NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 113 A 4.3380 8.2649 123.5854 51.9981 19.4592 175.6970 114 R 4.4239 7.6836 119.9402 52.0614 32.5901 174.4635 115 H 5.0420 8.3884 117.5058 53.2468 32.7392 172.6210 116 C 4.2720 8.5062 119.0039 59.5457 31.7597 174.2431 117 G 3.8073 8.5335 113.9869 47.0099 0.0000 173.8391 118 H 4.5750 8.0025 115.5420 56.3801 29.3999 175.1332 119 C 4.7819 7.4745 114.6448 54.1530 44.2008 171.5648 120 P 4.2616 0.0000 0.0000 61.7875 31.0279 175.9135 121 E 3.2945 7.9886 120.1091 59.4266 29.7052 176.9950 122 E 4.5048 8.1469 116.5519 56.7115 30.1891 176.3516 123 W 5.1296 8.3125 118.2929 55.9919 31.8791 175.3175 124 I 4.8414 8.4741 115.1314 59.4475 40.1003 174.3498 125 T 4.4942 8.7042 114.6290 61.2568 69.7857 171.7124 126 Y 4.1971 8.9851 128.5341 56.8941 40.3869 175.3019 127 S 4.1788 7.9443 121.6120 56.8378 63.4979 173.8174 128 N 4.2031 8.7503 120.8203 53.6254 37.1772 174.4603 129 S 4.7645 7.9040 112.6850 56.5499 66.0897 173.3169 130 C 4.9894 8.8182 120.3912 57.0190 36.1928 171.9340 131 Y 5.3619 9.4290 117.8932 56.5272 42.2945 173.7438 132 Y 3.9986 8.3527 123.1713 55.5562 41.0416 174.4464 133 I 3.4912 7.2505 127.3794 60.0558 38.0742 175.4836 134 G 2.9886 8.5959 116.1921 42.7519 0.0000 174.3122 135 K 3.8759 7.7856 118.5937 55.8472 30.7926 175.1605 136 E 4.7567 7.3634 117.3492 54.4902 32.7976 175.5735 137 R 4.7519 8.6734 122.9626 55.5664 30.7640 175.6629 138 R 4.8633 9.5017 122.9243 55.0185 35.1524 174.1152 139 T 5.0008 8.1414 114.2473 60.6872 69.3072 175.0238 140 W 3.0337 7.6906 135.0000 60.9948 30.4534 177.6125 141 E 3.7904 8.3606 116.7253 60.2803 28.7391 179.0275 142 E 3.7999 7.9117 117.0912 59.8128 29.5899 179.6019 143 S 3.1935 8.4955 116.0750 61.3593 62.9396 176.6744 144 L 3.5488 7.2629 122.9549 57.6055 41.6658 178.9378 145 L 3.7834 7.5775 118.7163 57.7377 41.4046 179.0770 146 A 3.9008 8.1109 119.8548 55.5273 18.4763 178.7164 147 C 4.4548 7.6585 114.7265 60.6437 40.1258 176.5329 148 T 4.0172 7.4594 116.4806 65.3574 68.1434 176.1894 149 S 4.3726 8.2417 113.8229 59.2152 62.4537 174.2103 150 K 4.4698 7.8932 120.4753 56.6986 32.3495 177.0757 151 N 4.2439 8.4871 113.6255 53.7250 36.4420 173.2388 152 S 4.7857 7.6028 112.9924 56.6841 66.9878 172.9199 153 S 4.7524 8.2872 115.3476 56.5582 65.5547 173.8438 154 L 4.4723 8.2606 122.6990 54.5162 42.9859 176.0566 155 L 4.2657 8.4479 126.4367 55.8546 42.8922 176.0881 156 S 5.0904 8.8817 120.6171 56.4839 65.2700 173.3272 157 I 4.5055 8.3390 123.8817 60.4025 37.3287 174.6680 158 D 4.6311 9.6277 128.7550 54.4787 41.9788 175.7843 159 N 5.1122 7.5808 116.2595 51.8273 41.8053 175.5089 160 E 4.2569 8.8421 119.4316 57.2855 29.3487 177.7362 161 E 4.5793 8.0860 121.1033 56.9281 31.4104 177.4817 162 E 3.8478 8.2532 119.0183 59.3535 29.4639 178.2988 163 M 4.0112 8.0336 117.2404 58.2385 32.3359 177.7036 164 K 4.0443 7.9853 119.4101 59.3408 32.4975 178.0821 165 F 4.0905 7.6492 120.5421 61.5260 39.1172 176.9865 166 L 3.2856 8.1182 119.4729 57.1538 41.5581 178.5186 167 S 4.1482 7.3475 112.8065 60.3628 63.4512 175.5168 168 I 3.9562 7.3146 121.2803 62.1367 37.1572 177.1128 169 I 3.9215 6.9033 120.2078 61.2113 37.7934 175.7798 170 S 4.4075 6.9923 114.1126 56.9677 67.1440 173.0448 171 P 4.4979 0.0000 0.0000 64.3150 32.7774 175.9194 172 S 4.9770 7.5956 114.2869 56.5122 64.9709 173.7631 173 S 5.3311 8.1433 115.4606 57.6259 66.1839 173.8399 174 W 5.1203 8.8737 126.5640 56.9721 29.4479 175.4306 175 I 4.7953 8.4961 117.9855 58.2008 39.6622 176.7489 176 G 4.3383 8.7134 112.1077 46.2108 0.0000 173.5210 177 V 5.0572 7.8139 119.2439 61.5381 35.4755 174.4573 178 F 5.3948 9.0786 122.2096 55.6126 41.6541 173.9793 179 R 3.8486 8.2780 119.5521 55.1659 31.5556 175.2869 180 N 4.5004 8.6481 116.9905 54.2018 39.5066 177.8379 181 S 4.5771 7.6484 114.7754 56.8453 65.5923 174.3510 182 S 4.1010 8.6370 115.7844 61.5301 62.3800 174.8862 183 H 4.5803 7.4518 120.9747 54.3202 28.6168 172.4975 184 H 4.8616 7.5456 120.3487 52.9940 33.0503 171.4429 185 P 4.5954 0.0000 0.0000 62.4180 32.4228 176.0892 186 W 4.2205 8.8672 121.4562 56.7213 30.4153 175.3884 187 V 4.9587 8.4347 123.8633 61.2049 34.5043 175.9804 188 T 5.1185 8.3137 116.2051 60.6772 70.4349 175.0129 189 M 4.3064 8.7462 120.0659 58.9658 32.0239 177.7619 190 N 4.2750 8.2651 114.7342 55.0435 38.7301 176.0370 191 G 3.9408 7.8698 104.5140 45.1379 0.0000 173.2210 192 L 4.3148 7.4747 118.7646 53.1373 42.6894 176.1885 193 A 4.3740 8.4319 125.0934 51.8879 18.4747 177.4794 194 F 4.6131 8.9820 126.4852 58.7758 40.4778 175.7966 195 K 4.4967 7.7345 126.0696 55.0092 32.1295 175.5874 196 H 4.5557 6.1965 113.5972 53.8563 33.2224 174.0951 197 E 3.9942 8.5421 122.7168 56.4242 29.8169 176.4705 198 I 4.5114 7.8965 122.7294 59.0086 40.7674 174.2033 199 K 4.2531 8.3208 127.2000 55.1679 33.4219 176.2437 *204 A 4.3689 8.5045 126.1276 52.1824 20.1428 177.3596 205 E 4.5062 8.0927 112.5282 55.8469 29.7636 175.0168 206 L 4.6550 7.7293 117.0561 53.7205 42.9960 176.0770 207 N 4.8252 8.6376 116.2753 52.4311 41.8657 173.3220 208 C 5.3744 8.3324 115.8178 55.0736 39.5028 173.0433 209 A 5.3134 8.8756 123.6943 51.2442 20.9380 176.5522 210 V 4.6863 8.8497 111.9594 59.4483 36.8164 174.5188 211 L 4.6281 9.0838 125.4306 54.4920 43.1955 175.8093 212 Q 4.5128 8.8233 124.9675 54.9156 32.7741 175.0774 213 V 3.3047 9.1959 117.0340 63.0023 28.6607 172.8186 214 N 4.2406 8.0242 113.4634 54.0654 38.0124 173.5094 215 R 4.7011 7.5483 112.0800 54.2243 34.7800 173.7361 216 L 5.1270 8.2770 119.4756 53.1831 44.1217 175.5626 217 K 4.8549 8.9704 123.8880 54.5729 36.3252 174.3563 218 S 5.1460 8.5998 118.4175 57.1632 63.7259 172.9806 219 A 4.9248 9.3807 127.9164 49.7793 23.3492 175.0378 220 Q 3.9789 8.7805 120.6277 56.3257 29.5793 177.9725 221 C 4.3825 9.0958 123.3193 58.8218 40.3490 175.1016 222 G 3.8811 7.9269 107.2618 46.1592 0.0000 174.3356 223 S 4.3127 8.4306 117.4725 59.0661 63.5407 175.1738 224 S 4.8490 8.8809 120.7452 57.9885 62.3495 173.0830 225 I 4.5054 9.0859 126.0901 59.1568 41.0348 174.1557 226 I 5.1591 8.1637 122.9185 59.9898 38.3641 174.7895 227 Y 5.1695 8.3089 123.6974 55.5624 40.8608 174.0268 228 H 5.2253 8.7261 118.5345 54.3878 32.2999 172.3806 229 C 5.3812 8.8740 119.0785 55.4713 37.7117 172.7517 230 K 5.1679 9.2569 121.8060 55.5385 35.7128 175.1722 231 H 5.5251 8.3563 122.7415 54.1647 32.1706 174.4296 232 K 4.1883 8.6906 118.6876 57.4942 32.4880 175.9193 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 113 A 8.26 4.34 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.68 4.42 0.00 1.88 1.82 0.00 3.31 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 115 H 8.39 5.04 0.00 3.25 3.36 0.00 5.72 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 C 8.51 4.27 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 8.53 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 8.00 4.58 0.00 3.13 3.33 0.00 5.84 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 C 7.47 4.78 0.00 3.05 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.26 0.00 1.14 1.58 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.25 0.00 121 E 7.99 3.29 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 122 E 8.15 4.50 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.50 0.00 123 W 8.31 5.13 0.00 3.35 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 8.47 4.84 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.61 0.97 0.00 0.00 125 T 8.70 4.49 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 126 Y 8.99 4.20 0.00 2.74 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 7.94 4.18 0.00 3.35 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.75 4.20 0.00 2.86 2.87 0.00 0.00 6.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 S 7.90 4.76 0.00 3.68 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 C 8.82 4.99 0.00 3.29 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 9.43 5.36 0.00 2.93 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 8.35 4.00 0.00 1.43 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 I 7.25 3.49 1.47 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.09 0.60 0.00 0.00 134 G 8.60 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.79 3.88 0.00 1.78 1.84 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.22 1.24 7.81 136 E 7.36 4.76 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 137 R 8.67 4.75 0.00 1.74 1.96 0.00 3.17 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 138 R 9.50 4.86 0.00 1.85 1.80 0.00 3.30 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 139 T 8.14 5.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 140 W 7.69 3.03 0.00 1.84 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.36 3.79 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 142 E 7.91 3.80 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 143 S 8.50 3.19 0.00 3.35 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.26 3.55 0.00 0.55 1.24 0.69 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.58 3.78 0.00 1.72 1.57 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 146 A 8.11 3.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 C 7.66 4.45 0.00 3.03 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.46 4.02 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 149 S 8.24 4.37 0.00 3.77 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 K 7.89 4.47 0.00 2.11 1.93 0.00 1.77 0.00 0.00 1.55 0.00 0.00 2.63 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.44 7.81 151 N 8.49 4.24 0.00 2.84 2.91 0.00 0.00 6.89 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 7.60 4.79 0.00 4.15 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 8.29 4.75 0.00 3.86 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.26 4.47 0.00 1.50 1.53 0.82 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.45 4.27 0.00 2.17 1.87 1.20 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 156 S 8.88 5.09 0.00 4.10 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 I 8.34 4.51 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.95 0.91 0.00 0.00 158 D 9.63 4.63 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 N 7.58 5.11 0.00 2.80 2.71 0.00 0.00 6.97 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.84 4.26 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 161 E 8.09 4.58 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 162 E 8.25 3.85 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 163 M 8.03 4.01 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 164 K 7.99 4.04 0.00 1.92 1.82 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.58 7.81 165 F 7.65 4.09 0.00 3.04 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 8.12 3.29 0.00 1.93 1.52 0.38 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.35 4.15 0.00 3.97 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 I 7.31 3.96 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.83 0.00 0.00 169 I 6.90 3.92 1.38 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 -0.36 0.52 0.00 0.00 170 S 6.99 4.41 0.00 3.66 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.50 0.00 2.02 2.20 0.00 3.55 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.87 0.00 172 S 7.60 4.98 0.00 3.67 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 S 8.14 5.33 0.00 3.60 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 W 8.87 5.12 0.00 3.26 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.50 4.80 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 1.01 0.00 0.00 176 G 8.71 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 V 7.81 5.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 -0.19 0.00 0.00 178 F 9.08 5.39 0.00 2.65 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 R 8.28 3.85 0.00 0.98 1.62 0.00 2.81 0.00 0.00 2.40 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 180 N 8.65 4.50 0.00 2.65 2.73 0.00 0.00 6.87 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 S 7.65 4.58 0.00 3.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 8.64 4.10 0.00 3.85 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 H 7.45 4.58 0.00 2.95 3.12 0.00 5.95 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 H 7.55 4.86 0.00 2.96 3.01 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 P 0.00 4.60 0.00 2.10 2.06 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 186 W 8.87 4.22 0.00 3.44 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 8.43 4.96 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.80 0.00 0.00 188 T 8.31 5.12 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 189 M 8.75 4.31 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.64 0.00 190 N 8.27 4.27 0.00 2.77 2.96 0.00 0.00 7.09 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 7.87 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 L 7.47 4.31 0.00 1.82 1.65 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 193 A 8.43 4.37 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 F 8.98 4.61 0.00 2.99 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 K 7.73 4.50 0.00 1.61 1.55 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.51 7.81 196 H 6.20 4.56 0.00 2.16 2.97 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 E 8.54 3.99 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 198 I 7.90 4.51 1.71 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.56 0.07 0.00 0.00 199 K 8.32 4.25 0.00 1.75 1.69 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.31 7.81 *204 A 8.50 4.37 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 E 8.09 4.51 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 206 L 7.73 4.65 0.00 1.84 1.77 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 207 N 8.64 4.83 0.00 2.49 2.71 0.00 0.00 6.56 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 C 8.33 5.37 0.00 2.86 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 8.88 5.31 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 V 8.85 4.69 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.00 0.00 0.83 0.00 0.00 211 L 9.08 4.63 0.00 1.73 1.65 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 212 Q 8.82 4.51 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.88 0.00 0.00 0.00 0.00 0.00 2.17 2.06 0.00 213 V 9.20 3.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.89 0.00 0.00 214 N 8.02 4.24 0.00 2.81 2.85 0.00 0.00 7.08 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 R 7.55 4.70 0.00 1.81 1.71 0.00 3.29 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 216 L 8.28 5.13 0.00 1.76 1.52 1.16 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 217 K 8.97 4.85 0.00 1.71 1.55 0.00 1.58 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.31 7.81 218 S 8.60 5.15 0.00 4.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 A 9.38 4.92 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 Q 8.78 3.98 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.89 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 221 C 9.10 4.38 0.00 2.93 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 G 7.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 S 8.43 4.31 0.00 4.12 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 S 8.88 4.85 0.00 3.83 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 I 9.09 4.51 0.91 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.71 0.46 0.00 0.00 226 I 8.16 5.16 1.89 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.92 0.72 0.00 0.00 227 Y 8.31 5.17 0.00 3.06 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 H 8.73 5.23 0.00 3.10 3.24 0.00 5.59 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 C 8.87 5.38 0.00 2.92 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 K 9.26 5.17 0.00 1.90 1.64 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.13 0.82 7.81 231 H 8.36 5.53 0.00 3.23 3.25 0.00 5.85 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 K 8.69 4.19 0.00 1.71 1.68 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.47 7.81 * Residues marked with a * may have inaccurate shift predictions.