NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.5273 8.3649 120.1961 54.0316 42.0145 174.6362 5 I 3.9677 8.2821 128.4263 59.3408 37.9069 170.0826 6 V 4.1125 8.9016 128.0686 62.0364 33.7300 174.2919 7 L 5.0726 8.5515 127.0071 53.4321 44.3101 175.1377 8 T 4.8119 8.7792 121.4776 61.9942 70.8788 173.6279 9 Q 4.7392 8.7434 125.9112 55.3186 30.1762 176.4720 10 S 3.7266 8.5193 118.2298 60.9573 62.8409 173.9395 11 H 5.0335 7.6734 119.1981 52.5690 32.8161 173.8101 12 K 4.1076 8.6139 123.6392 58.9104 33.2233 176.6252 13 F 5.5122 7.9239 116.4204 55.9559 43.3403 174.4626 14 M 4.7817 9.1988 121.6825 53.8152 35.5806 174.5639 15 S 5.0330 8.7959 120.3978 58.3811 64.5604 173.6042 16 T 4.7671 8.8272 118.0245 61.3993 71.3678 171.9107 17 S 4.9733 8.2444 114.8442 56.4325 66.7152 173.9205 18 V 3.7776 8.4457 120.8574 65.1299 31.4540 176.1171 19 G 4.4605 8.8238 115.6216 44.9512 0.0000 173.3204 20 D 4.6502 7.9248 119.5767 54.0175 42.5956 174.9964 21 R 5.6575 8.2386 119.9276 54.1249 31.8550 175.2520 22 V 4.5111 8.4665 125.1687 61.1648 35.5099 174.4346 23 S 4.8309 8.4337 120.5929 56.9780 66.1537 173.2930 24 I 4.4487 8.7791 127.3002 59.9942 38.7588 175.3065 25 T 5.3552 8.5483 116.8345 60.3720 72.2023 173.7650 26 C 5.4560 9.4604 122.4981 55.2352 48.9677 172.3541 27 K 5.2576 9.2753 127.2900 54.6073 34.3588 175.1659 28 A 4.8904 8.9044 129.7876 51.5581 19.5370 176.9810 29 S 4.6389 8.3844 113.8478 58.4082 63.7292 173.7256 30 Q 4.4990 7.5203 117.3100 55.0521 32.3301 173.1810 31 D 4.6216 8.6489 119.7858 54.9275 41.5840 176.1850 32 V 4.3104 8.8608 119.1273 60.3248 33.8281 177.8153 33 G 3.9355 8.5020 114.3662 47.2305 0.0000 175.4071 34 T 4.8367 8.9428 116.7350 61.4829 68.9143 173.0963 35 A 3.3766 7.7828 125.4002 50.0414 17.3570 176.8773 36 V 4.6459 6.8074 121.0391 60.1239 35.5782 174.5950 37 A 5.3704 8.8756 128.2048 50.0408 22.8594 174.6077 38 W 5.0934 8.9462 119.3594 55.0589 32.3904 174.6183 39 Y 5.2359 9.9528 122.1955 56.2440 41.5678 174.1467 40 Q 4.6134 8.8397 123.7310 54.2805 31.9787 174.0973 41 Q 4.5672 8.7622 126.8319 54.4165 32.2598 174.0966 42 K 4.6623 8.4623 125.4854 54.2402 34.5383 174.5648 43 P 4.2269 0.0000 0.0000 64.3493 31.6289 176.5213 44 G 4.0280 8.8845 109.9324 46.5671 0.0000 173.2114 45 Q 4.6249 7.7288 116.4633 53.4003 32.8060 175.5048 46 S 4.0731 8.4123 115.1508 57.0192 64.0766 172.2316 47 P 3.9774 0.0000 0.0000 62.9961 31.7503 175.2977 48 K 4.3978 8.7577 124.0410 54.1515 34.9248 174.8732 49 L 4.1272 8.4846 129.7904 55.4049 42.3592 175.5692 50 L 4.5411 8.8099 125.4429 55.9611 44.4622 176.7052 51 I 5.4383 7.5153 118.2109 59.9718 41.7283 173.8043 52 Y 5.2825 8.6619 123.7623 54.9480 42.3068 174.8010 53 W 4.1645 9.3149 115.2549 57.2029 27.2210 177.6875 54 A 4.3055 8.6056 124.8462 53.6306 18.0737 179.6759 55 S 4.6379 8.7347 105.3229 58.3210 64.9388 173.5837 56 T 4.2971 8.1971 119.9111 62.4063 69.2600 174.3125 57 R 4.4211 8.5396 127.9016 56.6341 31.0382 175.4919 58 H 4.9331 9.1383 125.9144 55.4406 31.7082 174.5711 59 T 4.0247 8.4110 119.7758 65.7761 68.8341 172.6167 60 G 4.3291 9.5395 118.2910 46.1395 0.0000 174.3560 61 V 3.5055 7.2509 118.8221 62.2650 32.0679 174.0974 62 P 4.6405 0.0000 0.0000 62.1765 32.4136 176.6797 63 D 4.4493 9.2255 119.5361 58.7424 40.9072 179.4968 64 R 3.8486 7.4487 116.7865 58.1107 31.3714 176.1317 65 F 4.9696 8.0672 117.7588 56.5646 40.3633 176.1137 66 T 4.6854 8.8770 119.4899 61.8534 72.6751 173.2821 67 G 4.5670 8.4566 112.3688 44.8717 0.0000 172.0287 68 S 4.7175 8.6712 113.8484 57.8302 66.6389 173.7637 69 G 4.3090 8.2104 105.2521 44.6075 0.0000 173.1718 70 S 4.5007 7.7447 112.4241 58.2018 64.5915 172.7847 71 G 3.9081 9.2536 118.9311 45.4187 0.0000 174.3858 72 T 4.5685 7.2744 112.2150 60.3730 70.8254 172.9117 73 D 5.3217 7.5703 121.0653 52.3834 43.7268 175.2240 74 F 5.2155 9.3621 121.3772 56.1386 43.6368 174.1777 75 T 5.1330 9.5708 118.2071 61.9443 73.0200 172.4140 76 L 4.5315 8.6789 128.5290 53.2978 44.2955 174.9968 77 T 4.7901 8.9146 122.8396 61.7437 72.1616 173.0132 78 I 3.8693 8.0272 127.8724 59.4646 37.8768 175.9239 79 S 3.8026 8.8690 123.3209 60.1886 62.7176 173.7142 80 N 5.0227 7.5438 120.6487 49.7661 38.4775 172.7177 81 V 3.8416 8.4076 122.1465 63.0874 33.1475 174.5557 82 Q 4.8829 9.5737 124.6925 54.0539 33.1989 176.5505 83 S 4.1084 9.0117 116.4647 62.0744 62.8216 176.9241 84 E 4.1861 8.1913 114.6354 58.0600 29.1815 177.0265 85 D 4.8028 8.0558 119.2431 55.5915 41.5197 176.4690 86 L 4.3587 8.4103 120.2618 55.5034 42.0251 176.4741 87 A 4.2854 7.9961 124.6818 52.1490 24.4134 173.8185 88 D 5.0390 8.0425 116.4634 53.4702 43.1215 175.8265 89 Y 5.2024 8.3459 119.7997 56.2445 41.3618 174.7545 90 F 5.3958 10.0316 122.1156 55.8544 43.4844 171.5388 91 C 4.5211 8.7369 116.2015 53.6251 45.2633 172.2643 92 Q 4.8479 8.6007 120.9626 54.4474 32.8600 173.1077 93 Q 4.7582 8.3090 126.3360 53.8121 31.6642 175.0076 94 Y 4.3317 7.6276 125.4089 57.0923 37.9028 177.4930 95 S 3.9019 7.8526 115.9824 61.6544 62.7436 173.7219 96 S 4.4475 7.2766 111.0773 56.2912 66.0430 172.6325 97 Y 4.3413 7.9215 118.3474 56.4461 38.7317 173.9822 98 P 4.7227 0.0000 0.0000 61.9441 32.6537 176.0353 99 L 3.7963 6.9401 120.3303 55.3475 42.0839 176.3777 100 T 4.8614 7.9213 110.6902 60.0425 72.7552 172.3547 101 F 5.3317 8.7276 119.2252 55.6651 43.2271 174.8866 102 G 4.5226 9.2749 107.2700 44.1939 0.0000 175.1172 103 A 4.1972 8.7484 123.3762 53.2351 18.7209 178.2326 104 G 3.3961 8.0052 102.0519 44.7987 0.0000 173.6973 105 T 4.6033 7.9228 114.7373 61.5998 72.5145 173.2594 106 K 4.5375 9.0783 129.9198 55.7454 33.3747 175.3330 107 L 5.1514 9.1587 130.9771 53.8561 43.2685 174.6884 108 E 5.0071 8.7450 124.2642 54.2132 33.2759 174.9204 109 L 4.8915 8.4986 121.3781 55.5133 42.5166 177.0192 110 K 4.6105 8.8540 125.1453 57.2329 39.6258 177.9067 *111 R 4.1101 7.9023 122.5271 56.3991 31.2377 177.9393 *132 Q 4.2399 7.9414 116.7182 54.6564 29.6353 173.8050 133 V 3.7342 8.3529 114.6578 64.8123 31.7383 176.0592 134 Q 4.6909 8.6451 126.3662 53.9616 30.4959 174.7688 135 L 4.4548 8.0939 124.4048 53.9205 44.6578 176.1796 136 Q 3.3737 8.8399 128.7991 57.5873 26.8963 175.0151 137 E 4.5165 7.6069 115.8635 53.9748 31.0115 174.2396 138 P 4.8354 0.0000 0.0000 61.5909 34.4721 175.1619 139 G 4.0489 8.3492 105.9930 45.7797 0.0000 173.0161 140 G 4.9950 8.0830 105.3219 46.7307 0.0000 172.2926 141 E 4.9227 8.6614 118.0765 54.5016 33.7324 174.3803 142 L 5.0336 8.5073 122.9550 53.7583 43.9344 175.6413 143 V 4.5685 8.9807 118.9150 59.5534 36.2000 174.0877 144 R 4.7742 8.2045 121.0099 53.9151 32.1881 173.6736 145 P 4.3313 0.0000 0.0000 64.7088 31.7230 176.6211 146 G 3.8792 8.9407 111.4222 45.1275 0.0000 173.2509 147 A 4.3730 8.1604 121.9687 51.8124 20.1022 176.0790 148 S 5.0946 8.3064 112.3898 56.8324 65.6438 173.3523 149 V 4.5534 8.5392 124.6014 59.7533 35.3204 174.4434 150 K 4.7901 8.3827 121.7842 54.7994 34.4939 175.2610 151 L 4.6815 8.8715 128.9692 53.9414 43.3234 176.3626 152 S 5.0513 8.6528 116.7782 57.3204 65.8619 174.8570 153 C 4.6686 8.5452 121.5609 55.4510 45.5857 171.8542 154 K 4.6625 8.4623 126.7743 55.2811 32.7697 175.4958 155 A 4.8409 8.5856 129.2052 50.7994 21.2953 175.9368 156 S 4.2520 8.5456 111.9669 58.4648 65.1925 174.7497 157 G 3.9311 10.1631 113.5298 45.4614 0.0000 172.2207 158 Y 4.5222 6.8707 114.8955 56.0331 40.2847 174.2871 159 T 3.9624 8.3260 116.9273 63.3197 67.5819 174.9747 160 F 3.8597 8.5518 130.2353 61.1506 39.4041 176.6087 161 T 3.6487 7.7164 108.8946 63.5336 68.9855 175.3147 162 S 4.4606 7.8795 116.2678 59.0509 63.3040 173.5133 163 Y 4.8760 7.4978 117.7583 55.4297 41.0743 175.2869 164 W 4.5479 9.2197 123.7382 57.2074 30.4511 175.4495 165 I 4.8103 8.9299 122.5332 59.8371 40.1346 174.5230 166 N 5.5542 9.4174 124.4025 51.4252 41.9037 173.8491 167 W 5.0734 8.7401 120.7689 54.9314 32.3727 174.6960 168 V 4.9598 9.2196 125.1042 60.9713 34.1315 174.1202 169 K 4.5524 8.9703 128.8790 55.1779 34.6627 175.3427 170 Q 4.6540 8.5278 127.1170 54.6637 31.7942 173.6386 171 R 4.5961 8.4289 126.1540 54.4244 31.6996 174.7389 172 P 4.3872 0.0000 0.0000 64.4335 31.6493 175.9909 173 G 4.1777 8.9944 109.5516 45.4342 0.0000 173.0403 174 Q 4.6382 7.4702 117.1968 53.9132 31.3663 174.3442 175 G 4.0860 8.2926 107.0863 45.3690 0.0000 172.4895 176 L 4.6125 7.8614 118.6635 53.0675 43.3724 175.5857 177 E 5.0301 8.8469 121.7697 54.2992 32.7247 174.8973 178 W 4.8189 9.4108 135.0000 57.5573 31.1604 175.7419 179 I 3.7032 8.9121 129.1814 62.1743 38.1071 176.2078 180 G 2.7889 5.7583 106.6517 45.9370 0.0000 170.2305 181 N 5.8956 7.9734 116.6911 52.0697 41.7932 173.0773 182 I 5.0981 8.9635 117.1172 60.2652 42.2207 172.7258 183 Y 3.8808 8.9095 131.2388 55.6144 38.7700 173.9859 184 P 3.8907 0.0000 0.0000 65.7435 31.5957 177.6012 185 S 4.0919 7.1963 110.6765 60.9131 61.9652 174.6046 186 D 4.8380 7.6809 114.2877 52.2689 39.8046 175.4298 187 S 3.7609 8.4186 113.4570 59.8018 61.2256 171.3970 188 Y 4.2410 7.9360 122.4160 58.0244 39.4537 174.9392 189 T 5.1560 7.6197 115.4803 59.9158 72.1883 172.6767 190 N 4.9678 8.7822 120.5762 51.6609 41.9471 172.9767 191 Y 5.0148 8.4202 120.0490 55.8981 41.4443 174.8224 192 N 4.9621 9.1563 122.7631 53.4986 39.7902 176.0914 193 Q 4.1820 9.2540 125.1808 58.1596 29.2098 178.5410 194 K 3.8466 9.3458 119.8602 58.6199 32.4748 177.3607 195 F 4.7100 8.3701 115.8585 56.8626 39.2442 177.0366 196 K 3.5004 7.5654 124.7160 59.3093 31.7682 177.2108 197 D 4.7163 7.9251 114.1297 53.9463 41.7839 176.0130 198 K 4.3756 7.8476 120.8313 57.9830 33.9057 176.2081 199 A 5.0478 7.6502 119.5363 50.8573 20.8077 176.7824 200 T 4.5680 7.9595 114.7941 62.6560 72.8612 172.9379 201 L 5.2126 9.2961 127.6279 53.4049 44.0310 175.8858 202 T 4.8610 8.6357 111.6159 60.9354 72.8551 172.5274 203 V 5.1138 8.2521 113.7519 60.2156 36.5565 174.8448 204 D 4.6688 9.1467 120.9214 52.4568 42.8037 176.0475 205 K 4.1606 8.9258 126.8168 59.3576 32.6349 179.4052 206 S 4.1562 8.4475 112.8358 60.9351 62.0157 174.9664 207 S 4.4683 7.5340 109.6197 57.1165 63.7380 173.7263 208 S 2.7900 7.3836 114.4357 59.9833 60.3807 171.9617 209 T 4.6311 6.7249 115.0619 61.6216 72.3917 174.6240 210 A 5.2242 8.9663 128.5938 51.2001 21.4327 175.4550 211 Y 5.3462 9.2378 116.8814 56.6809 43.0576 174.2852 212 M 4.7628 8.5075 120.3383 53.9061 36.0105 173.2554 213 Q 4.9111 8.5828 127.0109 54.2490 31.9284 173.7732 214 L 5.0480 8.5268 126.7620 52.9850 44.0385 175.8006 215 S 4.8160 8.2610 117.0048 55.9063 66.1301 173.6794 216 S 3.6534 8.4414 113.9768 59.3373 60.3215 172.9064 217 L 4.4336 7.8208 119.9374 55.4585 42.5995 177.1631 218 T 5.0668 9.2382 110.9317 59.5954 72.2214 174.7693 219 S 4.1772 8.8313 115.7145 61.7289 62.6101 176.6815 220 E 4.0829 7.6870 117.8801 58.8352 29.2508 177.3783 221 D 4.7890 8.5091 117.1234 55.0250 40.9961 176.2344 222 S 4.7130 7.8106 117.0511 58.0612 63.6022 173.7124 223 A 4.1323 8.1247 125.2880 52.0868 23.8926 174.4036 224 V 4.2670 7.5520 118.5415 61.9803 33.1976 174.4423 225 Y 4.9078 8.8060 126.4895 56.5648 39.8555 174.6937 226 F 5.3311 9.8211 124.4190 55.9129 41.8388 172.5070 227 C 4.4495 8.4159 116.2426 53.6852 39.3442 172.3522 228 A 4.8347 8.3466 121.6773 50.5705 22.7257 174.9350 229 R 4.8423 8.4711 118.8423 53.5586 34.2783 174.0306 230 W 4.3705 9.1631 133.4831 59.6046 30.3693 175.8543 231 G 3.3054 9.6950 113.3845 45.2648 0.0000 172.0910 232 Y 4.5248 8.0168 117.3143 57.1306 41.0721 173.9352 233 W 4.7370 8.7811 125.3641 54.8219 30.9187 177.0136 234 G 3.9993 8.5860 111.1142 45.3003 0.0000 173.4825 235 Q 4.2711 8.6692 116.6182 56.0853 29.1849 177.6193 236 G 3.8006 8.7083 102.0584 45.5706 0.0000 172.6355 237 T 4.8127 8.1032 114.3339 61.5708 72.9930 172.9960 238 L 4.8771 8.4513 127.8175 53.9572 44.0115 175.1519 239 V 4.8674 8.8844 126.2327 61.4312 34.4663 174.1848 240 T 4.9237 8.7163 123.8159 61.7062 71.9841 172.8432 241 V 4.8555 8.2821 126.3951 61.3687 33.2222 175.4440 242 S 4.4069 8.5690 123.2843 57.5994 67.1174 174.6257 *243 A 4.0850 8.6184 127.1697 52.4159 18.6695 175.8896 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 4 D 8.36 4.53 0.00 2.69 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 5 I 8.28 3.97 1.81 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 1.27 0.77 0.87 0.00 0.00 6 V 8.90 4.11 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 0.98 0.00 0.00 0.96 0.00 0.00 7 L 8.55 5.07 0.00 1.62 1.54 0.81 0.65 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 8 T 8.78 4.81 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 9 Q 8.74 4.74 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 10 S 8.52 3.73 0.00 3.63 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 11 H 7.67 5.03 0.00 3.15 3.31 0.00 5.70 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 12 K 8.61 4.11 0.00 1.70 1.56 0.00 1.59 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.30 1.04 7.81 13 F 7.92 5.51 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 M 9.20 4.78 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 15 S 8.80 5.03 0.00 3.75 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 16 T 8.83 4.77 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 1.20 0.00 0.00 17 S 8.24 4.97 0.00 4.06 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 18 V 8.45 3.78 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 0.84 0.00 0.00 0.93 0.00 0.00 19 G 8.82 4.46 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 0.00 20 D 7.92 4.65 0.00 2.83 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 21 R 8.24 5.66 0.00 1.73 1.74 0.00 2.94 0.00 0.00 3.75 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.33 0.00 22 V 8.47 4.51 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 0.84 0.00 0.00 0.84 0.00 0.00 23 S 8.43 4.83 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 24 I 8.78 4.45 1.48 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 1.10 0.00 0.00 25 T 8.55 5.36 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 26 C 9.46 5.46 0.00 3.20 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 9.28 5.26 0.00 1.88 1.66 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.52 7.81 28 A 8.90 4.89 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 29 S 8.38 4.64 0.00 3.94 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 30 Q 7.52 4.50 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 31 D 8.65 4.62 0.00 2.62 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.86 4.31 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 0.68 0.00 0.00 1.00 0.00 0.00 33 G 8.50 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 34 T 8.94 4.84 4.39 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 1.53 0.00 0.00 35 A 7.78 3.38 0.32 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 36 V 6.81 4.65 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 0.38 0.00 0.00 -0.46 0.00 0.00 37 A 8.88 5.37 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 38 W 8.95 5.09 0.00 3.25 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 39 Y 9.95 5.24 0.00 2.86 2.62 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 40 Q 8.84 4.61 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 1.95 1.73 0.00 41 Q 8.76 4.57 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.60 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 42 K 8.46 4.66 0.00 1.85 1.67 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.45 7.81 43 P 0.00 4.23 0.00 2.04 2.02 0.00 3.81 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 2.04 2.11 0.00 44 G 8.88 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 45 Q 7.73 4.62 0.00 2.14 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 46 S 8.41 4.07 0.00 3.77 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 3.98 0.00 0.49 0.81 0.00 2.20 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.07 0.00 48 K 8.76 4.40 0.00 1.58 1.58 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.65 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.15 1.18 7.81 49 L 8.48 4.13 0.00 1.54 1.21 0.39 0.21 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 50 L 8.81 4.54 0.00 1.75 1.53 0.88 0.04 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 51 I 7.52 5.44 2.10 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 1.47 0.75 1.13 0.00 0.00 52 Y 8.66 5.28 0.00 3.25 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 W 9.31 4.16 0.00 3.55 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 54 A 8.61 4.31 1.65 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 0.00 0.00 55 S 8.73 4.64 0.00 3.91 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 56 T 8.20 4.30 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 0.90 0.00 0.00 57 R 8.54 4.42 0.00 1.86 1.88 0.00 3.29 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 58 H 9.14 4.93 0.00 3.45 3.13 0.00 5.67 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.41 4.02 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 1.26 0.00 0.00 60 G 9.54 4.33 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 0.00 61 V 7.25 3.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.98 0.00 0.00 62 P 0.00 4.64 0.00 2.37 2.25 0.00 3.84 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 2.52 2.20 0.00 63 D 9.23 4.45 0.00 2.67 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 64 R 7.45 3.85 0.00 1.66 1.45 0.00 3.34 0.00 0.00 3.35 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 65 F 8.07 4.97 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 66 T 8.88 4.69 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 1.19 0.00 0.00 67 G 8.46 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 0.00 0.00 0.00 0.00 68 S 8.67 4.72 0.00 3.90 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 69 G 8.21 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 0.00 0.00 0.00 0.00 70 S 7.74 4.50 0.00 3.79 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 71 G 9.25 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 72 T 7.27 4.57 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 1.16 0.00 0.00 73 D 7.57 5.32 0.00 2.47 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 9.36 5.22 0.00 3.25 3.24 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 75 T 9.57 5.13 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 1.15 0.00 0.00 76 L 8.68 4.53 0.00 0.27 0.28 0.52 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.91 4.79 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 1.11 0.00 0.00 78 I 8.03 3.87 1.52 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.58 0.23 0.00 0.00 79 S 8.87 3.80 0.00 3.79 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 80 N 7.54 5.02 0.00 2.70 2.65 0.00 0.00 6.53 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 81 V 8.41 3.84 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 0.85 0.00 0.00 0.85 0.00 0.00 82 Q 9.57 4.88 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 83 S 9.01 4.11 0.00 3.90 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 84 E 8.19 4.19 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 85 D 8.06 4.80 0.00 2.96 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 86 L 8.41 4.36 0.00 1.55 1.77 0.98 0.81 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 87 A 8.00 4.29 1.03 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 88 D 8.04 5.04 0.00 2.77 2.32 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 89 Y 8.35 5.20 0.00 2.98 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 90 F 10.03 5.40 0.00 3.11 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 91 C 8.74 4.52 0.00 1.95 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 92 Q 8.60 4.85 0.00 2.28 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 1.91 1.22 0.00 93 Q 8.31 4.76 0.00 1.85 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 1.95 2.22 0.00 94 Y 7.63 4.33 0.00 2.57 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 95 S 7.85 3.90 0.00 3.56 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 96 S 7.28 4.45 0.00 3.85 3.65 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 97 Y 7.92 4.34 0.00 3.01 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 98 P 0.00 4.72 0.00 2.58 2.42 0.00 3.85 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 2.10 2.16 0.00 99 L 6.94 3.80 0.00 0.39 0.99 0.43 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 100 T 7.92 4.86 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 1.31 0.00 0.00 101 F 8.73 5.33 0.00 2.87 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 G 9.27 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.75 4.20 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 0.00 104 G 8.01 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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6.92 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 133 V 8.35 3.73 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 0.96 0.00 0.00 0.93 0.00 0.00 134 Q 8.65 4.69 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 135 L 8.09 4.45 0.00 1.53 1.52 0.92 0.72 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 0.00 136 Q 8.84 3.37 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 137 E 7.61 4.52 0.00 1.95 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 2.21 2.38 0.00 138 P 0.00 4.84 0.00 2.14 2.24 0.00 3.71 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 1.89 1.84 0.00 139 G 8.35 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 0.00 140 G 8.08 4.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.66 4.92 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 142 L 8.51 5.03 0.00 1.67 1.60 0.92 0.92 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 0.00 143 V 8.98 4.57 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.99 0.00 0.00 144 R 8.20 4.77 0.00 1.88 1.76 0.00 3.20 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 145 P 0.00 4.33 0.00 2.07 2.01 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 146 G 8.94 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 0.00 147 A 8.16 4.37 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 0.00 148 S 8.31 5.09 0.00 3.77 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 0.00 149 V 8.54 4.55 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 0.55 0.00 0.00 0.91 0.00 0.00 150 K 8.38 4.79 0.00 1.63 1.64 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.16 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.25 1.37 7.81 151 L 8.87 4.68 0.00 1.52 1.63 0.76 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.65 5.05 0.00 3.75 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 0.00 153 C 8.55 4.67 0.00 3.07 3.26 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 0.00 154 K 8.46 4.66 0.00 1.65 1.60 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.70 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.29 1.39 7.81 155 A 8.59 4.84 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 S 8.55 4.25 0.00 3.72 3.64 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 0.00 157 G 10.16 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 0.00 0.00 0.00 158 Y 6.87 4.52 0.00 2.91 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 0.00 159 T 8.33 3.96 4.42 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 1.25 0.00 0.00 160 F 8.55 3.86 0.00 2.55 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 0.00 161 T 7.72 3.65 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 1.18 0.00 0.00 162 S 7.88 4.46 0.00 4.03 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 0.00 163 Y 7.50 4.88 0.00 2.96 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 0.00 164 W 9.22 4.55 0.00 3.34 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 0.00 165 I 8.93 4.81 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 0.84 0.00 0.00 166 N 9.42 5.55 0.00 2.48 2.87 0.00 0.00 6.36 7.93 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 0.00 167 W 8.74 5.07 0.00 3.10 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 0.00 168 V 9.22 4.96 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 1.04 0.00 0.00 0.91 0.00 0.00 169 K 8.97 4.55 0.00 1.72 1.59 0.00 1.79 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 0.99 7.81 170 Q 8.53 4.65 0.00 2.21 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 171 R 8.43 4.60 0.00 1.82 1.83 0.00 3.39 0.00 0.00 3.43 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.61 0.00 172 P 0.00 4.39 0.00 2.19 2.07 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 173 G 8.99 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 0.00 0.00 0.00 174 Q 7.47 4.64 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 175 G 8.29 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 0.00 0.00 0.00 176 L 7.86 4.61 0.00 0.28 0.81 -0.48 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 177 E 8.85 5.03 0.00 2.07 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 2.45 2.37 0.00 178 W 9.41 4.82 0.00 3.59 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 0.00 179 I 8.91 3.70 1.74 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 -0.30 0.16 0.59 0.00 0.00 180 G 5.76 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 0.00 0.00 0.00 181 N 7.97 5.90 0.00 3.32 3.61 0.00 0.00 6.85 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 I 8.96 5.10 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.26 1.10 0.00 0.00 183 Y 8.91 3.88 0.00 1.43 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 P 0.00 3.89 0.00 1.36 1.06 0.00 2.78 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 185 S 7.20 4.09 0.00 3.64 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 0.00 186 D 7.68 4.84 0.00 2.85 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 0.00 187 S 8.42 3.76 0.00 4.05 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 0.00 188 Y 7.94 4.24 0.00 3.41 2.89 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 0.00 189 T 7.62 5.16 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 1.15 0.00 0.00 190 N 8.78 4.97 0.00 2.59 2.47 0.00 0.00 6.75 7.10 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 0.00 191 Y 8.42 5.01 0.00 2.85 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 0.00 192 N 9.16 4.96 0.00 3.35 3.18 0.00 0.00 7.15 7.32 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 0.00 193 Q 9.25 4.18 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.68 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 194 K 9.35 3.85 0.00 1.60 1.83 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.60 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.50 1.09 7.81 195 F 8.37 4.71 0.00 3.16 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 0.00 196 K 7.57 3.50 0.00 1.66 1.93 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 197 D 7.93 4.72 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 0.00 198 K 7.85 4.38 0.00 1.90 2.03 0.00 1.63 0.00 0.00 1.99 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.54 7.81 199 A 7.65 5.05 1.17 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 0.00 0.00 200 T 7.96 4.57 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 1.20 0.00 0.00 201 L 9.30 5.21 0.00 1.37 1.58 0.91 0.83 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 0.00 202 T 8.64 4.86 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 1.22 0.00 0.00 203 V 8.25 5.11 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 0.78 0.00 0.00 1.04 0.00 0.00 204 D 9.15 4.67 0.00 2.93 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 0.00 205 K 8.93 4.16 0.00 1.90 1.91 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.49 7.81 206 S 8.45 4.16 0.00 3.77 4.47 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.53 4.47 0.00 3.87 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 0.00 208 S 7.38 2.79 0.00 3.68 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 0.00 209 T 6.72 4.63 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 0.31 0.00 0.00 210 A 8.97 5.22 1.53 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 0.00 211 Y 9.24 5.35 0.00 2.89 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 0.00 212 M 8.51 4.76 0.00 0.53 0.57 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 213 Q 8.58 4.91 0.00 2.03 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.56 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 214 L 8.53 5.05 0.00 1.43 1.40 0.13 0.26 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 0.00 215 S 8.26 4.82 0.00 3.80 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 0.00 216 S 8.44 3.65 0.00 3.95 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 0.00 217 L 7.82 4.43 0.00 1.71 1.60 0.89 0.41 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 0.00 218 T 9.24 5.07 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 1.25 0.00 0.00 219 S 8.83 4.18 0.00 4.04 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 0.00 220 E 7.69 4.08 0.00 2.10 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 0.00 2.37 2.30 0.00 221 D 8.51 4.79 0.00 2.83 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 S 7.81 4.71 0.00 3.73 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 0.00 223 A 8.12 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 7.55 4.27 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.80 0.00 0.00 225 Y 8.81 4.91 0.00 3.08 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 0.00 226 F 9.82 5.33 0.00 3.01 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 0.00 227 C 8.42 4.45 0.00 1.79 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 0.00 228 A 8.35 4.83 0.06 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 0.00 229 R 8.47 4.84 0.00 1.80 1.64 0.00 3.11 0.00 0.00 3.05 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.42 0.00 230 W 9.16 4.37 0.00 3.45 3.24 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 0.00 231 G 9.70 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 0.00 0.00 0.00 232 Y 8.02 4.52 0.00 2.83 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 0.00 233 W 8.78 4.74 0.00 2.99 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 0.00 234 G 8.59 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 Q 8.67 4.27 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 236 G 8.71 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 0.00 237 T 8.10 4.81 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 238 L 8.45 4.88 0.00 1.72 1.52 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 239 V 8.88 4.87 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 0.95 0.00 0.00 1.02 0.00 0.00 240 T 8.72 4.92 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 0.00 241 V 8.28 4.86 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 0.78 0.00 0.00 0.96 0.00 0.00 242 S 8.57 4.41 0.00 3.80 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 *243 A 8.62 4.08 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 * Residues marked with a * may have inaccurate shift predictions.