NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5508 8.2893 120.3330 55.7250 33.8436 174.4834 2 E 5.0165 7.9944 113.8776 53.7767 29.6636 175.5297 3 R 3.8488 8.9754 121.6744 60.5095 31.3182 179.5109 4 Y 3.8737 7.8420 115.9397 61.0356 37.9355 177.9129 5 E 4.2134 8.4404 119.0273 59.8174 29.6767 179.1572 6 N 4.4068 8.6055 116.7620 55.9513 38.4460 177.3397 7 L 3.7891 7.9105 121.8201 58.3237 42.2236 179.1351 8 F 4.4276 8.3342 117.8507 60.4300 38.8051 177.6544 9 A 4.0749 8.2309 120.6379 55.3734 18.0070 179.7683 10 Q 4.0132 7.8896 115.4116 59.0193 28.9575 178.6578 11 L 4.1736 8.3945 120.5990 57.7022 41.6766 179.0194 12 N 4.3845 8.5145 117.2712 56.4736 38.7412 175.9146 13 D 4.6884 8.0018 116.6025 55.3343 41.2747 176.5504 14 R 4.5221 7.5833 114.3910 58.2155 30.0458 175.3040 15 R 3.5804 7.5482 113.9868 58.5216 28.0859 175.6722 16 E 4.8863 8.4429 119.3498 54.4484 32.5942 176.0965 17 G 4.2466 8.7619 112.4286 45.0052 0.0000 172.7084 18 A 5.0105 8.8377 122.8753 50.4438 21.3845 176.1479 19 F 5.2609 9.4360 124.1064 56.4886 42.1216 174.2534 20 V 4.5653 8.6488 127.6119 59.6162 33.4133 172.6877 21 P 4.7961 0.0000 0.0000 61.6275 33.5650 174.2238 22 F 5.8108 8.4523 123.5494 56.1345 41.4418 174.9323 23 V 4.2608 6.7726 116.4810 60.0859 36.8664 173.6026 24 T 4.5312 7.9864 118.7448 61.7647 70.0967 174.7223 25 L 3.9778 8.5900 128.0103 56.4293 42.2936 177.7400 26 G 3.7992 9.1627 111.5387 45.2692 0.0000 171.6986 27 D 4.6300 7.6472 119.6158 51.8397 42.0780 174.3627 28 P 4.5673 0.0000 0.0000 63.3436 32.2501 175.8437 29 G 4.1445 7.3117 104.6925 42.6411 0.0000 174.0922 30 I 3.6683 8.1683 121.0393 64.3439 37.3188 178.3162 31 E 3.9320 8.1794 118.6871 59.8783 29.3182 179.3275 32 Q 3.9859 8.0308 118.6379 59.1147 29.0804 178.1277 33 S 4.0395 8.3169 114.5203 61.2980 62.3668 176.0869 34 L 4.0011 7.9651 121.6802 57.7476 41.2794 179.7601 35 K 3.9746 7.9619 117.9569 59.3394 31.9460 179.3445 36 I 3.6804 8.0376 120.4597 64.5326 37.0687 178.4582 37 I 3.6422 8.0636 120.7199 64.6637 36.8998 178.2707 38 D 4.3890 8.3515 119.7800 57.6000 40.4651 179.2393 39 T 3.8772 8.0623 116.4233 66.5945 68.5376 176.6181 40 L 4.0227 8.2603 121.3231 58.0248 41.6610 179.8775 41 I 3.6644 7.8768 119.5259 64.4580 36.8854 178.0210 42 D 4.3648 8.1908 117.5357 57.1201 41.0303 177.6157 43 A 4.2636 8.3368 120.7203 52.4192 18.2583 177.9037 44 G 3.9545 7.7391 104.6746 44.9045 0.0000 174.3274 45 A 4.2841 7.8641 123.9267 52.5572 18.7805 177.8980 46 D 4.6277 8.7175 122.8286 56.6274 42.0223 176.1619 47 A 4.7018 7.5654 117.9387 50.6414 23.4105 174.7312 48 L 4.8892 8.8614 117.7851 52.9471 46.1932 175.9668 49 E 5.1798 8.8849 122.5441 54.6402 32.4320 174.3334 50 L 4.8663 9.6034 128.1989 52.8162 44.7291 175.9884 51 G 4.5305 8.4537 111.3016 44.1083 0.0000 172.5612 52 V 4.6514 8.2409 123.0539 59.9971 32.9502 173.8115 53 P 4.2148 0.0000 0.0000 63.1444 31.6205 175.4416 54 F 5.4871 8.7343 124.4134 56.0975 42.5036 174.7465 55 S 3.8621 8.3149 121.4009 60.8025 62.9467 174.4222 56 D 4.5260 6.0500 119.1145 51.4034 41.4598 174.3528 57 P 3.3877 0.0000 0.0000 60.9756 30.0341 178.2302 58 L 4.1479 7.7532 118.5885 58.0607 40.7751 178.2082 59 A 4.8544 8.6521 122.4185 52.0023 19.4171 175.7146 60 D 4.8545 8.0503 117.3259 53.2824 44.8729 176.7975 61 G 3.9878 8.3291 108.9624 43.0186 0.0000 172.6839 62 P 4.2702 0.0000 0.0000 66.3632 30.9311 178.3867 63 T 3.8682 7.9482 114.7372 66.6942 68.3942 176.4323 64 I 3.8890 7.7188 120.9560 64.4098 37.1816 178.2370 65 Q 4.0460 8.3031 119.0250 59.2771 28.5137 178.8821 66 N 4.4433 8.5983 117.3549 55.9656 38.5636 177.4047 67 A 4.0154 7.9144 122.1006 55.3097 18.4744 179.4618 68 N 4.2184 8.4914 115.0985 56.2567 38.4918 177.6600 69 L 4.1647 7.7857 120.1719 57.9008 41.5140 179.7822 70 R 3.9130 8.0152 116.6086 59.1328 30.3412 178.6666 71 A 4.3065 7.9131 121.7639 54.7933 18.4126 179.7090 72 F 4.2538 8.6189 116.3569 60.7063 38.7452 177.7827 73 A 4.3308 8.4249 119.5579 54.4454 18.2199 178.4790 74 A 4.4360 7.8900 117.1537 51.6678 19.1404 177.8776 75 G 3.8737 8.3331 105.8560 45.8077 0.0000 174.2437 76 V 3.7024 7.7554 119.3710 62.6344 32.1997 175.8113 77 T 4.8676 8.1290 116.2068 58.7773 73.1913 173.0838 78 P 4.3192 0.0000 0.0000 65.7987 31.3022 178.7603 79 A 4.1992 8.1418 119.0793 55.4497 18.2680 179.5914 80 Q 4.0276 8.0723 116.2587 59.1079 28.7695 178.5854 81 C 4.0370 8.2038 117.8598 62.9839 28.1755 176.2806 82 F 4.2850 8.3049 119.1399 60.3874 38.4959 177.6747 83 E 4.0635 8.1051 118.1846 59.4737 29.1863 179.2361 84 M 4.0405 8.2283 118.9622 58.3611 32.0263 178.5711 85 L 3.9239 8.4194 119.2177 57.8381 41.8245 179.4943 86 A 4.0031 8.0367 120.4248 55.3106 18.2146 179.7397 87 I 3.8244 7.6614 117.9995 64.6395 37.2844 178.7758 88 I 3.7544 8.1523 121.0602 64.4277 36.7063 178.5428 89 R 3.9430 7.9863 118.5720 59.4184 29.9951 178.1988 90 E 4.0828 8.1812 117.4412 58.7439 29.4488 178.6963 91 K 4.4424 7.4984 117.5546 56.8402 32.8576 176.2008 92 H 4.7397 7.7768 114.6475 52.9365 30.0290 171.3339 93 P 4.3913 0.0000 0.0000 64.7010 31.5511 177.6693 94 T 4.3291 7.6328 106.6558 61.4669 70.3249 174.2479 95 I 3.7655 7.5532 123.3704 60.0990 38.6447 173.8396 96 P 4.3045 0.0000 0.0000 62.6548 32.6842 175.1983 97 I 4.6906 9.3722 124.7380 59.5077 40.2071 174.6512 98 G 4.7465 9.3089 114.7688 43.5576 0.0000 171.6094 99 L 5.3326 8.8715 123.2914 52.7622 44.3752 175.3767 100 L 5.0499 9.0386 125.1728 53.9808 44.0029 175.1064 101 M 4.7662 9.2822 125.8847 53.7090 36.3862 174.1878 102 Y 4.3950 7.9426 116.6043 56.0430 40.3869 176.8671 103 A 3.8325 9.4264 126.7949 55.6617 18.4722 179.6931 104 N 4.4238 7.9893 114.6620 56.9203 38.8554 176.8532 105 L 4.2979 7.3750 119.0014 57.0510 41.6829 179.2277 106 V 2.8294 7.1916 117.3679 65.3677 32.0187 177.3586 107 F 4.2429 8.9205 120.6783 61.1456 38.9671 176.0561 108 N 4.0901 8.3585 115.4927 56.2385 38.7397 174.6100 109 N 4.6473 7.8156 117.1891 53.1458 39.7918 175.2001 110 G 3.7384 7.8621 105.1127 45.5452 0.0000 175.0895 111 I 3.8397 8.4207 125.4744 64.6086 37.1369 177.8290 112 D 4.4200 8.1489 117.9632 57.5383 41.0854 177.9483 113 A 3.9015 8.0299 120.6237 55.0071 18.3004 179.2559 114 F 3.8057 8.1460 119.0989 61.7977 39.5709 177.1653 115 Y 3.9806 8.1531 115.9069 60.6634 37.5661 178.3099 116 A 3.7850 8.0782 122.3453 54.9589 18.4495 179.6429 117 R 3.5515 7.7275 117.2727 59.4208 29.9037 178.5068 118 C 4.1754 7.6823 116.5910 62.8012 28.1806 175.7073 119 E 3.9340 8.2370 120.7766 59.3191 29.0266 178.4437 120 Q 4.0511 7.9092 118.4020 59.2866 29.2195 178.2706 121 V 4.0220 7.6994 110.3892 61.7139 31.8813 176.8993 122 G 3.9148 7.7648 106.8843 45.5270 0.0000 174.0297 123 V 3.8999 7.7926 118.7103 62.6538 32.2741 175.3171 124 D 5.0782 9.2898 124.8606 55.4207 42.9944 176.2925 125 S 5.2938 8.0197 110.9383 57.2144 67.3323 173.4816 126 V 4.7557 8.7734 119.9317 61.5666 35.0924 172.9572 127 L 4.7875 9.2107 130.7858 53.3318 44.4606 175.1405 128 V 4.2229 7.9779 126.7211 61.2062 31.8085 175.4076 129 A 3.7715 8.5253 132.0424 53.7972 18.6910 177.9990 130 D 4.6692 7.4902 112.6038 53.0597 39.9557 176.5852 131 V 4.0290 7.1138 120.4179 60.9132 32.1681 173.2711 132 P 4.5726 0.0000 0.0000 61.9849 32.2537 177.9884 133 V 3.5043 8.2267 113.4033 63.9208 30.9886 178.6294 134 E 4.0993 8.2385 117.1530 58.4231 29.3442 177.9117 135 E 4.6609 7.9616 116.1510 56.0738 30.5377 177.4312 136 S 4.5643 7.9775 115.1678 60.1019 63.3965 175.4656 137 A 3.8367 8.1774 124.4968 55.5372 18.0648 177.4358 138 P 4.1658 0.0000 0.0000 65.7014 31.1753 178.8008 139 F 4.0598 8.1921 117.3084 60.5151 39.0263 177.7902 140 R 3.9015 8.4754 116.0529 59.1516 29.2367 178.8967 141 Q 3.8668 8.1333 118.6139 58.7817 28.6143 178.5048 142 A 3.9367 7.7514 121.3675 54.8662 18.3849 179.4127 143 A 3.5004 7.5257 119.4974 55.3142 18.5813 179.8649 144 L 4.0081 8.0430 117.6231 58.0836 41.4392 180.0805 145 R 3.9743 7.9220 117.0540 58.5513 29.8977 177.7676 146 H 4.9809 7.4020 115.4008 53.8862 29.7633 174.1341 147 N 4.2559 7.9156 115.6870 54.7541 36.5171 174.1542 148 I 4.8090 8.1524 117.7148 59.3765 39.9404 175.9163 149 A 4.3838 9.0704 129.9648 50.9724 19.9292 174.4360 150 P 4.8685 0.0000 0.0000 62.1763 33.0709 174.9919 151 I 4.3672 7.8273 125.2454 59.4397 39.0168 175.1759 152 F 4.9316 8.3413 123.5169 55.6613 42.9679 174.0411 153 I 4.6988 8.4805 122.7050 60.9540 38.6364 175.3517 154 C 4.7219 9.3886 128.1429 56.7886 32.1371 171.5539 155 P 4.8161 0.0000 0.0000 61.6305 32.2365 175.3195 156 P 4.4038 0.0000 0.0000 65.7585 31.3174 178.1045 157 N 4.6906 8.0322 112.7371 52.9691 37.1941 174.9110 158 A 4.2568 7.5868 121.6590 52.6589 19.2772 177.1338 159 D 4.9967 8.0334 118.4340 50.8958 44.0258 175.9516 160 D 4.3949 8.5521 117.1770 57.7462 41.1436 177.7363 161 D 4.2425 7.9813 118.8836 57.2140 40.8621 178.3649 162 L 3.8868 7.9903 120.4156 57.9338 42.0832 178.9504 163 L 4.0274 7.9792 119.0210 57.9376 41.5917 179.7506 164 R 3.4284 7.8214 117.8938 58.9460 29.8482 179.1940 165 Q 3.1835 7.6239 117.5524 58.7647 28.6841 178.6707 166 V 3.4000 7.9145 119.3254 66.1352 31.2185 177.9451 167 A 4.0071 7.7257 119.3262 55.2210 18.3151 179.2848 168 S 4.1679 7.6366 110.7275 61.3481 62.5256 175.3160 169 Y 4.7985 8.2681 118.5561 58.7822 38.2137 176.3924 170 G 4.1898 7.8070 108.1510 45.3983 0.0000 172.4533 171 R 4.5107 8.1484 117.4169 55.7903 33.7660 173.3578 172 G 3.7307 9.3424 109.7600 45.1943 0.0000 172.8727 173 Y 4.9644 6.6176 117.0001 55.4573 41.6148 173.6265 174 T 4.5323 9.0157 118.0165 62.3830 71.0306 173.5732 175 Y 4.8267 8.8438 128.4054 56.5877 39.6227 173.6986 176 L 4.7518 8.9694 130.5617 54.4599 43.3533 176.4574 177 L 4.6417 8.5757 125.7614 55.5042 43.3337 176.7212 *196 L 4.3934 7.9760 119.4130 55.9630 43.9220 178.5625 197 I 3.7351 7.6385 118.6819 64.2996 36.8572 178.2135 198 E 3.8947 8.0123 118.9526 59.3799 29.4321 179.3285 199 K 3.5976 7.8862 117.9749 59.2013 32.0186 179.2667 200 L 4.0455 7.9733 119.2155 57.8724 41.5897 179.7557 201 K 3.9054 8.0015 118.3762 59.3238 31.6808 179.0373 202 E 3.8606 8.0009 119.2538 58.7400 29.4586 177.4442 203 Y 4.8507 7.2591 114.3003 57.0775 38.4550 174.9875 204 H 3.9612 8.1401 115.2675 56.7549 26.9245 175.0369 205 A 4.4253 8.1712 119.5292 51.3806 19.1890 178.4873 206 A 4.1600 8.5091 120.7916 51.2239 19.5899 175.8985 207 P 4.0288 0.0000 0.0000 63.3070 32.4651 175.3166 208 A 4.9011 8.4989 125.5113 51.2758 20.4832 175.7994 209 L 4.9590 9.0104 122.5079 52.7075 44.7734 175.6005 210 Q 4.2871 9.1328 126.3815 55.9817 30.0769 175.2041 211 G 4.0447 8.9690 117.5614 45.5623 0.0000 169.7774 *212 F 3.5765 9.8161 123.9744 58.0407 36.0418 171.2835 213 G 3.9448 9.0302 113.8421 44.6015 0.0000 173.0415 214 I 4.3022 7.5006 120.7933 60.4423 35.9218 175.3026 215 S 5.0359 10.2757 118.0827 57.4698 64.7385 174.3086 216 S 4.7521 7.9239 114.4974 55.4292 65.9284 172.9243 217 P 4.0815 0.0000 0.0000 65.9813 30.9278 178.7748 218 E 4.3010 8.0114 116.9635 58.9935 29.4803 179.0832 219 Q 4.0602 8.1951 119.0091 58.3126 28.7207 178.7507 220 V 3.5842 7.5426 119.3964 66.0045 31.7764 177.9708 221 S 4.1022 8.0825 113.8266 61.5443 62.7230 176.2543 222 A 3.9908 8.4583 124.5523 54.6199 18.0584 179.5499 223 A 3.9070 7.9898 119.3165 55.4139 18.5713 180.0808 224 V 3.9084 7.7806 118.1576 65.6706 31.3585 178.2420 225 R 3.9244 8.1512 117.6610 59.1542 29.9907 178.0346 226 A 4.1807 7.7914 119.6824 52.9384 18.4609 177.8377 227 G 3.9140 7.4172 102.9678 45.2679 0.0000 174.2357 228 A 4.2126 8.1138 123.3322 51.4566 19.3345 178.5630 229 A 4.1758 8.8787 122.8645 52.7616 19.1416 178.1182 230 G 3.7963 7.0210 101.6876 45.8534 0.0000 171.1171 231 A 5.2028 8.3461 119.6873 50.3919 23.0382 175.6362 232 I 4.6390 8.7533 121.2116 59.6265 39.9452 176.1214 233 S 4.7363 9.0427 123.1544 56.7146 61.6658 174.7195 234 G 3.8181 8.7574 116.1097 47.6627 0.0000 172.3583 235 S 4.6957 8.0100 110.1233 57.3976 66.7945 175.7323 236 A 3.8918 8.4978 123.3284 55.4403 18.0071 179.4052 237 I 3.6047 7.8061 117.5072 64.6196 37.2062 178.7285 238 V 3.6823 7.8535 118.5061 65.7604 31.3138 178.1091 239 K 3.9695 8.1814 118.6407 59.4267 31.6613 179.3054 240 I 3.6268 7.3353 118.8956 64.2655 37.2731 178.2931 241 I 3.8184 7.5983 120.1299 64.4175 36.7851 177.8145 242 E 3.9139 8.1656 118.9280 59.6151 29.4778 178.9366 243 K 4.2232 8.1983 116.8116 58.1113 32.4559 177.4598 244 N 5.0358 7.7485 116.6015 52.6813 39.2290 176.6830 245 L 3.9692 8.2204 120.8291 57.9223 41.8878 178.7996 246 A 4.0398 8.0631 120.5518 53.9888 18.6909 177.4190 247 S 4.5633 7.8859 110.8778 55.5525 64.6057 172.7867 248 P 4.2413 0.0000 0.0000 65.8288 31.2896 178.6617 249 K 4.0088 7.9535 116.7134 59.4749 31.9613 179.0763 250 Q 4.0175 8.0168 119.4325 58.8908 28.9710 177.4910 251 M 3.9919 8.1500 119.5249 58.7693 32.2848 178.2281 252 L 3.9736 7.8844 118.6413 57.6606 41.8840 179.4267 253 A 3.9852 7.8847 120.2491 55.2684 18.3766 179.3879 254 E 3.9813 8.5780 118.1790 59.1651 29.5825 178.9597 255 L 4.0880 8.2185 119.4337 57.6867 41.6168 179.3169 256 R 3.9171 8.1972 118.6423 59.6818 30.0724 178.7052 257 S 4.1223 7.9978 114.5237 61.4794 62.7330 176.5495 258 F 4.0892 8.4122 123.2369 61.4023 39.2383 177.3915 259 V 3.4519 8.2312 118.1822 65.9252 31.3238 177.8240 260 S 4.2505 8.6448 114.3762 60.7572 61.6796 176.0810 261 A 3.8361 7.8707 123.3695 55.3837 17.8786 179.5850 262 M 3.4729 7.3006 116.3853 57.9747 32.0058 178.6440 263 K 3.9461 8.0086 120.0337 59.3354 32.4700 178.7427 264 A 3.9277 7.8610 120.8505 55.0133 18.0345 179.1696 265 A 4.0571 7.3739 117.0960 54.1418 18.6525 179.0077 266 S 4.3664 8.0034 112.2777 59.5400 63.3643 174.6521 267 R 4.1246 7.5628 126.2522 56.4865 29.9149 176.0522 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 1 M 8.29 4.55 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 2 E 7.99 5.02 0.00 2.38 2.11 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 2.40 2.34 0.00 3 R 8.98 3.85 0.00 1.75 1.80 0.00 3.43 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 1.66 1.73 0.00 4 Y 7.84 3.87 0.00 3.17 3.25 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 0.00 0.00 0.00 0.00 5 E 8.44 4.21 0.00 2.30 2.11 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 2.51 2.65 0.00 6 N 8.61 4.41 0.00 2.69 2.86 0.00 0.00 6.70 6.42 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 7 L 7.91 3.79 0.00 1.57 1.46 0.78 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.33 4.43 0.00 3.20 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 9 A 8.23 4.07 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 10 Q 7.89 4.01 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 11 L 8.39 4.17 0.00 1.95 2.02 0.97 0.58 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 12 N 8.51 4.38 0.00 3.01 3.01 0.00 0.00 6.82 8.01 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 13 D 8.00 4.69 0.00 2.86 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.58 4.52 0.00 1.90 1.92 0.00 3.18 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.66 0.00 15 R 7.55 3.58 0.00 1.92 2.11 0.00 3.11 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 16 E 8.44 4.89 0.00 2.07 1.81 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 2.22 2.23 0.00 17 G 8.76 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.84 5.01 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 9.44 5.26 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 20 V 8.65 4.57 1.81 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 0.93 0.00 0.00 0.73 0.00 0.00 21 P 0.00 4.80 0.00 2.13 1.96 0.00 3.72 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.85 0.00 22 F 8.45 5.81 0.00 3.34 3.16 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 23 V 6.77 4.26 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 0.62 0.00 0.00 0.70 0.00 0.00 24 T 7.99 4.53 4.21 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 1.17 0.00 0.00 25 L 8.59 3.98 0.00 1.55 1.52 0.77 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 26 G 9.16 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.65 4.63 0.00 2.60 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.57 0.00 2.21 2.13 0.00 3.84 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 1.94 0.00 29 G 7.31 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 30 I 8.17 3.67 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.89 0.90 0.00 0.00 31 E 8.18 3.93 0.00 2.00 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 2.40 2.38 0.00 32 Q 8.03 3.99 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 33 S 8.32 4.04 0.00 4.01 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 34 L 7.97 4.00 0.00 1.91 1.69 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.96 3.97 0.00 2.01 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.64 7.81 36 I 8.04 3.68 2.03 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 1.51 0.81 0.89 0.00 0.00 37 I 8.06 3.64 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.85 0.00 0.00 38 D 8.35 4.39 0.00 2.81 2.75 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 0.00 0.00 0.00 0.00 39 T 8.06 3.88 4.44 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 1.26 0.00 0.00 40 L 8.26 4.02 0.00 1.78 1.74 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.88 3.66 1.88 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.03 0.82 0.00 0.00 42 D 8.19 4.36 0.00 2.75 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 43 A 8.34 4.26 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 44 G 7.74 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.86 4.28 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.72 4.63 0.00 2.53 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.57 4.70 1.14 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 0.00 0.00 0.00 0.00 0.00 48 L 8.86 4.89 0.00 1.52 1.45 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.88 5.18 0.00 2.23 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 0.00 2.61 2.55 0.00 50 L 9.60 4.87 0.00 1.50 1.39 0.85 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.45 4.53 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 0.00 0.00 0.00 52 V 8.24 4.65 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 0.89 0.00 0.00 0.83 0.00 0.00 53 P 0.00 4.21 0.00 1.34 1.11 0.00 3.56 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.89 0.00 54 F 8.73 5.49 0.00 2.85 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.31 3.86 0.00 3.58 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 6.05 4.53 0.00 2.23 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 0.00 0.00 0.00 0.00 57 P 0.00 3.39 0.00 2.40 2.11 0.00 3.60 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 2.03 2.07 0.00 58 L 7.75 4.15 0.00 1.81 1.88 1.06 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.65 4.85 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 60 D 8.05 4.85 0.00 2.89 2.57 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 0.00 0.00 0.00 0.00 61 G 8.33 3.99 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 62 P 0.00 4.27 0.00 2.28 2.35 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 63 T 7.95 3.87 4.27 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 1.29 0.00 0.00 64 I 7.72 3.89 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.93 1.14 0.00 0.00 65 Q 8.30 4.05 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 66 N 8.60 4.44 0.00 2.98 2.88 0.00 0.00 6.92 7.82 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 67 A 7.91 4.02 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 0.00 0.00 68 N 8.49 4.22 0.00 3.06 3.07 0.00 0.00 7.05 6.34 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 69 L 7.79 4.16 0.00 1.76 1.77 0.96 1.41 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 70 R 8.02 3.91 0.00 2.02 1.99 0.00 3.17 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 71 A 7.91 4.31 1.14 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 0.00 0.00 0.00 0.00 0.00 72 F 8.62 4.25 0.00 3.13 3.03 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 73 A 8.42 4.33 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 74 A 7.89 4.44 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.33 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 76 V 7.76 3.70 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 0.80 0.00 0.00 0.92 0.00 0.00 77 T 8.13 4.87 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 1.31 0.00 0.00 78 P 0.00 4.32 0.00 2.37 2.37 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 79 A 8.14 4.20 1.39 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 0.00 0.00 80 Q 8.07 4.03 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 81 C 8.20 4.04 0.00 3.03 2.76 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 82 F 8.30 4.28 0.00 3.24 3.02 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 83 E 8.11 4.06 0.00 2.22 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 2.36 2.54 0.00 84 M 8.23 4.04 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.56 0.00 85 L 8.42 3.92 0.00 1.81 1.72 0.43 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.04 4.00 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 87 I 7.66 3.82 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 0.91 0.00 0.00 88 I 8.15 3.75 1.99 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 1.40 1.15 0.91 0.00 0.00 89 R 7.99 3.94 0.00 1.78 2.14 0.00 3.30 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 90 E 8.18 4.08 0.00 2.12 1.99 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 2.34 2.62 0.00 91 K 7.50 4.44 0.00 1.71 1.53 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.55 7.81 92 H 7.78 4.74 0.00 3.09 3.18 0.00 5.66 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 93 P 0.00 4.39 0.00 2.16 2.17 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 94 T 7.63 4.33 4.19 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 1.19 0.00 0.00 95 I 7.55 3.77 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.87 0.84 0.00 0.00 96 P 0.00 4.30 0.00 1.48 0.49 0.00 3.54 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 1.62 1.69 0.00 97 I 9.37 4.69 1.86 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 1.11 0.79 0.91 0.00 0.00 98 G 9.31 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.87 5.33 0.00 1.69 1.62 0.88 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 L 9.04 5.05 0.00 1.85 1.79 0.80 0.68 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 0.00 101 M 9.28 4.77 0.00 1.67 1.73 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.67 0.00 102 Y 7.94 4.40 0.00 2.19 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 0.00 0.00 0.00 0.00 103 A 9.43 3.83 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 0.00 104 N 7.99 4.42 0.00 2.93 2.82 0.00 0.00 7.17 6.66 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 0.00 105 L 7.37 4.30 0.00 1.54 1.75 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.19 2.83 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 0.77 0.00 0.00 0.14 0.00 0.00 107 F 8.92 4.24 0.00 3.25 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 0.00 108 N 8.36 4.09 0.00 3.00 2.86 0.00 0.00 7.05 7.73 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 0.00 109 N 7.82 4.65 0.00 2.73 2.75 0.00 0.00 7.25 7.98 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 0.00 110 G 7.86 3.74 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 0.00 0.00 0.00 111 I 8.42 3.84 1.78 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 0.92 0.00 0.00 112 D 8.15 4.42 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.03 3.90 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.15 3.81 0.00 3.25 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 8.15 3.98 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.08 3.78 1.23 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 0.00 0.00 117 R 7.73 3.55 0.00 1.54 1.35 0.00 2.87 0.00 0.00 2.78 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 118 C 7.68 4.18 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.24 3.93 0.00 2.29 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 2.33 2.36 0.00 120 Q 7.91 4.05 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 121 V 7.70 4.02 2.16 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 0.91 0.00 0.00 1.19 0.00 0.00 122 G 7.76 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 0.00 123 V 7.79 3.90 2.28 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 0.90 0.00 0.00 0.95 0.00 0.00 124 D 9.29 5.08 0.00 2.76 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 0.00 125 S 8.02 5.29 0.00 3.87 4.11 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 0.00 126 V 8.77 4.76 2.45 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 1.01 0.00 0.00 1.15 0.00 0.00 127 L 9.21 4.79 0.00 1.62 1.41 0.65 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.98 4.22 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.76 0.00 0.00 129 A 8.53 3.77 0.55 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 0.00 0.00 0.00 0.00 0.00 0.00 130 D 7.49 4.67 0.00 2.76 2.76 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 0.00 131 V 7.11 4.03 1.67 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 0.57 0.00 0.00 0.21 0.00 0.00 132 P 0.00 4.57 0.00 2.49 2.15 0.00 3.71 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 2.14 1.97 0.00 133 V 8.23 3.50 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 0.59 0.00 0.00 0.90 0.00 0.00 134 E 8.24 4.10 0.00 1.91 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 2.31 2.46 0.00 135 E 7.96 4.66 0.00 1.90 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 2.25 2.42 0.00 136 S 7.98 4.56 0.00 4.38 4.45 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 0.00 137 A 8.18 3.84 1.33 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 0.00 0.00 138 P 0.00 4.17 0.00 2.02 2.26 0.00 3.72 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 2.04 2.06 0.00 139 F 8.19 4.06 0.00 3.37 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 0.00 140 R 8.48 3.90 0.00 2.08 2.39 0.00 2.68 0.00 0.00 2.77 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.56 0.00 141 Q 8.13 3.87 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 142 A 7.75 3.94 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 0.00 143 A 7.53 3.50 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 0.00 144 L 8.04 4.01 0.00 1.77 1.72 0.92 1.11 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 0.00 145 R 7.92 3.97 0.00 1.84 1.79 0.00 3.08 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 146 H 7.40 4.98 0.00 3.18 3.51 0.00 5.77 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 N 7.92 4.26 0.00 2.95 2.94 0.00 0.00 6.68 6.91 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 0.00 148 I 8.15 4.81 2.17 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 1.42 1.17 1.19 0.00 0.00 149 A 9.07 4.38 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.87 0.00 1.94 2.12 0.00 3.69 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 2.26 2.04 0.00 151 I 7.83 4.37 1.58 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.54 0.59 0.00 0.00 152 F 8.34 4.93 0.00 2.99 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 0.00 153 I 8.48 4.70 1.83 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.23 0.94 0.00 0.00 154 C 9.39 4.72 0.00 3.01 2.90 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 0.00 206 A 8.51 4.16 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 0.00 207 P 0.00 4.03 0.00 0.73 1.20 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.81 0.00 208 A 8.50 4.90 1.23 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 0.00 0.00 209 L 9.01 4.96 0.00 1.21 1.26 -0.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.13 4.29 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 211 G 8.97 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 *212 F 9.82 3.58 0.00 2.47 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 0.00 0.00 0.00 213 G 9.03 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 0.00 214 I 7.50 4.30 2.15 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 1.52 1.13 1.08 0.00 0.00 215 S 10.28 5.04 0.00 3.94 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 0.00 216 S 7.92 4.75 0.00 3.99 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 0.00 217 P 0.00 4.08 0.00 2.09 2.02 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 218 E 8.01 4.30 0.00 2.18 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 2.36 2.26 0.00 219 Q 8.20 4.06 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 220 V 7.54 3.58 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 1.13 0.00 0.00 0.87 0.00 0.00 221 S 8.08 4.10 0.00 4.08 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 0.00 222 A 8.46 3.99 1.39 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 0.00 0.00 223 A 7.99 3.91 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 0.00 224 V 7.78 3.91 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 1.28 0.00 0.00 1.02 0.00 0.00 225 R 8.15 3.92 0.00 1.94 2.09 0.00 3.31 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 226 A 7.79 4.18 1.39 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 0.00 0.00 227 G 7.42 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 0.00 228 A 8.11 4.21 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 A 8.88 4.18 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.02 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 A 8.35 5.20 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 232 I 8.75 4.64 1.53 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.36 1.00 0.00 0.00 233 S 9.04 4.74 0.00 4.30 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 0.00 234 G 8.76 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 0.00 235 S 8.01 4.70 0.00 3.99 4.07 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 0.00 236 A 8.50 3.89 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 0.00 237 I 7.81 3.60 2.15 0.00 0.00 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 1.74 1.40 0.96 0.00 0.00 238 V 7.85 3.68 2.30 0.00 0.00 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 1.15 0.00 0.00 239 K 8.18 3.97 0.00 1.92 1.79 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.72 7.81 240 I 7.34 3.63 1.94 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 1.32 0.35 0.88 0.00 0.00 241 I 7.60 3.82 2.05 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 1.40 0.90 0.96 0.00 0.00 242 E 8.17 3.91 0.00 2.01 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 2.33 2.38 0.00 243 K 8.20 4.22 0.00 1.87 1.84 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.68 7.81 244 N 7.75 5.04 0.00 2.81 2.92 0.00 0.00 6.83 6.76 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 0.00 245 L 8.22 3.97 0.00 1.63 1.74 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 246 A 8.06 4.04 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 0.00 247 S 7.89 4.56 0.00 4.05 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 0.00 248 P 0.00 4.24 0.00 2.18 2.30 0.00 3.60 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 249 K 7.95 4.01 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.49 7.81 250 Q 8.02 4.02 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 251 M 8.15 3.99 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 252 L 7.88 3.97 0.00 1.77 1.71 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 253 A 7.88 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 E 8.58 3.98 0.00 2.17 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 2.34 2.37 0.00 255 L 8.22 4.09 0.00 1.95 1.77 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 256 R 8.20 3.92 0.00 1.98 2.14 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 257 S 8.00 4.12 0.00 4.15 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 0.00 258 F 8.41 4.09 0.00 3.23 3.27 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 0.00 259 V 8.23 3.45 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 1.08 0.00 0.00 1.24 0.00 0.00 260 S 8.64 4.25 0.00 3.99 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 A 7.87 3.84 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 0.00 262 M 7.30 3.47 0.00 0.51 0.57 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 1.23 1.35 0.00 263 K 8.01 3.95 0.00 1.82 1.76 0.00 1.56 0.00 0.00 1.96 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.47 7.81 264 A 7.86 3.93 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 0.00 265 A 7.37 4.06 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 0.00 266 S 8.00 4.37 0.00 4.10 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 0.00 267 R 7.56 4.12 0.00 1.93 1.86 0.00 3.17 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 * Residues marked with a * may have inaccurate shift predictions.