NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4259 8.2893 120.3300 55.5041 32.3011 174.4357 2 K 4.2326 7.4241 121.9548 54.3451 33.1592 173.4330 3 E 4.9127 8.1403 120.0758 55.7787 31.1429 178.1523 4 V 4.4311 7.6312 117.3033 61.5869 34.2773 175.9062 5 A 4.2339 8.5462 131.1646 51.6385 19.0030 176.7948 6 V 4.4390 7.5607 112.4947 61.0440 30.0803 175.0170 7 Y 4.5442 7.8380 123.9663 58.4194 40.4726 175.5139 8 Q 4.4474 7.9877 125.2374 53.7828 31.5216 173.8857 9 I 4.3710 8.4759 127.5969 59.9037 38.0018 173.8072 10 P 4.2899 0.0000 0.0000 64.2228 31.2377 179.2676 11 V 4.2850 8.4841 119.3292 62.2334 31.3151 177.3472 12 L 4.1916 8.8387 117.6331 56.2793 42.0283 176.8757 13 S 3.9997 8.1608 113.4387 58.2435 62.7536 172.6300 14 P 4.5052 0.0000 0.0000 62.2790 32.0931 175.5182 15 S 3.7807 8.5157 116.7565 59.3552 62.9845 174.5125 16 G 4.4900 7.5709 117.1691 46.4270 0.0000 173.1175 17 R 4.6129 8.4428 120.6445 55.9994 32.9267 174.9442 18 R 4.3843 8.0597 126.1403 55.2908 32.5855 174.0666 19 E 5.1326 8.0945 116.0650 56.4631 31.4672 175.4873 20 L 4.2485 9.2134 118.9490 55.6882 45.4615 175.5523 21 A 3.9799 7.6000 121.7903 51.4119 21.3921 178.0008 22 A 4.5035 8.4477 121.8262 54.1034 18.7205 179.0154 23 D 4.5362 7.9505 118.8393 57.1789 41.0106 176.7688 24 L 4.9848 7.1575 117.7665 52.2699 43.9312 175.3443 25 P 4.6194 0.0000 0.0000 63.6881 28.7652 175.9500 26 A 4.1085 8.0129 126.4493 54.7316 19.1652 178.2640 27 E 4.7134 7.5859 108.9584 55.7862 33.2644 175.4585 28 I 4.3436 8.5280 117.6911 59.2735 39.5189 175.9367 29 N 4.6622 8.5600 123.5651 51.4674 37.9331 173.3577 30 P 4.1909 0.0000 0.0000 66.4398 31.8958 176.6002 31 H 4.0795 8.7033 115.1233 59.7029 29.4500 176.6395 32 L 3.8004 9.2730 121.3540 58.2865 42.3443 179.2576 33 L 4.0233 8.0053 118.6863 57.9006 41.6034 179.1729 34 W 4.3405 8.5336 128.0917 60.8983 30.6351 177.3052 35 E 3.1107 8.5561 118.4620 59.2544 28.7216 179.2466 36 V 3.6439 7.5119 117.9294 66.0764 31.7627 178.3278 37 V 3.8309 7.8280 117.9069 65.7351 31.3413 177.9908 38 R 3.6575 8.4061 119.4503 58.7971 29.7634 178.2430 39 W 3.8236 7.9602 128.1993 60.7498 30.8033 177.6372 40 Q 3.0359 8.2001 118.4362 58.3933 27.9395 178.3038 41 L 3.6756 7.9797 121.8804 58.2106 42.1367 177.9160 42 A 4.1194 7.4927 120.8598 52.8341 18.6380 178.6962 43 K 3.9149 8.2274 116.1557 59.5243 32.5187 178.8185 44 R 4.2880 7.2630 114.7474 55.5687 30.3465 176.4193 45 R 4.3967 7.2713 118.1595 55.7188 31.7491 177.0713 46 R 3.8135 8.6584 122.2127 59.4431 29.8676 176.9604 47 G 4.1566 8.4085 103.4979 46.6772 0.0000 173.4923 48 T 4.4686 7.5665 100.6870 61.2629 69.8165 174.6637 49 A 4.4907 8.2465 125.9035 51.7720 19.6116 177.0426 50 S 4.8340 8.4491 117.2190 57.4797 64.6621 173.8489 51 T 4.4919 8.5239 117.8120 60.7705 71.6356 173.3527 52 K 4.7406 8.1891 120.3460 54.6174 34.6579 176.8701 53 T 4.4581 8.9295 119.9595 61.2744 68.0314 175.1269 54 R 4.1391 8.5837 120.4518 58.3203 29.3019 177.5342 55 G 4.0451 7.9835 105.9018 45.3951 0.0000 173.4029 56 E 4.5996 8.6194 117.5085 55.6352 30.8421 175.8703 57 V 3.9840 7.4122 118.5171 61.2410 32.9464 176.3500 58 A 4.0190 7.9238 125.2193 53.1625 17.7287 177.2328 59 Y 4.7681 7.0769 116.0708 58.0104 39.1945 174.8082 60 S 4.6847 8.2270 115.7935 56.6736 64.0599 174.1266 61 G 3.7017 8.8112 111.7431 48.2996 0.0000 174.3884 62 R 3.5308 7.3025 117.6309 55.0413 30.3989 175.4583 63 K 4.9275 8.9225 124.2235 54.6926 31.0544 177.9074 64 I 3.1626 6.8663 124.4509 62.2636 39.6922 175.2123 65 W 5.3451 7.7341 119.0029 54.0365 32.5418 174.5558 66 P 4.2856 0.0000 0.0000 63.5033 31.0040 178.4686 67 Q 3.8314 8.4478 123.7601 56.1786 31.3148 173.9535 68 K 4.1669 8.9912 114.9050 56.9198 32.3563 177.7973 69 H 4.6584 9.1541 112.8271 55.9879 28.5409 176.5068 70 T 3.9714 7.7308 117.9129 66.4393 69.1953 175.8591 71 G 3.9730 8.1373 107.3707 45.8849 0.0000 174.0069 72 R 3.9320 6.9157 117.0615 54.5986 31.2103 175.5616 73 A 4.2078 7.8454 121.6365 51.3114 19.1331 177.6946 74 R 4.1605 8.1603 116.5194 57.3981 29.9372 175.7412 75 H 4.8543 8.5792 114.3791 55.9262 33.1038 173.1332 76 G 4.0335 9.1942 108.2602 46.7164 0.0000 175.4219 77 D 5.6270 9.4071 121.6504 50.2344 42.3692 177.9386 78 I 2.7433 8.1097 113.0332 62.0721 37.6180 176.9870 79 G 3.8172 7.9498 109.5171 47.2266 0.0000 174.0218 80 A 4.3341 7.9195 123.9134 51.3894 19.0700 175.3784 81 P 4.6315 0.0000 0.0000 65.7155 31.1438 178.2117 82 I 3.6344 7.7793 110.6244 61.5280 36.5886 175.8175 83 F 4.6979 8.6397 126.0395 59.5356 40.0775 178.5712 84 V 3.1542 8.2630 123.8573 63.9519 32.6763 176.0243 85 G 4.0205 9.3916 104.3160 45.6270 0.0000 171.9502 86 G 4.3487 7.2969 105.3500 43.4346 0.0000 173.5453 87 G 4.1364 8.6026 107.3378 46.5364 0.0000 173.0173 88 V 4.5760 8.0355 119.5427 58.3403 33.7592 178.6469 89 V 4.2606 8.1123 128.2420 62.2931 30.2138 179.2373 90 F 5.1070 8.3876 113.2150 56.4225 37.4931 175.4893 91 G 3.9550 9.3991 109.4151 44.1433 0.0000 172.4543 92 P 4.4245 0.0000 0.0000 62.6360 31.9361 175.2943 93 K 5.1371 8.1281 118.6841 53.4471 35.8020 173.9514 94 P 4.5847 0.0000 0.0000 63.2873 31.4602 175.7373 95 R 4.5196 8.1104 115.4474 55.3323 33.3012 173.3114 96 D 4.7712 8.4817 120.0865 54.0267 41.6883 175.5901 97 Y 4.4515 8.7286 123.2850 57.8442 38.4903 175.5030 98 S 4.8478 7.9603 114.8992 57.1598 64.9981 172.7561 99 Y 4.9464 7.8669 118.0262 56.5881 40.7900 175.3940 100 T 4.4300 8.3421 114.6788 61.4304 67.6592 173.0849 101 L 3.9080 7.2932 125.1994 53.8074 43.1365 174.9373 102 P 4.1540 0.0000 0.0000 63.0724 31.9724 177.5589 103 K 3.8545 8.5392 121.3945 59.4138 32.4810 178.8542 104 K 4.2662 7.9823 115.5876 57.3171 31.8717 177.7698 105 V 4.3406 7.2668 117.5959 62.6176 32.5471 176.8386 106 R 4.0670 7.7968 117.2762 58.6726 29.5694 177.0065 107 K 4.2300 7.9866 117.6969 57.4640 33.0339 179.7897 108 K 4.7460 7.8806 116.6824 58.9415 32.3095 178.6294 109 G 3.8014 8.0526 104.9545 46.7013 0.0000 175.3347 110 L 4.0846 9.3717 123.1242 57.9553 41.8248 178.7590 111 A 4.2390 8.0002 120.3437 55.6154 18.6038 179.1048 112 M 3.9300 7.9946 116.2702 58.8918 32.0205 179.0166 113 A 3.9836 8.2665 120.6104 55.2311 18.4571 179.7121 114 V 3.4971 7.4740 115.3075 66.6150 31.9035 177.2740 115 A 4.4354 9.9692 121.5885 53.2540 17.8801 178.7894 116 D 4.3580 8.5239 115.6814 56.6451 41.7483 179.5569 117 R 3.8487 8.0157 118.1260 59.3949 30.5064 177.8540 118 A 4.1699 8.0889 120.5556 55.2945 18.1225 179.0590 119 R 3.8180 8.1205 115.2866 60.2140 30.1047 178.0852 120 E 4.0890 7.8361 116.4836 57.9403 29.7482 178.1923 121 G 4.0643 8.7921 107.9385 45.1576 0.0000 175.0013 122 K 4.1163 7.9758 117.2743 57.9076 32.8829 176.0443 123 L 4.8664 7.9057 123.5497 54.2568 43.1875 175.7663 124 L 4.7977 9.0062 127.5401 53.3902 45.9466 174.6880 125 L 5.6950 8.5158 126.3613 53.4651 41.5328 176.2638 126 V 4.2351 8.1124 125.4214 63.1120 33.5055 174.4153 127 E 4.7664 8.3354 125.6072 57.2646 33.0847 177.0421 128 A 4.4878 7.8932 121.6897 51.1314 20.4226 177.5410 129 F 4.2685 8.2124 120.3204 55.1596 39.9623 174.0028 130 A 4.2244 8.5100 126.8881 55.2325 18.7795 179.2303 131 G 3.8210 7.9999 103.2916 45.9544 0.0000 172.7614 132 V 4.1337 9.1423 121.5340 61.6935 34.6580 172.0553 133 N 3.9424 8.3843 113.8418 58.1956 34.9544 177.1141 134 G 3.7298 7.7446 99.9190 46.2321 0.0000 172.3239 135 K 4.4259 7.4510 123.3916 54.5104 35.6689 174.9840 136 T 4.1515 8.6820 125.3259 66.3027 68.3812 175.8939 137 K 3.9223 8.2073 119.1765 60.0121 32.1686 178.7564 138 E 3.9264 8.3854 117.8980 59.7963 29.1991 178.9565 139 F 4.3440 8.2449 120.3704 60.7545 39.5954 176.6753 140 L 4.0733 8.9040 119.9760 59.1181 41.7172 178.4094 141 A 3.9670 8.7522 119.4859 54.6394 18.5263 178.5589 142 W 4.2770 8.7350 124.5811 60.3684 30.9359 178.3961 143 A 3.6854 8.9496 121.5756 55.2253 17.3768 179.2953 144 K 3.7363 8.0078 117.6709 59.8852 31.8976 177.6758 145 E 4.1340 7.4479 115.3328 56.8564 29.4317 176.8280 146 A 4.2813 7.9151 120.9286 51.3986 19.7845 176.8149 147 G 3.8193 7.8572 103.2472 46.3502 0.0000 175.4697 148 L 4.5046 7.3221 121.3282 53.2242 40.1130 176.0137 149 D 4.1997 7.7626 120.8034 54.2282 40.3258 178.3982 150 G 2.0711 7.5403 107.3750 45.1510 0.0000 173.9462 151 S 4.3872 7.7179 113.9536 58.1949 63.3322 174.9538 152 E 4.7035 7.9203 119.5536 53.8089 31.0560 173.9822 153 S 4.5297 8.5807 117.6602 58.9767 63.9362 173.7191 154 V 5.3489 9.7705 124.2770 60.0249 34.8143 173.8199 155 L 4.5682 8.4902 128.8469 54.2737 43.2025 174.6131 156 L 5.1791 8.8220 128.7590 53.4085 44.8160 175.3146 157 V 5.4058 8.4742 118.6022 59.0156 35.3370 174.5274 158 T 4.5462 8.3291 117.5115 61.4902 70.0484 172.9391 159 G 3.8602 8.7820 113.2026 45.3650 0.0000 172.8294 160 N 4.6863 7.7640 119.6454 51.9248 39.6210 174.8242 161 E 4.2339 8.4319 127.3368 57.0273 30.4921 177.4919 162 L 4.4689 7.5026 117.8884 55.5806 45.1031 179.5376 163 V 3.4008 7.3948 117.2665 65.6805 30.8681 177.7023 164 R 3.6268 7.1400 116.9304 59.0790 30.0562 178.1917 165 R 3.8997 7.7598 117.7226 59.7567 29.9227 177.9190 166 A 3.9176 8.2227 121.1480 53.3996 18.3148 180.7965 167 A 3.8944 7.9559 122.7042 49.8530 17.3319 178.0548 168 R 3.7392 8.2022 120.4673 59.6712 28.9557 176.7782 169 N 4.4713 7.9962 113.5275 54.5360 39.2382 174.4195 170 L 4.6097 8.1308 118.3281 52.0447 42.8691 175.6368 171 P 4.5847 0.0000 0.0000 64.0289 31.4429 176.4017 172 W 5.2134 7.7634 114.5396 55.9423 30.4560 174.0791 173 V 4.6368 7.5331 120.5860 61.4839 33.1537 175.8377 174 V 4.0844 8.9348 129.3169 61.0189 31.2176 173.8757 175 T 4.0434 8.0340 120.3430 62.2807 68.2294 172.5799 176 L 4.2929 8.0702 125.3468 54.2456 46.3895 174.8358 177 A 4.4671 8.6703 129.7617 51.6519 19.0269 174.5993 178 P 4.5944 0.0000 0.0000 64.0467 32.4708 177.0508 179 E 4.1873 8.2543 119.2655 59.0929 29.8841 179.1101 180 G 3.8542 8.0433 101.9889 46.3133 0.0000 174.2991 181 L 4.2773 8.1414 124.3952 54.9896 39.6178 174.2766 182 N 4.9590 8.0299 119.1305 50.6472 39.1906 177.4486 183 V 3.7647 8.6792 116.3929 64.5851 31.4553 177.6059 184 Y 4.3712 8.0018 119.4851 60.6764 38.2166 177.1022 185 D 4.0988 10.6100 119.3765 57.5433 40.8135 179.0605 186 I 3.7192 7.5361 119.2507 64.3764 37.1649 178.1424 187 V 3.8708 7.3420 118.0993 65.4690 31.6519 177.8706 188 R 3.9156 7.8856 115.4506 57.9475 29.2279 176.7925 189 T 4.5730 6.6102 107.2398 60.0781 70.4522 174.4138 190 E 4.2893 8.5076 122.7619 58.3542 31.0914 176.7281 191 R 4.7737 7.9911 118.7436 54.2328 33.8100 173.8248 192 L 5.0700 8.6813 127.6863 53.3149 44.8341 175.0231 193 V 5.0625 8.9343 125.6352 61.5645 34.4182 174.0539 194 M 5.3472 9.5617 127.2824 53.5169 35.9411 176.5756 195 D 5.0200 8.5394 121.8070 54.5545 42.8624 175.8698 196 L 4.7578 10.8200 113.1140 56.5003 43.6352 178.3494 197 D 4.4378 8.5733 118.0945 57.1767 40.6108 178.4575 198 A 4.2956 8.2352 120.9558 54.6020 18.2464 179.1729 199 W 4.0350 8.1381 125.9207 60.1592 31.2265 177.5557 200 E 4.4306 8.8404 120.1654 59.1325 28.7062 179.0397 201 V 3.7051 8.4108 119.4331 64.3908 31.1790 178.0516 202 F 4.1687 7.6122 120.6321 60.7946 39.2567 176.4771 203 Q 3.7539 7.7857 115.8333 57.1888 29.0085 176.9738 204 N 4.5927 7.7340 117.3544 54.9985 39.0412 176.3353 205 R 4.1049 7.1149 115.8980 55.6562 30.2576 175.0246 206 I 4.4428 8.0000 122.1951 60.0379 40.0171 177.3560 207 G 4.8893 8.6139 127.0700 47.1553 0.0000 172.0646 *208 G 3.7078 7.5699 111.3628 45.7115 0.0000 172.1069 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.29 4.43 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 2 K 7.42 4.23 0.00 1.99 1.82 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.52 7.81 3 E 8.14 4.91 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.20 0.00 4 V 7.63 4.43 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 0.96 0.00 0.00 1.06 0.00 0.00 5 A 8.55 4.23 1.18 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 0.00 0.00 6 V 7.56 4.44 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 0.80 0.00 0.00 0.94 0.00 0.00 7 Y 7.84 4.54 0.00 3.03 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 8 Q 7.99 4.45 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 9 I 8.48 4.37 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.54 0.86 0.00 0.00 10 P 0.00 4.29 0.00 2.24 1.99 0.00 3.88 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 11 V 8.48 4.29 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 0.83 0.00 0.00 0.96 0.00 0.00 12 L 8.84 4.19 0.00 1.68 1.70 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.16 4.00 0.00 4.05 4.09 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 14 P 0.00 4.51 0.00 1.92 2.04 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 15 S 8.52 3.78 0.00 3.67 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 16 G 7.57 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 17 R 8.44 4.61 0.00 1.68 2.02 0.00 3.21 0.00 0.00 3.16 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 18 R 8.06 4.38 0.00 1.57 1.43 0.00 2.93 0.00 0.00 2.66 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 19 E 8.09 5.13 0.00 2.06 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 2.02 2.16 0.00 20 L 9.21 4.25 0.00 1.81 1.91 1.18 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.60 3.98 1.34 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 22 A 8.45 4.50 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 23 D 7.95 4.54 0.00 3.10 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 24 L 7.16 4.98 0.00 1.78 1.76 1.02 1.19 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 25 P 0.00 4.62 0.00 2.21 2.15 0.00 3.83 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 26 A 8.01 4.11 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.59 4.71 0.00 1.93 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 0.00 2.12 2.19 0.00 28 I 8.53 4.34 1.92 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 1.34 0.93 0.96 0.00 0.00 29 N 8.56 4.66 0.00 2.82 2.82 0.00 0.00 7.17 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 30 P 0.00 4.19 0.00 2.10 2.16 0.00 3.81 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.22 0.00 31 H 8.70 4.08 0.00 3.27 3.59 0.00 5.90 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 9.27 3.80 0.00 1.85 1.87 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.01 4.02 0.00 2.11 1.85 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 34 W 8.53 4.34 0.00 3.40 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 35 E 8.56 3.11 0.00 2.05 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 0.00 2.39 2.31 0.00 36 V 7.51 3.64 2.31 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 1.14 0.00 0.00 1.07 0.00 0.00 37 V 7.83 3.83 2.22 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 0.87 0.00 0.00 1.13 0.00 0.00 38 R 8.41 3.66 0.00 0.94 1.65 0.00 2.85 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.31 0.00 39 W 7.96 3.82 0.00 3.22 3.30 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 40 Q 8.20 3.04 0.00 1.94 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.53 0.00 0.00 0.00 0.00 0.00 1.90 2.62 0.00 41 L 7.98 3.68 0.00 1.54 1.50 0.85 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.49 4.12 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.23 3.91 0.00 1.69 1.67 0.00 0.92 0.00 0.00 0.74 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.74 1.05 7.81 44 R 7.26 4.29 0.00 1.87 1.83 0.00 2.91 0.00 0.00 2.98 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 45 R 7.27 4.40 0.00 1.84 1.76 0.00 2.84 0.00 0.00 2.63 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.67 0.00 46 R 8.66 3.81 0.00 1.72 1.94 0.00 3.40 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 47 G 8.41 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 7.57 4.47 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 1.26 0.00 0.00 49 A 8.25 4.49 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.45 4.83 0.00 3.85 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.52 4.49 4.26 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 1.23 0.00 0.00 52 K 8.19 4.74 0.00 1.68 1.70 0.00 1.61 0.00 0.00 1.91 0.00 0.00 2.70 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.37 7.81 53 T 8.93 4.46 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 1.31 0.00 0.00 54 R 8.58 4.14 0.00 2.10 2.06 0.00 3.07 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 55 G 7.98 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 56 E 8.62 4.60 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 57 V 7.41 3.98 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 0.26 0.00 0.00 0.90 0.00 0.00 58 A 7.92 4.02 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 59 Y 7.08 4.77 0.00 2.98 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.23 4.68 0.00 3.82 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.81 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 0.00 0.00 0.00 62 R 7.30 3.53 0.00 1.84 1.77 0.00 3.08 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 63 K 8.92 4.93 0.00 1.80 1.73 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.67 1.52 7.81 64 I 6.87 3.16 1.42 0.00 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.04 0.86 0.00 0.00 65 W 7.73 5.35 0.00 3.57 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 66 P 0.00 4.29 0.00 2.23 2.13 0.00 3.96 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 67 Q 8.45 3.83 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 68 K 8.99 4.17 0.00 1.65 1.35 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.56 7.81 69 H 9.15 4.66 0.00 3.14 3.25 0.00 5.76 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 70 T 7.73 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 71 G 8.14 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 6.92 3.93 0.00 0.67 0.91 0.00 3.11 0.00 0.00 3.03 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 73 A 7.85 4.21 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.16 4.16 0.00 1.96 1.97 0.00 3.07 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 75 H 8.58 4.85 0.00 3.41 3.32 0.00 5.68 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 9.19 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 77 D 9.41 5.63 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 78 I 8.11 2.74 0.92 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.06 -0.54 0.00 0.00 79 G 7.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.92 4.33 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 4.63 0.00 2.20 2.33 0.00 3.91 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 2.08 1.92 0.00 82 I 7.78 3.63 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.34 0.89 0.00 0.00 83 F 8.64 4.70 0.00 3.31 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 84 V 8.26 3.15 2.22 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 0.86 0.00 0.00 1.00 0.00 0.00 85 G 9.39 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 86 G 7.30 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 0.00 0.00 0.00 87 G 8.60 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 88 V 8.04 4.58 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 0.71 0.00 0.00 0.94 0.00 0.00 89 V 8.11 4.26 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 0.22 0.00 0.00 0.80 0.00 0.00 90 F 8.39 5.11 0.00 3.13 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 91 G 9.40 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 92 P 0.00 4.42 0.00 2.29 2.26 0.00 3.68 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 2.11 2.04 0.00 93 K 8.13 5.14 0.00 1.62 1.73 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.35 7.81 94 P 0.00 4.58 0.00 2.08 2.07 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 95 R 8.11 4.52 0.00 1.66 1.90 0.00 2.34 0.00 0.00 2.87 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.92 0.00 96 D 8.48 4.77 0.00 2.62 2.58 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 97 Y 8.73 4.45 0.00 3.00 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 98 S 7.96 4.85 0.00 3.96 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 99 Y 7.87 4.95 0.00 3.09 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.34 4.43 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 1.19 0.00 0.00 101 L 7.29 3.91 0.00 0.29 0.35 1.04 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.15 0.00 2.12 1.92 0.00 3.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 103 K 8.54 3.85 0.00 1.74 1.77 0.00 1.61 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.36 7.81 104 K 7.98 4.27 0.00 1.77 1.79 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.38 7.81 105 V 7.27 4.34 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 0.74 0.00 0.00 0.87 0.00 0.00 106 R 7.80 4.07 0.00 1.78 1.82 0.00 2.54 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.51 0.00 107 K 7.99 4.23 0.00 1.69 1.66 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.37 7.81 108 K 7.88 4.75 0.00 1.89 1.78 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.65 7.81 109 G 8.05 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.37 4.08 0.00 1.92 1.81 1.11 1.20 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 0.00 111 A 8.00 4.24 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 M 7.99 3.93 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.79 0.00 113 A 8.27 3.98 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 0.00 0.00 114 V 7.47 3.50 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.47 0.00 0.00 115 A 9.97 4.44 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.52 4.36 0.00 2.82 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.02 3.85 0.00 2.01 2.13 0.00 3.41 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 118 A 8.09 4.17 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 0.00 119 R 8.12 3.82 0.00 1.85 2.25 0.00 3.28 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 120 E 7.84 4.09 0.00 2.19 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 0.00 2.37 2.52 0.00 121 G 8.79 4.06 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 0.00 122 K 7.98 4.12 0.00 1.73 1.97 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.53 7.81 123 L 7.91 4.87 0.00 1.70 1.62 1.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 124 L 9.01 4.80 0.00 1.81 1.62 0.95 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.52 5.70 0.00 1.69 1.76 0.36 0.84 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 0.00 126 V 8.11 4.24 2.05 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 0.86 0.00 0.00 0.78 0.00 0.00 127 E 8.34 4.77 0.00 1.98 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 2.17 2.26 0.00 128 A 7.89 4.49 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.21 4.27 0.00 2.88 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.51 4.22 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 0.00 131 G 8.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 9.14 4.13 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 0.69 0.00 0.00 0.91 0.00 0.00 133 N 8.38 3.94 0.00 2.91 2.96 0.00 0.00 7.03 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 0.00 134 G 7.74 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.45 4.43 0.00 1.99 1.71 0.00 1.66 0.00 0.00 1.83 0.00 0.00 3.28 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.61 7.81 136 T 8.68 4.15 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 1.31 0.00 0.00 137 K 8.21 3.92 0.00 1.85 1.95 0.00 1.72 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.61 7.81 138 E 8.39 3.93 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 139 F 8.24 4.34 0.00 3.07 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 0.00 140 L 8.90 4.07 0.00 2.01 1.94 1.27 1.16 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 0.00 141 A 8.75 3.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 W 8.74 4.28 0.00 3.56 3.50 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 0.00 143 A 8.95 3.69 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 0.00 144 K 8.01 3.74 0.00 1.80 1.98 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.45 7.81 145 E 7.45 4.13 0.00 1.70 1.61 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 2.17 2.30 0.00 146 A 7.92 4.28 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.86 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.32 4.50 0.00 1.78 2.12 1.11 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 149 D 7.76 4.20 0.00 2.57 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 0.00 150 G 7.54 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 0.00 0.00 0.00 0.00 0.00 0.00 151 S 7.72 4.39 0.00 3.88 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 0.00 152 E 7.92 4.70 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 153 S 8.58 4.53 0.00 4.01 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 0.00 154 V 9.77 5.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.25 0.00 0.00 155 L 8.49 4.57 0.00 1.80 1.53 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.82 5.18 0.00 1.75 1.37 1.07 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.47 5.41 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 0.95 0.00 0.00 1.05 0.00 0.00 158 T 8.33 4.55 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 1.03 0.00 0.00 159 G 8.78 3.86 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 0.00 0.00 0.00 160 N 7.76 4.69 0.00 2.65 2.39 0.00 0.00 7.18 7.31 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 0.00 161 E 8.43 4.23 0.00 1.92 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 2.20 2.26 0.00 162 L 7.50 4.47 0.00 1.76 1.50 0.85 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.39 3.40 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 -0.40 0.00 0.00 164 R 7.14 3.63 0.00 1.85 1.72 0.00 3.27 0.00 0.00 3.06 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 165 R 7.76 3.90 0.00 1.71 1.92 0.00 3.20 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 166 A 8.22 3.92 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 0.00 167 A 7.96 3.89 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 R 8.20 3.74 0.00 2.03 1.77 0.00 3.04 0.00 0.00 3.16 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 0.00 169 N 8.00 4.47 0.00 2.63 2.78 0.00 0.00 6.86 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 0.00 170 L 8.13 4.61 0.00 1.32 1.02 1.06 0.92 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 0.00 171 P 0.00 4.58 0.00 2.32 2.25 0.00 3.83 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.10 0.00 172 W 7.76 5.21 0.00 3.50 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 V 7.53 4.64 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 -0.11 0.00 0.00 174 V 8.93 4.08 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 0.90 0.00 0.00 0.94 0.00 0.00 175 T 8.03 4.04 4.08 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 1.12 0.00 0.00 176 L 8.07 4.29 0.00 1.74 1.59 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 177 A 8.67 4.47 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.59 0.00 2.22 2.20 0.00 3.75 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 179 E 8.25 4.19 0.00 2.10 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 2.37 2.37 0.00 180 G 8.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 L 8.14 4.28 0.00 1.73 1.70 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 182 N 8.03 4.96 0.00 3.07 2.98 0.00 0.00 6.10 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 0.00 183 V 8.68 3.76 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 0.94 0.00 0.00 1.14 0.00 0.00 184 Y 8.00 4.37 0.00 3.30 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 D 10.61 4.10 0.00 2.79 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 0.00 186 I 7.54 3.72 2.04 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 1.40 0.61 0.93 0.00 0.00 187 V 7.34 3.87 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.03 0.00 0.00 188 R 7.89 3.92 0.00 1.76 1.57 0.00 2.21 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.49 0.00 189 T 6.61 4.57 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 190 E 8.51 4.29 0.00 1.96 2.06 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 2.34 2.29 0.00 191 R 7.99 4.77 0.00 2.02 1.82 0.00 3.47 0.00 0.00 3.38 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 192 L 8.68 5.07 0.00 1.79 1.52 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 193 V 8.93 5.06 2.37 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 1.18 0.00 0.00 1.11 0.00 0.00 194 M 9.56 5.35 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 195 D 8.54 5.02 0.00 3.01 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 10.82 4.76 0.00 1.79 1.72 1.10 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 197 D 8.57 4.44 0.00 2.76 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 A 8.24 4.30 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 W 8.14 4.03 0.00 3.54 3.44 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 0.00 200 E 8.84 4.43 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 201 V 8.41 3.71 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.95 0.00 0.00 202 F 7.61 4.17 0.00 2.86 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 0.00 203 Q 7.79 3.75 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.80 0.00 204 N 7.73 4.59 0.00 2.80 2.80 0.00 0.00 6.78 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 0.00 205 R 7.11 4.10 0.00 1.74 1.86 0.00 3.24 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 206 I 8.00 4.44 1.46 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 -0.19 0.72 0.00 0.00 207 G 8.61 4.89 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 *208 G 7.57 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 * Residues marked with a * may have inaccurate shift predictions.