NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4618 8.1776 116.7953 58.5095 63.5985 172.1474 5 I 4.4387 8.0486 119.3180 57.4463 39.3920 172.8604 6 P 4.3838 0.0000 0.0000 62.6949 31.8477 177.4411 7 L 4.4097 8.4372 123.8026 53.6396 42.5861 176.7940 8 I 4.0342 8.0475 120.9207 63.2373 37.4571 175.0853 9 G 4.1978 8.6719 112.4529 45.7449 0.0000 174.2585 10 E 4.2309 7.9041 118.7379 55.7133 30.6438 176.9922 11 R 4.3952 8.5270 124.2875 55.9675 31.0854 175.8593 12 F 4.1180 9.0191 128.8983 57.8732 39.9562 173.1949 13 P 4.0018 0.0000 0.0000 62.6710 31.4981 175.5558 14 E 4.2982 8.6808 124.7003 56.5602 30.1103 175.4024 15 M 4.7818 8.8265 122.3568 54.2904 35.1203 172.9041 16 E 5.0135 8.7076 121.2404 54.6857 31.6618 175.3480 17 V 4.5705 8.8960 119.8195 59.8519 36.1984 174.5599 18 T 4.7851 8.3851 120.3659 62.5381 70.1449 174.0055 19 T 5.3651 9.2236 116.2876 58.3788 72.6118 174.1967 20 D 4.6014 8.7718 118.5555 54.3185 39.5470 176.3504 21 H 4.7141 9.0227 116.5105 54.9353 31.3018 175.3683 22 G 3.6913 6.4273 105.3991 45.5754 0.0000 170.2908 23 V 4.7960 7.8722 121.8330 61.2771 32.9852 176.7053 24 I 4.6129 8.5461 120.6783 58.9380 41.3055 173.9603 25 K 4.8836 8.4186 124.8492 55.2189 34.3005 174.8645 26 L 5.0971 9.1743 126.8333 52.1384 45.1577 175.1713 27 P 4.6581 0.0000 0.0000 63.1513 31.7596 177.3667 28 D 4.3862 8.1229 120.5582 58.3869 40.5545 178.0421 29 H 3.8535 8.3108 118.4981 59.3780 29.6457 176.5195 30 Y 4.2677 7.5698 117.1943 59.9825 38.2116 177.8487 31 V 3.8839 7.7036 120.6282 65.6421 31.3885 178.2844 32 S 4.1432 7.8173 113.6199 61.5904 62.7388 175.2828 33 Q 4.1754 7.5277 113.9524 55.6620 28.7231 175.8655 34 G 3.9966 7.9029 106.1391 46.7935 0.0000 173.6740 35 K 5.0406 8.2861 118.1702 53.9289 35.4916 176.6900 36 W 4.6618 8.9783 123.8881 56.7288 30.7579 175.2244 37 F 5.2382 8.5982 115.8775 55.2883 41.4366 173.7059 38 V 4.4134 8.6047 121.3719 61.3317 33.5022 174.2882 39 L 5.3996 9.1549 132.4216 53.0589 43.2726 174.8745 40 F 5.6228 7.5977 122.3047 55.0814 40.2563 174.8312 41 S 5.3566 8.7274 117.8851 57.4009 65.3524 173.1580 42 H 5.0967 9.0442 117.1695 53.7437 32.7344 173.1700 43 P 4.2609 0.0000 0.0000 65.5872 31.6467 176.3729 44 A 4.5167 7.2870 118.0677 50.6166 21.6811 175.2445 45 D 3.3700 9.0328 120.5516 53.7540 41.8410 176.3134 46 F 2.7808 5.4600 116.0604 58.8981 36.3054 175.9050 47 T 4.5247 6.8187 108.4566 58.7981 71.5115 172.1993 48 P 4.3783 0.0000 0.0000 66.0756 31.5187 179.3165 49 V 3.5134 7.7229 115.0611 63.6347 31.1429 177.2468 *51 T 4.2928 8.0453 117.0260 63.3622 70.4198 176.3634 52 T 3.9918 7.9545 111.9525 64.8858 68.6166 176.4534 53 E 3.9749 8.1478 121.1923 59.1368 29.5438 179.0249 54 F 4.7698 8.4705 117.4419 60.9963 39.0105 177.7691 55 V 3.6554 8.0969 117.5626 66.0223 31.1217 177.8947 56 S 4.0884 8.0431 111.6867 61.4912 62.6620 175.7865 57 F 4.2370 8.7989 120.4944 60.6976 38.4458 177.6370 58 A 4.3207 8.2597 119.0429 55.1233 18.2437 179.4483 59 R 4.2294 8.2374 115.2471 57.9181 30.3938 177.6196 60 R 4.6527 7.6520 116.8253 56.0182 30.9961 177.0640 61 Y 4.3954 8.4079 121.7797 61.2268 38.6775 178.1079 62 E 4.0576 8.3843 118.9187 59.4117 28.2232 178.8208 63 D 4.3426 8.1255 118.6032 57.2801 40.7776 178.6783 64 F 4.3100 7.9872 118.0686 60.3777 38.9757 177.6713 65 Q 3.9147 8.0658 119.3364 59.0625 28.5966 178.2166 66 R 3.9781 8.0473 118.9760 58.5076 30.1390 177.4201 67 L 4.4681 7.0443 116.3055 53.3424 42.1968 176.3461 68 G 3.8650 8.0541 107.6593 46.7497 0.0000 173.2342 69 V 4.6365 8.1360 119.9473 60.9207 33.2814 174.6537 70 D 4.8792 8.9214 127.7678 53.1352 43.0407 175.4478 71 L 4.7255 8.2252 120.5038 53.2253 44.4983 176.0611 72 I 4.3775 7.8272 122.0683 59.7444 41.5156 174.5853 73 G 3.6638 8.8709 117.4189 45.3357 0.0000 171.9981 74 L 5.1882 8.8214 122.0474 53.2266 45.8121 175.2001 75 S 5.3673 8.8720 119.1557 56.0955 66.2306 173.9243 76 V 4.7531 8.0816 127.3775 60.8768 28.7476 173.8391 77 D 4.9453 7.6424 121.2102 52.6908 45.8677 176.5358 78 S 4.3138 8.6972 114.8721 57.9910 63.9993 175.7748 79 V 3.4296 7.9631 121.3428 64.9125 31.0219 178.5128 80 F 4.3668 7.5416 117.9519 60.4516 38.7520 177.6312 81 S 4.4215 8.0120 113.4617 61.9260 62.6668 176.0917 82 H 4.6246 8.1137 119.8634 58.6825 28.5714 177.8905 83 I 3.8137 7.8945 121.0516 64.3609 36.7839 178.7751 84 K 4.2839 8.3014 118.9733 58.9622 31.9134 179.3444 85 W 3.7645 8.7507 129.4259 60.2898 30.5877 178.3363 86 K 3.8602 8.3199 118.5104 59.4024 31.4387 179.2266 87 E 4.0446 8.4114 119.1046 59.0371 29.2730 179.1642 88 W 4.1995 8.3078 128.6121 60.5452 30.8925 178.1788 89 I 3.8371 8.1065 119.8130 64.4569 36.6868 178.0572 90 E 4.0739 8.3174 119.9459 58.4266 29.1576 178.5559 91 R 3.9376 7.4694 117.5136 58.9674 30.6036 177.3996 92 H 4.1448 7.7922 114.4249 57.1847 28.9882 176.3176 93 I 4.0652 7.3549 119.6893 60.5783 38.1338 176.1852 94 G 4.0428 8.1029 107.0980 45.4492 0.0000 173.1128 95 V 4.2603 7.6189 118.5134 60.2549 33.6714 174.9605 96 R 3.9116 8.4885 127.6702 56.0073 30.6295 175.5791 97 I 3.8267 7.8159 125.8340 58.9646 37.4481 173.6156 98 P 4.1573 0.0000 0.0000 64.2959 31.8615 177.0322 99 F 4.5362 6.6804 112.8643 55.3124 38.9922 173.2135 100 P 4.4870 0.0000 0.0000 62.9022 32.8567 174.8277 101 I 4.9526 9.7948 122.7615 59.4115 40.7921 174.9833 102 I 4.2074 9.0538 128.5495 61.2245 38.1822 175.0246 103 A 4.4653 9.1302 130.3956 50.8715 19.1036 177.2992 104 D 4.8711 8.4421 123.3522 52.3266 41.2906 173.4481 105 P 4.5841 0.0000 0.0000 63.4191 32.7576 178.4655 106 Q 3.7999 9.1079 120.4501 55.4609 29.3768 173.1145 107 G 3.8170 7.9248 105.1564 47.5198 0.0000 176.1897 108 T 3.8237 8.0862 117.3721 66.4733 68.8280 176.4719 109 V 3.5369 8.0843 119.4140 66.0071 31.6073 177.7425 110 A 4.0395 8.6020 120.7317 55.0942 18.0461 179.6003 111 R 3.9464 7.9207 117.0670 59.3835 29.9290 178.6999 112 R 3.9025 8.0099 118.1894 58.9302 30.1926 177.7146 113 L 4.2053 8.1710 116.9269 54.4049 41.8905 177.3148 114 G 4.1580 7.4671 106.2560 47.0440 0.0000 174.0756 115 L 4.6113 8.6441 117.5759 54.4010 41.4625 176.2766 116 L 4.7597 7.3786 117.5520 53.0149 46.0884 176.2187 *121 A 4.3002 8.4767 121.4309 51.9780 20.3327 180.1024 122 T 3.7907 8.0764 105.2872 63.7652 69.3730 173.8404 123 H 4.2096 8.7027 118.2951 58.9995 28.7984 176.9351 124 T 4.1020 7.8911 114.7314 66.1537 68.6552 175.6618 125 V 4.2870 7.3620 122.2971 62.2680 28.6948 174.4391 126 R 4.8603 7.4739 120.3612 54.5021 34.6372 174.7248 127 G 3.7313 8.2744 109.1185 45.6883 0.0000 171.9762 128 V 4.9222 7.8791 123.7933 60.9191 33.9025 174.2881 129 F 5.0885 9.3369 127.3977 55.9377 41.4220 174.6422 130 I 4.6175 8.6189 126.0288 59.7907 38.8561 175.0063 131 V 4.6162 7.8966 127.7858 60.7016 34.2531 175.4627 132 D 3.3700 8.1835 127.3457 51.2762 40.5815 177.0108 133 A 4.1871 6.9635 120.1506 54.2885 18.3824 179.3974 134 R 4.1008 7.6757 113.1459 57.2279 30.6418 177.3681 135 G 3.9057 8.4629 107.1404 45.3561 0.0000 172.5463 136 V 4.5016 8.4490 119.7593 60.3191 33.2828 175.3036 137 I 4.2319 8.2536 128.0271 61.7153 37.4581 176.6090 138 R 4.5516 9.0346 123.9892 57.1979 32.8245 176.6143 139 T 4.7945 7.6993 113.6191 62.2308 73.3228 172.9407 140 M 4.9075 8.6202 123.9227 53.4222 35.4555 174.6607 141 L 4.6787 8.3274 123.4202 53.1289 44.9504 175.1527 142 Y 4.8349 8.8163 122.1398 56.7378 39.0504 174.6569 143 Y 4.7328 8.6465 121.8783 55.4559 40.4307 174.2917 144 P 4.6919 0.0000 0.0000 62.1103 32.6566 177.2416 145 M 4.1444 8.5649 116.5979 58.2225 31.1918 177.0955 146 E 4.3063 8.1343 114.4442 56.3374 30.1669 175.8106 147 L 4.7693 7.7878 121.2679 53.3117 44.9159 175.5797 148 G 4.0166 8.5934 114.6308 43.9831 0.0000 173.7336 149 R 3.1140 8.8375 124.2433 55.5570 30.7165 177.5562 150 L 4.0975 7.9787 123.4659 54.2735 41.8366 177.5482 151 V 3.2955 7.8753 126.7714 65.6369 31.4924 177.2113 152 D 4.1883 7.8633 118.3074 56.8830 40.5536 178.0779 153 E 3.9455 7.9772 119.7696 59.1865 29.6466 178.7331 154 I 3.7076 7.6785 119.4258 64.3844 37.2087 178.1482 155 L 3.4423 7.4225 119.4349 57.6372 41.2783 179.5790 156 R 4.1524 7.6907 118.5327 59.3528 29.8754 178.6102 157 I 3.6915 7.9012 119.8630 64.5110 37.2002 178.7911 158 V 3.3458 7.5072 112.6034 64.1134 31.4604 178.4546 159 K 3.7570 7.8606 119.0403 59.6488 31.9907 178.6911 160 A 3.7687 8.0366 120.9243 54.9585 18.0213 179.3966 161 L 3.9593 8.1476 119.0349 57.9562 42.2336 179.3623 162 K 4.0376 8.3473 119.2137 59.1332 31.8529 179.3381 163 L 4.0400 7.8186 119.2637 57.7169 41.5212 179.5990 164 G 3.6654 8.2747 106.0433 47.4668 0.0000 175.5005 165 D 4.3741 7.8710 120.9694 57.3554 40.7687 179.0869 166 S 4.2732 7.8087 112.4194 60.8707 63.2604 175.0917 167 L 4.2344 8.1617 118.8379 53.9566 42.1996 176.2367 168 K 3.9077 7.4864 116.0205 57.7979 29.7598 175.0135 169 R 4.8634 8.0224 115.8616 54.3226 35.0239 176.0378 170 A 4.3840 9.0812 123.2181 51.1496 20.8757 176.3678 171 V 4.2648 7.9421 120.4123 60.2893 32.9073 174.1713 172 P 4.4502 0.0000 0.0000 61.6382 32.3389 175.3575 173 A 3.9875 8.3146 122.1196 54.0788 18.7521 177.4238 174 D 4.6060 9.0801 120.3484 54.5005 38.3179 173.6841 175 W 4.4721 7.8319 129.2929 57.3280 30.9762 173.7503 176 P 3.6032 0.0000 0.0000 62.8219 31.1505 175.5544 177 N 4.8821 7.8155 115.1478 53.5451 39.4632 174.8378 178 N 4.5767 8.0263 117.0209 53.3373 39.7534 175.3428 179 E 3.9911 8.8478 125.1236 59.2495 29.8603 178.2938 180 I 3.9443 7.8469 118.6829 62.9565 38.0116 176.5875 181 I 4.1833 8.3077 111.6530 59.3440 40.1174 178.3742 182 G 3.9106 8.1783 112.4264 46.9410 0.0000 175.6297 183 E 3.9276 9.4162 123.0063 57.0094 30.5020 177.4554 184 G 4.1996 7.9157 108.5705 45.6339 0.0000 172.7408 185 L 4.8323 8.7788 119.7609 52.6107 45.3045 176.0916 186 I 4.4275 8.5119 124.3794 60.8332 38.5516 175.3711 187 V 3.8797 8.2752 127.5486 61.5285 32.0642 174.1259 188 P 4.2186 0.0000 0.0000 61.9396 31.5827 174.5430 189 P 4.5036 0.0000 0.0000 62.1225 31.7118 174.4344 190 P 4.5750 0.0000 0.0000 63.1852 31.7812 176.5780 191 T 4.6722 8.5526 109.6782 61.3522 69.9964 174.0701 192 T 4.7230 7.4035 112.2579 59.3593 73.3321 174.2890 193 E 3.7859 8.5282 121.0463 59.6584 29.4758 179.4317 194 D 4.3453 7.9697 118.4155 57.4723 41.1049 178.6661 195 Q 4.0278 8.0895 118.2287 58.8173 28.2311 178.6599 196 A 4.1441 7.8964 121.6682 55.1746 18.3780 180.0049 197 R 3.8702 7.8168 115.8239 59.4980 30.4310 179.2504 198 A 4.0898 7.9832 120.2729 54.8771 18.5591 179.7157 199 R 4.0687 8.0049 117.3522 59.8853 30.0237 178.3990 200 M 4.0871 7.6415 115.6930 57.3280 32.2889 176.9827 201 E 4.3936 8.0408 116.7447 56.8704 30.2855 177.5325 202 S 4.1228 7.7566 112.8166 59.1504 63.4001 175.3304 203 G 3.9068 7.4607 104.9346 46.1891 0.0000 174.2947 204 Q 3.8125 7.8873 122.0002 58.1718 29.1238 175.7140 205 Y 4.8079 7.2016 112.7357 55.9242 40.7540 176.0381 206 R 3.9343 7.6405 119.2105 56.4935 31.1818 175.8609 207 S 5.2990 8.2454 115.0663 57.3914 65.1077 173.4882 208 L 4.5479 8.5533 123.7512 55.0196 43.8286 175.8129 209 D 4.3958 7.2858 114.9569 52.7966 44.4798 176.1836 210 W 4.3526 9.0551 119.5600 58.7990 27.8487 176.8942 211 W 4.4150 6.6431 113.0925 56.2770 28.3496 176.0671 212 F 4.3332 7.3538 122.7545 55.8869 39.0126 172.7306 213 C 5.7573 8.0022 120.1012 57.4599 31.7555 172.4045 214 W 5.3891 8.6494 117.5564 56.1942 31.7798 173.4300 215 D 4.8083 8.7883 119.0023 52.6216 41.7518 174.0735 216 T 5.0715 8.2335 103.9849 59.8937 68.1572 171.3149 217 P 4.4664 0.0000 0.0000 64.8516 32.7700 177.6012 218 A 4.1975 7.9603 122.4945 51.5685 19.2409 177.8710 219 S 4.3985 8.6587 117.3836 58.2131 65.2319 175.7556 220 R 3.9556 8.5692 121.6708 59.5442 29.7529 179.1422 221 D 4.2915 8.0115 118.2458 57.4818 40.7187 178.2317 222 D 4.4046 7.9187 119.0544 57.2890 40.8015 179.1932 223 V 3.3403 7.6824 118.1450 66.1526 31.7654 178.1006 224 E 3.9160 8.0290 117.9394 58.7778 28.9975 178.9372 225 E 3.6444 7.9060 119.0074 58.8787 29.4422 178.3664 226 A 3.6932 7.4009 120.7385 55.0481 18.4846 179.8734 227 R 3.7743 7.6483 116.5650 59.0536 30.0073 179.1092 228 R 3.7624 7.5147 118.4580 59.6776 29.8577 178.1065 229 Y 4.2798 7.0090 115.1475 61.2786 37.3386 178.7544 230 L 4.0758 7.8596 119.3743 57.5203 41.7754 179.3597 231 R 3.8826 8.1458 118.9587 59.3909 29.8278 178.5569 232 R 3.8612 7.8008 117.2608 59.3353 30.1429 178.0833 233 A 4.0950 7.8186 119.0905 54.2015 18.4266 178.5900 234 A 4.3348 7.2976 117.1834 52.5635 19.7715 177.5782 235 E 4.0782 7.7696 117.6462 55.4951 30.1586 176.6276 236 K 4.0491 8.5725 125.5841 55.3662 32.6466 174.6260 237 P 4.1958 0.0000 0.0000 62.5250 31.7192 176.2162 238 A 4.0330 8.4828 125.3228 52.0698 17.3509 172.6270 239 K 3.8306 8.4418 128.4921 56.6104 32.4278 176.6848 240 L 4.5068 8.1963 123.2920 53.9462 43.1185 176.3532 241 L 4.4344 8.2819 117.8828 56.0367 42.2441 177.9653 242 Y 4.3398 8.0582 115.9134 59.4137 38.5050 177.2175 243 E 3.5263 7.5811 119.9013 58.9480 29.8782 176.3652 244 E 4.0909 7.8183 119.3024 56.4448 29.9420 176.1877 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 4 S 8.18 4.46 0.00 3.91 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 5 I 8.05 4.44 2.10 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 1.04 0.00 0.00 6 P 0.00 4.38 0.00 2.12 2.05 0.00 3.88 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.05 0.00 7 L 8.44 4.41 0.00 1.93 1.64 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.05 4.03 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.51 1.04 0.00 0.00 9 G 8.67 4.20 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 0.00 0.00 0.00 10 E 7.90 4.23 0.00 2.14 1.89 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 2.34 2.27 0.00 11 R 8.53 4.40 0.00 1.84 1.85 0.00 3.27 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 12 F 9.02 4.12 0.00 3.05 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.00 0.00 1.61 1.78 0.00 2.20 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.82 0.00 14 E 8.68 4.30 0.00 1.91 1.86 0.00 0.00 0.00 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 2.37 0.00 15 M 8.83 4.78 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.74 0.00 16 E 8.71 5.01 0.00 1.96 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 2.16 2.27 0.00 17 V 8.90 4.57 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.95 0.00 0.00 18 T 8.39 4.79 4.20 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 1.14 0.00 0.00 19 T 9.22 5.37 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 1.16 0.00 0.00 20 D 8.77 4.60 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 H 9.02 4.71 0.00 3.16 3.33 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 6.43 3.69 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 0.00 0.00 0.00 23 V 7.87 4.80 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 0.85 0.00 0.00 0.90 0.00 0.00 24 I 8.55 4.61 1.55 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.00 0.49 0.00 0.00 25 K 8.42 4.88 0.00 1.82 1.66 0.00 1.64 0.00 0.00 2.02 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.63 1.44 7.81 26 L 9.17 5.10 0.00 1.76 1.68 0.90 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.66 0.00 2.48 2.59 0.00 4.00 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 28 D 8.12 4.39 0.00 2.76 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 8.31 3.85 0.00 3.04 2.72 0.00 5.77 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 7.57 4.27 0.00 3.17 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.70 3.88 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.08 0.00 0.00 32 S 7.82 4.14 0.00 3.86 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 33 Q 7.53 4.18 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 34 G 7.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.29 5.04 0.00 1.99 1.87 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.76 7.81 36 W 8.98 4.66 0.00 3.17 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 37 F 8.60 5.24 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.60 4.41 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 39 L 9.15 5.40 0.00 1.91 1.72 1.05 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.60 5.62 0.00 3.10 3.01 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 0.00 0.00 0.00 41 S 8.73 5.36 0.00 4.01 4.01 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 0.00 0.00 0.00 42 H 9.04 5.10 0.00 3.26 3.23 0.00 5.62 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.26 0.00 2.16 2.35 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 44 A 7.29 4.52 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 9.03 3.37 0.00 2.71 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 0.00 0.00 0.00 46 F 5.46 2.78 0.00 2.74 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 6.82 4.52 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 57 F 8.80 4.24 0.00 3.28 2.85 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 58 A 8.26 4.32 1.44 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 0.00 0.00 59 R 8.24 4.23 0.00 1.98 2.04 0.00 3.15 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.91 0.00 60 R 7.65 4.65 0.00 2.04 1.83 0.00 3.15 0.00 0.00 2.94 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 61 Y 8.41 4.40 0.00 3.36 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.38 4.06 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 63 D 8.13 4.34 0.00 2.76 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 7.99 4.31 0.00 3.18 3.15 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 65 Q 8.07 3.91 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 66 R 8.05 3.98 0.00 2.04 2.06 0.00 3.30 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 67 L 7.04 4.47 0.00 1.79 1.49 0.70 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.05 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.14 4.64 2.41 0.00 0.00 0.00 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 0.91 0.00 0.00 70 D 8.92 4.88 0.00 2.34 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.23 4.73 0.00 1.20 1.01 0.89 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.83 4.38 1.72 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.33 0.77 0.00 0.00 73 G 8.87 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.14 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 0.00 2.25 2.25 0.00 91 R 7.47 3.94 0.00 1.86 1.87 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 92 H 7.79 4.14 0.00 1.55 2.59 0.00 5.69 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.35 4.07 1.97 0.00 0.00 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 1.21 0.95 0.96 0.00 0.00 94 G 8.10 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 7.62 4.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 96 R 8.49 3.91 0.00 1.73 1.69 0.00 3.18 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.75 0.00 97 I 7.82 3.83 1.37 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.66 -0.48 0.00 0.00 98 P 0.00 4.16 0.00 1.14 1.66 0.00 2.80 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.39 0.00 99 F 6.68 4.54 0.00 3.23 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.49 0.00 2.03 1.89 0.00 3.91 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 101 I 9.79 4.95 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.35 1.06 0.00 0.00 102 I 9.05 4.21 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.20 0.99 0.00 0.00 103 A 9.13 4.47 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.44 4.87 0.00 2.80 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 0.00 105 P 0.00 4.58 0.00 2.28 2.17 0.00 3.90 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 106 Q 9.11 3.80 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.63 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 107 G 7.92 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.09 3.82 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 109 V 8.08 3.54 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.94 0.00 0.00 110 A 8.60 4.04 1.44 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 0.00 0.00 111 R 7.92 3.95 0.00 2.11 2.06 0.00 3.10 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 112 R 8.01 3.90 0.00 1.87 2.06 0.00 3.30 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 113 L 8.17 4.21 0.00 1.66 1.68 0.84 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 114 G 7.47 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 4.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.99 0.00 0.00 129 F 9.34 5.09 0.00 3.02 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.62 4.62 1.94 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 1.19 0.63 1.15 0.00 0.00 131 V 7.90 4.62 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 0.00 0.00 0.78 0.00 0.00 0.28 0.00 0.00 132 D 8.18 3.37 0.00 1.58 1.54 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 0.00 0.00 0.00 0.00 133 A 6.96 4.19 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 R 7.68 4.10 0.00 1.83 1.93 0.00 3.19 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 135 G 8.46 3.91 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 0.00 0.00 0.00 136 V 8.45 4.50 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.89 0.00 0.00 137 I 8.25 4.23 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.05 1.12 0.00 0.00 138 R 9.03 4.55 0.00 1.68 2.00 0.00 3.24 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 139 T 7.70 4.79 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 1.23 0.00 0.00 140 M 8.62 4.91 0.00 1.61 1.94 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 1.93 0.00 141 L 8.33 4.68 0.00 1.60 1.77 1.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 142 Y 8.82 4.83 0.00 2.80 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 0.00 143 Y 8.65 4.73 0.00 2.81 2.94 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 0.00 144 P 0.00 4.69 0.00 2.60 2.22 0.00 3.84 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 145 M 8.56 4.14 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 146 E 8.13 4.31 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 147 L 7.79 4.77 0.00 1.64 1.72 0.99 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.59 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.84 3.11 0.00 1.45 1.32 0.00 2.97 0.00 0.00 3.01 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.31 0.00 150 L 7.98 4.10 0.00 1.74 1.56 0.89 0.88 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 0.00 151 V 7.88 3.30 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.16 0.00 0.00 152 D 7.86 4.19 0.00 2.67 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.98 3.95 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 154 I 7.68 3.71 2.11 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.84 1.12 0.00 0.00 155 L 7.42 3.44 0.00 1.04 0.13 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.69 4.15 0.00 2.03 2.27 0.00 3.46 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 157 I 7.90 3.69 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.67 0.97 0.00 0.00 158 V 7.51 3.35 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.94 0.00 0.00 159 K 7.86 3.76 0.00 2.07 2.07 0.00 1.55 0.00 0.00 1.87 0.00 0.00 3.19 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.68 7.81 160 A 8.04 3.77 1.28 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 0.00 0.00 0.00 161 L 8.15 3.96 0.00 2.10 1.71 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.35 4.04 0.00 1.79 1.69 0.00 0.88 0.00 0.00 1.21 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.14 0.36 7.81 163 L 7.82 4.04 0.00 1.72 1.54 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 164 G 8.27 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 7.87 4.37 0.00 2.96 2.81 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 0.00 166 S 7.81 4.27 0.00 4.04 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.16 4.23 0.00 1.83 1.73 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 168 K 7.49 3.91 0.00 1.99 1.88 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.40 7.81 169 R 8.02 4.86 0.00 1.57 1.76 0.00 3.37 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 170 A 9.08 4.38 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.94 4.26 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 0.42 0.00 0.00 0.57 0.00 0.00 172 P 0.00 4.45 0.00 2.30 2.12 0.00 3.53 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.23 0.00 173 A 8.31 3.99 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 0.00 174 D 9.08 4.61 0.00 2.92 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 W 7.83 4.47 0.00 3.43 3.15 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 0.00 176 P 0.00 3.60 0.00 1.44 0.49 0.00 3.41 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.77 0.00 177 N 7.82 4.88 0.00 2.71 2.76 0.00 0.00 6.79 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 N 8.03 4.58 0.00 2.88 2.93 0.00 0.00 7.07 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 0.00 179 E 8.85 3.99 0.00 1.96 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 2.30 2.38 0.00 180 I 7.85 3.94 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.45 0.55 0.00 0.00 181 I 8.31 4.18 1.18 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.66 -0.56 0.00 0.00 182 G 8.18 3.91 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 0.00 0.00 0.00 183 E 9.42 3.93 0.00 2.01 1.97 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 2.37 2.28 0.00 184 G 7.92 4.20 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 0.00 0.00 0.00 185 L 8.78 4.83 0.00 1.57 1.42 0.77 -0.19 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 0.00 186 I 8.51 4.43 1.80 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 0.78 0.62 0.70 0.00 0.00 187 V 8.28 3.88 1.70 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 0.43 0.00 0.00 -0.06 0.00 0.00 188 P 0.00 4.22 0.00 2.08 1.99 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 189 P 0.00 4.50 0.00 2.32 2.32 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 190 P 0.00 4.58 0.00 2.36 2.14 0.00 4.12 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.31 0.00 191 T 8.55 4.67 4.29 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 1.28 0.00 0.00 192 T 7.40 4.72 4.22 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 1.26 0.00 0.00 193 E 8.53 3.79 0.00 2.00 1.97 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 2.31 2.30 0.00 194 D 7.97 4.35 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.09 4.03 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 196 A 7.90 4.14 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 R 7.82 3.87 0.00 1.86 2.16 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 198 A 7.98 4.09 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 R 8.00 4.07 0.00 2.29 2.27 0.00 3.49 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.92 0.00 200 M 7.64 4.09 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.94 0.00 201 E 8.04 4.39 0.00 1.98 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 2.31 2.35 0.00 202 S 7.76 4.12 0.00 3.98 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 7.46 3.91 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 0.00 0.00 0.00 204 Q 7.89 3.81 0.00 1.74 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.67 0.00 0.00 0.00 0.00 0.00 1.73 1.99 0.00 205 Y 7.20 4.81 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 R 7.64 3.93 0.00 0.67 0.66 0.00 2.49 0.00 0.00 2.90 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.00 207 S 8.25 5.30 0.00 3.89 3.70 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 0.00 208 L 8.55 4.55 0.00 1.03 1.16 0.87 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 209 D 7.29 4.40 0.00 2.24 1.54 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 0.00 0.00 0.00 0.00 210 W 9.06 4.35 0.00 3.69 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 W 6.64 4.42 0.00 3.06 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 F 7.35 4.33 0.00 1.56 2.18 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 0.00 213 C 8.00 5.76 0.00 2.79 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 W 8.65 5.39 0.00 3.47 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.79 4.81 0.00 2.85 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 0.00 216 T 8.23 5.07 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 1.37 0.00 0.00 217 P 0.00 4.47 0.00 2.23 2.27 0.00 3.87 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 218 A 7.96 4.20 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.66 4.40 0.00 4.08 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.57 3.96 0.00 1.87 2.01 0.00 3.12 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 221 D 8.01 4.29 0.00 2.68 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 0.00 222 D 7.92 4.40 0.00 2.94 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 0.00 223 V 7.68 3.34 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 0.75 0.00 0.00 1.02 0.00 0.00 224 E 8.03 3.92 0.00 2.08 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 2.23 2.21 0.00 225 E 7.91 3.64 0.00 2.03 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 2.01 2.15 0.00 226 A 7.40 3.69 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 0.00 227 R 7.65 3.77 0.00 1.68 1.84 0.00 3.00 0.00 0.00 2.96 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.36 0.00 228 R 7.51 3.76 0.00 1.86 1.71 0.00 3.02 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 229 Y 7.01 4.28 0.00 3.14 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 0.00 230 L 7.86 4.08 0.00 1.78 1.70 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 231 R 8.15 3.88 0.00 1.94 2.01 0.00 3.06 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 232 R 7.80 3.86 0.00 1.95 2.12 0.00 3.32 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 233 A 7.82 4.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 A 7.30 4.33 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 E 7.77 4.08 0.00 1.97 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 2.56 2.37 0.00 236 K 8.57 4.05 0.00 1.72 1.74 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.38 7.81 237 P 0.00 4.20 0.00 2.24 2.06 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 238 A 8.48 4.03 1.28 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 0.00 0.00 0.00 239 K 8.44 3.83 0.00 1.91 1.82 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.43 7.81 240 L 8.20 4.51 0.00 1.75 1.80 1.17 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 241 L 8.28 4.43 0.00 1.69 1.74 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 242 Y 8.06 4.34 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 E 7.58 3.53 0.00 1.70 1.76 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 1.47 1.47 0.00 244 E 7.82 4.09 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.