NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2847 7.8827 121.4462 61.1400 38.8017 173.7839 17 V 4.3166 8.3981 124.9079 61.6525 33.1707 174.3802 18 G 3.6218 9.1123 114.8473 46.2343 0.0000 172.8084 19 G 4.3391 7.7319 108.0657 44.6459 0.0000 172.2347 20 Y 5.0885 7.8156 117.3992 55.0771 42.2317 174.6933 21 T 4.4145 8.5674 116.5189 63.5375 68.5666 175.7222 22 C 4.3829 8.6393 125.1531 61.2642 36.3806 173.9007 23 G 4.2082 8.4095 106.1915 43.2880 0.0000 173.0590 24 A 3.9939 8.6324 125.4064 53.7635 18.8434 177.2843 25 N 4.1980 8.6872 119.6717 54.4706 36.3603 175.2156 26 T 4.2859 7.5057 107.2002 62.2030 70.3323 175.2393 27 V 4.0597 7.0504 122.5410 60.1963 31.2507 173.6370 28 P 4.4517 0.0000 0.0000 64.3659 32.0998 178.1451 29 Y 5.0485 6.8794 115.6143 56.3696 38.7155 174.5855 30 Q 4.7342 7.2867 122.9352 56.2429 29.8116 175.2568 31 V 4.8889 9.0023 118.1552 59.6437 36.5469 174.1722 32 S 4.8345 8.6500 116.5248 56.5673 65.1461 172.5253 33 L 4.7433 8.4989 127.5504 53.1549 43.5497 174.9712 34 N 6.0155 9.0813 122.4820 49.9973 41.9849 174.8879 *37 S 4.9784 7.8041 120.1288 58.4923 64.0688 174.3982 38 G 3.9839 9.8016 108.7666 46.3297 0.0000 172.4381 39 Y 4.5765 6.5038 115.5191 56.1303 40.2643 172.7172 40 H 4.7533 8.7534 121.2240 55.9108 30.3643 174.5884 41 F 5.0338 8.0040 120.1988 57.0737 39.8623 173.8966 42 C 4.7165 6.8310 115.0194 56.0778 44.9986 172.8640 43 G 4.3011 8.5491 108.7387 45.2930 0.0000 172.0478 44 G 4.4779 8.0582 105.5883 46.4296 0.0000 172.5943 45 S 5.4659 8.5636 115.2667 56.4441 66.7640 173.6577 46 L 4.7638 9.2446 127.5916 54.7797 42.5238 177.1389 47 I 4.2421 8.5107 119.6346 60.7323 38.4903 174.6158 48 N 4.3488 7.7493 117.6793 52.1969 39.1215 175.0941 49 S 4.2304 8.3522 112.9052 60.9290 62.8109 175.8018 50 Q 4.5959 8.1945 117.0278 54.9641 30.6082 174.5567 51 W 5.3558 7.8941 116.9541 54.6937 32.8101 174.7233 52 V 5.0863 8.9123 122.4385 61.1237 34.7903 174.4919 53 V 4.9356 8.5395 125.7474 60.6323 34.4121 174.8995 54 S 4.9405 8.8743 115.6190 57.9348 66.2346 172.5254 55 A 4.6726 8.7822 120.5532 50.2452 19.9895 178.5906 56 A 3.8856 8.2306 123.6538 55.1363 18.5555 179.1748 57 H 4.6232 8.4880 109.2988 57.0249 28.5380 175.2322 58 C 4.7471 7.6426 116.6907 56.8885 40.6781 173.3677 59 Y 4.2985 7.6991 121.9878 58.2143 38.7178 175.4506 60 K 3.8284 7.3403 123.6535 55.3346 36.0856 174.8681 61 S 4.4301 7.9445 115.2353 57.8312 65.3711 173.4622 62 G 3.5106 8.5118 108.2602 46.2097 0.0000 172.9903 63 I 4.5722 7.1107 119.1470 59.5303 40.9419 176.1654 64 Q 4.7793 8.4415 126.0620 54.2587 32.1223 173.8589 65 V 4.5336 9.0147 126.7700 61.5945 33.7087 174.4967 66 R 5.1627 8.9084 127.0234 54.5889 32.6845 175.0107 67 L 4.7552 9.2279 124.4804 52.5989 45.0214 177.0339 *69 G 4.2921 8.2359 106.0383 46.3540 0.0000 172.6352 70 E 4.7405 8.3226 119.0726 55.1193 30.8036 174.8938 71 D 4.7727 8.0089 118.7758 54.6720 44.1772 174.2986 72 N 4.9700 8.3974 124.3412 52.1353 38.6278 175.9977 73 I 4.0236 8.3479 118.9550 61.7246 37.4874 176.3773 74 N 4.7315 8.4944 117.9183 53.1158 39.6699 174.7917 75 V 4.3295 7.4779 118.0393 60.5716 33.8265 174.8665 76 V 4.0193 8.4802 127.2682 62.8337 31.7307 175.2418 77 E 4.4312 9.4205 126.6217 55.7009 30.1163 175.9881 78 G 4.1245 8.1969 108.1054 45.7029 0.0000 174.4283 79 N 4.8921 8.2331 115.5616 53.2315 39.7116 174.7455 80 E 5.0623 8.0050 117.7486 55.4134 31.8111 175.6148 81 Q 4.3488 8.8722 120.0611 54.2191 32.9896 174.1077 82 F 5.6732 8.7505 122.3390 55.9414 41.3308 174.9223 83 I 4.7212 8.8712 124.4228 59.5779 41.2006 175.3939 84 S 4.9095 8.6156 121.2125 57.8152 64.7603 173.0280 85 A 4.7459 8.2489 124.3514 51.7688 18.7343 177.7005 86 S 4.6202 8.9010 116.6058 59.6314 64.7812 174.5369 87 K 4.6951 7.5122 117.1228 55.7715 35.5858 174.9109 88 S 5.3165 8.7300 116.9373 56.9411 66.5893 173.5246 89 I 4.6094 9.0862 124.5557 59.6519 40.0507 174.7000 90 V 4.4413 8.4373 127.3472 61.4750 33.0989 175.0227 91 H 3.4418 8.5677 126.9921 55.9024 29.9034 174.1996 92 P 4.2353 0.0000 0.0000 65.4748 30.9788 177.0455 93 S 4.6833 7.7662 112.4221 58.0370 63.1871 173.1706 94 Y 4.3068 8.0961 123.3781 57.6043 39.0942 174.3849 95 N 4.6350 8.0372 125.4965 51.4941 39.8698 174.9115 96 S 4.0680 7.7652 119.5601 58.9757 63.7388 174.9151 97 N 4.4280 8.2604 119.2918 55.4904 38.7903 176.2670 98 T 3.9711 7.7735 105.4756 61.0724 69.8282 174.7192 99 L 3.7913 7.6281 120.7078 55.6276 39.5932 173.8746 100 N 4.5395 7.6124 116.6036 54.4801 39.6498 174.3973 101 N 4.9988 8.7520 120.0852 54.5558 35.8931 175.6355 102 D 4.7378 7.8038 117.8357 53.2529 39.8774 174.3771 103 I 4.9337 7.1484 120.8994 59.5527 42.3366 172.9167 104 M 5.4172 9.1318 125.8849 54.4134 36.3058 173.1806 105 L 5.4595 9.1216 122.7769 53.0889 45.5128 175.5463 106 I 4.9985 9.0089 122.8906 59.4468 40.8450 174.2289 107 K 3.8366 8.7302 128.4088 54.3809 33.8971 175.3567 108 L 4.5817 8.0680 127.4219 53.9614 42.1685 177.3560 109 K 4.1165 8.9353 122.4439 58.9972 32.4758 177.5014 110 S 4.6620 7.7396 112.7988 56.1608 66.8306 173.0782 111 A 4.4970 8.3018 123.4474 51.6580 19.0098 177.4939 112 A 4.2608 8.8699 123.5268 51.9343 19.7238 177.1961 113 S 4.6434 8.6136 116.3865 57.1057 63.9428 174.4761 114 L 4.5281 8.5086 125.3663 54.2027 43.0892 175.9782 115 N 4.7697 9.0542 117.9895 52.4881 40.0031 174.6371 116 S 4.1398 8.9242 113.3255 62.2134 62.7922 175.9694 117 R 4.2184 8.5338 116.9826 56.7537 30.5997 176.5629 118 V 4.4689 7.9157 117.3918 61.0108 33.9073 173.6685 119 A 5.1532 8.5781 128.1861 50.4142 23.0919 174.8587 120 S 5.1903 8.6779 113.8783 57.3163 65.4033 172.9877 121 I 4.4469 8.2851 120.4970 59.2922 39.6591 175.1932 122 S 4.5507 8.2812 122.4513 57.6128 64.0125 174.0658 123 L 4.2995 8.0811 123.2227 53.3357 42.5322 175.1571 124 P 4.5558 0.0000 0.0000 62.8677 32.2777 176.2598 125 T 4.1565 8.1967 108.4561 62.2739 69.9203 174.3836 *127 S 4.4590 7.5483 114.9945 58.3476 64.0705 173.4567 128 C 4.5311 8.3270 117.0889 55.9100 41.1271 173.6743 129 A 4.4415 7.9739 124.9360 51.2175 19.8875 177.2509 130 S 4.3554 8.0413 113.5563 57.0657 64.7996 173.3725 *132 A 4.2599 8.1861 123.6320 53.4337 19.3452 175.8481 133 G 4.1002 8.9799 109.0594 45.7307 0.0000 174.8438 134 T 4.0043 7.7960 116.2561 63.8152 69.5036 173.7352 135 Q 4.9278 8.5415 124.1005 55.0212 30.7794 175.4164 136 C 5.3058 9.1206 119.4384 55.0662 45.5942 172.3277 137 L 5.2469 8.8867 121.8423 53.4972 44.3828 174.9858 138 I 5.2668 9.1433 127.1935 58.7243 40.1579 174.8319 139 S 4.9365 9.0280 119.5045 56.0806 66.5017 173.0687 140 G 3.9641 7.3406 109.4614 45.8156 0.0000 172.5217 141 W 4.7552 8.5437 117.8320 56.3496 29.5951 177.0555 142 G 4.2171 7.9989 108.1335 43.5231 0.0000 173.5229 143 N 3.5573 7.8808 117.4842 54.2812 38.9799 174.2942 144 T 5.1833 8.4103 112.9879 60.2962 69.2105 173.8549 145 K 4.6339 7.8076 120.3660 54.9488 35.0566 176.5157 146 S 4.3647 8.8031 119.3339 61.0646 63.0182 174.6605 147 S 4.4771 8.8636 116.1334 55.7050 63.0942 173.3882 148 G 4.2902 7.2467 112.0292 44.0673 0.0000 169.5052 149 T 4.7050 7.7672 115.9938 61.6384 71.5960 174.3692 150 S 4.4549 9.3407 121.9059 57.5180 65.8288 172.0150 151 Y 4.9043 8.6911 125.5330 55.5924 39.7000 174.4807 152 P 4.7405 0.0000 0.0000 62.4873 33.1021 174.9828 153 D 5.0631 8.6611 115.3447 54.2219 43.6491 176.7520 154 V 5.6413 7.7423 110.0586 58.3030 34.7712 175.5406 155 L 3.2934 8.1966 124.7610 55.0320 43.1082 175.9745 156 K 4.8814 7.9870 124.5273 54.7801 35.5780 174.4713 157 C 5.3175 8.4023 119.5575 55.2291 42.9731 172.8707 158 L 4.9090 8.4751 121.8148 53.8250 45.6316 174.2988 159 K 5.2338 8.8887 124.8002 54.8976 34.0759 175.4709 160 A 4.9896 8.8956 124.8595 49.8365 23.2297 173.8363 161 P 5.0563 0.0000 0.0000 62.0506 33.8995 174.9800 162 I 4.5486 8.1804 121.4651 61.0334 38.2871 175.7006 163 L 4.9494 8.6409 126.7772 52.8902 43.6294 176.8749 164 S 4.3160 8.4383 115.2070 58.2608 63.7971 175.2407 165 D 4.4523 8.7567 122.3764 57.3521 40.4838 179.1606 166 S 4.1539 8.1314 114.8977 61.6869 62.9090 176.7395 167 S 4.1756 7.7650 116.8096 60.8426 62.7945 175.5439 168 C 4.2756 7.9354 122.2912 59.6790 43.3033 175.6489 169 K 3.8915 8.2892 119.4344 59.6949 31.6976 179.2200 170 S 4.2971 7.9657 114.4438 61.0789 62.8250 176.1442 171 A 4.0213 7.5668 122.6618 53.6238 19.7492 177.3590 172 Y 4.8428 7.7401 114.5375 55.1827 38.0190 172.8356 173 P 4.5345 0.0000 0.0000 63.8147 32.3047 177.7886 174 G 4.0251 8.9102 109.8458 46.0502 0.0000 173.8753 175 Q 4.4574 7.9682 116.8649 56.0375 30.0657 175.7674 176 I 4.3582 7.8170 119.1724 60.3138 38.2855 175.0395 177 T 4.6976 8.1705 114.4737 59.4194 71.2889 174.7528 178 S 4.3454 8.5837 114.6664 60.3315 63.2827 174.3401 179 N 4.9705 8.1989 118.4942 53.3528 38.4993 173.8426 180 M 5.6167 7.8296 117.2807 53.8662 36.2080 174.4248 181 F 5.0806 8.5949 114.6710 56.0229 42.1006 172.3927 182 C 5.6010 9.0476 116.0129 55.5656 40.0229 172.7994 183 A 4.9937 9.1848 121.5748 51.1435 22.5742 176.1627 184A G 3.7093 6.9368 106.1139 44.5872 0.0000 172.7345 184 Y 4.6616 8.2725 119.3761 54.8665 40.3083 176.4166 185 L 4.0761 8.6181 126.1131 57.3002 41.7162 179.4253 186 E 4.2399 8.2514 116.5089 57.5287 30.3288 176.6082 187 G 4.2194 7.9985 105.6040 44.9748 0.0000 171.3847 188A G 4.3376 8.5477 108.0097 44.8096 0.0000 174.1772 188 K 5.3387 7.2085 116.4848 53.2967 35.5772 175.3623 189 D 4.5750 8.2595 122.3117 54.3806 44.7553 174.6519 190 S 5.0877 8.7883 115.7543 57.6680 65.6645 173.3048 191 C 4.7890 9.2666 118.7813 55.4977 44.4069 172.5023 192 Q 4.4902 8.5250 117.1747 57.5046 28.8425 176.7304 193 G 4.3406 9.1952 108.3698 45.7801 0.0000 173.9710 194 D 4.7763 8.0995 117.9815 54.8211 42.0179 176.8389 195 S 4.4180 8.0071 115.6245 60.3664 63.4002 175.2716 196 G 4.2847 8.7791 111.9044 46.5793 0.0000 174.0078 197 G 4.2946 7.6325 106.8207 45.2096 0.0000 171.4161 198 P 5.2132 0.0000 0.0000 62.3757 33.6601 175.6998 199 V 4.6100 8.3073 120.0360 61.5058 34.4938 173.8199 200 V 4.9126 8.6457 128.6729 61.2442 34.2248 173.6837 201 C 5.0901 8.6490 124.4153 55.7249 44.0611 174.5550 202 S 3.5811 9.8548 119.4344 59.7173 60.0824 173.4905 203 G 3.9474 8.5261 105.6509 45.4493 0.0000 173.9821 204 K 4.7189 7.5300 117.7307 53.0629 35.4235 175.3943 *209 L 4.3878 8.2572 122.1413 55.5089 42.3466 176.0038 210 Q 4.5738 8.7785 125.4981 56.3595 30.9655 175.6571 211 G 5.4050 8.0216 103.9756 45.8999 0.0000 171.9832 212 I 5.0855 8.2181 119.2301 59.0195 41.4195 175.2999 213 V 3.7694 8.8735 127.3805 63.7110 31.8059 174.1998 214 S 4.8308 8.5654 120.9503 58.8309 64.3357 174.5443 215 W 4.9786 7.3871 114.8270 57.1004 31.5784 172.3054 216 G 4.0218 8.0537 105.7588 47.1268 0.0000 172.0701 217 S 4.6495 8.2426 114.5405 56.4707 62.9699 172.8143 *219 G 4.3736 8.0089 117.3792 45.5395 0.0000 170.7081 220 C 5.0359 8.1521 114.6739 56.3785 39.7894 173.8860 221A A 3.7121 8.8389 125.4707 53.2429 16.5321 177.0067 221 Q 4.6738 7.2217 114.5656 55.5704 30.4783 175.9633 222 K 4.1362 8.3535 120.9967 57.6938 32.8002 176.0759 223 N 4.2417 9.1216 120.9002 54.0528 37.1593 175.4030 224 K 4.4159 7.4481 116.2742 53.8385 32.1312 173.2995 225 P 4.5998 0.0000 0.0000 62.3756 33.1714 177.3345 226 G 3.8087 8.5058 107.0116 45.6136 0.0000 172.8719 227 V 4.3254 7.4476 120.6368 60.6672 34.0151 174.0948 228 Y 4.9433 8.0366 124.6912 56.0627 41.7905 175.0113 229 T 4.4657 8.5612 119.4733 63.4987 70.2029 174.5350 230 K 5.0166 9.2392 127.9860 55.2390 31.2154 177.1297 231 V 3.9574 8.7691 125.6573 65.8481 31.4252 174.8235 232 C 4.5187 8.3219 112.4832 58.0491 41.5151 174.6342 233 N 4.3679 7.9613 116.8534 54.0577 38.5706 174.9308 234 Y 4.8026 8.0414 118.1352 57.5293 39.1426 177.6305 235 V 3.6828 8.0184 122.1056 66.2582 31.4562 178.1941 236 S 4.1190 8.0735 114.4318 61.3192 62.7023 176.2316 237 W 4.1648 8.2975 130.5984 60.4230 30.4768 177.9063 238 I 3.0316 8.0700 119.7262 64.1924 36.1118 178.5943 239 K 3.8009 8.1452 119.5141 59.5057 31.6247 179.5647 240 Q 3.9087 7.9434 117.5144 59.1336 28.5705 178.5856 241 T 3.7560 7.6276 117.2554 66.4008 68.1772 176.9146 242 I 2.5190 6.9278 113.3016 63.0330 37.5049 177.6826 243 A 4.1303 7.2471 121.0510 53.9174 18.3386 178.6013 244 S 4.6664 7.2220 111.2347 58.3679 63.2867 174.0584 245 N 4.6724 7.7741 125.0080 53.6627 39.5748 174.1499 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 16 I 7.88 4.28 1.78 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 1.39 0.87 0.91 0.00 0.00 17 V 8.40 4.32 2.09 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 1.02 0.00 0.00 0.91 0.00 0.00 18 G 9.11 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.73 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.82 5.09 0.00 2.99 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 21 T 8.57 4.41 4.30 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 1.23 0.00 0.00 22 C 8.64 4.38 0.00 2.90 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 23 G 8.41 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 0.00 0.00 0.00 0.00 24 A 8.63 3.99 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 25 N 8.69 4.20 0.00 2.81 2.87 0.00 0.00 7.06 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 26 T 7.51 4.29 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 1.33 0.00 0.00 27 V 7.05 4.06 1.75 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 0.33 0.00 0.00 0.78 0.00 0.00 28 P 0.00 4.45 0.00 2.36 2.28 0.00 3.59 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.01 0.00 29 Y 6.88 5.05 0.00 3.25 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 30 Q 7.29 4.73 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.77 0.00 0.00 0.00 0.00 0.00 2.04 2.57 0.00 31 V 9.00 4.89 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 0.96 0.00 0.00 1.00 0.00 0.00 32 S 8.65 4.83 0.00 3.06 3.31 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 33 L 8.50 4.74 0.00 0.40 1.05 0.81 0.13 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 34 N 9.08 6.02 0.00 2.43 2.50 0.00 0.00 6.61 7.02 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 *37 S 7.80 4.98 0.00 3.68 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.80 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 39 Y 6.50 4.58 0.00 3.06 2.98 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 40 H 8.75 4.75 0.00 2.85 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.00 5.03 0.00 3.04 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 42 C 6.83 4.72 0.00 2.25 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 43 G 8.55 4.30 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 0.00 44 G 8.06 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.56 5.47 0.00 3.85 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 46 L 9.24 4.76 0.00 1.85 1.66 1.08 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.51 4.24 1.90 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 1.55 0.97 0.96 0.00 0.00 48 N 7.75 4.35 0.00 2.93 2.98 0.00 0.00 6.43 7.91 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 49 S 8.35 4.23 0.00 4.04 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 0.00 50 Q 8.19 4.60 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 51 W 7.89 5.36 0.00 3.24 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 52 V 8.91 5.09 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 1.17 0.00 0.00 0.98 0.00 0.00 53 V 8.54 4.94 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 0.74 0.00 0.00 1.06 0.00 0.00 54 S 8.87 4.94 0.00 3.90 3.78 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 55 A 8.78 4.67 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 56 A 8.23 3.89 0.42 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 57 H 8.49 4.62 0.00 3.35 3.55 0.00 5.55 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.64 4.75 0.00 3.25 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 59 Y 7.70 4.30 0.00 2.90 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.34 3.83 0.00 1.32 1.22 0.00 0.61 0.00 0.00 1.00 0.00 0.00 2.62 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.83 7.81 61 S 7.94 4.43 0.00 3.89 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.51 3.51 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 0.00 63 I 7.11 4.57 1.88 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 1.35 1.07 0.95 0.00 0.00 64 Q 8.44 4.78 0.00 2.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.95 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 65 V 9.01 4.53 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 0.95 0.00 0.00 0.90 0.00 0.00 66 R 8.91 5.16 0.00 1.54 1.74 0.00 2.66 0.00 0.00 2.47 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.18 0.00 67 L 9.23 4.76 0.00 1.58 1.60 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 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 0.00 0.00 0.00 0.00 70 E 8.32 4.74 0.00 2.15 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.11 0.00 71 D 8.01 4.77 0.00 2.77 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 72 N 8.40 4.97 0.00 2.86 2.75 0.00 0.00 7.18 7.74 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 73 I 8.35 4.02 1.43 0.00 0.00 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 1.30 1.31 -0.46 0.00 0.00 74 N 8.49 4.73 0.00 2.87 2.88 0.00 0.00 6.94 7.87 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 75 V 7.48 4.33 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 0.74 0.00 0.00 1.00 0.00 0.00 76 V 8.48 4.02 2.10 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 0.81 0.00 0.00 1.04 0.00 0.00 77 E 9.42 4.43 0.00 1.96 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 2.29 2.46 0.00 78 G 8.20 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 0.00 0.00 0.00 79 N 8.23 4.89 0.00 2.74 2.82 0.00 0.00 7.10 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 80 E 8.01 5.06 0.00 1.42 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 81 Q 8.87 4.35 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.01 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 82 F 8.75 5.67 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.87 4.72 1.87 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 1.23 0.85 0.94 0.00 0.00 84 S 8.62 4.91 0.00 3.75 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 85 A 8.25 4.75 1.19 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 86 S 8.90 4.62 0.00 3.77 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 87 K 7.51 4.70 0.00 1.85 1.90 0.00 1.48 0.00 0.00 1.96 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.51 7.81 88 S 8.73 5.32 0.00 3.96 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 89 I 9.09 4.61 2.07 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 1.25 0.98 1.17 0.00 0.00 90 V 8.44 4.44 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 0.62 0.00 0.00 0.77 0.00 0.00 91 H 8.57 3.44 0.00 2.80 2.95 0.00 5.66 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 92 P 0.00 4.24 0.00 2.14 2.16 0.00 2.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.83 0.00 93 S 7.77 4.68 0.00 3.92 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.10 4.31 0.00 2.84 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 95 N 8.04 4.64 0.00 2.60 2.44 0.00 0.00 6.56 7.01 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 96 S 7.77 4.07 0.00 3.99 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.26 4.43 0.00 2.78 2.78 0.00 0.00 6.79 7.37 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 98 T 7.77 3.97 4.13 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 1.10 0.00 0.00 99 L 7.63 3.79 0.00 1.55 1.95 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.61 4.54 0.00 2.81 2.65 0.00 0.00 7.29 6.61 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 0.00 101 N 8.75 5.00 0.00 3.09 2.73 0.00 0.00 7.44 8.09 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 0.00 102 D 7.80 4.74 0.00 3.22 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 0.00 103 I 7.15 4.93 1.56 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.20 0.16 0.00 0.00 104 M 9.13 5.42 0.00 2.14 1.83 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 2.67 2.66 0.00 105 L 9.12 5.46 0.00 1.76 1.86 0.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.01 5.00 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 1.20 1.17 0.88 0.00 0.00 107 K 8.73 3.84 0.00 0.79 1.14 0.00 1.51 0.00 0.00 1.41 0.00 0.00 2.70 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.07 4.58 0.00 1.50 1.53 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.94 4.12 0.00 1.67 1.84 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.49 7.81 110 S 7.74 4.66 0.00 3.77 3.68 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 0.00 111 A 8.30 4.50 1.21 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 0.00 112 A 8.87 4.26 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 0.00 113 S 8.61 4.64 0.00 3.78 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.51 4.53 0.00 1.65 1.71 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 115 N 9.05 4.77 0.00 2.85 2.92 0.00 0.00 6.94 7.17 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 0.00 116 S 8.92 4.14 0.00 3.89 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 0.00 117 R 8.53 4.22 0.00 1.91 1.99 0.00 3.11 0.00 0.00 3.16 7.33 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.46 0.00 4.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.33 4.53 0.00 2.93 2.98 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 0.00 129 A 7.97 4.44 1.06 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 0.00 0.00 130 S 8.04 4.36 0.00 4.15 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 *132 A 8.19 4.26 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 0.00 133 G 8.98 4.10 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 0.00 0.00 0.00 134 T 7.80 4.00 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 1.15 0.00 0.00 135 Q 8.54 4.93 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 136 C 9.12 5.31 0.00 2.76 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 0.00 137 L 8.89 5.25 0.00 1.77 1.55 1.04 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.14 5.27 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 0.76 1.54 1.00 0.00 0.00 139 S 9.03 4.94 0.00 3.51 3.61 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 0.00 140 G 7.34 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.54 4.76 0.00 3.17 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 0.00 142 G 8.00 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 0.00 0.00 0.00 0.00 143 N 7.88 3.56 0.00 2.09 2.58 0.00 0.00 6.96 8.08 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 0.00 144 T 8.41 5.18 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 1.26 0.00 0.00 145 K 7.81 4.63 0.00 1.77 1.69 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.26 1.32 7.81 146 S 8.80 4.36 0.00 3.86 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 0.00 147 S 8.86 4.48 0.00 3.80 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 0.00 148 G 7.25 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 0.00 0.00 0.00 0.00 149 T 7.77 4.70 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 1.41 0.00 0.00 150 S 9.34 4.45 0.00 3.80 3.61 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 0.00 151 Y 8.69 4.90 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.74 0.00 2.39 2.12 0.00 3.92 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 153 D 8.66 5.06 0.00 2.66 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 0.00 154 V 7.74 5.64 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 0.90 0.00 0.00 0.97 0.00 0.00 155 L 8.20 3.29 0.00 1.34 1.23 -0.91 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 7.99 4.88 0.00 1.60 1.48 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.45 7.81 157 C 8.40 5.32 0.00 1.41 2.26 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 0.00 158 L 8.48 4.91 0.00 1.67 1.41 1.01 0.69 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 0.00 159 K 8.89 5.23 0.00 1.81 1.80 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.64 7.81 160 A 8.90 4.99 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 0.00 161 P 0.00 5.06 0.00 2.03 2.12 0.00 3.16 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.81 0.00 162 I 8.18 4.55 1.90 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 1.10 0.68 0.83 0.00 0.00 163 L 8.64 4.95 0.00 1.54 1.59 0.92 0.95 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 0.00 164 S 8.44 4.32 0.00 4.01 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 0.00 165 D 8.76 4.45 0.00 2.74 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.13 4.15 0.00 4.05 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 0.00 167 S 7.76 4.18 0.00 4.15 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 7.94 4.28 0.00 3.02 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 0.00 169 K 8.29 3.89 0.00 1.87 1.92 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.65 7.81 170 S 7.97 4.30 0.00 3.89 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.57 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.74 4.84 0.00 3.19 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 0.00 173 P 0.00 4.53 0.00 2.08 2.03 0.00 3.83 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 2.05 2.11 0.00 174 G 8.91 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 7.97 4.46 0.00 2.48 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.47 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 176 I 7.82 4.36 1.98 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.93 0.99 0.00 0.00 177 T 8.17 4.70 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 1.29 0.00 0.00 178 S 8.58 4.35 0.00 4.01 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 0.00 179 N 8.20 4.97 0.00 3.09 3.12 0.00 0.00 6.95 6.97 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 0.00 180 M 7.83 5.62 0.00 1.75 1.97 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.58 0.00 181 F 8.59 5.08 0.00 3.10 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 0.00 182 C 9.05 5.60 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.18 4.99 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 184A G 6.94 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 0.00 184 Y 8.27 4.66 0.00 3.22 3.08 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 0.00 185 L 8.62 4.08 0.00 1.73 1.73 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.25 4.24 0.00 2.15 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 2.48 2.31 0.00 187 G 8.00 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 0.00 0.00 0.00 0.00 188A G 8.55 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.21 5.34 0.00 1.46 1.72 0.00 1.08 0.00 0.00 2.01 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.42 1.07 7.81 189 D 8.26 4.58 0.00 2.80 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 0.00 190 S 8.79 5.09 0.00 4.00 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 0.00 191 C 9.27 4.79 0.00 2.90 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 0.00 192 Q 8.53 4.49 0.00 2.42 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 5.45 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 193 G 9.20 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.10 4.78 0.00 3.04 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.01 4.42 0.00 3.95 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.78 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.63 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 0.00 0.00 0.00 0.00 198 P 0.00 5.21 0.00 2.31 2.36 0.00 3.71 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 2.23 2.26 0.00 199 V 8.31 4.61 2.34 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 0.85 0.00 0.00 0.76 0.00 0.00 200 V 8.65 4.91 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 0.93 0.00 0.00 0.64 0.00 0.00 201 C 8.65 5.09 0.00 2.81 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.85 3.58 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.53 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 0.00 204 K 7.53 4.72 0.00 1.74 1.64 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.26 4.39 0.00 1.50 1.63 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.78 4.57 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.49 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 8.02 5.40 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 0.00 212 I 8.22 5.09 1.93 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 1.31 0.94 1.01 0.00 0.00 213 V 8.87 3.77 2.29 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 0.97 0.00 0.00 1.19 0.00 0.00 214 S 8.57 4.83 0.00 3.89 3.78 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 0.00 215 W 7.39 4.98 0.00 3.32 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.05 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.24 4.65 0.00 4.26 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 *219 G 8.01 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 0.00 0.00 0.00 0.00 220 C 8.15 5.04 0.00 2.95 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 221A A 8.84 3.71 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 0.00 221 Q 7.22 4.67 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 222 K 8.35 4.14 0.00 1.73 1.71 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.54 7.81 223 N 9.12 4.24 0.00 2.80 2.80 0.00 0.00 6.73 7.62 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 0.00 224 K 7.45 4.42 0.00 1.70 1.92 0.00 1.74 0.00 0.00 1.43 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.51 7.81 225 P 0.00 4.60 0.00 2.12 2.11 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 226 G 8.51 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.45 4.33 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.00 -0.55 0.00 0.00 228 Y 8.04 4.94 0.00 1.43 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 0.00 229 T 8.56 4.47 4.30 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 1.23 0.00 0.00 230 K 9.24 5.02 0.00 2.16 1.99 0.00 1.84 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.64 7.81 231 V 8.77 3.96 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 1.12 0.00 0.00 1.12 0.00 0.00 232 C 8.32 4.52 0.00 3.16 3.22 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 0.00 233 N 7.96 4.37 0.00 2.35 2.43 0.00 0.00 7.02 7.30 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 0.00 234 Y 8.04 4.80 0.00 3.12 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 0.00 235 V 8.02 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.10 0.00 0.00 236 S 8.07 4.12 0.00 3.96 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 0.00 237 W 8.30 4.16 0.00 3.45 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 0.00 238 I 8.07 3.03 2.05 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.04 0.74 0.00 0.00 239 K 8.15 3.80 0.00 1.77 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.63 7.81 240 Q 7.94 3.91 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 241 T 7.63 3.76 3.51 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 0.80 0.00 0.00 242 I 6.93 2.52 0.61 0.00 0.00 0.59 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 0.19 -0.30 0.00 0.00 243 A 7.25 4.13 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 0.00 244 S 7.22 4.67 0.00 3.79 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 0.00 245 N 7.77 4.67 0.00 2.96 2.96 0.00 0.00 6.89 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 * Residues marked with a * may have inaccurate shift predictions.