NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -9 S 4.4328 8.3349 117.0993 57.3158 64.0314 173.2009 -8 D 4.2484 8.6685 123.7073 53.4238 40.9862 174.8739 -7 K 4.5759 9.1830 125.5196 54.8476 36.2960 174.4688 -6 I 4.4308 8.2506 125.9488 59.6730 39.2240 174.6382 -5 H 4.5626 8.6489 123.9561 54.7431 32.1130 171.9965 -4 H 4.7067 8.3340 127.2537 54.2660 29.9234 173.5659 -3 H 3.9823 8.7362 127.0979 59.1982 30.2111 176.0630 -2 H 4.1654 8.4195 117.9279 59.4805 29.8409 175.6523 -1 H 4.0490 7.8730 117.1482 59.3689 29.7858 175.9995 0 H 3.8974 8.0753 114.9546 57.5001 29.5733 175.2792 -7 E 4.6059 9.3130 125.3196 55.2476 33.0960 174.4688 -6 T 4.6108 8.4006 119.6488 60.3730 70.2240 172.9382 -4 F 4.5967 8.2140 129.3537 56.9660 40.5234 175.2659 -3 D 3.8923 8.6562 129.2979 58.3982 42.3111 178.2630 -2 T 3.7854 8.1495 113.3279 66.2805 70.6409 176.2523 -1 L 3.6590 7.6130 120.7482 59.4689 43.1858 179.4995 0 L 3.5074 7.8153 118.5546 57.6001 42.9733 178.7792 10 Q 4.2807 7.7280 115.1141 56.3384 29.5008 175.5107 11 L 4.6274 7.5210 118.6692 52.7173 43.4109 175.8803 12 P 4.2528 0.0000 0.0000 65.4343 31.5083 178.7050 13 L 3.5823 7.8427 118.9187 57.0557 41.9827 177.2855 14 F 4.9606 7.8947 115.1687 56.8278 39.3634 175.6512 15 Q 4.0256 7.5979 119.0587 57.5321 28.7233 176.6755 16 G 3.9078 8.8664 107.2099 45.7746 0.0000 172.8494 17 L 4.7556 7.5794 118.8356 52.4112 44.0422 176.9130 18 C 4.4370 8.4051 118.4029 57.9646 31.8461 174.3452 19 H 3.9222 8.7063 118.5528 59.1669 28.2361 177.6456 20 E 4.0116 8.1543 120.3799 59.4103 29.5965 178.4689 21 D 4.3162 8.0599 118.5142 57.1174 41.0231 178.0238 22 F 4.2056 8.4307 121.3444 61.8543 39.3253 177.2339 23 T 3.6514 8.3457 115.2539 66.8944 68.0767 176.7675 24 S 4.2716 7.8980 115.5251 61.5520 62.8612 176.6224 25 I 3.7103 7.6566 122.4969 64.3816 36.8778 178.5651 26 L 3.7651 7.5787 119.6869 57.5601 41.0612 179.0044 27 D 4.3484 7.8236 118.3585 57.2639 40.8827 178.4038 28 K 4.2973 7.5495 115.7238 56.1345 32.7306 177.0129 29 V 3.4214 6.5545 112.3435 58.6325 34.1579 175.2585 30 K 3.8886 5.9563 123.4476 55.6105 32.1491 175.9484 31 L 4.4392 8.1808 126.8999 53.8623 43.0544 175.8718 32 H 4.7490 8.9507 122.0127 54.2686 30.4367 173.6262 33 F 5.1008 8.8390 122.8665 56.3772 40.2899 175.8038 34 I 4.6875 8.8066 123.7575 59.4806 41.1705 174.0993 35 K 4.8564 8.6967 127.6861 55.2050 34.0102 174.9825 36 H 5.1291 9.0552 123.2297 53.7707 32.6813 173.4114 37 K 4.4863 9.0309 121.1648 55.6177 33.5669 176.3602 38 A 4.2908 8.0119 124.5848 53.6051 18.4664 178.2827 39 G 4.0024 9.1970 112.1585 44.9653 0.0000 173.5915 40 E 4.3167 8.0066 119.9203 56.1376 31.0261 176.2354 41 T 4.3295 8.3792 120.5725 63.8111 68.5854 174.6686 42 I 3.8282 8.7190 128.7230 63.8552 37.8238 176.7741 43 I 4.5870 7.5613 121.1571 59.2452 41.9108 173.7848 44 K 4.8885 8.4224 126.8482 54.0869 34.5044 175.5968 45 S 4.5949 8.8874 122.9829 60.1307 63.2377 174.7709 46 G 4.0810 9.1478 111.5020 45.5969 0.0000 173.7760 47 N 4.8484 7.9038 117.2511 51.9668 39.9702 173.1138 48 P 4.9314 0.0000 0.0000 62.8176 32.2027 175.1733 49 C 4.1082 8.9968 125.4718 58.1875 32.0390 172.8078 50 T 4.7827 8.1230 115.9726 60.8005 70.1666 172.8585 51 Q 4.9810 7.9405 117.3513 56.1983 31.6032 173.0611 52 L 4.4702 8.9974 121.0587 53.6978 43.3710 174.8147 53 C 5.3551 8.5545 124.5725 54.8039 47.2817 172.0487 54 F 5.2724 9.3763 125.2410 55.5302 41.7581 174.3909 55 L 4.5974 9.3767 126.5606 54.9061 42.2623 176.8082 56 L 4.4873 9.1663 127.5286 56.4483 43.1422 177.3506 57 K 4.4583 8.1258 118.2076 56.6088 36.0380 175.9483 58 G 4.2606 9.3179 111.6695 43.9421 0.0000 170.9179 59 E 5.2168 8.7572 118.5532 54.2781 32.8765 175.7004 60 I 5.1055 8.8121 119.3012 59.2553 41.7646 174.0802 61 S 5.1487 8.8578 118.8175 56.7135 65.3640 173.8498 62 I 3.9295 8.8121 126.6630 60.8466 38.4710 175.2076 63 V 4.6346 8.4259 126.3785 61.4034 34.4085 174.2679 64 T 4.7380 8.7816 124.6000 61.8333 72.0312 172.6808 65 N 5.1340 8.6642 123.6146 51.5313 40.2897 175.0731 66 A 4.0120 8.3518 125.6968 50.9466 20.0809 176.9214 67 K 3.9219 8.5316 117.9552 58.4690 32.4523 177.3620 68 E 3.8313 9.2406 120.1584 56.8318 27.1138 174.0095 69 N 4.1921 8.0820 113.2166 54.1402 36.7545 175.9149 70 I 3.9697 7.3583 112.4717 63.5192 38.3374 175.0050 71 Y 5.1956 7.0113 117.5808 56.3825 41.4909 173.6024 72 T 5.0119 9.2824 116.7108 61.8788 72.7877 173.0335 73 V 4.2342 8.6979 126.3934 61.0098 33.9371 174.2207 74 I 4.7993 8.5775 128.9100 59.4556 39.9334 174.0813 75 E 4.7989 8.9766 128.3542 54.2011 32.5259 174.7075 76 Q 4.6482 8.4485 126.1451 55.8155 29.7270 175.6323 77 I 4.4756 8.8270 124.2010 59.4983 40.8391 174.3721 78 E 4.9548 8.6096 125.0757 54.2861 31.5941 175.8419 79 A 4.4111 8.3985 124.7811 51.7198 19.1585 175.6104 80 P 5.4759 0.0000 0.0000 62.1553 33.4029 174.6804 81 Y 4.8572 8.3835 119.8994 56.6850 42.3622 172.5444 82 L 4.3363 7.7904 128.2019 53.3979 43.4331 175.5846 83 I 3.5378 8.0124 128.2145 61.2296 37.6184 176.6626 84 E 4.0099 8.8283 127.0672 55.3549 26.9085 174.1432 85 P 4.2250 0.0000 0.0000 65.7480 32.0169 179.3293 86 Q 4.1906 8.1427 116.3685 58.6983 28.8914 177.5806 87 S 4.3488 8.1785 113.8809 58.9606 63.2117 175.5734 88 L 3.8656 7.6137 122.6833 56.4910 41.9838 175.6673 89 F 4.8377 7.6755 115.1894 55.5616 43.5568 175.6133 90 G 3.8002 8.4776 111.5257 44.9810 0.0000 176.6021 *92 N 4.4148 8.6975 125.2935 53.5879 38.4108 172.1419 93 T 4.6371 7.8736 116.4936 61.1988 70.2730 173.9145 94 N 5.1579 8.8409 119.6859 52.7378 40.9597 174.4435 95 Y 4.4223 8.7168 119.9733 58.8114 38.4547 177.6026 96 A 4.1742 9.7201 126.9301 53.8072 19.3588 177.1349 97 S 4.8409 8.5040 109.7875 56.9038 66.6575 173.9913 98 S 4.9026 8.4837 116.7297 57.4857 65.3465 173.2872 99 Y 4.9193 9.0285 119.7188 56.2215 41.4831 174.6697 100 V 4.7936 8.6122 123.5423 60.5090 35.1827 174.4133 101 A 4.2744 9.0287 130.2943 53.0151 18.6751 177.3499 102 H 4.2484 9.3057 124.2358 59.2096 30.2415 175.4364 103 T 4.5559 7.5150 107.4707 59.6749 72.0242 172.5585 104 E 4.3506 8.7406 122.0792 57.1043 30.2098 176.9286 105 V 4.9149 8.9569 118.7272 59.9785 36.3794 173.9956 106 H 5.4771 9.2944 121.0274 54.3258 31.5078 173.5435 107 T 5.4303 9.1323 112.7449 59.8523 72.9194 172.9852 108 V 4.8487 8.8236 120.5327 60.1844 34.8114 173.7486 109 C 5.7504 9.2800 120.9852 55.2733 41.9344 172.8900 110 I 5.0575 8.5836 122.5783 59.1539 40.3142 175.7561 111 S 4.5603 8.9916 121.2011 57.9227 63.8538 175.0006 112 K 3.8736 8.7971 123.1433 59.7191 31.7047 178.9656 113 A 3.9180 7.9980 120.4225 55.4604 18.3273 179.5603 114 F 4.1191 8.4399 116.2178 60.3764 38.8156 178.2234 115 V 3.7476 8.0247 118.1064 66.0569 31.2358 178.1595 116 L 4.0460 8.0856 117.7875 57.9764 41.6200 179.4432 117 S 4.2827 8.2329 112.9879 61.0172 63.3521 174.3688 118 D 4.7238 8.2398 120.1818 55.8535 42.2076 178.5336 119 L 3.9862 7.6820 118.5139 57.8620 41.5641 179.2108 120 F 4.4323 8.3884 115.4810 59.1804 39.0866 176.4892 121 R 4.0934 7.8426 118.9246 57.2701 30.3749 176.2848 122 Y 4.8281 7.7392 117.8894 55.9171 40.0266 175.7630 123 D 4.4809 8.9723 125.5088 57.0830 39.3439 179.1027 124 I 3.7327 7.8636 120.6856 63.7314 37.1374 178.1169 125 F 4.0071 8.2788 121.3563 61.2808 39.2116 177.3233 126 R 3.3270 7.9469 114.4325 58.8689 29.2620 178.1196 127 L 4.0487 7.8940 120.4386 58.0445 42.3974 178.4756 128 N 4.4243 8.0869 116.3431 56.2375 38.3935 177.4787 129 Y 3.6053 7.4054 117.6808 58.3620 38.5421 177.2374 *131 N 4.6610 8.1277 117.7062 52.9763 41.1070 176.9516 132 I 3.6365 7.6491 118.7502 64.4967 37.1796 178.7656 133 V 3.6896 7.8289 119.0648 66.0414 31.3701 178.2684 134 S 4.1633 8.0217 114.5766 61.5488 62.6502 176.1169 135 N 4.3689 8.3578 119.3317 56.2696 38.2835 177.3808 136 R 3.8882 7.9964 119.6016 59.4153 30.2137 178.4665 137 A 4.0658 8.1025 120.5440 55.2347 18.3284 179.6391 138 Q 4.0156 8.6468 116.9247 59.2485 28.6805 178.8408 139 N 4.4080 8.5607 117.8020 56.3865 38.3839 177.5540 140 L 4.0726 7.8630 119.2997 57.8329 41.9979 178.7033 141 Y 4.3665 8.2615 119.5882 60.8656 38.8139 177.6964 142 S 4.2651 8.5370 114.2199 61.8230 62.1436 176.4784 143 R 4.2204 7.9934 120.2568 58.8752 29.5215 178.8342 144 L 3.9508 7.7527 118.0501 56.2265 41.4324 177.7860 145 W 4.5523 7.5056 116.6436 56.1530 29.6250 175.7468 146 D 4.6196 7.4616 117.4971 53.8860 40.8063 176.2848 147 E 4.1244 8.4796 120.9876 55.8092 30.0584 175.5771 148 P 4.5204 0.0000 0.0000 62.3895 32.3804 176.1314 149 T 4.2235 8.1116 109.3234 61.5734 69.5472 174.5473 150 L 4.5876 8.3332 121.3591 54.7424 43.3496 175.8689 151 D 4.7556 7.4083 117.9866 50.8242 43.8260 175.5498 152 L 3.8951 8.3026 119.8545 57.9157 41.9580 178.3920 153 K 3.8704 7.9748 119.5312 59.5426 32.1221 178.7925 154 S 4.0933 8.8053 114.9923 61.0641 62.8944 176.2096 155 K 3.8118 8.0750 123.2547 59.4105 31.8541 178.8019 156 I 3.3120 7.8981 120.2479 64.2839 36.8786 178.5110 157 I 3.7196 7.7412 120.6826 64.3331 36.8436 178.4663 158 R 3.8575 8.3116 119.9556 59.2771 29.6828 178.0698 159 F 4.1029 8.1048 119.6867 61.4560 39.6063 176.8708 160 F 4.1424 7.9182 117.1327 60.7211 38.7478 177.7407 161 L 4.1418 8.3849 119.0264 57.7516 41.2658 179.5379 162 S 4.3559 8.3895 112.9156 60.3981 62.9165 174.5327 163 H 4.8284 7.8531 118.6727 55.5297 28.8663 173.6147 164 C 5.0670 7.7693 117.2872 57.8118 30.2142 174.3816 165 E 4.2276 9.8105 124.2612 58.7797 29.3629 177.6638 166 K 4.7115 8.2397 115.9514 54.7601 36.0788 174.0788 167 P 4.7651 0.0000 0.0000 62.1057 31.7129 175.2424 168 Q 4.6952 7.8047 117.2912 57.0430 32.4108 173.5875 169 G 3.8519 9.1340 110.0178 44.1992 0.0000 171.6353 170 E 4.8430 8.2668 118.8313 55.1639 30.9236 175.4855 171 K 5.0916 9.2540 125.0136 55.0457 37.1351 175.2667 172 T 5.0914 8.9263 119.5229 61.8458 72.4489 172.9073 173 F 5.0419 9.6718 124.8643 55.8356 41.4141 174.8552 174 K 5.0250 9.3181 125.3614 55.2953 33.3953 176.4772 175 V 4.6844 8.3028 123.5919 60.3800 34.4340 174.0821 176 K 4.4908 8.6979 132.0769 56.6598 31.7339 178.7401 *178 D 4.5664 8.7895 121.6791 55.6367 42.8938 177.4297 179 D 4.4000 8.0241 118.2778 57.1976 40.8098 178.4971 180 L 3.7119 8.0739 120.6471 57.8262 42.1050 178.4982 181 A 3.8960 7.9709 120.3173 55.5108 18.0724 179.5499 182 R 3.8451 7.7564 115.7001 59.7868 29.9398 179.1444 183 C 4.1404 7.9121 115.1212 62.2881 28.1900 175.2823 184 L 4.1346 7.6114 117.4665 53.4410 42.4374 175.7223 185 D 4.2846 7.5464 118.0710 54.8865 40.1096 170.8716 186 D 4.5931 7.9591 116.6134 52.6345 44.7302 174.0036 187 T 4.6309 8.4600 108.6314 59.7054 72.4467 174.7885 188 R 3.8091 8.4320 121.8250 59.7659 30.0051 178.4851 189 L 3.9181 7.7875 119.2611 58.2287 42.2128 178.5642 190 N 4.3135 8.0300 116.1917 56.3361 38.4291 177.4861 191 I 3.6228 7.8615 121.3178 64.3555 37.2193 178.2778 192 S 4.0486 8.5315 114.2397 61.2475 62.1871 176.0367 193 K 3.8736 8.0098 122.0588 60.0445 31.9770 178.9047 194 T 3.8920 7.9501 115.8199 66.5634 68.3659 176.7891 195 L 4.0474 8.2773 121.3448 57.9291 41.5899 179.3756 196 N 4.3863 8.3170 116.4297 56.0870 38.3560 177.2573 197 E 3.9366 8.2202 120.0473 59.5597 29.5786 179.2735 198 L 3.9738 7.9039 118.8331 58.0332 41.6910 179.5569 199 Q 4.4018 8.1279 120.6599 58.7927 28.7802 177.8974 200 D 4.4443 8.3416 119.5338 57.1449 40.8482 177.4967 201 N 4.8124 8.1557 114.8146 52.8505 38.5118 175.7030 202 G 3.9329 7.7108 107.5000 46.3744 0.0000 175.0605 203 L 4.3573 8.0916 121.2338 55.5046 42.4945 176.3640 204 I 4.8919 7.3082 110.2828 59.3113 41.8260 173.7360 205 E 4.9595 9.3739 121.4073 54.5235 33.0537 175.0560 206 L 4.8062 8.9523 124.1211 53.6747 43.2533 175.6704 207 H 4.9469 8.9992 123.2830 54.1803 32.5531 173.5059 208 R 4.0090 8.6134 118.7463 57.4855 29.2870 172.3761 209 K 4.1430 8.8539 122.6890 55.6791 30.0710 174.1570 210 E 5.2072 7.8961 117.2618 55.2936 33.4580 173.3726 211 I 4.8726 9.3565 128.1120 59.4753 40.1168 174.2370 212 L 4.6806 8.7901 130.3811 54.2750 43.6729 175.4261 213 I 4.5104 8.9922 128.0548 58.9070 37.6587 174.5144 214 P 4.1148 0.0000 0.0000 64.9717 31.8329 176.2904 215 D 4.5226 7.7385 118.1263 51.6695 42.8398 175.2363 216 A 4.0720 8.9611 130.6263 54.9349 18.3095 178.6846 217 Q 4.3657 8.2742 119.3125 58.6584 28.8676 178.0747 218 K 4.2358 7.7950 117.1754 57.9104 32.1877 178.2461 219 L 4.3170 7.7151 118.6362 55.8941 41.9174 176.6105 220 L 4.2071 7.6941 123.6757 54.9403 41.6174 176.6000 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 -9 S 8.33 4.43 0.00 3.65 3.72 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 -8 D 8.67 4.25 0.00 2.71 2.69 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 -7 K 9.18 4.58 0.00 1.82 1.60 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.43 7.81 -6 I 8.25 4.43 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 1.28 0.75 0.87 0.00 0.00 -5 H 8.65 4.56 0.00 2.95 3.12 0.00 5.87 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 H 8.33 4.71 0.00 3.09 3.06 0.00 5.75 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 H 8.74 3.98 0.00 3.11 3.35 0.00 5.99 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 8.42 4.17 0.00 3.13 3.28 0.00 5.98 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 7.87 4.05 0.00 2.95 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 H 8.08 3.90 0.00 2.96 3.36 0.00 5.84 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -7 E 9.31 4.61 0.00 2.04 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 2.17 2.30 0.00 -6 T 8.40 4.61 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 1.17 0.00 0.00 -4 F 8.21 4.60 0.00 2.94 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 -3 D 8.66 3.89 0.00 2.54 2.84 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 -2 T 8.15 3.79 4.24 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 1.21 0.00 0.00 -1 L 7.61 3.66 0.00 1.28 1.70 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0 L 7.82 3.51 0.00 1.29 1.82 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 7.73 4.28 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 11 L 7.52 4.63 0.00 2.05 1.67 1.28 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.25 0.00 2.08 2.05 0.00 3.58 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 13 L 7.84 3.58 0.00 1.21 1.39 -0.16 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.89 4.96 0.00 3.23 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 15 Q 7.60 4.03 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.08 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 16 G 8.87 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 17 L 7.58 4.76 0.00 1.84 1.70 1.43 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 C 8.41 4.44 0.00 3.15 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 H 8.71 3.92 0.00 2.99 3.10 0.00 5.62 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 20 E 8.15 4.01 0.00 2.07 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 2.40 2.44 0.00 21 D 8.06 4.32 0.00 2.76 2.69 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 22 F 8.43 4.21 0.00 3.04 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.35 3.65 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 24 S 7.90 4.27 0.00 3.90 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 25 I 7.66 3.71 1.91 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 0.46 0.26 0.87 0.00 0.00 26 L 7.58 3.77 0.00 1.31 1.43 0.37 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.82 4.35 0.00 2.84 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 28 K 7.55 4.30 0.00 1.91 2.09 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.62 1.72 7.81 29 V 6.55 3.42 1.59 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 0.67 0.00 0.00 0.78 0.00 0.00 30 K 5.96 3.89 0.00 1.47 1.49 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.17 1.33 7.81 31 L 8.18 4.44 0.00 1.55 1.08 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 32 H 8.95 4.75 0.00 3.01 3.25 0.00 5.60 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.84 5.10 0.00 2.97 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.81 4.69 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.83 0.75 0.00 0.00 35 K 8.70 4.86 0.00 1.68 1.62 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.27 7.81 36 H 9.06 5.13 0.00 3.13 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 9.03 4.49 0.00 1.86 1.73 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.45 7.81 38 A 8.01 4.29 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 39 G 9.20 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 40 E 8.01 4.32 0.00 2.08 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 2.34 2.43 0.00 41 T 8.38 4.33 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 42 I 8.72 3.83 1.96 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 0.79 0.34 0.76 0.00 0.00 43 I 7.56 4.59 1.77 0.00 0.00 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 0.68 0.49 0.17 0.00 0.00 44 K 8.42 4.89 0.00 1.80 1.65 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.39 7.81 45 S 8.89 4.59 0.00 4.11 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 46 G 9.15 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 47 N 7.90 4.85 0.00 3.01 2.86 0.00 0.00 6.57 7.54 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 48 P 0.00 4.93 0.00 2.06 2.04 0.00 3.41 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.82 0.00 49 C 9.00 4.11 0.00 1.40 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 50 T 8.12 4.78 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 1.18 0.00 0.00 51 Q 7.94 4.98 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 52 L 9.00 4.47 0.00 1.77 1.52 1.26 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 53 C 8.55 5.36 0.00 2.99 2.84 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 54 F 9.38 5.27 0.00 3.12 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 55 L 9.38 4.60 0.00 1.86 1.89 1.09 0.55 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 56 L 9.17 4.49 0.00 1.78 1.79 1.17 0.81 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 57 K 8.13 4.46 0.00 1.81 1.64 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.47 7.81 58 G 9.32 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 0.00 0.00 0.00 0.00 59 E 8.76 5.22 0.00 2.06 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 2.17 2.28 0.00 60 I 8.81 5.11 2.04 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 1.35 1.19 0.96 0.00 0.00 61 S 8.86 5.15 0.00 3.70 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 62 I 8.81 3.93 1.73 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.80 0.54 0.00 0.00 63 V 8.43 4.63 1.93 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 0.97 0.00 0.00 0.82 0.00 0.00 64 T 8.78 4.74 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 1.17 0.00 0.00 65 N 8.66 5.13 0.00 2.52 2.79 0.00 0.00 7.10 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.35 4.01 0.27 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 67 K 8.53 3.92 0.00 1.90 1.75 0.00 1.94 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.54 1.06 7.81 68 E 9.24 3.83 0.00 2.09 2.01 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 2.21 2.25 0.00 69 N 8.08 4.19 0.00 2.81 2.83 0.00 0.00 6.88 7.06 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 70 I 7.36 3.97 2.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.46 1.04 0.00 0.00 71 Y 7.01 5.20 0.00 3.27 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 9.28 5.01 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 1.19 0.00 0.00 73 V 8.70 4.23 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 0.58 0.00 0.00 0.39 0.00 0.00 74 I 8.58 4.80 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.58 0.88 0.00 0.00 75 E 8.98 4.80 0.00 1.88 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 2.11 2.20 0.00 76 Q 8.45 4.65 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.36 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 77 I 8.83 4.48 1.56 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 1.01 0.63 -0.02 0.00 0.00 78 E 8.61 4.95 0.00 1.83 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 2.24 2.28 0.00 79 A 8.40 4.41 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 80 P 0.00 5.48 0.00 2.21 2.14 0.00 3.49 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.85 0.00 81 Y 8.38 4.86 0.00 3.05 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 82 L 7.79 4.34 0.00 1.42 1.17 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.01 3.54 1.70 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 1.00 0.54 0.20 0.00 0.00 84 E 8.83 4.01 0.00 2.27 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 2.52 2.48 0.00 85 P 0.00 4.23 0.00 2.03 1.89 0.00 3.57 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.69 0.00 86 Q 8.14 4.19 0.00 2.30 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 87 S 8.18 4.35 0.00 3.84 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 88 L 7.61 3.87 0.00 1.60 1.45 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 89 F 7.68 4.84 0.00 3.16 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 90 G 8.48 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 *92 N 8.70 4.41 0.00 2.72 2.83 0.00 0.00 6.83 7.70 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 93 T 7.87 4.64 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 1.20 0.00 0.00 94 N 8.84 5.16 0.00 2.77 2.71 0.00 0.00 7.05 7.51 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 95 Y 8.72 4.42 0.00 2.98 3.16 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 96 A 9.72 4.17 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 97 S 8.50 4.84 0.00 3.57 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.48 4.90 0.00 3.62 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 99 Y 9.03 4.92 0.00 2.79 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 0.00 100 V 8.61 4.79 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 1.05 0.00 0.00 0.89 0.00 0.00 101 A 9.03 4.27 1.37 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 0.00 102 H 9.31 4.25 0.00 3.14 3.43 0.00 5.94 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.52 4.56 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 1.24 0.00 0.00 104 E 8.74 4.35 0.00 2.02 1.93 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 2.34 2.36 0.00 105 V 8.96 4.91 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 106 H 9.29 5.48 0.00 3.19 3.33 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 9.13 5.43 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 1.31 0.00 0.00 108 V 8.82 4.85 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 -0.05 0.00 0.00 109 C 9.28 5.75 0.00 2.86 3.13 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 0.00 110 I 8.58 5.06 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.88 1.03 0.00 0.00 111 S 8.99 4.56 0.00 4.08 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 0.00 112 K 8.80 3.87 0.00 1.79 1.79 0.00 1.42 0.00 0.00 1.50 0.00 0.00 2.70 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.28 1.22 7.81 113 A 8.00 3.92 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 0.00 114 F 8.44 4.12 0.00 3.28 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 0.00 115 V 8.02 3.75 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 1.23 0.00 0.00 116 L 8.09 4.05 0.00 1.61 1.66 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.23 4.28 0.00 3.95 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 0.00 118 D 8.24 4.72 0.00 3.20 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 0.00 119 L 7.68 3.99 0.00 1.21 0.13 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.39 4.43 0.00 3.41 3.15 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 0.00 121 R 7.84 4.09 0.00 1.46 1.68 0.00 3.11 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 122 Y 7.74 4.83 0.00 3.09 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 0.00 123 D 8.97 4.48 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 0.00 124 I 7.86 3.73 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.79 0.97 0.00 0.00 125 F 8.28 4.01 0.00 3.17 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 0.00 126 R 7.95 3.33 0.00 1.89 1.90 0.00 3.25 0.00 0.00 3.53 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.66 0.00 127 L 7.89 4.05 0.00 1.67 1.93 0.91 1.17 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 0.00 128 N 8.09 4.42 0.00 2.64 2.69 0.00 0.00 6.69 7.06 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 0.00 129 Y 7.41 3.61 0.00 2.49 2.49 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 *131 N 8.13 4.66 0.00 2.93 2.85 0.00 0.00 7.03 7.40 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 0.00 132 I 7.65 3.64 1.88 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.08 0.79 0.00 0.00 133 V 7.83 3.69 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.23 0.00 0.00 134 S 8.02 4.16 0.00 3.90 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 0.00 135 N 8.36 4.37 0.00 2.94 2.88 0.00 0.00 6.65 7.19 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 0.00 136 R 8.00 3.89 0.00 1.94 2.12 0.00 3.14 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 137 A 8.10 4.07 1.38 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 0.00 0.00 138 Q 8.65 4.02 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 139 N 8.56 4.41 0.00 2.76 2.91 0.00 0.00 7.08 6.75 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 0.00 140 L 7.86 4.07 0.00 1.73 1.82 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.26 4.37 0.00 3.23 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 0.00 142 S 8.54 4.27 0.00 4.14 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.99 4.22 0.00 2.00 1.97 0.00 3.21 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 144 L 7.75 3.95 0.00 0.94 0.92 0.81 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 145 W 7.51 4.55 0.00 3.18 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.46 4.62 0.00 2.71 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 0.00 147 E 8.48 4.12 0.00 1.97 1.89 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 2.34 2.32 0.00 148 P 0.00 4.52 0.00 2.16 2.02 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 149 T 8.11 4.22 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 1.25 0.00 0.00 150 L 8.33 4.59 0.00 1.61 1.70 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 151 D 7.41 4.76 0.00 2.85 2.71 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 0.00 152 L 8.30 3.90 0.00 1.72 1.65 0.86 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 153 K 7.97 3.87 0.00 1.83 1.76 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.49 7.81 154 S 8.81 4.09 0.00 4.04 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 0.00 155 K 8.08 3.81 0.00 1.95 1.90 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.43 7.81 156 I 7.90 3.31 1.85 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 1.17 0.33 0.30 0.00 0.00 157 I 7.74 3.72 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.79 0.95 0.00 0.00 158 R 8.31 3.86 0.00 1.84 2.10 0.00 3.11 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 159 F 8.10 4.10 0.00 2.84 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 0.00 160 F 7.92 4.14 0.00 3.16 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 0.00 161 L 8.38 4.14 0.00 1.72 1.76 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 162 S 8.39 4.36 0.00 3.92 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 0.00 163 H 7.85 4.83 0.00 3.27 3.36 0.00 5.80 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 C 7.77 5.07 0.00 3.15 3.16 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 0.00 165 E 9.81 4.23 0.00 1.96 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 2.51 2.52 0.00 166 K 8.24 4.71 0.00 1.85 1.76 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.55 7.81 167 P 0.00 4.77 0.00 2.26 2.31 0.00 3.71 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 2.05 1.97 0.00 168 Q 7.80 4.70 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.48 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 169 G 9.13 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 0.00 170 E 8.27 4.84 0.00 2.12 1.77 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 2.33 2.27 0.00 171 K 9.25 5.09 0.00 1.72 1.63 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.61 7.81 172 T 8.93 5.09 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 1.28 0.00 0.00 173 F 9.67 5.04 0.00 2.98 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 0.00 174 K 9.32 5.02 0.00 1.70 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.40 7.81 175 V 8.30 4.68 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 0.75 0.00 0.00 1.10 0.00 0.00 176 K 8.70 4.49 0.00 2.01 1.59 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.56 1.50 7.81 *178 D 8.79 4.57 0.00 2.82 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 0.00 179 D 8.02 4.40 0.00 2.92 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 0.00 180 L 8.07 3.71 0.00 1.71 1.58 0.38 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 181 A 7.97 3.90 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 0.00 182 R 7.76 3.85 0.00 2.09 2.00 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 183 C 7.91 4.14 0.00 2.73 2.71 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 0.00 184 L 7.61 4.13 0.00 1.44 1.51 0.60 0.36 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 0.00 185 D 7.55 4.28 0.00 2.63 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 0.00 186 D 7.96 4.59 0.00 2.55 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 T 8.46 4.63 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 1.18 0.00 0.00 188 R 8.43 3.81 0.00 1.87 1.97 0.00 3.17 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 1.68 1.69 0.00 189 L 7.79 3.92 0.00 1.73 1.62 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 190 N 8.03 4.31 0.00 2.87 2.80 0.00 0.00 7.08 7.33 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 0.00 191 I 7.86 3.62 2.01 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.83 0.00 0.00 192 S 8.53 4.05 0.00 3.89 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 0.00 193 K 8.01 3.87 0.00 1.94 1.94 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.48 7.81 194 T 7.95 3.89 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 1.20 0.00 0.00 195 L 8.28 4.05 0.00 1.69 1.74 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 196 N 8.32 4.39 0.00 2.97 2.86 0.00 0.00 7.02 6.94 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 0.00 197 E 8.22 3.94 0.00 2.18 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 2.32 2.55 0.00 198 L 7.90 3.97 0.00 1.90 1.77 1.01 0.92 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 0.00 199 Q 8.13 4.40 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 200 D 8.34 4.44 0.00 2.84 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 0.00 201 N 8.16 4.81 0.00 2.69 2.83 0.00 0.00 7.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 G 7.71 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 0.00 203 L 8.09 4.36 0.00 1.76 1.74 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 204 I 7.31 4.89 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.84 0.81 0.00 0.00 205 E 9.37 4.96 0.00 1.79 1.70 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 2.19 2.23 0.00 206 L 8.95 4.81 0.00 1.46 1.57 0.92 1.05 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 0.00 207 H 9.00 4.95 0.00 3.09 3.19 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 R 8.61 4.01 0.00 1.83 1.75 0.00 3.42 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 209 K 8.85 4.14 0.00 1.98 1.93 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.43 7.81 210 E 7.90 5.21 0.00 2.12 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 2.36 2.40 0.00 211 I 9.36 4.87 1.94 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 1.17 0.70 0.80 0.00 0.00 212 L 8.79 4.68 0.00 1.84 1.57 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 213 I 8.99 4.51 1.79 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.32 0.88 0.00 0.00 214 P 0.00 4.11 0.00 2.16 2.09 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 215 D 7.74 4.52 0.00 2.68 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 0.00 216 A 8.96 4.07 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 0.00 217 Q 8.27 4.37 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.27 0.00 218 K 7.80 4.24 0.00 2.23 1.85 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.47 1.35 7.81 219 L 7.72 4.32 0.00 1.78 1.78 1.03 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 220 L 7.69 4.21 0.00 1.76 1.59 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.