAL 228 Ca -0.00 -2.62 -0.24 0.00 0.82 0.00 0.00 66.70 64.66 3gu1 h VAL 228 Cb 0.55 2.78 -0.04 0.00 -1.52 0.00 0.00 31.29 33.06 3gu1 h VAL 228 CO 0.04 0.84 -1.95 0.35 0.02 0.00 0.00 177.57 176.86 3gu1 n THR 229 N -3.55 1.12 -0.01 2.57 -2.24 -0.01 -4.58 114.28 107.58 3gu1 n THR 229 Ca -0.21 -0.74 -0.05 0.00 -2.27 0.00 0.00 64.05 60.77 3gu1 n THR 229 Cb 1.07 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 3gu1 n THR 229 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gu1 n GLU 230 N -2.74 0.15 0.00 -0.78 1.02 0.67 -5.06 120.64 113.90 3gu1 n GLU 230 Ca -0.19 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 3gu1 n GLU 230 Cb 0.95 -0.75 0.00 0.00 -0.02 0.00 0.00 31.44 31.62 3gu1 n GLU 230 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gu1 n GLY 231 N 2.74 2.69 3.68 0.62 0.00 -0.23 -4.62 105.19 110.08 3gu1 n GLY 231 Ca -0.09 -1.09 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 3gu1 n GLY 231 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gu1 s ILE 232 N -2.00 4.87 -1.73 -0.61 1.01 0.38 -3.98 121.20 119.14 3gu1 s ILE 232 Ca 0.00 -0.01 -0.19 0.00 0.00 0.00 0.00 60.65 60.45 3gu1 s ILE 232 Cb 0.00 -3.16 0.17 0.00 0.01 0.00 0.00 42.46 39.48 3gu1 s ILE 232 CO 0.00 0.50 0.75 0.00 0.00 0.00 0.00 174.94 176.19 3gu1 n ALA 233 N 3.10 -1.27 -1.15 9.38 0.00 -1.26 -0.73 120.51 128.58 3gu1 n ALA 233 Ca -0.17 -0.04 -0.05 0.00 0.00 0.00 0.00 53.44 53.17 3gu1 n ALA 233 Cb 0.53 -3.31 -0.02 0.00 0.00 0.00 0.00 19.45 16.65 3gu1 n ALA 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gu1 n GLY 234 N -1.36 0.61 0.08 0.00 0.00 -1.26 -4.86 105.19 98.40 3gu1 n GLY 234 Ca 0.07 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.13 3gu1 n GLY 234 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gu1 h THR 235 N 0.00 0.00 0.00 2.61 1.35 -1.27 -3.47 112.91 112.13 3gu1 h THR 235 Ca -0.11 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 3gu1 h THR 235 Cb 0.86 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 3gu1 h THR 235 CO 0.16 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 3gu1 n GLY 236 N 1.29 2.19 3.67 5.82 0.00 -1.26 -4.96 105.19 111.94 3gu1 n GLY 236 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3gu1 n GLY 236 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gu1 s ILE 237 N -2.77 4.79 0.16 -0.61 1.01 -1.26 -4.74 121.20 117.77 3gu1 s ILE 237 Ca 0.00 1.90 0.02 0.00 0.00 0.00 0.00 60.65 62.57 3gu1 s ILE 237 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 3gu1 s ILE 237 CO 0.00 -0.04 0.30 -0.13 0.00 0.00 0.00 174.94 175.07 3gu1 s ARG 238 N 2.39 3.46 0.17 2.79 0.52 -1.26 -0.47 118.95 126.55 3gu1 s ARG 238 Ca 0.44 -0.54 -0.28 0.00 -0.52 0.00 0.00 55.73 54.83 3gu1 s ARG 238 Cb -0.17 -2.94 -0.08 0.00 0.52 0.00 0.00 34.95 32.28 3gu1 s ARG 238 CO 0.13 0.50 0.86 0.00 0.02 0.00 0.00 175.30 176.81 3gu1 s ALA 239 N -1.76 3.37 -2.09 2.13 0.00 -0.03 -4.64 121.76 118.74 3gu1 s ALA 239 Ca 0.35 0.48 0.24 0.00 0.00 0.00 0.00 51.96 53.03 3gu1 s ALA 239 Cb -0.11 -3.10 0.24 0.00 0.00 0.00 0.00 23.12 20.15 3gu1 s ALA 239 CO 0.29 0.20 1.25 0.41 0.00 0.00 0.00 175.76 177.90 3gu1 n GLY 240 N 1.72 -0.01 3.29 0.00 0.00 -0.01 -4.49 105.19 105.69 3gu1 n GLY 240 Ca -0.03 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 3gu1 n GLY 240 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gu1 s VAL 241 N -2.41 0.09 0.00 1.61 -7.23 -1.13 -4.34 120.40 106.98 3gu1 s VAL 241 Ca 0.22 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.68 3gu1 s VAL 241 Cb 0.19 -1.21 0.00 0.00 0.56 0.00 0.00 36.38 35.92 3gu1 s VAL 241 CO 0.52 -0.39 0.00 -0.38 -0.31 0.00 0.00 175.10 174.55 3gu1 n ILE 242 N -0.19 0.00 0.00 -0.62 5.41 -0.31 -1.83 119.36 121.82 3gu1 n ILE 242 Ca -0.16 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.59 3gu1 n ILE 242 Cb 0.63 -0.68 0.00 0.00 -0.71 0.00 0.00 39.64 38.88 3gu1 n ILE 242 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3gu1 n LEU 244 N 0.00 0.00 -3.66 1.39 4.77 -0.56 -0.97 117.00 117.97 3gu1 n LEU 244 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3gu1 n LEU 244 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3gu1 n LEU 244 CO 0.00 0.00 0.29 0.00 -1.33 0.00 0.00 177.39 176.35 3gu1 s ALA 245 N -2.00 -1.47 0.21 -1.18 0.00 -1.26 -1.37 121.76 114.69 3gu1 s ALA 245 Ca 0.00 1.56 0.05 0.00 0.00 0.00 0.00 51.96 53.57 3gu1 s ALA 245 Cb 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 23.12 22.27 3gu1 s ALA 245 CO 0.00 -0.29 -0.06 -1.54 0.00 0.00 0.00 175.76 173.87 3gu1 s SER 246 N 0.04 2.03 0.85 0.00 1.04 -0.95 -4.33 113.70 112.38 3gu1 s SER 246 Ca -0.02 -1.12 -0.12 0.00 0.48 0.00 0.00 55.95 55.16 3gu1 s SER 246 Cb -0.04 -0.04 0.12 0.00 0.10 0.00 0.00 66.02 66.16 3gu1 s SER 246 CO 0.02 -0.39 1.21 -0.44 0.98 0.00 0.00 173.24 174.62 3gu1 s SER 247 N -3.28 4.08 0.05 7.02 0.01 -1.18 -3.25 113.70 117.16 3gu1 s SER 247 Ca 0.24 0.56 -0.20 0.00 1.31 0.00 0.00 55.95 57.86 3gu1 s SER 247 Cb 0.04 -0.92 -0.13 0.00 0.21 0.00 0.00 66.02 65.22 3gu1 s SER 247 CO 0.06 -2.14 1.41 -0.09 0.41 0.00 0.00 173.24 172.89 3gu1 h ARG 248 N -1.19 0.35 -0.01 12.44 2.43 -1.91 -3.32 114.38 123.18 3gu1 h ARG 248 Ca -0.45 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 3gu1 h ARG 248 Cb 1.30 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3gu1 h ARG 248 CO 0.56 0.66 -0.27 -0.25 -1.51 0.00 0.00 179.97 179.16 3gu1 n ASP 249 N -4.62 0.78 -3.63 -3.80 8.00 -1.26 -4.53 116.55 107.50 3gu1 n ASP 249 Ca -0.05 -0.66 -0.01 0.00 0.71 0.00 0.00 54.79 54.77 3gu1 n ASP 249 Cb 0.30 0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 3gu1 n ASP 249 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gu1 s ALA 250 N -2.61 -2.26 -0.59 2.24 0.00 -1.25 -5.04 121.76 112.26 3gu1 s ALA 250 Ca 0.22 1.73 -0.21 0.00 0.00 0.00 0.00 51.96 53.71 3gu1 s ALA 250 Cb 0.19 -0.28 0.07 0.00 0.00 0.00 0.00 23.12 23.11 3gu1 s ALA 250 CO 0.55 -0.64 0.80 0.42 0.00 0.00 0.00 175.76 176.88 3gu1 s ILE 251 N -2.05 4.62 0.95 0.00 1.01 -1.26 -3.09 121.20 121.39 3gu1 s ILE 251 Ca 0.12 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 60.14 3gu1 s ILE 251 Cb 0.01 -4.51 0.16 0.00 0.01 0.00 0.00 42.46 38.13 3gu1 s ILE 251 CO -0.03 -1.15 1.10 0.42 0.00 0.00 0.00 174.94 175.27 3gu1 s THR 252 N 3.26 2.37 0.24 2.92 -4.23 -1.26 -4.66 115.64 114.29 3gu1 s THR 252 Ca 0.18 0.12 -0.05 0.00 -1.18 0.00 0.00 61.69 60.76 3gu1 s THR 252 Cb -0.19 -2.33 0.21 0.00 1.34 0.00 0.00 72.50 71.52 3gu1 s THR 252 CO 0.10 -0.16 1.82 -0.65 -0.54 0.00 0.00 174.62 175.20 3gu1 h PRO 253 N -1.88 0.81 -0.38 3.99 0.11 -1.99 0.21 132.00 132.88 3gu1 h PRO 253 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 3gu1 h PRO 253 Cb 1.28 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3gu1 h PRO 253 CO 0.48 0.54 0.25 -0.92 -0.21 0.00 0.00 178.00 178.13 3gu1 h TYR 254 N 0.83 0.48 -0.71 0.65 3.20 -2.02 -2.72 116.97 116.69 3gu1 h TYR 254 Ca 0.38 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.22 3gu1 h TYR 254 Cb 0.29 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 3gu1 h TYR 254 CO -0.05 0.31 0.27 0.93 -1.64 0.00 0.00 178.16 177.98 3gu1 h GLU 255 N 0.51 1.07 -0.27 1.82 5.08 -1.51 -2.86 114.58 118.41 3gu1 h GLU 255 Ca 0.14 -0.20 0.08 0.00 -1.00 0.00 0.00 59.36 58.37 3gu1 h GLU 255 Cb -0.04 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 3gu1 h GLU 255 CO -0.03 0.89 0.21 1.96 -1.00 0.00 0.00 179.01 181.04 3gu1 h GLN 256 N 1.02 0.00 -0.81 2.33 4.20 -0.34 -0.72 115.11 120.79 3gu1 h GLN 256 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3gu1 h GLN 256 Cb 0.23 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 3gu1 h GLN 256 CO -0.02 0.00 0.52 -0.07 -0.67 0.00 0.00 178.83 178.59 3gu1 h LEU 257 N 0.00 0.95 -0.33 1.46 3.38 -1.28 -0.64 115.31 118.84 3gu1 h LEU 257 Ca 0.13 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 3gu1 h LEU 257 Cb 0.55 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3gu1 h LEU 257 CO -0.00 0.71 -0.56 -0.26 0.09 0.00 0.00 178.44 178.42 3gu1 h PHE 258 N 1.11 1.02 -0.48 1.13 -1.00 -1.27 -1.82 116.94 115.63 3gu1 h PHE 258 Ca 0.30 -0.37 -0.02 0.00 2.81 0.00 0.00 57.97 60.69 3gu1 h PHE 258 Cb -0.09 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.26 3gu1 h PHE 258 CO -0.01 1.18 0.24 0.74 -1.61 0.00 0.00 178.31 178.85 3gu1 h PHE 259 N 0.62 0.68 -0.24 -0.55 -1.00 -1.15 0.91 116.94 116.21 3gu1 h PHE 259 Ca 0.01 -0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.72 3gu1 h PHE 259 Cb 1.16 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 40.50 3gu1 h PHE 259 CO 0.07 0.54 0.01 0.00 -1.61 0.00 0.00 178.31 177.32 3gu1 h ARG 260 N 0.63 0.42 -0.94 1.51 3.08 -1.12 -0.70 114.38 117.25 3gu1 h ARG 260 Ca 0.17 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 60.10 3gu1 h ARG 260 Cb 0.10 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 3gu1 h ARG 260 CO -0.02 0.58 0.63 0.00 -1.07 0.00 0.00 179.97 180.09 3gu1 h ALA 261 N 0.82 1.20 -0.33 0.04 0.00 -1.15 -2.49 119.26 117.35 3gu1 h ALA 261 Ca 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3gu1 h ALA 261 Cb 0.39 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3gu1 h ALA 261 CO 0.01 0.59 0.09 0.00 0.00 0.00 0.00 179.25 179.94 3gu1 h ALA 262 N 1.35 0.43 -0.92 0.00 0.00 -0.61 -1.94 119.26 117.57 3gu1 h ALA 262 Ca 0.35 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 55.18 3gu1 h ALA 262 Cb -0.15 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.44 3gu1 h ALA 262 CO -0.08 0.09 0.56 0.00 0.00 0.00 0.00 179.25 179.82 3gu1 h ALA 263 N 0.93 1.32 -0.36 0.00 0.00 -0.86 0.32 119.26 120.61 3gu1 h ALA 263 Ca 0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3gu1 h ALA 263 Cb 0.28 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3gu1 h ALA 263 CO -0.00 0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.60 3gu1 h ARG 264 N 0.94 0.55 -0.21 0.00 3.08 -1.17 -0.67 114.38 116.90 3gu1 h ARG 264 Ca 0.43 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 60.26 3gu1 h ARG 264 Cb 0.35 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3gu1 h ARG 264 CO -0.23 0.55 -0.37 0.28 -1.07 0.00 0.00 179.97 179.13 3gu1 h VAL 265 N 0.44 1.30 -0.23 2.04 2.07 -0.73 -2.14 116.25 118.99 3gu1 h VAL 265 Ca 0.12 -1.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.12 3gu1 h VAL 265 Cb 0.21 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3gu1 h VAL 265 CO -0.01 0.47 0.05 -0.61 0.02 0.00 0.00 177.57 177.49 3gu1 h GLN 266 N 0.39 0.37 -0.74 1.57 -0.00 -0.07 -0.06 115.11 116.58 3gu1 h GLN 266 Ca 0.04 -0.09 -0.02 0.00 -0.00 0.00 0.00 58.65 58.58 3gu1 h GLN 266 Cb 0.83 -0.05 -0.04 0.00 0.00 0.00 0.00 27.48 28.23 3gu1 h GLN 266 CO 0.07 0.49 0.39 0.00 0.00 0.00 0.00 178.83 179.78 3gu1 h ARG 267 N 0.19 1.03 0.00 1.69 3.08 -1.03 0.23 114.38 119.56 3gu1 h ARG 267 Ca 0.07 -0.12 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 3gu1 h ARG 267 Cb 0.29 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 3gu1 h ARG 267 CO 0.00 0.76 -0.71 0.93 -1.07 0.00 0.00 179.97 179.88 3gu1 h GLU 268 N 1.03 0.00 0.00 0.04 5.08 -1.14 -3.40 114.58 116.19 3gu1 h GLU 268 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3gu1 h GLU 268 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3gu1 h GLU 268 CO -0.04 0.71 -0.76 0.25 -1.00 0.00 0.00 179.01 178.17 3gu1 n THR 269 N -3.34 0.00 -0.47 1.13 -2.24 -0.06 -4.82 114.28 104.48 3gu1 n THR 269 Ca 0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 3gu1 n THR 269 Cb 0.80 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 3gu1 n THR 269 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gu1 n GLY 270 N 2.09 1.53 3.67 3.38 0.00 0.78 -3.13 105.19 113.51 3gu1 n GLY 270 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3gu1 n GLY 270 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3gu1 n VAL 271 N -2.00 2.32 -1.42 1.61 3.14 -1.26 -4.86 118.33 115.85 3gu1 n VAL 271 Ca 0.00 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.57 3gu1 n VAL 271 Cb 0.00 -1.41 0.08 0.00 -1.06 0.00 0.00 33.84 31.44 3gu1 n VAL 271 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3gu1 s PRO 272 N -2.00 2.47 -0.06 1.45 0.02 -1.26 -4.76 135.00 130.85 3gu1 s PRO 272 Ca 0.60 1.20 0.03 0.00 0.02 0.00 0.00 61.00 62.84 3gu1 s PRO 272 Cb -0.56 -1.92 0.01 0.00 0.02 0.00 0.00 34.50 32.05 3gu1 s PRO 272 CO 0.59 -1.48 -0.14 0.42 -0.33 0.00 0.00 177.00 176.06 3gu1 s ILE 273 N -2.78 1.28 0.07 2.83 1.01 0.68 -1.17 121.20 123.12 3gu1 s ILE 273 Ca 0.62 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.77 3gu1 s ILE 273 Cb -0.18 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 3gu1 s ILE 273 CO 0.52 0.38 -0.22 0.27 0.00 0.00 0.00 174.94 175.89 3gu1 s ILE 274 N 0.47 1.81 0.27 2.92 -4.36 -0.14 -0.69 121.20 121.48 3gu1 s ILE 274 Ca -0.12 -1.41 0.04 0.00 -0.26 0.00 0.00 60.65 58.90 3gu1 s ILE 274 Cb -0.15 -1.60 -0.06 0.00 1.25 0.00 0.00 42.46 41.91 3gu1 s ILE 274 CO 0.04 0.12 0.01 0.42 0.24 0.00 0.00 174.94 175.76 3gu1 s THR 275 N -0.96 1.20 -0.12 8.37 -4.23 -0.61 -1.50 115.64 117.80 3gu1 s THR 275 Ca 0.08 -2.04 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 3gu1 s THR 275 Cb -0.09 -2.51 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 3gu1 s THR 275 CO 0.03 -0.21 -0.16 -2.28 -0.54 0.00 0.00 174.62 171.46 3gu1 s HIS 276 N -3.30 2.74 -0.06 3.99 2.46 -0.47 -1.85 115.29 118.79 3gu1 s HIS 276 Ca 0.31 -0.72 0.04 0.00 0.47 0.00 0.00 55.06 55.17 3gu1 s HIS 276 Cb 0.06 -1.80 -0.02 0.00 -0.13 0.00 0.00 32.58 30.69 3gu1 s HIS 276 CO 0.12 -0.24 -0.17 0.95 -2.47 0.00 0.00 174.74 172.93 3gu1 s THR 277 N 0.28 2.83 -0.16 0.89 -4.23 -1.22 -2.23 115.64 111.79 3gu1 s THR 277 Ca -0.12 -0.80 -0.20 0.00 -1.18 0.00 0.00 61.69 59.40 3gu1 s THR 277 Cb -0.16 -2.10 -0.03 0.00 1.34 0.00 0.00 72.50 71.55 3gu1 s THR 277 CO 0.06 0.58 0.56 -1.58 -0.54 0.00 0.00 174.62 173.70 3gu1 s GLN 278 N -0.52 4.26 -1.52 3.99 2.00 -1.20 -4.48 119.66 122.19 3gu1 s GLN 278 Ca 0.07 0.54 -0.09 0.00 -2.00 0.00 0.00 55.36 53.88 3gu1 s GLN 278 Cb -0.12 -3.52 0.07 0.00 0.80 0.00 0.00 33.01 30.24 3gu1 s GLN 278 CO 0.01 -0.08 0.70 0.39 -0.50 0.00 0.00 175.29 175.81 3gu1 n GLU 279 N 4.48 -3.94 -2.29 1.67 1.02 -1.26 -2.53 120.64 117.79 3gu1 n GLU 279 Ca -0.04 0.46 -0.15 0.00 -0.02 0.00 0.00 57.16 57.42 3gu1 n GLU 279 Cb 0.51 -5.00 -0.01 0.00 -0.02 0.00 0.00 31.44 26.92 3gu1 n GLU 279 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gu1 n GLY 280 N -1.69 -0.23 3.20 0.62 0.00 -1.25 -4.89 105.19 100.95 3gu1 n GLY 280 Ca -0.11 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.51 3gu1 n GLY 280 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gu1 s GLN 281 N -4.74 0.91 0.00 1.61 -1.52 -1.05 -4.62 119.66 110.24 3gu1 s GLN 281 Ca 0.01 -1.29 0.00 0.00 -1.95 0.00 0.00 55.36 52.12 3gu1 s GLN 281 Cb -0.00 -0.47 0.00 0.00 -0.22 0.00 0.00 33.01 32.31 3gu1 s GLN 281 CO 0.01 0.05 0.00 1.04 -0.25 0.00 0.00 175.29 176.14 3gu1 n GLN 282 N 0.17 -0.13 0.13 2.91 1.13 -1.26 -4.07 117.38 116.26 3gu1 n GLN 282 Ca -0.13 0.03 -0.13 0.00 -1.94 0.00 0.00 57.00 54.83 3gu1 n GLN 282 Cb 0.59 -3.04 -0.06 0.00 0.11 0.00 0.00 30.24 27.84 3gu1 n GLN 282 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 3gu1 h GLY 283 N 0.00 -0.35 1.01 1.08 0.00 -1.95 0.18 103.07 103.05 3gu1 h GLY 283 Ca 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 3gu1 h GLY 283 CO 0.00 -0.16 0.43 -2.55 0.00 0.00 0.00 176.54 174.26 3gu1 h PRO 284 N -0.36 1.07 -0.51 4.80 0.11 -1.91 -2.45 132.00 132.75 3gu1 h PRO 284 Ca 0.00 -0.12 -0.04 0.00 0.11 0.00 0.00 66.00 65.95 3gu1 h PRO 284 Cb 0.34 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 3gu1 h PRO 284 CO -0.05 0.79 0.14 1.96 -0.21 0.00 0.00 178.00 180.63 3gu1 h GLN 285 N 1.07 0.77 -0.50 1.05 7.50 -1.89 -0.55 115.11 122.56 3gu1 h GLN 285 Ca 0.27 -0.14 -0.10 0.00 0.50 0.00 0.00 58.65 59.18 3gu1 h GLN 285 Cb 0.02 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 27.41 3gu1 h GLN 285 CO -0.05 0.68 -0.08 1.96 -1.50 0.00 0.00 178.83 179.84 3gu1 h GLN 286 N 0.74 0.94 -0.33 1.46 4.20 -0.42 -0.64 115.11 121.07 3gu1 h GLN 286 Ca 0.17 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 3gu1 h GLN 286 Cb 0.25 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3gu1 h GLN 286 CO -0.01 1.00 0.06 0.00 -0.67 0.00 0.00 178.83 179.22 3gu1 h ALA 287 N 0.91 0.43 -0.08 3.87 0.00 -1.05 -1.46 119.26 121.88 3gu1 h ALA 287 Ca 0.13 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3gu1 h ALA 287 Cb 0.63 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3gu1 h ALA 287 CO 0.04 0.11 0.04 1.49 0.00 0.00 0.00 179.25 180.93 3gu1 h GLU 288 N 0.37 0.12 0.04 0.00 4.57 -1.08 -1.90 114.58 116.69 3gu1 h GLU 288 Ca 0.10 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.27 3gu1 h GLU 288 Cb 0.33 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 3gu1 h GLU 288 CO 0.00 0.21 -0.09 1.25 -1.18 0.00 0.00 179.01 179.21 3gu1 h LEU 289 N -0.01 -0.25 -0.33 1.64 5.85 -1.04 0.15 115.31 121.33 3gu1 h LEU 289 Ca 0.03 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3gu1 h LEU 289 Cb 0.14 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3gu1 h LEU 289 CO -0.00 -0.14 0.14 -0.07 -0.34 0.00 0.00 178.44 178.03 3gu1 h LEU 290 N -0.17 0.44 -0.97 2.25 3.38 -1.24 -1.59 115.31 117.40 3gu1 h LEU 290 Ca 0.02 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 3gu1 h LEU 290 Cb 0.20 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3gu1 h LEU 290 CO -0.07 0.47 -0.18 0.71 0.09 0.00 0.00 178.44 179.47 3gu1 h THR 291 N 0.39 1.25 0.00 0.22 1.35 -1.30 -1.40 112.91 113.42 3gu1 h THR 291 Ca 0.11 -1.15 -0.02 0.00 -0.55 0.00 0.00 66.41 64.80 3gu1 h THR 291 Cb 0.16 1.22 -0.00 0.00 -1.73 0.00 0.00 68.15 67.79 3gu1 h THR 291 CO -0.01 0.38 -0.10 0.77 -0.25 0.00 0.00 175.52 176.31 3gu1 h SER 292 N 0.49 0.00 -0.24 5.36 4.64 -0.63 -1.55 113.55 121.62 3gu1 h SER 292 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3gu1 h SER 292 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3gu1 h SER 292 CO 0.04 0.10 0.00 0.18 -0.87 0.00 0.00 176.83 176.28 3gu1 n LEU 293 N -3.35 2.01 0.00 5.97 4.77 -0.63 -4.92 117.00 120.85 3gu1 n LEU 293 Ca -0.01 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 55.09 3gu1 n LEU 293 Cb 0.28 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 3gu1 n LEU 293 CO 0.29 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 3gu1 n GLY 294 N 1.18 0.79 3.77 -0.72 0.00 -0.58 -4.79 105.19 104.84 3gu1 n GLY 294 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3gu1 n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gu1 s ALA 295 N -2.07 3.27 -0.31 4.61 0.00 -0.59 -4.72 121.76 121.96 3gu1 s ALA 295 Ca 0.00 0.59 -0.29 0.00 0.00 0.00 0.00 51.96 52.26 3gu1 s ALA 295 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 3gu1 s ALA 295 CO 0.00 0.17 1.47 0.34 0.00 0.00 0.00 175.76 177.74 3gu1 s ASP 296 N -1.38 6.42 0.56 0.00 3.68 -1.26 -4.24 116.67 120.45 3gu1 s ASP 296 Ca 0.46 1.23 0.26 0.00 2.13 0.00 0.00 52.55 56.63 3gu1 s ASP 296 Cb -0.23 -2.54 1.48 0.00 -1.45 0.00 0.00 42.92 40.19 3gu1 s ASP 296 CO 0.28 -1.29 2.02 1.55 0.13 0.00 0.00 175.17 177.86 3gu1 h PRO 297 N 10.45 0.00 0.00 4.34 0.13 -1.87 0.41 132.00 145.45 3gu1 h PRO 297 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3gu1 h PRO 297 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3gu1 h PRO 297 CO 1.04 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.81 3gu1 n ALA 298 N -2.50 2.35 -1.07 -0.56 0.00 -1.26 -2.80 120.51 114.67 3gu1 n ALA 298 Ca 0.07 -0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.45 3gu1 n ALA 298 Cb 0.51 -1.41 0.12 0.00 0.00 0.00 0.00 19.45 18.67 3gu1 n ALA 298 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3gu1 n ARG 299 N -1.15 1.29 -5.19 0.00 5.12 0.13 -4.55 116.66 112.31 3gu1 n ARG 299 Ca 0.15 -2.36 -0.32 0.00 -1.93 0.00 0.00 57.85 53.40 3gu1 n ARG 299 Cb 0.15 -1.37 -0.17 0.00 -1.16 0.00 0.00 32.46 29.90 3gu1 n ARG 299 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3gu1 s ILE 300 N -2.49 2.14 -0.22 0.55 1.01 -1.12 -0.23 121.20 120.84 3gu1 s ILE 300 Ca 0.27 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.93 3gu1 s ILE 300 Cb 0.23 -1.82 0.05 0.00 0.01 0.00 0.00 42.46 40.94 3gu1 s ILE 300 CO 0.03 0.56 -0.07 -0.32 0.00 0.00 0.00 174.94 175.13 3gu1 s MET 301 N 0.31 1.78 -0.25 2.79 1.75 0.13 -1.42 119.30 124.39 3gu1 s MET 301 Ca -0.18 -0.95 -0.28 0.00 -1.25 0.00 0.00 55.69 53.03 3gu1 s MET 301 Cb -0.18 -2.54 0.01 0.00 2.84 0.00 0.00 34.83 34.96 3gu1 s MET 301 CO 0.08 -0.54 0.99 0.42 -0.65 0.00 0.00 175.02 175.32 3gu1 s ILE 302 N 1.38 4.70 0.66 10.11 -1.09 0.32 -1.57 121.20 135.71 3gu1 s ILE 302 Ca -0.05 1.85 0.01 0.00 -2.23 0.00 0.00 60.65 60.24 3gu1 s ILE 302 Cb -0.18 -4.28 0.10 0.00 -1.58 0.00 0.00 42.46 36.52 3gu1 s ILE 302 CO -0.07 -0.20 0.91 -0.83 -1.23 0.00 0.00 174.94 173.52 3gu1 s GLY 303 N 1.31 1.78 -1.02 6.18 0.00 -0.77 -1.21 107.32 113.58 3gu1 s GLY 303 Ca 0.42 -1.68 -0.05 0.00 0.00 0.00 0.00 44.72 43.41 3gu1 s GLY 303 CO 0.08 -1.20 0.25 1.42 0.00 0.00 0.00 173.10 173.65 3gu1 n HIS 304 N -2.63 -1.67 0.40 1.90 8.25 -1.20 -3.44 115.22 116.81 3gu1 n HIS 304 Ca 0.13 0.24 0.13 0.00 -0.26 0.00 0.00 57.72 57.97 3gu1 n HIS 304 Cb 0.60 -2.53 0.51 0.00 1.12 0.00 0.00 29.99 29.70 3gu1 n HIS 304 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3gu1 h MET 305 N -0.48 0.00 0.00 -0.41 2.86 -1.44 -1.99 114.93 113.47 3gu1 h MET 305 Ca -0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 3gu1 h MET 305 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 3gu1 h MET 305 CO 0.40 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 177.97 3gu1 n ASP 306 N -2.49 0.00 0.02 1.22 3.85 -1.25 -2.71 116.55 115.19 3gu1 n ASP 306 Ca 0.02 0.21 0.08 0.00 -0.71 0.00 0.00 54.79 54.40 3gu1 n ASP 306 Cb 0.29 -0.36 0.37 0.00 -1.35 0.00 0.00 41.12 40.07 3gu1 n ASP 306 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3gu1 n GLY 307 N 0.15 -1.10 3.25 6.12 0.00 -0.75 -4.60 105.19 108.26 3gu1 n GLY 307 Ca 0.06 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3gu1 n GLY 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3gu1 s ASN 308 N -3.17 2.95 0.00 1.61 3.04 -1.10 -3.94 114.94 114.33 3gu1 s ASN 308 Ca 0.08 -0.49 0.17 0.00 0.04 0.00 0.00 52.86 52.65 3gu1 s ASN 308 Cb 0.11 -0.78 0.37 0.00 -1.54 0.00 0.00 41.25 39.41 3gu1 s ASN 308 CO 0.31 0.24 1.29 0.35 -3.04 0.00 0.00 177.10 176.25 3gu1 n THR 309 N 2.94 0.69 -3.28 -5.21 -2.24 -1.26 -4.85 114.28 101.07 3gu1 n THR 309 Ca -0.17 -0.85 -0.44 0.00 -2.27 0.00 0.00 64.05 60.32 3gu1 n THR 309 Cb 0.52 0.76 -0.07 0.00 -2.10 0.00 0.00 70.33 69.44 3gu1 n THR 309 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gu1 s ASP 310 N -1.14 6.19 0.41 3.42 -1.08 -1.26 -4.91 116.67 118.31 3gu1 s ASP 310 Ca 0.31 -0.95 0.23 0.00 -0.52 0.00 0.00 52.55 51.63 3gu1 s ASP 310 Cb 0.17 -2.24 1.25 0.00 -1.46 0.00 0.00 42.92 40.65 3gu1 s ASP 310 CO 0.24 -0.71 1.67 1.55 0.52 0.00 0.00 175.17 178.44 3gu1 h PRO 311 N 8.83 0.00 -0.18 4.34 0.13 -1.95 0.02 132.00 143.20 3gu1 h PRO 311 Ca -0.27 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.77 3gu1 h PRO 311 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3gu1 h PRO 311 CO 0.88 0.00 -0.26 0.00 -0.23 0.00 0.00 178.00 178.39 3gu1 h ALA 312 N 1.66 1.23 -0.44 -0.56 0.00 -1.99 0.33 119.26 119.49 3gu1 h ALA 312 Ca 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 3gu1 h ALA 312 Cb 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3gu1 h ALA 312 CO 0.00 0.51 0.09 -0.92 0.00 0.00 0.00 179.25 178.92 3gu1 h TYR 313 N 0.30 0.76 -0.21 0.00 5.03 -1.40 -1.22 116.97 120.22 3gu1 h TYR 313 Ca 0.05 -0.10 -0.08 0.00 2.58 0.00 0.00 58.73 61.17 3gu1 h TYR 313 Cb 0.62 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.69 3gu1 h TYR 313 CO 0.01 0.71 -0.19 0.45 -1.32 0.00 0.00 178.16 177.83 3gu1 h HIS 314 N 0.58 0.59 -0.92 -3.82 -0.00 -1.51 -2.34 115.15 107.73 3gu1 h HIS 314 Ca 0.13 -0.17 0.04 0.00 -0.00 0.00 0.00 60.37 60.37 3gu1 h HIS 314 Cb 0.36 -0.13 -0.06 0.00 -0.00 0.00 0.00 27.41 27.58 3gu1 h HIS 314 CO 0.02 0.84 0.59 0.00 -0.00 0.00 0.00 177.93 179.38 3gu1 h ARG 315 N 0.18 1.10 -0.39 2.45 3.08 -0.79 0.32 114.38 120.34 3gu1 h ARG 315 Ca 0.04 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3gu1 h ARG 315 Cb 0.73 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 3gu1 h ARG 315 CO 0.05 0.73 0.16 1.49 -1.07 0.00 0.00 179.97 181.33 3gu1 h GLU 316 N 1.14 0.58 -0.16 0.04 4.81 -1.20 -0.12 114.58 119.66 3gu1 h GLU 316 Ca 0.37 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 3gu1 h GLU 316 Cb 0.03 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 3gu1 h GLU 316 CO -0.13 0.54 0.10 1.15 -0.73 0.00 0.00 179.01 179.94 3gu1 h THR 317 N 0.49 1.07 0.00 0.32 2.02 -0.87 -2.71 112.91 113.21 3gu1 h THR 317 Ca 0.13 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3gu1 h THR 317 Cb 0.17 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.45 3gu1 h THR 317 CO -0.01 0.06 -0.03 -0.07 0.37 0.00 0.00 175.52 175.84 3gu1 h LEU 318 N 0.20 0.00 -2.37 2.58 3.38 -0.54 -2.22 115.31 116.33 3gu1 h LEU 318 Ca 0.06 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.06 3gu1 h LEU 318 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3gu1 h LEU 318 CO -0.01 0.03 0.14 -0.09 0.09 0.00 0.00 178.44 178.60 3gu1 h ARG 319 N 0.00 0.00 0.00 1.13 2.43 -0.68 -0.94 114.38 116.32 3gu1 h ARG 319 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3gu1 h ARG 319 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3gu1 h ARG 319 CO 0.00 0.00 0.00 0.72 -1.51 0.00 0.00 179.97 179.18 3gu1 n HIS 320 N -3.63 0.00 -0.52 2.20 8.25 -0.84 -4.89 115.22 115.80 3gu1 n HIS 320 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3gu1 n HIS 320 Cb 0.24 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.22 3gu1 n HIS 320 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gu1 n GLY 321 N 0.74 1.05 3.91 -1.41 0.00 -0.36 -4.82 105.19 104.31 3gu1 n GLY 321 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 3gu1 n GLY 321 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gu1 s VAL 322 N -3.17 3.42 0.27 1.61 -7.23 -1.26 -4.33 120.40 109.71 3gu1 s VAL 322 Ca 0.00 0.10 0.01 0.00 -1.81 0.00 0.00 61.98 60.27 3gu1 s VAL 322 Cb 0.00 -3.40 -0.04 0.00 0.56 0.00 0.00 36.38 33.50 3gu1 s VAL 322 CO 0.00 -0.45 0.46 -0.44 -0.31 0.00 0.00 175.10 174.36 3gu1 s SER 323 N -4.35 6.34 0.02 4.85 0.01 -0.51 -4.72 113.70 115.34 3gu1 s SER 323 Ca 0.56 0.38 0.04 0.00 1.31 0.00 0.00 55.95 58.24 3gu1 s SER 323 Cb -0.11 -2.00 -0.02 0.00 0.21 0.00 0.00 66.02 64.11 3gu1 s SER 323 CO 0.47 -0.16 -0.13 0.27 0.41 0.00 0.00 173.24 174.10 3gu1 s ILE 324 N -2.09 1.00 -0.07 1.44 -4.36 0.33 -0.52 121.20 116.93 3gu1 s ILE 324 Ca 0.39 -0.79 0.05 0.00 -0.26 0.00 0.00 60.65 60.04 3gu1 s ILE 324 Cb -0.10 -0.88 -0.01 0.00 1.25 0.00 0.00 42.46 42.71 3gu1 s ILE 324 CO 0.32 0.10 -0.23 0.00 0.24 0.00 0.00 174.94 175.37 3gu1 s ALA 325 N -0.63 2.26 -0.98 2.27 0.00 -0.35 -1.80 121.76 122.53 3gu1 s ALA 325 Ca 0.02 -1.02 -0.13 0.00 0.00 0.00 0.00 51.96 50.83 3gu1 s ALA 325 Cb -0.06 -0.77 0.22 0.00 0.00 0.00 0.00 23.12 22.50 3gu1 s ALA 325 CO 0.00 0.40 1.01 -0.06 0.00 0.00 0.00 175.76 177.11 3gu1 s PHE 326 N -0.10 3.77 -0.69 0.00 0.40 -0.26 -1.39 117.98 119.72 3gu1 s PHE 326 Ca -0.05 -2.12 0.15 0.00 -0.60 0.00 0.00 56.93 54.32 3gu1 s PHE 326 Cb -0.14 -3.97 0.53 0.00 0.51 0.00 0.00 43.02 39.95 3gu1 s PHE 326 CO 0.04 -1.11 1.45 -0.40 0.70 0.00 0.00 175.22 175.90 3gu1 n ASP 327 N 4.24 3.94 -0.74 1.36 3.85 -1.26 -1.35 116.55 126.59 3gu1 n ASP 327 Ca 0.21 -2.54 0.06 0.00 -0.71 0.00 0.00 54.79 51.82 3gu1 n ASP 327 Cb 0.45 -0.46 0.16 0.00 -1.35 0.00 0.00 41.12 39.91 3gu1 n ASP 327 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3gu1 n ARG 328 N 0.33 1.18 -1.73 0.11 1.74 -1.11 -0.61 116.66 116.57 3gu1 n ARG 328 Ca 0.20 -2.91 -0.42 0.00 -0.77 0.00 0.00 57.85 53.95 3gu1 n ARG 328 Cb 0.76 -1.24 -0.03 0.00 -1.02 0.00 0.00 32.46 30.94 3gu1 n ARG 328 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gu1 s ILE 329 N -2.43 2.19 0.00 0.55 1.01 -0.86 -1.08 121.20 120.58 3gu1 s ILE 329 Ca 0.36 0.04 0.00 0.00 0.00 0.00 0.00 60.65 61.05 3gu1 s ILE 329 Cb 0.36 -3.03 0.00 0.00 0.01 0.00 0.00 42.46 39.80 3gu1 s ILE 329 CO -0.08 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.47 3gu1 n GLY 330 N 4.04 2.82 3.44 6.18 0.00 -1.26 -4.51 105.19 115.90 3gu1 n GLY 330 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 3gu1 n GLY 330 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gu1 s LEU 331 N 0.00 4.97 -0.34 0.99 2.96 -0.24 -2.65 118.68 124.37 3gu1 s LEU 331 Ca 0.00 -0.97 -0.00 0.00 -0.22 0.00 0.00 54.13 52.93 3gu1 s LEU 331 Cb 0.00 -2.44 0.08 0.00 0.50 0.00 0.00 46.19 44.33 3gu1 s LEU 331 CO 0.00 -0.97 0.06 -1.10 -1.32 0.00 0.00 176.35 173.02 3gu1 s GLN 332 N 2.77 2.08 0.00 1.98 -0.21 -0.03 -4.63 119.66 121.63 3gu1 s GLN 332 Ca 0.16 -1.57 0.00 0.00 0.02 0.00 0.00 55.36 53.96 3gu1 s GLN 332 Cb -0.20 -3.29 0.00 0.00 1.00 0.00 0.00 33.01 30.53 3gu1 s GLN 332 CO 0.11 -0.82 0.00 0.41 -2.12 0.00 0.00 175.29 172.87 3gu1 n GLY 333 N 4.52 0.71 3.80 3.09 0.00 -0.94 -4.07 105.19 112.30 3gu1 n GLY 333 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 3gu1 n GLY 333 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3gu1 s MET 334 N -0.89 3.00 -1.76 1.61 1.75 -1.26 -4.56 119.30 117.20 3gu1 s MET 334 Ca 0.00 -0.61 -0.15 0.00 -1.25 0.00 0.00 55.69 53.68 3gu1 s MET 334 Cb 0.00 -2.80 0.15 0.00 2.84 0.00 0.00 34.83 35.02 3gu1 s MET 334 CO 0.00 0.59 0.39 1.33 -0.65 0.00 0.00 175.02 176.68 3gu1 n VAL 335 N 0.60 -0.42 -0.78 10.11 0.24 -1.26 -0.13 118.33 126.69 3gu1 n VAL 335 Ca -0.09 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 3gu1 n VAL 335 Cb 0.52 -0.73 0.00 0.00 -1.47 0.00 0.00 33.84 32.15 3gu1 n VAL 335 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3gu1 n GLY 336 N -1.63 1.43 3.71 7.63 0.00 -1.26 -4.64 105.19 110.43 3gu1 n GLY 336 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 3gu1 n GLY 336 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gu1 n THR 337 N -2.00 3.37 -2.01 2.61 -1.04 0.81 -4.91 114.28 111.11 3gu1 n THR 337 Ca 0.00 -0.50 -0.16 0.00 -2.04 0.00 0.00 64.05 61.35 3gu1 n THR 337 Cb 0.00 -1.56 0.10 0.00 -1.82 0.00 0.00 70.33 67.05 3gu1 n THR 337 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3gu1 n PRO 338 N -0.65 -0.32 -2.53 -2.82 -0.04 -1.26 -2.21 135.00 125.17 3gu1 n PRO 338 Ca 0.10 -1.45 -0.27 0.00 -0.04 0.00 0.00 63.50 61.83 3gu1 n PRO 338 Cb 0.43 -0.62 0.01 0.00 -0.04 0.00 0.00 33.50 33.28 3gu1 n PRO 338 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3gu1 s THR 339 N -2.29 4.39 0.36 0.52 -4.23 -1.26 -3.75 115.64 109.38 3gu1 s THR 339 Ca 0.43 0.12 0.05 0.00 -1.18 0.00 0.00 61.69 61.11 3gu1 s THR 339 Cb -0.02 -3.69 0.19 0.00 1.34 0.00 0.00 72.50 70.32 3gu1 s THR 339 CO 0.30 -0.69 1.93 0.44 -0.54 0.00 0.00 174.62 176.05 3gu1 h ASP 340 N 0.06 0.48 -0.86 3.99 3.45 -1.96 -1.93 116.42 119.65 3gu1 h ASP 340 Ca -0.46 -0.07 0.07 0.00 0.43 0.00 0.00 57.03 57.00 3gu1 h ASP 340 Cb 1.23 -0.12 -0.06 0.00 -0.56 0.00 0.00 39.33 39.81 3gu1 h ASP 340 CO 0.61 0.50 0.53 0.00 -1.57 0.00 0.00 179.24 179.31 3gu1 h ALA 341 N 1.57 1.19 -0.55 3.45 0.00 -1.99 -0.10 119.26 122.83 3gu1 h ALA 341 Ca 0.12 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3gu1 h ALA 341 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3gu1 h ALA 341 CO -0.00 0.26 -0.11 0.93 0.00 0.00 0.00 179.25 180.33 3gu1 h GLU 342 N 0.96 1.04 -0.27 0.00 5.08 -1.78 -2.51 114.58 117.10 3gu1 h GLU 342 Ca 0.38 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3gu1 h GLU 342 Cb 0.19 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3gu1 h GLU 342 CO -0.18 1.08 0.12 0.00 -1.00 0.00 0.00 179.01 179.03 3gu1 h ARG 343 N 0.92 0.40 0.00 2.33 3.08 -0.75 -2.68 114.38 117.68 3gu1 h ARG 343 Ca 0.14 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3gu1 h ARG 343 Cb 0.69 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 3gu1 h ARG 343 CO 0.05 0.41 -0.21 -0.07 -1.07 0.00 0.00 179.97 179.08 3gu1 h LEU 344 N 0.30 0.00 -0.44 3.04 3.38 -0.99 0.52 115.31 121.11 3gu1 h LEU 344 Ca 0.09 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 3gu1 h LEU 344 Cb 0.15 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3gu1 h LEU 344 CO -0.01 0.21 0.03 -1.28 0.09 0.00 0.00 178.44 177.48 3gu1 h SER 345 N 0.00 0.73 -0.20 -0.43 0.87 -1.20 -0.59 113.55 112.73 3gu1 h SER 345 Ca -0.00 -0.29 -0.16 0.00 -1.23 0.00 0.00 61.79 60.11 3gu1 h SER 345 Cb 0.37 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 3gu1 h SER 345 CO 0.03 0.84 -0.51 0.58 -0.53 0.00 0.00 176.83 177.24 3gu1 h VAL 346 N 0.60 1.31 -0.58 2.23 2.07 -1.12 -2.82 116.25 117.95 3gu1 h VAL 346 Ca 0.13 -1.73 -0.02 0.00 0.82 0.00 0.00 66.70 65.90 3gu1 h VAL 346 Cb 0.45 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 3gu1 h VAL 346 CO 0.02 0.54 0.30 0.25 0.02 0.00 0.00 177.57 178.70 3gu1 h LEU 347 N 0.39 0.75 -1.04 2.57 5.85 -0.83 -1.50 115.31 121.49 3gu1 h LEU 347 Ca -0.01 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 3gu1 h LEU 347 Cb 1.12 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 3gu1 h LEU 347 CO 0.11 0.65 -0.47 0.71 -0.34 0.00 0.00 178.44 179.10 3gu1 h THR 348 N 0.79 1.31 -0.32 1.05 1.35 -1.15 0.12 112.91 116.06 3gu1 h THR 348 Ca 0.20 -1.63 -0.03 0.00 -0.55 0.00 0.00 66.41 64.40 3gu1 h THR 348 Cb 0.09 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 3gu1 h THR 348 CO -0.03 0.46 0.10 0.74 -0.25 0.00 0.00 175.52 176.54 3gu1 h THR 349 N 0.00 1.21 -0.25 6.82 2.02 -1.16 -0.70 112.91 120.84 3gu1 h THR 349 Ca -0.00 -0.68 -0.13 0.00 0.77 0.00 0.00 66.41 66.37 3gu1 h THR 349 Cb 0.85 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 3gu1 h THR 349 CO 0.06 0.23 -0.39 -0.07 0.37 0.00 0.00 175.52 175.72 3gu1 h LEU 350 N 0.36 0.62 -0.64 2.58 3.38 -0.99 -2.13 115.31 118.49 3gu1 h LEU 350 Ca 0.10 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 3gu1 h LEU 350 Cb 0.26 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3gu1 h LEU 350 CO -0.00 0.94 -0.08 -0.07 0.09 0.00 0.00 178.44 179.32 3gu1 h LEU 351 N 0.48 0.98 -1.21 1.67 3.38 -0.90 -1.92 115.31 117.80 3gu1 h LEU 351 Ca 0.04 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3gu1 h LEU 351 Cb 0.89 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3gu1 h LEU 351 CO 0.08 1.08 0.00 1.23 0.09 0.00 0.00 178.44 180.91 3gu1 h GLY 352 N 0.96 0.00 -1.70 0.83 0.00 -0.85 -2.35 103.07 99.96 3gu1 h GLY 352 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3gu1 h GLY 352 CO 0.04 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.76 3gu1 n GLU 353 N -2.78 2.11 -0.90 4.80 1.02 -0.78 -4.94 120.64 119.17 3gu1 n GLU 353 Ca 0.01 -1.72 0.00 0.00 -0.02 0.00 0.00 57.16 55.43 3gu1 n GLU 353 Cb 0.27 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 3gu1 n GLU 353 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gu1 n GLY 354 N 1.28 0.47 0.63 0.62 0.00 -0.88 -4.98 105.19 102.33 3gu1 n GLY 354 Ca 0.17 -0.73 0.05 0.00 0.00 0.00 0.00 46.02 45.50 3gu1 n GLY 354 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gu1 n TYR 355 N -2.90 0.47 -0.33 1.61 4.01 -0.86 -4.56 117.16 114.60 3gu1 n TYR 355 Ca 0.00 -0.22 0.27 0.00 -0.16 0.00 0.00 57.90 57.79 3gu1 n TYR 355 Cb 0.00 -0.03 0.57 0.00 -0.31 0.00 0.00 39.34 39.58 3gu1 n TYR 355 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3gu1 h ALA 356 N 3.51 2.47 0.00 -0.72 0.00 -1.83 0.79 119.26 123.48 3gu1 h ALA 356 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3gu1 h ALA 356 Cb 0.49 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3gu1 h ALA 356 CO 0.02 -0.88 0.00 -0.25 0.00 0.00 0.00 179.25 178.14 3gu1 n ASP 357 N -4.53 0.00 -0.04 0.00 8.00 -1.26 -2.99 116.55 115.72 3gu1 n ASP 357 Ca 0.26 -0.60 0.01 0.00 0.71 0.00 0.00 54.79 55.18 3gu1 n ASP 357 Cb 1.00 -0.07 0.02 0.00 -0.02 0.00 0.00 41.12 42.06 3gu1 n ASP 357 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gu1 n ARG 358 N -1.07 1.95 -4.71 -1.24 5.12 0.27 -4.88 116.66 112.10 3gu1 n ARG 358 Ca 0.17 -1.42 -0.33 0.00 -1.93 0.00 0.00 57.85 54.34 3gu1 n ARG 358 Cb 0.11 -0.94 -0.13 0.00 -1.16 0.00 0.00 32.46 30.33 3gu1 n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3gu1 s LEU 359 N -1.01 2.86 0.16 0.55 1.43 -1.16 -0.51 118.68 121.01 3gu1 s LEU 359 Ca 0.05 -0.25 0.07 0.00 -1.03 0.00 0.00 54.13 52.97 3gu1 s LEU 359 Cb 0.04 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 3gu1 s LEU 359 CO 0.00 0.20 -0.14 -0.76 0.23 0.00 0.00 176.35 175.89 3gu1 s LEU 360 N 0.12 2.48 -0.08 1.79 1.02 -0.75 -4.46 118.68 118.81 3gu1 s LEU 360 Ca -0.05 -0.92 0.02 0.00 0.02 0.00 0.00 54.13 53.19 3gu1 s LEU 360 Cb -0.15 -0.61 0.02 0.00 0.02 0.00 0.00 46.19 45.47 3gu1 s LEU 360 CO 0.04 -0.16 -0.11 -0.76 0.02 0.00 0.00 176.35 175.38 3gu1 s LEU 361 N -2.90 1.55 0.00 1.79 1.43 -1.26 -1.10 118.68 118.19 3gu1 s LEU 361 Ca 0.16 -0.30 -0.05 0.00 -1.03 0.00 0.00 54.13 52.91 3gu1 s LEU 361 Cb -0.02 -0.82 0.02 0.00 0.03 0.00 0.00 46.19 45.39 3gu1 s LEU 361 CO 0.05 0.00 0.54 -0.24 0.23 0.00 0.00 176.35 176.92 3gu1 n SER 362 N 4.05 -1.53 -0.01 2.29 2.88 -0.46 -4.37 113.62 116.48 3gu1 n SER 362 Ca -0.21 -2.68 0.01 0.00 -1.33 0.00 0.00 58.87 54.66 3gu1 n SER 362 Cb 0.51 2.72 -0.05 0.00 -0.75 0.00 0.00 64.21 66.65 3gu1 n SER 362 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 3gu1 n HIS 363 N -0.53 0.00 -2.76 0.66 -0.00 -1.02 -2.02 115.22 109.55 3gu1 n HIS 363 Ca -0.02 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.51 3gu1 n HIS 363 Cb 0.55 -0.19 0.02 0.00 -0.00 0.00 0.00 29.99 30.37 3gu1 n HIS 363 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3gu1 n ASP 364 N -1.88 -5.36 -4.83 0.41 4.64 0.22 -4.18 116.55 105.57 3gu1 n ASP 364 Ca -0.04 -0.19 -0.31 0.00 -1.38 0.00 0.00 54.79 52.87 3gu1 n ASP 364 Cb 0.34 -4.26 0.03 0.00 -1.04 0.00 0.00 41.12 36.19 3gu1 n ASP 364 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3gu1 s SER 365 N -2.62 5.68 -0.23 1.67 1.04 -1.26 -4.74 113.70 113.24 3gu1 s SER 365 Ca 0.19 1.60 0.02 0.00 0.48 0.00 0.00 55.95 58.25 3gu1 s SER 365 Cb -0.09 -2.50 0.04 0.00 0.10 0.00 0.00 66.02 63.58 3gu1 s SER 365 CO 0.24 -1.24 -0.14 -0.63 0.98 0.00 0.00 173.24 172.44 3gu1 s ILE 366 N -2.96 2.10 0.15 -1.02 1.01 -1.25 -0.35 121.20 118.87 3gu1 s ILE 366 Ca 0.58 -1.35 -0.02 0.00 0.00 0.00 0.00 60.65 59.86 3gu1 s ILE 366 Cb -0.13 -2.09 -0.15 0.00 0.01 0.00 0.00 42.46 40.10 3gu1 s ILE 366 CO 0.51 0.19 1.36 -0.50 0.00 0.00 0.00 174.94 176.50 3gu1 h TRP 367 N 7.84 0.54 -2.87 3.97 4.06 -0.81 -3.44 115.95 125.26 3gu1 h TRP 367 Ca -0.29 -0.27 -0.24 0.00 2.06 0.00 0.00 58.89 60.15 3gu1 h TRP 367 Cb 1.08 -0.07 -0.33 0.00 -1.00 0.00 0.00 29.16 28.84 3gu1 h TRP 367 CO 0.57 1.07 -0.56 -1.58 -3.56 0.00 0.00 178.44 174.38 3gu1 s HIS 368 N -3.39 -0.37 0.29 0.49 2.46 -0.02 -4.88 115.29 109.86 3gu1 s HIS 368 Ca -0.05 0.85 -0.28 0.00 0.47 0.00 0.00 55.06 56.04 3gu1 s HIS 368 Cb 0.10 -0.10 -0.09 0.00 -0.13 0.00 0.00 32.58 32.35 3gu1 s HIS 368 CO 0.85 -0.36 0.99 -1.58 -2.47 0.00 0.00 174.74 172.17 3gu1 s TRP 369 N 2.39 3.74 0.20 3.88 0.52 -1.26 -2.61 118.94 125.80 3gu1 s TRP 369 Ca 0.02 1.80 -0.04 0.00 0.02 0.00 0.00 56.10 57.91 3gu1 s TRP 369 Cb -0.12 -3.05 -0.05 0.00 -1.15 0.00 0.00 33.47 29.09 3gu1 s TRP 369 CO -0.08 0.04 0.44 -0.51 0.02 0.00 0.00 176.95 176.85 3gu1 s LEU 370 N -1.62 4.19 0.00 2.99 1.43 0.89 -4.82 118.68 121.74 3gu1 s LEU 370 Ca 0.46 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 3gu1 s LEU 370 Cb -0.25 -3.34 0.00 0.00 0.03 0.00 0.00 46.19 42.62 3gu1 s LEU 370 CO 0.32 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.46 3gu1 n GLY 371 N -0.43 -1.76 3.74 -3.19 0.00 -1.24 -4.71 105.19 97.60 3gu1 n GLY 371 Ca -0.03 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.93 3gu1 n GLY 371 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gu1 s ARG 372 N 0.00 4.70 0.32 1.61 0.52 -1.26 -4.69 118.95 120.15 3gu1 s ARG 372 Ca 0.00 1.62 -0.29 0.00 -0.52 0.00 0.00 55.73 56.54 3gu1 s ARG 372 Cb 0.00 -3.27 -0.12 0.00 0.52 0.00 0.00 34.95 32.08 3gu1 s ARG 372 CO 0.00 0.26 1.49 -0.35 0.02 0.00 0.00 175.30 176.72 3gu1 n PRO 373 N 1.91 2.51 -1.93 3.54 -0.04 -1.26 -4.90 135.00 134.83 3gu1 n PRO 373 Ca 0.00 0.89 -0.41 0.00 -0.04 0.00 0.00 63.50 63.94 3gu1 n PRO 373 Cb 0.47 -2.60 -0.02 0.00 -0.04 0.00 0.00 33.50 31.30 3gu1 n PRO 373 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3gu1 s PRO 374 N -1.24 4.22 -0.39 0.54 0.02 -1.26 -5.00 135.00 131.89 3gu1 s PRO 374 Ca 0.60 2.40 -0.14 0.00 0.02 0.00 0.00 61.00 63.87 3gu1 s PRO 374 Cb -0.52 -3.08 0.01 0.00 0.02 0.00 0.00 34.50 30.92 3gu1 s PRO 374 CO 0.56 -0.50 0.29 0.00 -0.33 0.00 0.00 177.00 177.02 3gu1 s ALA 375 N 0.05 3.49 -0.39 -1.55 0.00 -1.26 -5.04 121.76 117.06 3gu1 s ALA 375 Ca 0.61 -1.60 -0.27 0.00 0.00 0.00 0.00 51.96 50.70 3gu1 s ALA 375 Cb -0.44 -2.83 0.02 0.00 0.00 0.00 0.00 23.12 19.87 3gu1 s ALA 375 CO 0.44 -1.31 1.01 0.42 0.00 0.00 0.00 175.76 176.33 3gu1 s ILE 376 N 1.72 4.47 0.35 0.00 1.01 -1.26 -5.00 121.20 122.49 3gu1 s ILE 376 Ca 0.06 1.32 -0.28 0.00 0.00 0.00 0.00 60.65 61.74 3gu1 s ILE 376 Cb -0.18 -4.42 -0.11 0.00 0.01 0.00 0.00 42.46 37.75 3gu1 s ILE 376 CO 0.10 -0.65 1.46 -0.81 0.00 0.00 0.00 174.94 175.05 3gu1 n PRO 377 N 7.06 2.55 -0.30 2.79 -0.04 -1.26 -4.84 135.00 140.96 3gu1 n PRO 377 Ca 0.09 0.90 0.03 0.00 -0.04 0.00 0.00 63.50 64.48 3gu1 n PRO 377 Cb 0.48 -2.60 0.09 0.00 -0.04 0.00 0.00 33.50 31.43 3gu1 n PRO 377 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3gu1 n GLU 378 N 0.82 -0.11 0.17 0.54 4.07 -1.26 0.02 120.64 124.89 3gu1 n GLU 378 Ca 0.04 1.26 0.13 0.00 -0.06 0.00 0.00 57.16 58.53 3gu1 n GLU 378 Cb 0.38 -1.88 0.58 0.00 -0.06 0.00 0.00 31.44 30.45 3gu1 n GLU 378 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3gu1 h ALA 379 N 1.48 1.00 -0.01 4.31 0.00 -2.04 -2.33 119.26 121.67 3gu1 h ALA 379 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3gu1 h ALA 379 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3gu1 h ALA 379 CO -0.83 0.00 -0.33 0.00 0.00 0.00 0.00 179.25 178.09 3gu1 n ALA 380 N -1.83 3.25 -0.18 0.00 0.00 0.10 -4.51 120.51 117.34 3gu1 n ALA 380 Ca 0.01 -0.55 -0.03 0.00 0.00 0.00 0.00 53.44 52.87 3gu1 n ALA 380 Cb 0.18 -0.94 0.07 0.00 0.00 0.00 0.00 19.45 18.75 3gu1 n ALA 380 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gu1 h LEU 381 N 2.13 0.33 -1.43 0.00 3.38 -1.33 -2.43 115.31 115.96 3gu1 h LEU 381 Ca 0.00 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 3gu1 h LEU 381 Cb 0.66 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3gu1 h LEU 381 CO 0.00 0.22 -0.29 1.55 0.09 0.00 0.00 178.44 180.02 3gu1 h PRO 382 N 0.48 0.00 -0.43 1.13 0.13 -1.81 0.47 132.00 131.98 3gu1 h PRO 382 Ca 0.25 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.38 3gu1 h PRO 382 Cb 0.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.31 3gu1 h PRO 382 CO -0.20 0.29 0.26 0.00 -0.23 0.00 0.00 178.00 178.11 3gu1 h ALA 383 N 1.71 1.65 -0.02 -0.56 0.00 -1.58 -2.99 119.26 117.48 3gu1 h ALA 383 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3gu1 h ALA 383 Cb 0.51 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3gu1 h ALA 383 CO 0.04 0.31 -0.03 1.33 0.00 0.00 0.00 179.25 180.90 3gu1 n VAL 384 N -4.45 0.00 -0.18 0.00 0.24 -0.83 -0.85 118.33 112.26 3gu1 n VAL 384 Ca 0.03 -0.49 -0.01 0.00 -2.04 0.00 0.00 64.34 61.84 3gu1 n VAL 384 Cb 0.08 1.31 0.08 0.00 -1.47 0.00 0.00 33.84 33.84 3gu1 n VAL 384 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3gu1 h LYS 385 N 2.89 0.18 -0.60 7.34 1.63 -0.76 -1.74 116.57 125.51 3gu1 h LYS 385 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 3gu1 h LYS 385 Cb 0.63 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.22 3gu1 h LYS 385 CO 0.00 0.12 0.00 -0.25 -3.45 0.00 0.00 179.45 175.87 3gu1 n ASP 386 N -5.18 3.37 -4.24 4.20 8.00 -1.25 -4.72 116.55 116.73 3gu1 n ASP 386 Ca 0.07 -2.11 -0.43 0.00 0.71 0.00 0.00 54.79 53.02 3gu1 n ASP 386 Cb 0.30 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 3gu1 n ASP 386 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 3gu1 n TRP 387 N 1.09 4.21 -3.65 1.24 -0.00 -0.66 -4.40 117.44 115.28 3gu1 n TRP 387 Ca 0.20 -3.12 -0.11 0.00 -0.00 0.00 0.00 57.50 54.47 3gu1 n TRP 387 Cb 0.57 -2.14 -0.05 0.00 -0.00 0.00 0.00 31.31 29.69 3gu1 n TRP 387 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 3gu1 s HIS 388 N 1.32 -0.20 -2.00 5.87 -3.43 -1.26 -4.84 115.29 110.76 3gu1 s HIS 388 Ca 0.42 -0.08 0.08 0.00 -0.80 0.00 0.00 55.06 54.68 3gu1 s HIS 388 Cb 0.02 0.24 0.48 0.00 -1.43 0.00 0.00 32.58 31.89 3gu1 s HIS 388 CO 0.01 -0.67 1.02 -0.35 -2.00 0.00 0.00 174.74 172.74 3gu1 n PRO 389 N -0.09 0.64 0.00 -0.38 -0.04 -1.26 -2.58 135.00 131.28 3gu1 n PRO 389 Ca -0.16 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.38 3gu1 n PRO 389 Cb 0.63 -1.20 0.04 0.00 -0.04 0.00 0.00 33.50 32.93 3gu1 n PRO 389 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3gu1 n LEU 390 N -0.70 2.14 0.06 1.53 4.77 -1.26 -4.63 117.00 118.91 3gu1 n LEU 390 Ca 0.06 -0.90 -0.13 0.00 -0.03 0.00 0.00 56.01 55.01 3gu1 n LEU 390 Cb 0.03 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.04 3gu1 n LEU 390 CO 0.05 0.39 0.81 -0.74 -1.33 0.00 0.00 177.39 176.56 3gu1 h HIS 391 N 2.80 -0.08 0.05 -1.77 2.76 -1.78 -0.82 115.15 116.31 3gu1 h HIS 391 Ca 0.00 -0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3gu1 h HIS 391 Cb 0.67 0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.65 3gu1 h HIS 391 CO 0.00 0.03 -0.02 0.82 -1.30 0.00 0.00 177.93 177.46 3gu1 h ILE 392 N -0.16 0.97 -0.54 6.26 2.04 -1.82 0.20 117.51 124.45 3gu1 h ILE 392 Ca -0.01 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 65.87 3gu1 h ILE 392 Cb 0.14 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 3gu1 h ILE 392 CO 0.01 0.01 0.24 0.28 0.00 0.00 0.00 178.15 178.70 3gu1 h SER 393 N -0.08 0.31 0.69 1.72 0.02 -1.84 -0.94 113.55 113.43 3gu1 h SER 393 Ca -0.01 0.05 -0.26 0.00 -0.84 0.00 0.00 61.79 60.73 3gu1 h SER 393 Cb 0.06 -0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.56 3gu1 h SER 393 CO 0.01 0.21 -1.43 0.44 -1.14 0.00 0.00 176.83 174.92 3gu1 h ASP 394 N 0.47 0.00 0.00 3.07 3.32 -1.07 -3.41 116.42 118.80 3gu1 h ASP 394 Ca 0.25 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.23 3gu1 h ASP 394 Cb 0.22 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3gu1 h ASP 394 CO -0.21 0.99 -1.27 0.47 -1.72 0.00 0.00 179.24 177.50 3gu1 n ASP 395 N -3.16 2.58 -0.04 6.45 8.00 0.68 -4.74 116.55 126.33 3gu1 n ASP 395 Ca -0.10 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.27 3gu1 n ASP 395 Cb 1.01 -0.10 -0.11 0.00 -0.02 0.00 0.00 41.12 41.90 3gu1 n ASP 395 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3gu1 h ILE 396 N -0.06 1.45 -0.98 0.53 1.08 -1.04 -2.81 117.51 115.69 3gu1 h ILE 396 Ca -0.11 -1.77 0.06 0.00 -0.39 0.00 0.00 64.86 62.65 3gu1 h ILE 396 Cb 1.15 2.59 -0.07 0.00 -3.07 0.00 0.00 36.82 37.42 3gu1 h ILE 396 CO -0.04 0.43 0.63 -0.07 -0.69 0.00 0.00 178.15 178.42 3gu1 h LEU 397 N -0.84 1.01 -0.76 1.44 3.38 -1.43 -0.24 115.31 117.86 3gu1 h LEU 397 Ca -0.00 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3gu1 h LEU 397 Cb 0.74 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 3gu1 h LEU 397 CO 0.01 0.65 0.22 -0.65 0.09 0.00 0.00 178.44 178.75 3gu1 h PRO 398 N 1.15 1.15 -0.45 1.13 0.11 -1.82 -1.12 132.00 132.14 3gu1 h PRO 398 Ca 0.42 -0.25 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 3gu1 h PRO 398 Cb 0.16 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 3gu1 h PRO 398 CO -0.17 0.98 -0.10 0.22 -0.21 0.00 0.00 178.00 178.72 3gu1 h ASP 399 N 1.10 0.79 -0.11 -2.05 -0.00 -1.09 -0.17 116.42 114.90 3gu1 h ASP 399 Ca 0.24 -0.24 -0.02 0.00 -0.00 0.00 0.00 57.03 57.01 3gu1 h ASP 399 Cb 0.32 -0.21 -0.00 0.00 -0.00 0.00 0.00 39.33 39.44 3gu1 h ASP 399 CO -0.01 0.92 -0.00 -0.07 -0.00 0.00 0.00 179.24 180.08 3gu1 h LEU 400 N 0.73 0.19 -0.33 2.28 3.38 -0.75 -2.47 115.31 118.34 3gu1 h LEU 400 Ca 0.12 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.79 3gu1 h LEU 400 Cb 0.59 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3gu1 h LEU 400 CO 0.04 0.46 0.17 0.03 0.09 0.00 0.00 178.44 179.23 3gu1 h ARG 401 N -0.09 0.35 0.00 1.13 2.47 -1.07 -1.41 114.38 115.75 3gu1 h ARG 401 Ca 0.03 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3gu1 h ARG 401 Cb 0.37 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 3gu1 h ARG 401 CO 0.01 0.23 0.00 0.07 0.56 0.00 0.00 179.97 180.83 3gu1 h ARG 402 N 0.36 0.00 -0.02 0.04 0.11 -0.95 -1.55 114.38 112.37 3gu1 h ARG 402 Ca 0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.21 3gu1 h ARG 402 Cb 0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.11 3gu1 h ARG 402 CO -0.08 0.00 -0.03 0.54 0.10 0.00 0.00 179.97 180.50 3gu1 n ARG 403 N -2.47 1.71 0.00 0.08 1.74 -0.62 -4.93 116.66 112.18 3gu1 n ARG 403 Ca 0.00 -1.10 0.00 0.00 -0.77 0.00 0.00 57.85 55.98 3gu1 n ARG 403 Cb 0.16 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 3gu1 n ARG 403 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gu1 n GLY 404 N 1.22 0.86 3.76 -0.13 0.00 -0.58 -5.08 105.19 105.24 3gu1 n GLY 404 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3gu1 n GLY 404 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gu1 s ILE 405 N -2.00 3.33 0.45 -0.61 -1.09 -0.70 -5.00 121.20 115.58 3gu1 s ILE 405 Ca 0.00 1.34 -0.03 0.00 -2.23 0.00 0.00 60.65 59.73 3gu1 s ILE 405 Cb 0.00 -3.85 -0.03 0.00 -1.58 0.00 0.00 42.46 37.00 3gu1 s ILE 405 CO 0.00 0.32 0.72 0.42 -1.23 0.00 0.00 174.94 175.16 3gu1 s THR 406 N -1.16 4.72 0.45 2.92 -4.23 -1.26 -4.14 115.64 112.94 3gu1 s THR 406 Ca 0.45 -0.09 0.11 0.00 -1.18 0.00 0.00 61.69 60.98 3gu1 s THR 406 Cb -0.33 -3.77 0.26 0.00 1.34 0.00 0.00 72.50 69.99 3gu1 s THR 406 CO 0.43 -0.67 2.08 -0.08 -0.54 0.00 0.00 174.62 175.85 3gu1 h GLU 407 N 0.35 0.31 -0.39 3.99 4.81 -1.98 -0.86 114.58 120.82 3gu1 h GLU 407 Ca -0.47 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 58.67 3gu1 h GLU 407 Cb 1.22 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 3gu1 h GLU 407 CO 0.61 0.23 0.01 1.49 -0.73 0.00 0.00 179.01 180.62 3gu1 h GLU 408 N 0.32 0.68 -0.77 1.92 4.81 -1.99 -0.74 114.58 118.82 3gu1 h GLU 408 Ca 0.08 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 3gu1 h GLU 408 Cb 0.00 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 3gu1 h GLU 408 CO -0.02 0.77 0.40 1.96 -0.73 0.00 0.00 179.01 181.39 3gu1 h GLN 409 N 0.51 1.09 -0.47 1.92 4.20 -1.64 0.86 115.11 121.58 3gu1 h GLN 409 Ca 0.11 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 3gu1 h GLN 409 Cb 0.45 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3gu1 h GLN 409 CO 0.02 0.83 0.05 0.28 -0.67 0.00 0.00 178.83 179.34 3gu1 h VAL 410 N 1.08 1.25 -0.27 -0.54 2.07 -1.12 -1.56 116.25 117.16 3gu1 h VAL 410 Ca 0.27 -0.96 -0.06 0.00 0.82 0.00 0.00 66.70 66.76 3gu1 h VAL 410 Cb 0.07 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3gu1 h VAL 410 CO -0.04 0.34 -0.11 1.23 0.02 0.00 0.00 177.57 179.01 3gu1 h GLY 411 N 0.66 0.48 0.83 2.17 0.00 -0.78 -0.99 103.07 105.44 3gu1 h GLY 411 Ca 0.14 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3gu1 h GLY 411 CO 0.01 0.29 0.03 -1.61 0.00 0.00 0.00 176.54 175.26 3gu1 h GLN 412 N 0.41 0.33 -0.52 4.80 5.75 -0.37 0.95 115.11 126.46 3gu1 h GLN 412 Ca 0.08 -0.09 -0.09 0.00 -0.15 0.00 0.00 58.65 58.39 3gu1 h GLN 412 Cb 0.45 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 3gu1 h GLN 412 CO 0.03 0.49 -0.05 0.52 -2.65 0.00 0.00 178.83 177.17 3gu1 h MET 413 N 0.12 0.94 0.00 1.69 2.86 -1.06 0.52 114.93 120.00 3gu1 h MET 413 Ca 0.06 -0.32 -0.14 0.00 -2.06 0.00 0.00 59.70 57.24 3gu1 h MET 413 Cb 0.33 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 3gu1 h MET 413 CO 0.00 0.98 -1.52 0.25 1.06 0.00 0.00 176.91 177.69 3gu1 n THR 414 N -4.25 0.97 0.04 2.22 -2.24 -0.40 -4.39 114.28 106.22 3gu1 n THR 414 Ca 0.01 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 3gu1 n THR 414 Cb 0.35 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.03 3gu1 n THR 414 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3gu1 n VAL 415 N -2.76 0.95 -0.08 2.28 0.31 0.18 -2.10 118.33 117.11 3gu1 n VAL 415 Ca -0.10 0.31 -0.07 0.00 -0.01 0.00 0.00 64.34 64.48 3gu1 n VAL 415 Cb 0.79 -1.55 -0.00 0.00 -0.91 0.00 0.00 33.84 32.16 3gu1 n VAL 415 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3gu1 h GLY 416 N 0.00 0.32 0.93 2.92 0.00 -1.00 -1.91 103.07 104.33 3gu1 h GLY 416 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 3gu1 h GLY 416 CO 0.00 -0.02 0.09 3.43 0.00 0.00 0.00 176.54 180.04 3gu1 h ASN 417 N 0.15 0.22 -1.00 0.19 2.35 -0.16 -2.71 115.58 114.62 3gu1 h ASN 417 Ca 0.13 -0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.80 3gu1 h ASN 417 Cb 0.15 -0.06 -0.05 0.00 0.05 0.00 0.00 38.32 38.41 3gu1 h ASN 417 CO -0.19 0.26 0.66 -0.65 -1.65 0.00 0.00 177.43 175.87 3gu1 h PRO 418 N 0.17 1.30 -0.75 0.81 0.11 -1.75 -1.16 132.00 130.72 3gu1 h PRO 418 Ca 0.06 -0.08 0.04 0.00 0.11 0.00 0.00 66.00 66.13 3gu1 h PRO 418 Cb 0.09 -0.29 -0.05 0.00 0.11 0.00 0.00 31.00 30.86 3gu1 h PRO 418 CO -0.01 0.86 0.46 0.00 -0.21 0.00 0.00 178.00 179.10 3gu1 h ALA 419 N 1.39 0.99 0.22 -0.75 0.00 -1.09 0.01 119.26 120.02 3gu1 h ALA 419 Ca 0.37 -0.02 -0.32 0.00 0.00 0.00 0.00 54.91 54.94 3gu1 h ALA 419 Cb -0.12 -0.22 0.03 0.00 0.00 0.00 0.00 17.79 17.48 3gu1 h ALA 419 CO -0.09 0.23 -1.41 -0.09 0.00 0.00 0.00 179.25 177.89 3gu1 h ARG 420 N 0.88 0.52 -0.38 0.00 2.43 -1.27 -1.53 114.38 115.03 3gu1 h ARG 420 Ca 0.31 -0.85 -0.10 0.00 -0.81 0.00 0.00 59.98 58.53 3gu1 h ARG 420 Cb 0.07 0.31 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3gu1 h ARG 420 CO -0.13 1.40 -0.16 1.25 -1.51 0.00 0.00 179.97 180.82 3gu1 h LEU 421 N 0.16 0.80 0.00 3.80 6.46 -1.11 -3.35 115.31 122.08 3gu1 h LEU 421 Ca -0.23 -0.39 0.00 0.00 -0.12 0.00 0.00 57.88 57.14 3gu1 h LEU 421 Cb 2.10 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 41.81 3gu1 h LEU 421 CO 0.26 1.01 -1.78 0.49 -0.62 0.00 0.00 178.44 177.81 3gu1 n PHE 422 N -4.29 0.00 1.69 1.25 3.01 -0.02 -4.59 117.46 114.51 3gu1 n PHE 422 Ca -0.02 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.59 3gu1 n PHE 422 Cb 0.40 -0.39 0.68 0.00 -0.01 0.00 0.00 39.48 40.16 3gu1 n PHE 422 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18