NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2591 8.3049 120.3319 55.3343 32.6061 174.4513 2 V 4.1393 7.6272 118.6370 59.0864 35.4715 173.4289 3 Y 4.3547 9.0749 121.1189 56.4432 39.7815 175.7836 4 V 4.3623 8.0929 124.1359 61.6713 33.0498 173.9295 5 S 4.5650 9.1387 120.7606 57.6974 66.3322 174.9466 6 N 4.8346 8.4766 120.7002 51.8440 37.3113 173.3450 7 K 4.4222 7.0089 117.5596 55.2314 37.0045 175.6454 8 Y 4.4354 8.0652 118.1538 57.2021 38.8267 175.8130 9 L 4.5583 8.2869 124.8255 53.9956 42.9808 177.5634 10 T 4.1771 8.6096 112.8700 61.5383 70.8814 175.3863 11 M 4.1415 8.5329 120.4931 58.9333 31.6973 178.2496 12 S 4.2058 7.9936 112.9040 61.3837 62.8216 175.8351 13 E 3.7220 8.1900 121.3661 59.2829 29.0621 179.0914 14 M 4.0423 8.4852 119.3281 58.4066 32.0960 178.6500 15 K 4.2580 8.4446 119.6680 59.4814 32.3417 179.1032 16 V 3.6704 7.5495 117.3919 66.0880 31.5050 177.7922 17 N 4.3264 8.1724 115.6961 56.2996 38.3050 177.2866 18 A 3.6436 8.3205 122.4262 55.0845 18.2390 179.4983 19 Q 3.8900 8.0912 118.1230 59.2467 29.0619 177.8075 20 Y 3.9130 8.0247 120.5996 60.6806 38.8216 177.9872 21 I 3.6114 8.0320 120.8870 64.2680 37.1541 178.0540 22 L 3.8786 8.0825 121.2558 58.3781 41.7231 178.6721 23 N 4.2299 8.0188 115.0776 56.4173 38.5885 176.6162 24 Y 3.8092 7.7856 120.7060 60.7885 39.0584 177.9544 25 L 3.8657 8.2778 120.1667 57.5750 41.3562 179.6768 26 S 4.4319 8.0789 114.8666 61.6316 62.8049 176.4395 27 S 4.3534 7.7141 116.7503 60.1516 62.6142 174.4932 28 N 4.8486 7.9398 118.1208 53.0968 38.7506 175.9573 29 G 4.0515 8.5352 105.8127 45.2316 0.0000 174.5602 30 W 4.5830 8.1308 119.8274 56.2300 30.0693 176.4903 31 T 4.3465 8.4542 112.2273 60.8647 69.4408 175.7344 32 K 4.1016 8.7559 123.1983 59.8205 32.0972 179.0801 33 Q 3.9427 8.2481 117.7546 58.9654 28.7260 178.4919 34 A 3.7294 8.0205 121.7711 54.9804 18.3420 179.8457 35 I 3.9387 8.1303 118.4455 64.9920 37.2572 178.5632 36 C 4.6161 8.7513 117.9979 62.4829 27.4108 176.2347 37 G 3.9394 8.4275 109.1616 47.5316 0.0000 175.4282 38 M 3.2657 8.0446 120.2169 57.9458 32.2333 178.1447 39 L 3.9020 8.4591 119.7547 57.7618 41.7823 179.6565 40 G 3.8818 8.4336 105.6181 47.9328 0.0000 175.5526 41 N 4.4075 8.0051 118.1056 56.5879 38.8029 177.1011 42 M 4.0338 8.1710 120.3730 58.5822 31.9651 178.7810 43 Q 3.9951 8.2209 119.4814 59.4414 29.1063 178.5163 44 S 4.1959 7.4788 114.1516 61.4947 62.8672 176.3549 45 E 4.2557 8.2494 121.0078 58.8613 29.3725 178.4534 46 S 4.5841 7.9245 107.9678 57.5100 64.9940 173.5750 47 T 3.5337 8.6117 109.4678 63.8770 68.0220 171.7491 48 I 3.0943 7.7809 115.5961 63.8658 34.9775 174.4601 49 N 4.8338 7.7921 117.4757 51.0536 40.7361 172.9876 50 P 4.2129 0.0000 0.0000 64.6976 31.6420 177.7085 51 G 4.1379 8.0031 103.5474 45.7088 0.0000 173.2612 52 L 4.4276 7.2450 124.2134 54.1192 43.4287 175.6026 53 W 5.3395 9.4036 126.0937 54.7179 31.8873 175.7405 54 Q 4.2293 9.2446 124.8109 57.7902 29.0016 176.4253 55 N 4.2472 9.8391 119.0701 53.5967 36.7086 174.6660 56 L 4.0806 8.2789 115.9223 55.5511 40.0572 175.5499 57 D 4.5457 8.0959 121.2094 52.7247 39.1638 173.5196 58 E 2.5400 7.8219 122.3157 56.6441 30.1565 177.0821 59 G 3.2048 5.3800 114.6805 44.8339 0.0000 173.3089 60 N 4.4520 7.1194 118.4745 53.4404 37.3371 175.3093 61 T 4.2643 8.2822 122.3743 65.5451 68.8784 176.3148 62 S 4.4490 7.9574 114.7441 59.1662 63.8617 173.4419 63 L 4.8791 7.8176 122.1898 52.8517 44.9552 175.6901 64 G 4.6598 8.6833 106.1604 47.9132 0.0000 172.7770 65 F 4.9988 8.8125 123.9094 57.7915 43.4807 174.9365 66 G 3.5952 7.8181 111.4176 43.6647 0.0000 173.3918 67 L 3.7616 8.3227 117.9221 57.6286 41.5206 178.8073 68 V 3.8941 6.8673 107.4853 60.1149 32.4117 175.7283 69 Q 3.4039 7.4714 118.1660 56.1209 26.2847 173.9108 70 W 4.2100 8.4175 118.1799 57.5293 30.1139 176.2705 71 T 4.9239 8.4459 119.2948 60.9062 71.5995 172.2006 72 P 4.7484 0.0000 0.0000 62.2944 32.4790 177.0405 73 A 4.3343 9.4086 123.1706 55.6225 18.2232 180.2332 74 S 3.9957 8.2642 112.6173 62.2142 62.1601 176.7308 75 N 4.3196 8.2227 119.1786 55.9604 38.0689 176.3491 76 Y 4.2425 8.1074 120.3319 59.7224 39.2638 177.5887 77 I 3.1992 7.3814 120.2588 64.2558 36.9902 177.9697 78 N 4.2187 8.0931 117.3208 55.8522 38.2941 177.3218 79 W 3.9130 7.7785 131.3277 59.5689 30.6861 177.8085 80 A 3.3175 7.8443 120.7947 55.2674 17.3799 179.3745 81 N 4.1650 7.7109 114.5564 56.2850 38.2720 177.5491 82 S 4.1666 7.4225 113.9102 60.3604 63.1460 175.4593 83 Q 4.1968 7.0616 119.0487 54.6831 28.7864 175.5692 84 G 3.7733 7.2537 106.8453 46.6750 0.0000 173.6142 85 L 4.7009 7.7100 119.2681 51.3604 43.9863 175.1641 86 P 4.4615 0.0000 0.0000 62.7453 32.0429 176.1684 87 Y 4.3422 8.6027 119.5371 59.0449 38.6411 176.4018 88 K 4.2675 6.8145 122.4382 53.7414 30.8948 174.6577 89 N 4.7332 7.8216 117.6826 50.9688 43.1815 172.7913 90 M 3.8542 8.7143 127.8571 59.1701 32.2831 177.9479 91 D 4.0895 8.1231 117.9476 57.5807 41.1417 178.8639 92 S 4.4088 8.3785 115.4873 61.9414 62.8442 176.7890 93 E 3.6858 8.3115 121.0788 59.1581 29.0914 179.3717 94 L 3.9733 7.9487 119.2154 57.6940 41.5412 179.6983 95 K 4.2449 8.6913 118.8942 59.1439 31.9082 179.5223 96 R 2.8579 8.0167 119.3747 59.0839 30.0441 178.4877 97 I 4.1291 7.9925 119.6690 64.6783 37.1745 178.4471 98 I 3.9400 8.2218 120.6711 64.2835 36.8689 178.0828 99 W 4.3022 8.8191 129.5858 60.7421 30.3443 177.7946 100 E 4.2423 9.0860 118.8343 59.3839 28.7746 179.3138 101 V 3.0918 7.2308 116.5894 66.0711 31.6568 177.6074 102 N 4.5332 7.9211 113.1156 54.7702 38.3191 175.3274 103 N 4.5590 7.0806 115.1422 52.7324 40.5561 174.6441 104 N 3.9916 7.9326 114.1279 54.4952 37.1429 173.4280 105 A 4.5154 8.1008 123.4040 52.3526 20.9085 177.3833 106 Q 3.8038 9.0401 126.1986 56.7868 28.6227 174.2616 107 W 4.0478 8.1262 125.6027 57.4349 31.1112 174.7056 108 I 4.4499 7.8043 126.1264 59.3786 38.8169 175.0864 109 N 4.9709 8.7269 124.1866 53.2091 36.9483 174.0392 110 L 4.6198 7.7690 120.9742 54.2801 42.7004 177.3175 111 R 4.5754 7.4055 117.3701 55.8780 31.9025 174.2344 112 D 4.3588 8.4460 112.2460 54.4639 39.2658 173.4893 113 M 4.5871 8.6468 114.1478 54.0633 36.4841 174.8295 114 T 4.3676 8.8850 117.9737 60.6755 71.6517 175.6179 115 F 2.7954 7.4720 122.3464 61.0663 39.0496 177.1707 116 K 3.7532 7.6877 116.1950 59.3713 31.9768 178.7276 117 E 4.0201 7.9503 118.5337 59.1988 29.2259 178.6729 118 Y 3.9700 7.6892 119.9155 60.6701 38.9712 178.3274 119 I 3.2055 7.4157 112.4025 62.7006 37.6166 177.1786 120 K 4.2532 7.2045 118.8720 56.2136 32.4819 176.6746 121 S 4.2328 7.4565 114.7131 58.3423 62.7607 173.4572 122 T 4.4606 8.0973 120.2210 61.5711 67.4182 174.2018 123 K 4.1562 7.6700 119.4549 55.5934 32.8888 177.4542 124 T 3.9135 8.2658 110.6293 61.1671 70.4768 173.5500 125 P 4.2007 0.0000 0.0000 65.8652 31.4672 178.7174 126 R 4.0329 8.2206 117.3022 59.7154 29.9937 178.3558 127 E 4.0257 8.0256 117.6261 59.5123 29.5037 179.4692 128 L 4.2569 8.1541 118.7392 57.7297 41.6023 179.1520 129 A 4.4095 8.4530 122.5489 55.1227 18.4089 179.6625 130 M 4.0859 8.0556 116.3946 58.2034 32.0047 179.1444 131 I 3.8057 8.0486 120.4060 64.0947 37.2775 178.1181 132 F 3.5763 8.9401 121.9376 60.8811 39.2440 176.7177 133 L 3.9154 8.3136 120.0361 58.4476 41.6812 179.0162 134 A 4.0670 7.5930 118.5931 54.3955 18.4502 179.1217 135 S 3.8389 7.4039 114.5988 59.4146 63.0557 175.8074 136 Y 3.4749 6.5675 120.8023 59.5250 39.0577 176.4298 137 E 3.9194 7.8663 117.1268 58.7422 30.4949 177.1326 138 R 3.5655 7.9168 115.1222 56.5452 27.7984 173.8352 139 P 4.5044 0.0000 0.0000 61.7129 33.0661 177.1304 140 A 3.9873 8.5451 121.9310 54.3756 18.4476 177.4375 141 N 4.8323 7.9396 114.3966 51.3456 39.9935 172.6282 142 P 4.4747 0.0000 0.0000 64.2767 32.2830 176.5238 143 N 4.6870 8.0167 117.9643 52.0178 37.4662 174.5682 144 Q 4.8220 7.9076 122.4838 51.7885 29.7866 174.7066 145 P 4.4187 0.0000 0.0000 65.0690 31.3883 178.2260 146 E 4.2809 8.1430 118.8666 58.8544 29.2845 179.0015 147 R 4.2261 7.9484 119.1535 59.3014 30.1173 179.1188 148 G 3.6659 8.1914 105.4605 47.8105 0.0000 175.5878 149 D 4.4090 8.0369 120.7740 57.2886 40.8946 178.7281 150 Q 3.8936 8.4820 118.6749 58.7723 28.6888 178.4685 151 A 4.4064 8.2363 121.8213 55.6126 18.3919 179.6406 152 E 4.0384 8.4477 116.9514 59.4331 29.4411 178.7063 153 Y 3.8952 8.2911 119.9812 60.7472 38.8136 178.5598 154 W 4.4934 8.3831 119.7724 59.9270 28.9204 177.8718 155 Y 4.1665 8.2923 118.9404 60.5797 38.2712 177.9280 156 K 4.0447 8.2118 119.6841 59.0890 32.5278 177.8071 157 N 4.5578 7.9305 113.3113 52.3222 39.2948 174.9121 158 L 4.6733 7.3740 120.8712 53.3588 43.3999 176.5708 159 S 4.6457 8.6494 117.7411 57.6448 65.6423 176.0207 160 G 3.2562 8.5599 103.9559 46.2017 0.0000 175.6366 *166 L 4.2859 8.9357 118.7091 54.6161 44.4375 177.0297 167 Q 4.7093 8.5172 120.4213 55.4005 30.5079 174.8219 168 L 4.7199 9.2285 125.2905 54.5386 43.3743 176.2985 169 A 4.5147 9.0572 128.6188 52.0084 19.2169 175.9937 170 Q 4.9015 8.9845 124.4695 55.1020 29.7078 174.8871 171 F 4.0619 9.3397 129.2679 58.0485 40.0188 174.3019 172 P 4.3138 0.0000 0.0000 64.0669 31.3672 175.8322 173 M 4.8308 5.9656 115.8779 53.6817 34.1068 175.0546 174 D 4.8637 8.7054 121.9738 54.2174 40.8987 175.5066 175 I 5.1239 7.7768 119.1441 59.7749 41.4372 174.7660 176 I 4.3978 8.6666 126.4105 59.6465 39.6945 174.6128 177 N 5.1593 8.8513 126.1904 52.0599 41.5646 172.5679 178 I 4.6435 9.0879 128.5923 60.4539 37.6125 176.2882 179 S 4.5554 8.6920 121.8129 59.6081 64.7087 174.6096 180 Q 4.3373 7.7841 121.8205 55.3425 32.1942 174.2519 181 G 4.0456 8.5219 117.2758 44.3406 0.0000 172.0186 182 E 4.2752 8.8442 119.2578 57.3630 29.8034 176.4682 183 N 4.4056 8.9496 118.6687 53.9700 37.2441 174.8879 184 G 3.8400 7.7958 107.4048 45.8334 0.0000 175.6632 185 S 4.2810 8.6111 117.1949 60.3744 63.8273 175.5988 186 F 4.4499 8.4246 123.1092 60.8600 39.1890 176.5145 187 S 4.6159 8.5627 108.7881 59.3107 64.8719 173.8160 188 H 4.9795 8.4342 116.7906 55.6523 29.4138 173.7583 189 K 4.1513 8.2868 120.9093 58.0569 31.9868 177.8894 190 G 4.1897 9.1606 111.4476 46.4906 0.0000 172.8056 191 T 4.9711 7.6549 108.9283 59.1523 71.2036 174.2220 192 L 4.4181 9.1711 120.7856 54.8749 42.1133 177.0048 193 C 4.5243 7.6674 116.5184 59.8708 29.6063 172.9410 194 I 4.7743 8.2059 121.4012 59.7969 41.3372 173.9747 195 D 5.2474 9.1671 127.1017 53.3516 42.5698 175.5093 196 F 5.5423 9.5685 122.0781 55.8461 42.3697 174.7851 197 V 4.8224 8.9293 115.7708 59.8549 34.3150 176.6185 198 G 3.7618 8.4440 111.9382 44.3399 0.0000 173.3467 199 K 3.8823 6.7600 117.7905 58.7531 32.0571 176.9907 200 T 4.7589 7.1928 105.6313 58.9883 71.9921 172.9544 201 E 4.3828 9.1635 120.5529 56.7693 30.3408 177.8155 202 K 4.4457 8.9148 117.1925 57.1521 31.7974 173.2489 203 Y 4.6796 8.7217 125.3331 56.3051 41.0326 173.8259 204 P 4.3106 0.0000 0.0000 62.4078 32.8703 174.5898 205 Y 4.5995 7.0232 117.5268 55.5963 41.5000 173.3026 206 Y 5.0651 8.1176 116.9796 55.4529 42.7647 174.8192 207 A 4.1704 8.9168 123.7373 51.7409 18.9259 177.0756 208 P 4.7187 0.0000 0.0000 64.7127 32.7945 175.3963 209 C 5.0230 7.6046 113.0764 57.3685 32.2729 173.1581 210 D 4.8831 8.4743 119.3498 54.9955 41.4518 175.7667 211 C 5.6212 9.2288 117.2900 57.8008 33.8996 172.5370 212 T 5.2809 8.8211 108.5794 60.0135 72.2311 172.4552 213 C 3.8458 8.6112 124.3657 58.7634 32.1455 174.0101 214 V 4.3217 8.1981 118.4557 60.9167 33.3185 175.4236 215 W 4.6650 7.2628 129.0768 56.0341 34.1417 172.8926 216 R 4.6771 7.4916 125.0741 54.4745 32.4977 174.2677 217 G 3.4190 8.0649 114.3446 44.5891 0.0000 173.8231 218 D 4.2923 8.6614 126.9694 56.9813 41.2649 178.1278 219 A 4.4845 7.8345 118.4402 52.5759 18.2025 177.7998 220 S 4.4463 7.5948 108.9920 58.1332 66.7697 173.6305 221 A 3.8409 7.7221 123.6608 53.7025 16.3149 175.4966 222 Y 5.7303 7.7505 119.2970 55.0405 42.6700 176.2644 223 L 5.3296 9.4618 119.5540 53.0781 45.4874 175.4111 224 A 5.2806 8.9983 125.3008 50.2046 21.5578 175.7421 225 W 5.1235 8.8271 120.3297 54.9242 33.7469 174.3577 226 T 4.8893 8.4883 116.8037 59.7696 70.3213 173.5402 227 S 4.9202 9.3220 123.9043 58.5911 63.6662 175.1410 228 D 4.4706 9.0482 124.1312 56.9881 40.7412 176.4739 229 K 4.7540 7.3496 112.9614 53.9421 36.3210 175.5244 230 E 3.7274 7.7504 119.0421 56.9223 30.0861 176.8899 231 V 4.5323 8.5255 121.7540 61.1177 35.9527 173.7753 232 M 4.3687 8.7218 124.8884 54.9174 33.1954 175.6086 233 C 4.7910 8.9206 124.1502 58.5740 29.8738 174.6245 234 A 4.1824 8.4761 122.7212 54.8025 18.2572 178.3203 235 D 4.5062 8.0076 113.2091 53.6691 39.7079 178.1436 236 G 3.8725 8.2365 108.8819 45.0304 0.0000 174.0317 237 S 4.4825 8.1897 114.9233 57.5408 65.1377 173.2742 238 V 5.1141 7.9306 121.1220 60.5507 33.2022 174.6793 239 R 4.5226 7.9115 121.6350 55.6250 32.4330 173.5612 240 Y 4.7701 8.4730 117.8040 57.9464 39.6489 174.6233 241 I 5.2869 8.9896 114.2790 59.6266 41.5577 174.0033 242 T 5.2079 8.8781 118.1384 60.2835 70.9900 172.4436 243 W 5.8137 8.7534 123.7789 55.1022 32.3105 173.6477 244 V 5.3555 9.1180 118.7857 60.1653 34.2135 174.1907 245 N 6.2309 9.9483 121.2645 51.8441 41.3053 174.1133 246 V 5.2182 9.3149 122.3138 61.7319 35.0522 176.1107 247 H 5.2616 9.6334 118.2212 56.5533 27.5739 175.1299 248 E 4.4766 8.2854 120.8214 56.3533 30.4662 175.6653 249 S 4.7578 8.2863 119.7493 56.4390 66.7392 172.4399 250 P 4.7153 0.0000 0.0000 61.6961 31.8913 176.1303 251 L 4.1436 8.2216 120.6883 54.3062 41.9489 176.0976 252 P 4.0419 0.0000 0.0000 64.8390 31.4918 175.9759 253 F 5.1588 7.7547 114.8869 55.5050 43.1447 172.7781 254 D 4.9420 8.2558 120.1926 50.8809 41.9127 175.9024 255 V 3.5348 7.8596 113.1000 63.0150 31.7411 176.6545 256 G 3.9403 9.1260 113.3644 44.8855 0.0000 173.9729 257 K 3.8126 7.6709 121.5437 57.1500 33.1159 175.4689 258 K 5.1098 8.6153 125.9282 54.6986 34.2615 175.3835 259 L 4.8041 8.9204 124.6752 52.8808 44.7788 176.0872 260 K 4.7624 8.8691 121.8007 54.7763 34.2110 176.3557 261 K 3.9389 8.8029 123.9088 58.6992 32.3101 177.1921 262 G 3.9764 9.2165 115.1956 45.3544 0.0000 173.6109 263 D 4.5148 8.0447 120.2894 53.5732 41.4112 175.6002 264 L 3.8817 8.6310 124.4481 56.0124 42.4117 175.9771 265 M 4.3709 7.7354 125.7285 56.8930 34.4630 175.3213 266 G 3.5805 5.9258 102.2617 44.1773 0.0000 171.8278 267 H 5.1167 7.9454 115.9470 53.6689 33.1477 173.9387 268 T 4.3945 9.0929 112.6368 62.9198 70.1812 173.3243 269 G 4.4904 8.2209 106.5535 46.3685 0.0000 173.9950 270 I 4.6406 8.6168 114.7983 60.3935 38.8802 176.1609 271 G 3.9143 8.1916 111.7145 47.3913 0.0000 176.0762 272 G 4.1355 9.0033 113.4611 46.1878 0.0000 173.9618 *276 G 3.7116 7.6919 106.1529 44.6702 0.0000 171.5907 277 D 4.8575 8.4684 119.7521 54.8880 42.3757 174.8272 278 H 4.9031 8.9791 120.3156 55.1310 32.9536 172.0123 279 W 5.3783 9.5861 128.8670 56.0053 33.3283 173.3776 280 H 5.3825 9.3136 127.8888 55.0124 31.0548 173.4001 281 F 5.6330 8.6998 127.7024 55.5775 42.7298 173.2807 282 N 5.1435 8.4492 122.8805 52.1718 42.5806 173.1253 283 V 5.1958 8.2654 124.8061 59.8444 35.1357 174.3133 284 I 4.9835 9.1298 116.0803 58.7286 41.2478 174.0490 285 D 4.5564 8.5778 123.3064 55.5908 41.8041 176.6203 286 G 3.9244 8.9777 111.6553 45.1048 0.0000 173.1827 287 K 4.2691 8.1220 115.1435 56.2272 32.6550 175.9896 288 E 4.4679 7.6890 119.0088 54.5972 30.3536 174.9809 289 Y 4.1953 8.4164 125.9871 57.7821 39.3885 175.9747 290 Q 4.0075 7.0409 125.8107 55.2543 31.3243 177.3252 291 G 3.2149 5.6148 106.5612 46.1153 0.0000 173.3037 292 W 5.0682 8.4478 121.9516 55.2002 33.2402 174.2248 293 T 4.7699 9.3078 115.7391 60.9245 71.1626 172.2212 294 K 5.0822 8.2798 121.6800 54.7661 35.2231 177.2991 295 K 4.4017 8.2465 117.3326 57.0782 35.1178 175.7220 296 P 4.4695 0.0000 0.0000 64.0998 31.7429 175.5401 297 D 4.9400 7.7095 119.5211 52.6596 43.6867 175.7796 298 S 4.8689 8.5507 116.7562 59.1052 63.6946 173.5168 299 C 4.7517 9.1393 118.1489 57.0376 33.4279 172.9543 300 L 3.6917 7.7787 118.7780 54.3071 41.6338 177.4738 301 A 3.9199 8.1609 125.0276 52.5606 19.3163 177.7980 302 G 3.5337 8.5225 104.2958 44.0830 0.0000 173.2380 303 T 4.2796 8.1866 111.7479 60.2067 69.8945 174.2672 304 E 4.3986 8.5734 127.1131 56.3488 30.6261 176.2606 305 L 4.6869 8.0985 123.1412 52.7761 45.2710 176.1303 306 H 3.9021 8.0755 118.3554 55.2852 29.3325 176.8448 307 I 3.8551 8.1237 125.3708 64.5839 37.1788 177.5221 308 Y 4.2095 6.6748 116.1120 58.5911 38.5911 176.1841 309 D 4.4561 7.2802 120.7459 56.7273 41.8127 178.7900 310 V 3.2539 7.7277 118.9730 65.0045 31.6646 175.4251 311 F 5.3399 8.1057 117.2856 55.5402 40.6320 175.6165 312 A 4.7317 9.0496 128.7374 52.2574 19.1642 178.1323 313 V 4.7198 8.4849 114.2955 60.5365 32.4238 175.8003 314 N 4.3266 8.5311 116.2927 55.4852 38.7105 174.6047 315 N 4.2152 8.7991 118.9229 54.4336 36.3979 173.7851 316 V 4.5583 7.3941 116.4645 61.0347 33.9213 174.4898 317 E 4.2252 9.1043 129.6173 55.4635 30.6322 175.0039 318 I 4.1356 8.2887 128.7141 60.3641 37.8735 174.3952 319 I 4.1182 8.4939 131.0307 62.7703 39.6283 175.7009 320 N 4.4097 8.1300 117.8581 54.2434 41.0138 175.5118 321 G 3.8944 8.8533 117.9316 43.0808 0.0000 171.4295 322 N 3.8626 10.1985 116.6215 53.5400 38.4547 174.2920 323 G 3.7905 7.6695 101.1022 46.0689 0.0000 173.8815 324 Y 3.9486 6.5901 116.6308 57.6581 38.6737 176.3304 325 D 4.4874 6.9020 121.7239 52.9966 39.8098 176.1030 326 W 4.6453 7.3855 120.6974 56.8137 30.4244 177.1896 327 K 4.7968 8.7746 121.6889 55.8327 35.7486 175.2550 328 T 4.9041 8.5272 116.3980 61.4342 68.9807 173.6091 329 S 4.7588 9.1570 118.4557 56.7845 65.4435 173.0593 330 D 4.9348 8.5891 124.9060 53.8023 41.5337 176.0812 331 W 4.3099 8.0588 127.5697 56.8276 31.2934 174.8969 332 Q 4.5135 7.4708 124.2545 53.8058 29.9231 175.4697 333 D 4.6997 7.9738 122.0999 54.8107 41.6719 176.6662 334 G 4.2023 8.6846 109.4266 46.2230 0.0000 173.6461 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 8.30 4.26 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 2 V 7.63 4.14 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.62 0.00 0.00 3 Y 9.07 4.35 0.00 2.90 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 4 V 8.09 4.36 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 0.83 0.00 0.00 0.83 0.00 0.00 5 S 9.14 4.57 0.00 3.98 3.83 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 6 N 8.48 4.83 0.00 2.96 2.91 0.00 0.00 6.77 6.68 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 7 K 7.01 4.42 0.00 1.69 1.62 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.46 7.81 8 Y 8.07 4.44 0.00 2.99 2.90 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 9 L 8.29 4.56 0.00 1.64 1.48 1.00 0.64 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 10 T 8.61 4.18 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 1.23 0.00 0.00 11 M 8.53 4.14 0.00 2.18 2.09 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 2.77 2.67 0.00 12 S 7.99 4.21 0.00 3.95 3.83 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 13 E 8.19 3.72 0.00 1.74 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 1.47 2.00 0.00 14 M 8.49 4.04 0.00 2.29 2.56 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.76 0.00 15 K 8.44 4.26 0.00 2.34 2.17 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.60 1.74 7.81 16 V 7.55 3.67 2.55 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 1.17 0.00 0.00 17 N 8.17 4.33 0.00 2.98 2.79 0.00 0.00 6.97 6.64 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 18 A 8.32 3.64 0.44 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 19 Q 8.09 3.89 0.00 2.35 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 20 Y 8.02 3.91 0.00 3.18 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 21 I 8.03 3.61 1.91 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.77 0.72 0.00 0.00 22 L 8.08 3.88 0.00 1.74 1.80 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.02 4.23 0.00 2.68 2.74 0.00 0.00 7.07 8.21 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 24 Y 7.79 3.81 0.00 2.75 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 25 L 8.28 3.87 0.00 1.51 0.99 -0.13 0.19 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 26 S 8.08 4.43 0.00 3.94 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 27 S 7.71 4.35 0.00 3.72 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 28 N 7.94 4.85 0.00 2.85 2.97 0.00 0.00 7.04 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 29 G 8.54 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 W 8.13 4.58 0.00 3.41 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 31 T 8.45 4.35 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 32 K 8.76 4.10 0.00 1.95 2.10 0.00 1.65 0.00 0.00 1.50 0.00 0.00 2.72 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.77 1.62 7.81 33 Q 8.25 3.94 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.12 0.00 34 A 8.02 3.73 1.11 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 0.00 0.00 35 I 8.13 3.94 2.13 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 1.53 0.99 0.88 0.00 0.00 36 C 8.75 4.62 0.00 3.25 3.46 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 37 G 8.43 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 38 M 8.04 3.27 0.00 2.15 1.67 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.28 0.00 39 L 8.46 3.90 0.00 1.83 1.32 0.76 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.43 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 41 N 8.01 4.41 0.00 2.77 2.93 0.00 0.00 7.12 7.66 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 42 M 8.17 4.03 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 43 Q 8.22 4.00 0.00 2.46 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 44 S 7.48 4.20 0.00 4.16 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 45 E 8.25 4.26 0.00 2.01 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 0.00 2.56 2.55 0.00 46 S 7.92 4.58 0.00 3.93 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 47 T 8.61 3.53 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 1.37 0.00 0.00 48 I 7.78 3.09 1.76 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.41 0.71 0.00 0.00 49 N 7.79 4.83 0.00 2.66 2.66 0.00 0.00 7.29 7.13 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 50 P 0.00 4.21 0.00 2.11 1.98 0.00 3.67 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 51 G 8.00 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 52 L 7.24 4.43 0.00 1.58 1.35 0.51 1.06 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 53 W 9.40 5.34 0.00 3.53 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 54 Q 9.24 4.23 0.00 2.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.07 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 55 N 9.84 4.25 0.00 2.99 2.96 0.00 0.00 7.06 7.85 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 56 L 8.28 4.08 0.00 1.88 1.87 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 57 D 8.10 4.55 0.00 2.73 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 58 E 7.82 2.54 0.00 1.73 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 59 G 5.38 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 0.00 0.00 0.00 60 N 7.12 4.45 0.00 2.94 2.86 0.00 0.00 7.07 7.35 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 61 T 8.28 4.26 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 1.23 0.00 0.00 62 S 7.96 4.45 0.00 4.01 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 63 L 7.82 4.88 0.00 1.88 1.82 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.68 4.66 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 0.00 0.00 0.00 65 F 8.81 5.00 0.00 2.35 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 66 G 7.82 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 0.00 0.00 0.00 67 L 8.32 3.76 0.00 1.51 1.57 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 68 V 6.87 3.89 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 0.45 0.00 0.00 -0.74 0.00 0.00 69 Q 7.47 3.40 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.56 0.00 70 W 8.42 4.21 0.00 3.56 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 71 T 8.45 4.92 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 72 P 0.00 4.75 0.00 2.39 2.37 0.00 3.78 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 2.38 2.02 0.00 73 A 9.41 4.33 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.26 4.00 0.00 4.06 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 75 N 8.22 4.32 0.00 2.91 3.00 0.00 0.00 6.60 7.23 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 76 Y 8.11 4.24 0.00 1.97 2.67 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 77 I 7.38 3.20 1.58 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.86 0.31 0.00 0.00 78 N 8.09 4.22 0.00 2.79 2.80 0.00 0.00 6.70 7.28 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 79 W 7.78 3.91 0.00 3.21 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 80 A 7.84 3.32 1.11 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 0.00 0.00 81 N 7.71 4.17 0.00 2.62 2.77 0.00 0.00 6.88 6.86 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 82 S 7.42 4.17 0.00 3.91 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 83 Q 7.06 4.20 0.00 1.36 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.66 0.00 0.00 0.00 0.00 0.00 1.29 1.16 0.00 84 G 7.25 3.77 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 0.00 0.00 0.00 85 L 7.71 4.70 0.00 1.51 1.55 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.46 0.00 2.15 2.04 0.00 3.77 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 87 Y 8.60 4.34 0.00 2.83 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 88 K 6.81 4.27 0.00 0.82 1.48 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.57 7.81 89 N 7.82 4.73 0.00 2.75 2.77 0.00 0.00 6.67 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 90 M 8.71 3.85 0.00 1.95 1.85 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.40 0.00 91 D 8.12 4.09 0.00 3.06 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 92 S 8.38 4.41 0.00 4.14 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 0.00 93 E 8.31 3.69 0.00 2.16 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 1.47 2.38 0.00 94 L 7.95 3.97 0.00 1.25 1.32 0.47 0.69 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 95 K 8.69 4.24 0.00 2.32 2.33 0.00 1.87 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.74 1.70 7.81 96 R 8.02 2.86 0.00 0.92 1.65 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.77 0.00 97 I 7.99 4.13 2.15 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 1.83 1.47 1.31 0.00 0.00 98 I 8.22 3.94 2.11 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.13 1.10 0.00 0.00 99 W 8.82 4.30 0.00 3.71 3.28 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 0.00 100 E 9.09 4.24 0.00 2.70 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 2.89 3.04 0.00 101 V 7.23 3.09 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 0.41 0.00 0.00 -0.35 0.00 0.00 102 N 7.92 4.53 0.00 2.61 2.76 0.00 0.00 6.90 7.44 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 0.00 103 N 7.08 4.56 0.00 1.59 2.09 0.00 0.00 7.11 7.88 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 0.00 104 N 7.93 3.99 0.00 2.73 2.95 0.00 0.00 7.08 7.96 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 0.00 105 A 8.10 4.52 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 9.04 3.80 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 107 W 8.13 4.05 0.00 3.10 2.90 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 0.00 108 I 7.80 4.45 1.66 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 1.14 0.60 0.84 0.00 0.00 109 N 8.73 4.97 0.00 2.89 2.85 0.00 0.00 7.05 7.78 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 0.00 110 L 7.77 4.62 0.00 1.66 1.56 0.83 0.71 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 0.00 111 R 7.41 4.58 0.00 1.78 1.89 0.00 3.53 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 112 D 8.45 4.36 0.00 2.79 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 M 8.65 4.59 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 114 T 8.88 4.37 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 1.28 0.00 0.00 115 F 7.47 2.80 0.00 2.35 2.54 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 0.00 116 K 7.69 3.75 0.00 1.64 1.73 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.36 7.81 117 E 7.95 4.02 0.00 2.16 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 2.29 2.26 0.00 118 Y 7.69 3.97 0.00 2.89 2.93 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 0.00 119 I 7.42 3.21 0.56 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.24 -0.19 0.00 0.00 120 K 7.20 4.25 0.00 1.72 1.80 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.40 7.81 121 S 7.46 4.23 0.00 3.83 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.10 4.46 4.23 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 1.19 0.00 0.00 123 K 7.67 4.16 0.00 1.77 1.74 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.38 7.81 124 T 8.27 3.91 4.37 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 1.17 0.00 0.00 125 P 0.00 4.20 0.00 2.17 2.18 0.00 3.58 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.53 0.00 126 R 8.22 4.03 0.00 2.00 1.94 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 1.66 1.71 0.00 127 E 8.03 4.03 0.00 2.28 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 0.00 2.35 2.36 0.00 128 L 8.15 4.26 0.00 1.90 1.93 0.72 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.45 4.41 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.06 4.09 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.03 0.00 131 I 8.05 3.81 2.30 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.85 1.21 0.00 0.00 132 F 8.94 3.58 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 0.00 133 L 8.31 3.92 0.00 2.05 1.85 0.93 1.38 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 0.00 134 A 7.59 4.07 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 0.00 135 S 7.40 3.84 0.00 2.72 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 0.00 136 Y 6.57 3.47 0.00 1.61 1.43 0.00 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 4.42 0.00 2.26 2.31 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 146 E 8.14 4.28 0.00 2.16 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 0.00 2.37 2.20 0.00 147 R 7.95 4.23 0.00 1.98 2.09 0.00 3.16 0.00 0.00 3.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 148 G 8.19 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 0.00 149 D 8.04 4.41 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.48 3.89 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 151 A 8.24 4.41 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.45 4.04 0.00 2.20 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 2.54 2.48 0.00 153 Y 8.29 3.90 0.00 2.87 2.78 0.00 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0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.52 4.71 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.09 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 168 L 9.23 4.72 0.00 1.93 1.88 1.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 169 A 9.06 4.51 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 0.00 170 Q 8.98 4.90 0.00 2.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 171 F 9.34 4.06 0.00 3.43 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 0.00 172 P 0.00 4.31 0.00 0.88 1.54 0.00 2.20 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.18 0.00 173 M 5.97 4.83 0.00 2.46 1.77 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.74 0.00 174 D 8.71 4.86 0.00 2.86 2.95 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 0.00 175 I 7.78 5.12 1.84 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 1.29 0.56 0.87 0.00 0.00 176 I 8.67 4.40 1.37 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 0.09 0.18 0.54 0.00 0.00 177 N 8.85 5.16 0.00 2.79 2.88 0.00 0.00 7.11 7.71 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 0.00 178 I 9.09 4.64 1.96 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.89 0.95 0.00 0.00 179 S 8.69 4.56 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 0.00 180 Q 7.78 4.34 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 181 G 8.52 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.84 4.28 0.00 2.01 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 2.28 2.11 0.00 183 N 8.95 4.41 0.00 2.93 2.92 0.00 0.00 6.95 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.80 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 S 8.61 4.28 0.00 4.05 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 0.00 186 F 8.42 4.45 0.00 2.97 3.28 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 0.00 187 S 8.56 4.62 0.00 3.89 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 0.00 188 H 8.43 4.98 0.00 3.47 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 K 8.29 4.15 0.00 1.88 1.76 0.00 1.85 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.67 7.81 190 G 9.16 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 0.00 0.00 0.00 0.00 191 T 7.65 4.97 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 1.35 0.00 0.00 192 L 9.17 4.42 0.00 1.53 1.49 0.52 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 193 C 7.67 4.52 0.00 2.43 2.42 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 0.00 194 I 8.21 4.77 1.61 0.00 0.00 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 1.28 0.70 0.29 0.00 0.00 195 D 9.17 5.25 0.00 2.56 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 0.00 196 F 9.57 5.54 0.00 3.18 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 0.00 197 V 8.93 4.82 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 0.85 0.00 0.00 1.02 0.00 0.00 198 G 8.44 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 0.00 0.00 0.00 199 K 6.76 3.88 0.00 1.42 1.77 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.24 1.05 7.81 200 T 7.19 4.76 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 1.28 0.00 0.00 201 E 9.16 4.38 0.00 2.03 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 2.38 2.32 0.00 202 K 8.91 4.45 0.00 1.85 2.02 0.00 1.60 0.00 0.00 1.47 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.29 7.81 203 Y 8.72 4.68 0.00 3.40 2.97 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 0.00 204 P 0.00 4.31 0.00 1.18 1.35 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 1.40 1.56 0.00 205 Y 7.02 4.60 0.00 1.96 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 0.00 206 Y 8.12 5.07 0.00 2.80 2.86 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 0.00 0.00 0.00 207 A 8.92 4.17 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 0.00 208 P 0.00 4.72 0.00 2.25 2.04 0.00 3.80 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.55 0.00 209 C 7.60 5.02 0.00 3.07 3.04 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 0.00 210 D 8.47 4.88 0.00 2.79 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 0.00 211 C 9.23 5.62 0.00 3.29 3.39 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 0.00 212 T 8.82 5.28 4.23 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 1.31 0.00 0.00 213 C 8.61 3.85 0.00 1.23 2.33 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 0.00 214 V 8.20 4.32 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 0.77 0.00 0.00 215 W 7.26 4.66 0.00 2.80 2.38 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 0.00 216 R 7.49 4.68 0.00 1.57 1.42 0.00 3.13 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.47 0.00 217 G 8.06 3.42 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 0.00 218 D 8.66 4.29 0.00 2.67 2.67 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 0.00 219 A 7.83 4.48 1.26 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 0.00 0.00 220 S 7.59 4.45 0.00 3.99 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 7.72 3.84 1.45 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 0.00 0.00 222 Y 7.75 5.73 0.00 3.54 3.34 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 0.00 223 L 9.46 5.33 0.00 2.01 1.86 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 224 A 9.00 5.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 W 8.83 5.12 0.00 1.78 2.35 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 0.00 226 T 8.49 4.89 4.18 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 1.20 0.00 0.00 227 S 9.32 4.92 0.00 4.30 4.35 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 0.00 228 D 9.05 4.47 0.00 2.78 2.87 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 0.00 229 K 7.35 4.75 0.00 1.72 1.59 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.56 7.81 230 E 7.75 3.73 0.00 1.56 1.63 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 1.81 1.47 0.00 231 V 8.53 4.53 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 1.03 0.00 0.00 0.99 0.00 0.00 232 M 8.72 4.37 0.00 1.43 0.82 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.12 0.00 233 C 8.92 4.79 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 0.00 234 A 8.48 4.18 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 0.00 235 D 8.01 4.51 0.00 2.67 2.74 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 0.00 236 G 8.24 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 0.00 237 S 8.19 4.48 0.00 3.83 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 0.00 238 V 7.93 5.11 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 0.97 0.00 0.00 0.68 0.00 0.00 239 R 7.91 4.52 0.00 1.98 1.91 0.00 2.94 0.00 0.00 3.62 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 240 Y 8.47 4.77 0.00 2.94 2.93 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 0.00 241 I 8.99 5.29 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.83 0.90 0.00 0.00 242 T 8.88 5.21 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 1.28 0.00 0.00 243 W 8.75 5.81 0.00 3.54 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 0.00 244 V 9.12 5.36 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 0.89 0.00 0.00 1.31 0.00 0.00 245 N 9.95 6.23 0.00 3.27 3.35 0.00 0.00 6.33 7.21 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 0.00 246 V 9.31 5.22 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 1.17 0.00 0.00 1.00 0.00 0.00 247 H 9.63 5.26 0.00 3.52 3.99 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 E 8.29 4.48 0.00 2.27 1.94 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 2.57 2.35 0.00 249 S 8.29 4.76 0.00 3.88 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 0.00 250 P 0.00 4.72 0.00 1.98 1.95 0.00 3.62 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 251 L 8.22 4.14 0.00 1.61 1.63 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 252 P 0.00 4.04 0.00 0.57 1.67 0.00 3.77 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 2.04 2.12 0.00 253 F 7.75 5.16 0.00 3.08 2.86 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 0.00 0.00 0.00 254 D 8.26 4.94 0.00 2.70 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 V 7.86 3.53 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 0.33 0.00 0.00 0.71 0.00 0.00 256 G 9.13 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 0.00 257 K 7.67 3.81 0.00 1.92 1.44 0.00 1.37 0.00 0.00 1.58 0.00 0.00 2.32 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.39 1.21 7.81 258 K 8.62 5.11 0.00 1.66 1.73 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.43 7.81 259 L 8.92 4.80 0.00 1.50 1.45 0.42 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 260 K 8.87 4.76 0.00 1.71 1.73 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.54 7.81 261 K 8.80 3.94 0.00 1.81 1.79 0.00 1.87 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.48 1.56 7.81 262 G 9.22 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 0.00 0.00 0.00 263 D 8.04 4.51 0.00 2.93 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 L 8.63 3.88 0.00 1.58 1.62 0.27 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 265 M 7.74 4.37 0.00 1.85 1.77 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.38 0.00 266 G 5.93 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 H 7.95 5.12 0.00 2.85 3.06 0.00 5.88 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 0.00 268 T 9.09 4.39 4.57 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 1.59 0.00 0.00 269 G 8.22 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 270 I 8.62 4.64 1.91 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 1.32 0.81 0.96 0.00 0.00 271 G 8.19 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 0.00 272 G 9.00 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 *276 G 7.69 3.71 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 0.00 0.00 0.00 277 D 8.47 4.86 0.00 2.81 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 0.00 278 H 8.98 4.90 0.00 3.60 3.47 0.00 5.25 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 W 9.59 5.38 0.00 3.43 3.34 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 0.00 280 H 9.31 5.38 0.00 3.76 3.39 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 F 8.70 5.63 0.00 1.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 N 8.45 5.14 0.00 2.74 2.48 0.00 0.00 6.69 7.71 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 0.00 283 V 8.27 5.20 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 0.73 0.00 0.00 1.14 0.00 0.00 284 I 9.13 4.98 1.87 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 1.19 0.76 0.77 0.00 0.00 285 D 8.58 4.56 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 G 8.98 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 0.00 0.00 0.00 287 K 8.12 4.27 0.00 1.51 1.11 0.00 0.61 0.00 0.00 1.39 0.00 0.00 2.49 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.08 1.19 7.81 288 E 7.69 4.47 0.00 1.87 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 2.12 2.16 0.00 289 Y 8.42 4.20 0.00 2.88 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 0.00 290 Q 7.04 4.01 0.00 1.70 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.09 2.34 0.00 291 G 5.61 3.21 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 0.00 0.00 0.00 292 W 8.45 5.07 0.00 3.01 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 0.00 293 T 9.31 4.77 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 1.21 0.00 0.00 294 K 8.28 5.08 0.00 1.65 1.82 0.00 2.04 0.00 0.00 1.74 0.00 0.00 2.74 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.38 7.81 295 K 8.25 4.40 0.00 1.84 1.81 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.16 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.31 7.81 296 P 0.00 4.47 0.00 2.16 2.16 0.00 3.90 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 1.98 1.98 0.00 297 D 7.71 4.94 0.00 2.88 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 0.00 298 S 8.55 4.87 0.00 3.85 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 0.00 299 C 9.14 4.75 0.00 2.85 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 0.00 300 L 7.78 3.69 0.00 1.18 1.20 0.85 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 301 A 8.16 3.92 1.08 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 0.00 0.00 302 G 8.52 3.53 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 0.00 303 T 8.19 4.28 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 1.15 0.00 0.00 304 E 8.57 4.40 0.00 1.81 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 2.24 2.21 0.00 305 L 8.10 4.69 0.00 1.34 1.34 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 306 H 8.08 3.90 0.00 2.45 1.32 0.00 5.83 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 I 8.12 3.86 2.15 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.63 1.82 0.00 0.00 308 Y 6.67 4.21 0.00 2.29 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 309 D 7.28 4.46 0.00 2.63 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 0.00 310 V 7.73 3.25 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.73 0.00 0.00 311 F 8.11 5.34 0.00 3.56 3.37 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 0.00 312 A 9.05 4.73 1.45 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 0.00 0.00 313 V 8.48 4.72 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 0.90 0.00 0.00 1.08 0.00 0.00 314 N 8.53 4.33 0.00 2.93 2.85 0.00 0.00 7.21 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 N 8.80 4.22 0.00 2.87 2.89 0.00 0.00 6.83 7.68 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 0.00 316 V 7.39 4.56 2.19 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 0.56 0.00 0.00 1.17 0.00 0.00 317 E 9.10 4.23 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 2.25 2.24 0.00 318 I 8.29 4.14 1.67 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 1.18 0.85 0.87 0.00 0.00 319 I 8.49 4.12 1.84 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 1.31 0.99 0.92 0.00 0.00 320 N 8.13 4.41 0.00 2.84 2.67 0.00 0.00 7.33 7.95 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 0.00 321 G 8.85 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 0.00 0.00 0.00 322 N 10.20 3.86 0.00 2.63 1.66 0.00 0.00 6.83 8.52 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 0.00 323 G 7.67 3.79 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 0.00 0.00 0.00 324 Y 6.59 3.95 0.00 2.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 325 D 6.90 4.49 0.00 2.45 2.40 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 0.00 326 W 7.39 4.65 0.00 3.24 3.12 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 0.00 327 K 8.77 4.80 0.00 1.85 1.92 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.54 7.81 328 T 8.53 4.90 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 1.27 0.00 0.00 329 S 9.16 4.76 0.00 3.88 3.77 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 0.00 330 D 8.59 4.93 0.00 2.72 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 0.00 331 W 8.06 4.31 0.00 3.42 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 0.00 332 Q 7.47 4.51 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 333 D 7.97 4.70 0.00 2.67 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 0.00 334 G 8.68 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 * Residues marked with a * may have inaccurate shift predictions.