NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2730 7.8827 121.4502 61.1886 38.3354 174.0404 17 V 4.1237 8.5000 126.6769 62.4819 32.2983 174.9393 18 G 3.7945 9.0568 114.2483 46.0704 0.0000 173.6866 19 G 4.0799 7.6591 109.8641 44.7234 0.0000 172.3517 20 Y 4.9451 7.5786 117.1580 55.3116 42.2745 174.2683 21 N 4.8826 8.8362 117.8342 53.2289 39.0943 176.1080 22 C 4.4647 8.6839 122.5201 56.8600 39.0767 174.0183 23 E 4.2276 9.0218 122.5037 55.9652 29.8775 176.1916 24 E 3.9508 8.6599 119.8944 58.5701 30.0015 177.4229 25 N 4.1167 8.4913 120.7045 54.3724 36.2379 174.9531 26 S 4.5165 7.5643 111.9195 58.9126 65.0140 174.3602 27 V 3.9160 7.0461 120.4261 60.8864 31.2854 174.1427 28 P 4.4389 0.0000 0.0000 65.0002 32.1561 177.8522 29 Y 5.2325 6.8363 115.6310 56.6624 38.7623 174.6075 30 Q 4.5384 7.4173 123.6761 56.3788 29.7185 175.4393 31 V 4.9546 8.8626 118.8945 59.5740 36.3937 174.3742 32 S 5.1817 8.5493 116.1132 56.7159 65.9260 172.9747 33 L 4.8366 8.4609 122.3077 53.4501 43.8798 175.3421 34 N 5.9935 8.2946 118.1925 50.9885 43.2500 174.1782 *37 S 4.6633 8.6005 117.7337 57.9148 62.9366 172.8931 38 G 4.1159 8.3190 117.8162 44.5520 0.0000 170.9910 39 Y 4.6726 7.3332 114.5782 54.6103 41.7394 174.6814 40 H 4.8687 8.8463 117.1650 55.8203 28.9451 175.0651 41 F 5.0250 7.9704 117.3516 56.8584 39.4293 173.9968 42 C 4.8590 7.4541 115.4393 56.5317 44.8154 173.3089 43 G 4.1203 8.7444 109.3373 45.9570 0.0000 172.2387 44 G 4.5260 8.0490 105.1619 46.4426 0.0000 172.7044 45 S 5.4302 8.8280 115.4071 56.4483 67.0665 173.7689 46 L 4.8547 9.2991 127.8511 54.8687 42.2638 176.9232 47 I 4.6112 8.5898 119.7134 60.6794 38.8204 174.8456 48 N 4.8682 7.7013 118.3750 52.4386 41.6741 174.6122 49 E 4.1335 8.9147 120.7147 58.7608 29.8538 177.5660 50 Q 4.6065 8.2271 118.6839 55.2322 31.3499 174.0415 51 W 5.6568 8.6090 117.3353 55.2881 33.7560 174.1301 52 V 4.9165 9.0381 123.5697 61.1688 34.1329 174.2299 53 V 4.8019 8.9352 127.8900 62.1032 33.3891 174.8138 54 S 5.1665 9.1821 120.9932 57.1809 66.5392 172.2134 55 A 4.5914 8.6310 121.8300 51.3411 19.6063 179.1127 56 G 3.3669 8.6369 110.3890 48.4261 0.0000 174.8001 57 H 4.7229 8.6933 113.1382 55.8918 28.7385 175.0487 58 C 4.7665 7.9524 117.0702 56.9848 40.4348 173.2417 59 Y 4.1701 7.5210 121.4302 58.0993 38.6755 175.5270 60 K 4.3255 7.2129 124.3262 54.4819 36.5490 176.5164 61 S 4.0839 8.3886 115.0212 60.4883 63.2148 174.7656 62 R 4.5286 7.6529 119.9768 53.9521 32.3428 174.0089 63 I 4.8558 8.1004 124.7669 59.6263 41.6852 173.7237 64 Q 4.7003 8.7540 128.2977 54.7014 30.6699 174.3225 65 V 4.5132 8.8530 127.3359 61.8895 33.6219 174.6437 66 R 4.8844 8.5807 125.9131 54.2974 33.1316 174.7598 67 L 4.7252 8.6051 123.1655 52.8265 45.1445 177.6304 *69 G 4.0189 8.4523 108.3019 45.0583 0.0000 172.8277 70 E 4.1904 7.9758 119.2718 56.3679 30.1051 174.3589 71 H 4.8985 8.5445 120.4246 57.6491 31.6931 172.7464 72 N 5.1505 8.0448 119.4239 52.9854 39.4442 174.7072 73 I 3.3255 9.0647 127.5182 62.5663 37.8615 176.4057 74 E 4.2709 7.9249 120.8071 57.8372 30.2573 176.4743 75 V 4.3163 7.7838 118.3133 60.3243 32.9826 175.2147 76 L 4.2860 8.6262 127.4904 55.5403 41.8387 176.8336 77 E 4.5340 9.2730 121.4229 55.2656 30.8435 176.3869 78 G 4.0658 8.2406 107.0853 45.6112 0.0000 174.5449 79 N 4.9152 8.2406 115.8499 53.0713 39.8324 174.7011 80 E 4.5397 8.1587 118.6618 56.4612 30.6161 176.1848 81 Q 4.6704 8.7735 121.7101 54.1533 32.4145 174.3937 82 F 4.8794 9.1034 122.6155 55.9278 40.7213 175.3181 83 I 4.6559 8.7148 125.0692 59.4650 41.1586 174.9084 84 N 5.0021 8.8279 124.1257 52.5548 40.0162 174.4760 85 A 4.3849 8.8002 125.1426 52.5632 18.5289 177.4427 86 A 4.2764 9.1572 124.9659 53.7230 19.9659 178.2460 87 K 4.6217 7.6257 113.2259 54.7162 36.8092 175.7729 88 I 4.8447 8.6099 124.3881 59.8556 39.8195 175.3496 89 I 4.5344 9.0264 129.6730 59.3575 39.0730 175.1144 90 R 4.5052 8.5425 127.5584 55.5842 31.2027 175.4663 91 H 3.4888 8.8656 125.4393 56.0747 30.0558 174.3154 92 P 4.2328 0.0000 0.0000 65.4915 31.3604 176.8908 93 Q 4.5307 7.9154 114.7922 55.6190 29.1848 174.8115 94 Y 4.2910 8.3246 121.1311 57.7630 39.2973 174.3596 95 D 4.4216 8.3888 127.3295 52.0593 42.1446 176.4132 96 R 3.4988 8.2566 127.4799 59.4268 30.3092 177.8690 97 K 3.9684 7.5523 114.7516 59.6184 31.5961 178.5369 98 T 3.8020 7.7424 106.9900 61.4266 69.3956 175.3766 99 L 3.5970 7.5896 120.8345 55.4411 39.8730 173.7745 100 N 4.4343 7.2503 118.4233 54.5176 39.4472 174.6963 101 N 4.5413 8.6970 121.1974 54.3864 35.6107 175.4872 102 D 5.0242 8.0024 117.9403 52.9813 39.7779 174.4661 103 I 4.7636 7.4983 120.8613 59.7246 42.1531 172.3737 104 M 5.3510 8.9702 126.6016 54.4943 36.2126 173.0757 105 L 5.4641 9.5305 125.6269 53.1270 45.1204 175.3534 106 I 4.9245 9.0439 123.9815 59.3544 40.1918 174.5853 107 K 3.3031 8.4621 129.5354 55.2317 33.0996 175.9662 108 L 4.4935 8.2403 128.2285 54.2876 41.8707 177.6502 109 S 4.3413 8.6613 117.8716 60.5996 63.4827 174.2502 110 S 4.6983 7.6957 112.7971 55.7825 66.0292 173.4523 111 R 4.2567 8.4360 120.2651 56.0424 30.0867 176.8696 112 A 4.2563 9.0430 126.5911 52.1982 19.4588 176.8111 113 V 4.0931 8.6867 120.6953 61.6750 32.4427 175.6792 114 I 4.5063 8.3658 129.6127 60.4663 38.4921 174.9273 115 N 4.6703 8.7680 123.7449 52.3401 38.9178 174.1522 116 A 4.2355 8.6902 118.5369 54.2940 19.1311 178.6530 117 R 4.2666 8.1169 113.2282 56.5990 31.3069 176.4486 118 V 4.4935 8.6055 118.0633 61.1144 33.3586 174.0711 119 S 5.0031 8.4400 120.8976 57.7261 66.9077 173.3170 120 T 4.9768 8.4210 110.5607 60.8427 70.5074 173.7220 121 I 4.4631 8.1277 121.9722 58.8375 40.4720 175.1250 122 S 4.3372 8.4537 123.1033 58.2818 63.5877 173.4189 123 L 4.4590 8.3733 125.6351 53.5733 42.7085 174.6627 124 P 4.7835 0.0000 0.0000 62.6876 32.5732 176.4351 125 T 4.1555 8.4554 110.2869 62.7907 69.6665 174.4727 *127 A 4.2813 7.8688 123.5757 50.8571 19.5143 174.1927 128 P 3.8953 0.0000 0.0000 61.0621 32.0169 174.4685 129 P 3.9826 0.0000 0.0000 62.6545 31.6879 175.4413 130 A 4.3039 8.2436 124.8291 50.7193 20.2603 175.9413 *132 T 4.3481 8.3525 119.3388 64.8375 69.6764 173.5552 133 G 4.0495 9.3278 114.5353 45.5242 0.0000 174.2530 134 T 3.8919 7.7899 116.7383 63.9456 69.4281 173.6313 135 K 4.6166 8.6276 127.7939 56.5064 33.1856 176.4460 136 C 5.3126 9.4160 123.9091 55.0755 45.7511 172.3955 137 L 5.2559 9.0666 122.8422 53.6026 43.8996 175.0660 138 I 5.3526 9.0951 127.5860 58.9733 39.8166 174.9262 139 S 5.3977 7.8768 118.8674 55.8000 66.4992 173.1086 140 G 3.6658 7.4352 108.0788 46.1933 0.0000 172.7290 141 W 4.7233 8.5572 116.9677 56.2434 29.3568 177.1298 142 G 3.9472 8.1451 108.9906 44.6364 0.0000 173.4758 143 N 4.5333 8.9322 118.9325 54.1334 39.1012 174.6795 144 T 5.0392 8.9561 113.4557 60.4761 69.5020 173.9197 145 A 4.8096 7.7481 125.0222 50.1803 21.3717 176.9763 146 S 4.3352 8.7904 117.1938 60.5931 63.4217 174.8730 147 S 4.5502 7.5838 113.5199 57.3541 65.7494 174.3854 148 G 4.0601 8.8467 106.9916 45.5537 0.0000 172.6063 149 A 4.3533 8.2075 121.9891 51.5971 19.3151 176.5442 150 D 4.6411 9.5900 121.2169 52.4604 45.2127 172.4386 *152 P 4.4235 0.0000 0.0000 63.0628 32.2930 176.1715 153 D 4.6077 8.7716 121.0203 57.1506 42.0797 176.1781 154 E 4.9643 8.0665 116.4291 54.4844 31.3182 176.1784 155 L 2.9438 8.4619 125.6192 55.9944 43.0508 176.0354 156 Q 4.7981 8.1632 124.6861 54.8899 31.0779 174.1078 157 C 5.2635 8.5238 118.8901 55.1919 42.2465 172.9836 158 L 4.8553 8.5348 122.6575 54.0068 45.6312 174.0331 159 D 5.5188 9.1145 126.1176 53.2452 42.0281 175.6858 160 A 4.7824 8.9602 124.8582 49.6610 23.2874 173.0672 161 P 5.1564 0.0000 0.0000 60.9673 34.6233 174.7134 162 V 4.0670 8.6466 121.9767 63.0819 32.3328 175.3977 163 L 4.9326 8.6091 128.4035 53.1325 43.4833 176.9218 164 S 4.3536 8.4669 115.2440 58.1694 63.8883 175.3157 165 Q 4.0641 8.7922 120.5622 59.0504 28.2666 179.0394 166 A 4.1798 7.9903 121.2598 55.3834 18.4626 179.6930 167 K 3.8982 8.2268 116.8129 59.5985 32.1877 178.9425 168 C 4.3443 8.2418 118.8410 59.7490 41.8855 175.4758 169 E 4.0193 9.0973 121.0574 59.2912 28.8244 179.1031 170 A 4.1163 8.0385 119.8861 55.5325 18.5661 179.6530 171 S 4.1546 8.1559 112.3263 60.3510 64.3482 174.5268 172 Y 4.7558 7.6933 118.8165 54.6660 37.9082 170.9623 173 P 4.5950 0.0000 0.0000 63.9825 31.4569 177.7377 174 G 3.9918 9.0699 111.6594 45.3774 0.0000 172.9558 175 K 4.2398 8.0862 118.4133 56.9417 33.2491 176.7350 176 I 4.2472 7.9018 120.0117 60.6535 37.1991 175.4998 177 T 4.5394 8.2759 116.3089 59.7328 70.7915 175.3157 178 S 4.3879 8.5204 114.6428 60.1084 63.3713 174.2684 179 N 4.9913 8.1956 118.6111 53.4559 38.4594 173.8983 180 M 5.7696 7.8397 117.4366 54.0235 36.3577 174.2133 181 F 5.0948 9.2786 115.2459 56.2834 42.4080 172.0286 182 C 5.5106 8.9221 115.6565 54.2406 43.1566 173.4404 183 V 4.6296 9.5648 122.5607 59.6717 33.6691 175.8970 184A G 3.7989 6.7099 114.3299 45.6671 0.0000 171.7316 184 F 4.7506 7.9597 120.2223 55.7523 42.4336 175.5994 185 L 4.2102 8.6379 124.6538 57.0555 41.8092 178.4211 186 E 4.0885 8.3214 116.6248 56.4601 30.0169 178.0517 187 G 3.8380 8.1885 108.2106 44.8254 0.0000 171.0565 188A G 4.2677 9.2294 107.4653 44.8944 0.0000 174.2256 188 K 4.8811 7.0550 116.7482 54.3243 35.3509 175.1601 189 D 4.6180 8.5513 122.2981 53.8063 45.5828 175.1556 190 S 4.9496 8.8315 116.5660 58.4537 64.7490 173.2921 191 C 4.7039 9.2388 119.4737 55.0912 43.9905 172.2815 192 Q 4.1533 8.7022 121.3168 58.3703 28.4114 177.2217 193 G 4.3415 9.1633 113.2845 45.7765 0.0000 173.6694 194 D 4.6424 8.4181 118.6774 55.0657 41.7027 176.8061 195 S 4.4979 7.9237 116.2308 60.2692 63.5079 175.1630 196 G 4.3247 8.6114 112.0770 46.5575 0.0000 173.8488 197 G 4.4187 7.8097 107.2551 45.2202 0.0000 170.6809 198 P 5.2465 0.0000 0.0000 61.7198 33.7469 175.2615 199 V 4.4437 8.5964 122.7829 61.4468 33.5805 174.0982 200 V 4.8510 8.7150 129.2404 61.2848 33.8056 173.6402 201 C 5.0998 8.9454 125.2249 55.6242 43.4968 174.2249 202 N 3.7749 9.8776 121.6589 54.4947 35.8358 174.9916 203 G 3.9319 8.4698 101.1409 45.8802 0.0000 173.4046 204 Q 4.6655 7.6508 117.1848 52.5398 32.3373 174.1534 *209 L 4.3511 8.3372 123.0521 55.5390 42.1964 175.6559 210 Q 4.3959 9.0738 126.5676 57.1995 30.5081 176.2102 211 G 5.1296 8.1367 104.2273 43.5157 0.0000 171.5471 212 V 5.1198 8.3429 120.1908 60.3600 34.7710 174.7145 213 V 3.4871 8.8285 128.1461 64.1719 31.7691 174.3335 214 S 5.0077 8.4278 122.2391 58.5270 63.7018 174.0139 215 W 5.1488 8.0515 114.0645 55.9016 32.4134 172.5449 216 G 3.9865 8.5033 106.2260 46.0278 0.0000 172.7755 217 D 4.8470 8.9659 119.6131 52.3813 40.8126 175.2378 *219 G 4.2219 7.8540 114.5548 45.2466 0.0000 169.9060 220 C 4.9559 8.1484 115.0761 56.2180 41.8308 174.0143 221A A 4.4083 9.5416 126.2680 53.1690 16.5306 177.1859 221 Q 4.4648 7.3827 117.0990 56.4639 29.5343 175.8712 222 K 4.1141 8.4629 121.9592 57.7805 32.5684 176.3134 223 N 4.2403 9.9467 123.9123 54.3326 37.1049 175.0558 224 K 4.3366 7.5833 112.7057 54.2616 32.8362 174.6158 225 P 4.5222 0.0000 0.0000 62.5879 32.3487 178.3581 226 G 3.5833 8.7870 107.8946 46.2118 0.0000 172.2934 227 V 4.2395 7.7237 120.4621 60.7127 34.2805 174.0826 228 Y 4.8911 8.3696 123.9306 55.9811 42.3393 174.9712 229 T 4.5102 8.6078 120.1072 63.5800 69.9926 174.2158 230 K 4.4833 9.2806 127.8149 56.0667 31.6568 177.3226 231 V 3.9774 8.8434 127.1725 66.0214 31.1063 176.7662 232 Y 4.2723 7.9795 118.8723 60.7332 38.3207 177.5034 233 N 4.2142 8.2416 115.8055 54.7660 38.7552 175.1989 234 Y 4.6733 7.9222 117.4267 57.5092 39.1669 177.4258 235 V 3.6146 7.5487 121.2806 66.1566 31.3583 177.9923 236 K 3.9253 7.9039 118.6763 59.1504 32.1230 178.4319 237 W 4.0892 8.2494 128.2423 60.3641 30.5611 177.8542 238 I 3.0394 8.1694 120.0154 63.9878 36.5246 178.1858 239 K 3.6427 7.5894 119.7909 59.6128 32.0488 178.3780 240 N 4.1673 8.2220 116.9625 56.7634 38.2248 177.5853 241 T 3.5903 7.3897 116.1858 66.4111 68.7450 176.6517 242 I 2.5204 7.3592 121.9142 63.6903 36.7208 178.3438 243 A 3.9245 7.8078 120.9557 54.9974 18.2992 179.2366 244 A 4.1799 7.9132 117.7562 53.7751 18.5073 177.8360 245 N 5.0865 7.7068 113.9606 53.2099 39.5467 174.9238 246 S 4.5325 8.2161 119.9957 58.7911 63.3626 174.1652 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 4.27 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.59 0.90 0.00 0.00 17 V 8.50 4.12 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 18 G 9.06 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.66 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 0.00 0.00 0.00 0.00 20 Y 7.58 4.95 0.00 2.98 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 21 N 8.84 4.88 0.00 2.72 2.88 0.00 0.00 6.94 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 22 C 8.68 4.46 0.00 2.80 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 23 E 9.02 4.23 0.00 2.07 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 2.43 2.41 0.00 24 E 8.66 3.95 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 25 N 8.49 4.12 0.00 2.78 3.03 0.00 0.00 7.00 7.57 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 26 S 7.56 4.52 0.00 4.01 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 27 V 7.05 3.92 1.78 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 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.44 0.00 2.38 2.42 0.00 3.66 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 2.21 2.01 0.00 29 Y 6.84 5.23 0.00 3.26 3.40 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 30 Q 7.42 4.54 0.00 1.76 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.74 0.00 0.00 0.00 0.00 0.00 1.85 2.43 0.00 31 V 8.86 4.95 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 0.90 0.00 0.00 0.96 0.00 0.00 32 S 8.55 5.18 0.00 3.67 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.46 4.84 0.00 0.53 1.19 0.87 0.42 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 34 N 8.29 5.99 0.00 2.67 2.60 0.00 0.00 6.86 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 8.60 4.66 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 38 G 8.32 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 39 Y 7.33 4.67 0.00 3.07 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 40 H 8.85 4.87 0.00 3.15 3.24 0.00 5.46 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.97 5.02 0.00 3.00 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 42 C 7.45 4.86 0.00 2.44 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 43 G 8.74 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 44 G 8.05 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.83 5.43 0.00 3.82 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 46 L 9.30 4.85 0.00 1.84 1.69 1.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.59 4.61 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.03 0.95 0.00 0.00 48 N 7.70 4.87 0.00 2.85 2.97 0.00 0.00 6.91 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 49 E 8.91 4.13 0.00 2.22 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 2.43 2.38 0.00 50 Q 8.23 4.61 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.06 2.23 0.00 51 W 8.61 5.66 0.00 3.22 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 52 V 9.04 4.92 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 1.05 0.00 0.00 0.97 0.00 0.00 53 V 8.94 4.80 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.03 0.00 0.00 54 S 9.18 5.17 0.00 3.89 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 55 A 8.63 4.59 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 56 G 8.64 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 0.00 0.00 0.00 57 H 8.69 4.72 0.00 3.42 3.67 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 7.95 4.77 0.00 3.27 3.41 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 59 Y 7.52 4.17 0.00 3.02 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 60 K 7.21 4.33 0.00 1.52 1.40 0.00 0.81 0.00 0.00 1.35 0.00 0.00 2.53 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 0.98 7.81 61 S 8.39 4.08 0.00 3.95 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 62 R 7.65 4.53 0.00 1.68 1.78 0.00 3.21 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 63 I 8.10 4.86 1.87 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 1.38 0.53 0.93 0.00 0.00 64 Q 8.75 4.70 0.00 2.24 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 65 V 8.85 4.51 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 0.99 0.00 0.00 0.89 0.00 0.00 66 R 8.58 4.88 0.00 1.56 1.25 0.00 2.91 0.00 0.00 2.72 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.31 0.00 67 L 8.61 4.73 0.00 1.54 1.53 0.92 0.78 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 *69 G 8.45 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 70 E 7.98 4.19 0.00 1.89 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 0.00 2.08 2.06 0.00 71 H 8.54 4.90 0.00 3.23 3.50 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.04 5.15 0.00 3.00 2.90 0.00 0.00 6.64 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 9.06 3.33 0.56 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.38 0.64 0.00 0.00 74 E 7.92 4.27 0.00 2.40 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 75 V 7.78 4.32 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 0.82 0.00 0.00 1.00 0.00 0.00 76 L 8.63 4.29 0.00 1.70 1.65 0.96 1.14 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 77 E 9.27 4.53 0.00 1.94 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 2.26 2.44 0.00 78 G 8.24 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 0.00 0.00 0.00 79 N 8.24 4.92 0.00 2.66 2.82 0.00 0.00 7.18 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 8.16 4.54 0.00 1.90 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 81 Q 8.77 4.67 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 82 F 9.10 4.88 0.00 2.83 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 83 I 8.71 4.66 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.65 0.87 0.00 0.00 84 N 8.83 5.00 0.00 2.63 2.70 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 85 A 8.80 4.38 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 9.16 4.28 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 87 K 7.63 4.62 0.00 1.51 1.67 0.00 1.64 0.00 0.00 1.89 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.36 7.81 88 I 8.61 4.84 2.05 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.62 1.10 0.00 0.00 89 I 9.03 4.53 2.10 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 1.14 0.00 0.00 90 R 8.54 4.51 0.00 1.69 1.62 0.00 2.21 0.00 0.00 2.80 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.45 0.00 91 H 8.87 3.49 0.00 2.82 3.08 0.00 5.65 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 4.23 0.00 2.05 2.13 0.00 2.93 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 93 Q 7.92 4.53 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 94 Y 8.32 4.29 0.00 3.07 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 95 D 8.39 4.42 0.00 2.47 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.26 3.50 0.00 1.74 1.82 0.00 3.31 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 97 K 7.55 3.97 0.00 1.82 1.72 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.28 7.81 98 T 7.74 3.80 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 1.08 0.00 0.00 99 L 7.59 3.60 0.00 1.30 1.75 0.73 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.25 4.43 0.00 2.86 2.58 0.00 0.00 7.27 6.59 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 0.00 101 N 8.70 4.54 0.00 3.00 2.67 0.00 0.00 7.24 8.06 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 0.00 102 D 8.00 5.02 0.00 3.13 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 0.00 103 I 7.50 4.76 1.46 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.40 0.17 0.00 0.00 104 M 8.97 5.35 0.00 2.32 1.87 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.68 0.00 105 L 9.53 5.46 0.00 1.77 1.90 0.19 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.04 4.92 1.91 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 1.15 0.89 0.85 0.00 0.00 107 K 8.46 3.30 0.00 0.79 0.99 0.00 1.24 0.00 0.00 1.37 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.83 0.21 7.81 108 L 8.24 4.49 0.00 1.45 1.54 0.89 0.81 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 0.00 109 S 8.66 4.34 0.00 3.84 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 0.00 110 S 7.70 4.70 0.00 3.91 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 0.00 111 R 8.44 4.26 0.00 1.72 1.93 0.00 3.52 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 112 A 9.04 4.26 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 0.00 113 V 8.69 4.09 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 0.00 114 I 8.37 4.51 1.89 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 1.49 0.98 0.97 0.00 0.00 115 N 8.77 4.67 0.00 2.74 2.74 0.00 0.00 7.00 7.04 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 0.00 116 A 8.69 4.24 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 0.00 117 R 8.12 4.27 0.00 1.88 1.99 0.00 3.28 0.00 0.00 3.16 7.38 0.00 0.00 0.00 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1.23 0.00 0.00 *127 A 7.87 4.28 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 0.00 128 P 0.00 3.90 0.00 1.86 1.55 0.00 3.22 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 129 P 0.00 3.98 0.00 1.80 1.51 0.00 3.37 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.44 0.00 130 A 8.24 4.30 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 *132 T 8.35 4.35 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 0.00 133 G 9.33 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 0.00 134 T 7.79 3.89 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 1.18 0.00 0.00 135 K 8.63 4.62 0.00 1.78 1.71 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 136 C 9.42 5.31 0.00 2.75 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 0.00 137 L 9.07 5.26 0.00 1.75 1.57 1.05 1.26 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 0.00 138 I 9.10 5.35 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.54 1.00 0.00 0.00 139 S 7.88 5.40 0.00 3.52 3.57 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 0.00 140 G 7.44 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.56 4.72 0.00 3.34 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 0.00 142 G 8.15 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 0.00 0.00 0.00 143 N 8.93 4.53 0.00 2.67 2.77 0.00 0.00 7.11 7.69 0.00 0.00 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 8.96 5.04 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 0.00 145 A 7.75 4.81 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.79 4.34 0.00 4.01 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 0.00 147 S 7.58 4.55 0.00 3.94 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 0.00 148 G 8.85 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 0.00 149 A 8.21 4.35 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 0.00 150 D 9.59 4.64 0.00 2.67 2.48 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 *152 P 0.00 4.42 0.00 2.40 2.11 0.00 4.10 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 2.02 2.10 0.00 153 D 8.77 4.61 0.00 2.76 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 0.00 154 E 8.07 4.96 0.00 1.87 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 155 L 8.46 2.94 0.00 1.29 1.24 -0.91 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.16 4.80 0.00 1.99 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.49 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 157 C 8.52 5.26 0.00 1.85 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 0.00 0.00 0.00 0.00 158 L 8.53 4.86 0.00 1.67 1.42 1.05 1.34 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 0.00 159 D 9.11 5.52 0.00 2.76 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 0.00 160 A 8.96 4.78 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 0.00 161 P 0.00 5.16 0.00 2.03 2.10 0.00 3.09 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 162 V 8.65 4.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.98 0.00 0.00 163 L 8.61 4.93 0.00 1.68 1.57 0.89 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.47 4.35 0.00 4.01 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 0.00 165 Q 8.79 4.06 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 166 A 7.99 4.18 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 K 8.23 3.90 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.46 7.81 168 C 8.24 4.34 0.00 3.20 3.33 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 0.00 169 E 9.10 4.02 0.00 2.27 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 2.41 0.00 170 A 8.04 4.12 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 0.00 171 S 8.16 4.15 0.00 3.81 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 4.76 0.00 3.14 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 0.00 173 P 0.00 4.59 0.00 2.21 2.14 0.00 3.49 0.00 0.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 174 G 9.07 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 K 8.09 4.24 0.00 2.21 1.84 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.61 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.56 1.60 7.81 176 I 7.90 4.25 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.98 1.11 0.00 0.00 177 T 8.28 4.54 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 0.00 178 S 8.52 4.39 0.00 4.03 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 0.00 179 N 8.20 4.99 0.00 2.92 3.10 0.00 0.00 6.64 7.58 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 0.00 180 M 7.84 5.77 0.00 1.88 2.17 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 181 F 9.28 5.09 0.00 3.06 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 0.00 182 C 8.92 5.51 0.00 2.91 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 0.00 183 V 9.56 4.63 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 0.59 0.00 0.00 0.70 0.00 0.00 184A G 6.71 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 0.00 184 F 7.96 4.75 0.00 3.13 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 0.00 185 L 8.64 4.21 0.00 1.74 1.73 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.32 4.09 0.00 1.97 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 2.42 0.00 187 G 8.19 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.23 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.05 4.88 0.00 1.67 1.76 0.00 0.74 0.00 0.00 1.49 0.00 0.00 2.56 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.20 1.07 7.81 189 D 8.55 4.62 0.00 2.85 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.83 4.95 0.00 3.97 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 0.00 191 C 9.24 4.70 0.00 2.96 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 0.00 192 Q 8.70 4.15 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.45 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 193 G 9.16 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 8.42 4.64 0.00 2.90 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 0.00 195 S 7.92 4.50 0.00 3.94 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 0.00 196 G 8.61 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.81 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 0.00 0.00 0.00 0.00 198 P 0.00 5.25 0.00 2.34 2.37 0.00 3.82 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 199 V 8.60 4.44 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 0.70 0.00 0.00 0.39 0.00 0.00 200 V 8.72 4.85 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 0.82 0.00 0.00 0.67 0.00 0.00 201 C 8.95 5.10 0.00 2.83 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 0.00 202 N 9.88 3.77 0.00 2.78 2.82 0.00 0.00 7.15 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 0.00 203 G 8.47 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 0.00 204 Q 7.65 4.67 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.50 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 *209 L 8.34 4.35 0.00 1.57 1.67 1.00 0.81 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 0.00 210 Q 9.07 4.40 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.47 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 211 G 8.14 5.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.34 5.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.04 0.00 0.00 213 V 8.83 3.49 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 0.81 0.00 0.00 1.16 0.00 0.00 214 S 8.43 5.01 0.00 3.92 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 8.05 5.15 0.00 3.36 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 0.00 216 G 8.50 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 D 8.97 4.85 0.00 3.29 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 *219 G 7.85 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 0.00 220 C 8.15 4.96 0.00 2.97 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 221A A 9.54 4.41 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 7.38 4.46 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 222 K 8.46 4.11 0.00 1.72 1.72 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.47 7.81 223 N 9.95 4.24 0.00 2.87 2.80 0.00 0.00 6.82 7.49 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 0.00 224 K 7.58 4.34 0.00 1.64 1.84 0.00 1.35 0.00 0.00 1.05 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.45 7.81 225 P 0.00 4.52 0.00 2.10 2.08 0.00 3.69 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 2.11 2.00 0.00 226 G 8.79 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.72 4.24 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 0.58 0.00 0.00 -0.94 0.00 0.00 228 Y 8.37 4.89 0.00 1.75 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 0.00 229 T 8.61 4.51 4.38 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 1.36 0.00 0.00 230 K 9.28 4.48 0.00 2.10 1.92 0.00 1.82 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.52 1.22 7.81 231 V 8.84 3.98 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.14 0.00 0.00 232 Y 7.98 4.27 0.00 3.06 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.24 4.21 0.00 2.30 2.27 0.00 0.00 6.88 6.74 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 0.00 234 Y 7.92 4.67 0.00 3.27 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 0.00 235 V 7.55 3.61 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 0.93 0.00 0.00 0.96 0.00 0.00 236 K 7.90 3.93 0.00 1.82 1.78 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.47 7.81 237 W 8.25 4.09 0.00 3.53 3.54 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 0.00 238 I 8.17 3.04 1.98 0.00 0.00 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 1.45 0.99 0.73 0.00 0.00 239 K 7.59 3.64 0.00 1.71 1.69 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.36 7.81 240 N 8.22 4.17 0.00 2.72 2.74 0.00 0.00 7.11 6.59 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 0.00 241 T 7.39 3.59 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 242 I 7.36 2.52 1.44 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.13 0.36 0.00 0.00 243 A 7.81 3.92 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 0.00 244 A 7.91 4.18 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 0.00 245 N 7.71 5.09 0.00 3.24 3.17 0.00 0.00 6.82 7.27 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 0.00 246 S 8.22 4.53 0.00 3.88 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 * Residues marked with a * may have inaccurate shift predictions.