NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2984 8.4444 121.4827 55.8469 31.2875 174.9812 3 T 4.2979 7.6058 114.1988 60.9876 68.1168 171.7970 4 A 4.2910 8.4737 129.0973 51.4096 23.2255 175.1429 5 L 4.3824 8.7634 122.4652 54.1036 42.3099 174.4175 6 Y 4.6459 8.4887 123.8598 57.5559 39.6475 174.6795 7 L 4.8554 9.0196 125.1970 53.6869 43.0899 175.7059 8 L 5.0302 8.8495 126.3009 52.4059 42.9405 174.8908 9 P 4.8611 0.0000 0.0000 62.7150 32.7314 175.8960 10 V 4.3782 7.3065 114.4822 59.4122 34.3068 175.6815 11 T 4.2129 8.3837 111.2091 61.6988 69.3173 174.7066 12 L 4.2231 8.4403 122.5329 57.2661 42.4701 177.1822 13 G 3.9101 7.4136 105.9747 45.0920 0.0000 172.4153 14 D 4.6653 8.5272 115.5626 53.0447 39.6763 176.2429 15 T 4.7748 7.3193 110.9232 58.1118 72.8589 173.0064 16 P 4.4091 0.0000 0.0000 62.7161 32.1438 177.4484 17 L 4.0295 8.5853 120.8496 58.0382 41.6841 178.8270 18 E 4.2647 8.1065 112.9641 57.4346 29.6140 176.9480 19 Q 4.2786 7.8462 120.6470 57.5902 29.5930 176.3185 20 V 4.4044 7.7200 106.6991 60.1991 33.6827 174.9266 21 L 4.7540 8.0439 120.5581 51.7264 43.6637 174.6871 22 P 4.4669 0.0000 0.0000 62.2174 32.1611 177.3237 23 S 4.0644 8.9501 116.4028 62.3088 62.4426 176.0748 24 Y 4.1875 8.3120 122.1819 61.0588 38.3989 178.0337 25 N 4.3466 8.6060 117.1138 56.3349 38.5425 177.6579 26 T 3.8448 8.1019 117.6997 66.4959 68.3688 176.5123 27 E 3.8907 7.9931 118.8996 59.5732 29.8666 179.2425 28 I 3.5905 7.2891 112.6726 63.6727 37.5922 178.2589 29 I 3.8739 7.5655 121.6989 64.1475 36.7133 177.7967 30 R 4.3796 8.0240 116.0160 57.0626 29.8000 177.1565 31 G 4.0371 7.7605 106.8085 44.9363 0.0000 173.0842 32 I 4.4862 7.5923 119.5103 59.3990 40.1989 175.5699 33 R 4.5491 7.9745 117.7373 55.5454 33.1565 174.1495 34 H 5.3119 7.8648 115.8580 53.9754 31.1331 173.2943 35 F 5.1927 9.0693 122.8442 55.6673 42.1685 174.7588 36 I 4.7914 9.9783 126.4302 60.9014 38.1912 175.5517 37 V 4.7752 8.6463 120.0035 59.8300 35.4227 177.1396 38 E 4.0732 8.8997 121.9417 58.7550 30.1120 176.1820 39 D 5.0092 7.7147 120.6054 51.9492 43.3237 176.2907 40 V 3.3228 8.2755 128.4662 65.0379 31.3579 178.1471 41 R 3.8503 7.8424 118.8523 58.5405 29.9323 177.9853 42 S 4.3083 8.0873 113.0055 60.1946 63.3572 176.3848 43 A 3.9012 7.7288 124.9879 55.0307 18.2596 179.5477 44 R 3.7033 7.4381 116.8029 59.3287 29.8619 178.6905 45 R 3.8634 7.5206 117.6993 59.2541 30.3729 178.1111 46 F 4.2514 8.3407 120.6961 61.4194 39.3171 177.1977 47 L 3.8457 8.6577 118.8068 57.6510 41.0746 179.7275 48 K 3.9603 7.6614 117.5044 58.9829 32.0957 178.9972 49 K 3.9791 7.6716 119.4344 58.7781 32.0933 178.6433 50 V 3.8661 6.9826 118.0771 62.5189 32.0969 175.5209 51 D 4.2060 7.1748 113.6669 53.3449 44.2092 176.4863 52 R 3.9632 8.8756 127.1771 59.2790 30.3184 178.1530 53 E 4.0606 8.3410 116.2586 59.0736 29.6677 177.7509 54 I 3.8680 7.2102 119.1040 61.1595 37.9493 176.6894 55 D 4.6238 8.3997 124.4693 52.9964 39.1653 175.8876 56 I 3.7636 8.0178 123.5823 63.5689 38.3887 176.5507 57 D 4.4876 8.1041 118.3974 56.0122 41.7173 176.0744 58 S 4.7139 7.6684 113.2302 56.1916 61.5303 172.3921 59 L 4.6762 7.2302 120.6612 53.0140 46.6424 177.1277 60 T 4.0792 8.6136 118.8101 62.1976 69.5464 174.0658 61 F 5.2827 8.1787 125.0678 56.6449 41.4020 175.9571 62 Y 4.2306 8.9713 118.2824 55.2790 40.6253 172.8660 63 P 5.4210 0.0000 0.0000 62.0757 32.0106 176.0681 64 L 4.8890 8.3456 123.3418 54.1242 44.0142 175.6814 *69 S 4.1815 8.5324 114.5902 57.3023 62.9934 172.8836 70 P 4.3067 0.0000 0.0000 65.3706 30.3564 178.3547 71 E 4.0467 7.9565 117.5270 59.3227 29.9949 178.3830 72 D 4.1162 7.7839 119.3156 56.6132 40.8717 178.5452 73 I 3.3528 7.4992 120.4398 64.4696 36.9493 178.4314 74 S 4.1955 7.4216 111.1864 61.0635 62.4145 176.2504 75 G 3.7101 7.5237 108.0701 48.0218 0.0000 175.5158 76 Y 4.1436 8.0333 118.4256 60.3056 38.0863 178.1598 77 L 4.1434 7.8001 118.8659 56.2438 41.7637 178.9923 78 K 3.8585 7.8541 119.3453 59.2619 31.9633 177.0854 79 P 4.2478 0.0000 0.0000 65.3780 31.0380 178.4823 80 L 4.2329 7.9617 119.7503 57.6591 41.9786 178.4940 81 A 4.0463 7.8282 119.5194 55.2641 18.3401 179.4537 82 G 3.7293 8.2978 103.0121 45.4616 0.0000 174.0061 83 G 3.8771 7.5209 107.7424 44.3517 0.0000 173.4614 84 A 4.5644 8.4053 123.5507 50.3635 20.6187 177.7638 85 S 4.3127 8.6280 117.9081 58.6280 63.7756 173.8624 *87 G 3.9305 8.3964 106.9886 46.3128 0.0000 172.0107 88 V 5.4847 9.2131 122.9312 60.1584 34.1220 174.3570 89 I 5.0965 8.9090 129.5644 59.1583 38.0546 174.3850 90 S 5.3422 8.1320 123.2738 55.4494 66.3143 173.9145 91 E 3.8719 9.0339 119.5965 58.9768 29.9680 177.4700 *99 D 4.4437 7.5028 120.4312 53.9532 41.6352 172.9529 100 P 4.9464 0.0000 0.0000 60.4638 29.4727 174.5945 101 G 4.1462 7.8485 110.7332 44.9918 0.0000 173.1959 102 A 4.0035 7.8964 122.1624 55.4386 18.1884 179.4968 103 D 4.3649 8.0483 116.7796 57.4581 41.0790 179.0058 104 V 3.5938 7.6553 118.4285 65.8009 31.5355 178.2095 105 V 3.5768 8.0970 118.0181 65.6835 31.4217 177.6678 106 A 3.9829 8.3640 120.9927 55.6036 18.2230 179.8162 107 I 3.6835 8.0213 117.9336 64.3010 37.1218 178.5581 108 A 3.9822 7.9491 121.5316 55.1711 18.1387 179.7491 109 Q 3.9181 8.2190 116.7436 59.1389 28.5912 178.8945 110 R 3.9443 7.8121 118.5415 59.1261 30.0895 177.3598 111 Q 4.3971 8.0375 116.0051 55.0409 29.6090 175.7611 112 K 3.8907 7.7963 117.2899 57.2836 30.4579 174.9467 113 L 4.5000 7.9860 117.0672 53.5114 43.6647 177.3047 114 K 4.1170 8.4691 123.0416 56.3701 33.1706 175.5166 115 V 4.7135 8.3187 127.4378 61.0583 33.9752 174.5141 116 I 4.5301 8.1171 126.7840 58.6024 40.9301 171.8632 117 P 4.9903 0.0000 0.0000 61.8882 32.4179 175.3094 118 L 4.7654 8.5188 124.4699 53.0192 43.1895 177.0660 119 V 3.7019 8.5396 122.0808 63.4639 32.0866 175.2282 120 G 4.0990 7.9107 113.1018 44.2740 0.0000 170.7840 121 P 4.4093 0.0000 0.0000 62.3925 32.2704 176.3788 122 S 4.5016 8.2797 114.3271 55.9693 65.5533 175.0425 123 S 4.1098 8.5780 124.6758 61.1224 63.0411 176.5422 124 I 3.3208 7.3987 123.5048 64.1609 36.7188 178.0375 125 I 3.6772 7.0750 112.1985 63.3312 37.7589 177.7740 126 L 4.0345 7.5357 120.4066 57.4866 41.7861 179.1107 127 S 4.2130 7.8037 113.9747 60.8451 62.8466 177.0009 128 V 3.4512 6.8475 117.5649 63.1718 31.1047 176.4389 *130 A 4.1975 7.9305 118.9741 50.9767 20.2122 178.7466 131 S 3.7737 7.1116 109.7250 58.4114 63.2602 175.8679 132 G 3.7245 8.0704 107.0712 45.2767 0.0000 172.8306 133 F 4.9814 7.2681 118.0408 55.3903 40.4560 174.9996 134 N 4.2665 7.9152 120.1563 54.2190 37.9624 174.6870 135 G 3.9577 8.5909 115.2836 46.9781 0.0000 173.7440 136 Q 3.9912 8.3725 119.7990 57.2421 29.3156 176.0616 137 S 4.4789 7.5724 111.2572 58.3472 64.4932 172.9718 138 F 5.6446 7.7652 119.7241 54.7777 41.5240 173.9117 139 A 4.7679 9.4675 121.3990 50.3693 22.2320 174.6147 140 F 5.4236 9.0958 124.8809 57.0205 41.0269 174.9477 141 H 4.5022 8.2482 121.1035 53.6884 29.8366 175.8759 142 G 3.2225 5.3800 108.8286 46.8775 0.0000 175.2879 143 Y 4.8949 8.3551 121.0714 56.0448 39.0449 174.5379 144 L 4.5632 8.0131 121.4930 52.1178 43.8422 174.8019 145 P 4.2536 0.0000 0.0000 63.5122 31.8748 176.9090 146 I 3.7987 8.3052 122.5992 64.0003 37.7706 176.2598 147 E 3.9276 8.0125 122.6318 55.3539 29.4199 174.2858 148 P 4.4472 0.0000 0.0000 63.9993 32.4365 175.6063 149 G 4.3449 8.9246 111.0142 46.5594 0.0000 175.8343 150 E 3.8697 7.9053 119.8454 58.9854 29.6660 178.6488 151 R 3.8295 7.8822 118.3377 59.1664 30.2802 178.1550 152 A 4.0296 7.8803 119.9266 54.1573 18.5196 178.8243 153 K 4.1268 7.8749 117.9512 58.3218 32.4000 178.8060 154 K 3.8972 7.9933 120.3476 59.2163 32.1409 178.5924 155 L 3.8719 7.5199 119.2800 57.6930 41.5754 179.2771 156 K 3.8450 7.5480 118.1480 59.9495 32.1083 178.6981 157 T 3.8762 7.9354 115.6489 66.8026 68.5357 176.5638 158 L 4.0267 8.5218 121.0454 57.8776 41.1974 179.2990 159 E 4.0718 8.8620 119.5963 59.3541 29.5736 178.9241 160 Q 4.2425 8.3946 118.3353 58.9499 28.6856 178.7728 161 R 4.1326 8.1514 119.2960 58.9414 30.1304 179.0178 162 V 4.0226 7.5461 119.2950 65.8988 31.3675 177.8346 163 Y 3.9957 7.6575 114.7726 60.7324 37.4829 178.3239 164 A 4.0956 8.5817 121.2455 54.7777 18.7458 178.2020 165 E 4.4473 8.2090 113.3774 55.3950 30.1031 176.1343 166 S 3.9550 7.7469 113.7405 59.8741 61.2566 171.8863 167 Q 4.8879 7.8821 119.6865 54.3874 31.6624 174.6956 168 T 4.1559 8.7559 124.1034 63.7588 69.9437 173.2315 169 Q 5.2667 8.9338 124.8717 54.3282 31.5192 174.7800 170 L 5.7835 9.2647 122.9426 52.3555 46.6166 175.4137 171 F 5.4470 7.7454 114.6166 56.7888 41.3806 171.7975 172 I 5.3597 8.9182 112.1441 59.8625 41.3614 173.5119 173 E 5.1703 8.2819 122.6478 55.0452 33.0395 174.5881 174 T 4.2195 9.1916 120.0887 61.1772 68.5888 173.5847 175 P 4.2293 0.0000 0.0000 66.3506 31.2030 177.2378 176 Y 4.5884 7.9458 112.4579 56.6643 37.4478 175.7034 177 R 4.5519 8.0194 117.4441 55.8910 32.1142 176.8228 178 N 4.5223 8.1012 116.9720 56.5783 38.8829 176.3195 179 H 4.3738 8.1854 115.1800 58.4879 29.2901 177.6416 180 K 4.2420 7.7608 116.4747 57.0915 31.4416 178.1336 *182 I 3.8935 7.7751 113.1464 60.2650 39.1539 177.3168 183 E 3.9255 8.3644 121.6250 59.1616 29.4989 178.5223 184 D 4.3655 8.5083 119.4490 56.9888 40.8094 178.9291 185 I 3.7715 7.4281 120.3534 64.1446 37.1874 177.6131 186 L 4.3655 8.0440 117.3611 57.0480 40.6072 177.6453 187 Q 4.5314 7.6271 117.4183 56.1624 30.3657 175.6748 188 N 4.8026 7.9642 114.7142 53.3376 40.4845 174.7223 189 C 4.8502 7.7666 115.3981 58.0273 29.9214 173.5116 190 R 4.1397 9.7340 121.2834 55.6067 30.3638 176.4958 191 P 4.2843 0.0000 0.0000 65.7550 31.4314 177.8038 192 Q 4.4838 7.9249 113.4497 56.2770 29.3965 175.9974 193 T 4.3623 7.8609 116.0396 63.2608 69.8530 173.3418 194 K 5.1434 9.4552 124.8380 55.0159 34.7811 175.2977 195 L 5.5749 9.8457 125.5607 53.5742 45.7422 174.4832 196 C 5.5162 9.6710 126.0905 57.7080 34.7892 172.2774 197 I 4.5604 8.6831 126.1755 59.3609 39.5969 174.2884 198 A 5.0409 8.5057 128.7724 50.1528 21.3612 175.1501 199 A 4.3914 9.0247 125.4965 51.6653 19.5448 179.9583 200 N 4.6065 8.8616 119.1392 54.0595 36.9940 175.0661 201 I 3.5762 7.4287 119.9069 63.2262 38.0701 178.5617 202 T 3.5894 9.4510 115.2760 62.8015 69.3940 173.6035 203 C 4.2265 7.9195 118.3309 60.4760 28.1451 172.7301 204 E 3.6577 7.9165 118.6022 55.4232 25.9601 173.5819 205 G 4.2437 8.2844 118.2038 45.4127 0.0000 170.0233 206 E 4.1754 7.6530 122.1722 55.7469 30.5141 176.1940 207 F 4.6287 8.8897 127.8657 56.5984 42.1359 173.2844 208 I 5.5097 8.2173 126.4185 58.2018 39.3983 174.5958 209 Q 4.5134 8.1005 123.8565 54.4184 32.5917 173.9458 210 T 5.3049 8.2398 116.2300 62.2296 71.8389 173.3808 211 R 4.5843 9.4078 123.3464 54.7458 35.4790 174.9146 212 T 4.5429 8.2631 116.7213 63.3624 69.6600 176.1461 213 V 3.8958 8.9695 124.8332 66.2553 31.6769 178.3908 214 K 3.9269 8.1205 119.3158 59.2782 31.9732 176.7220 215 D 4.8300 7.7748 115.8908 53.9290 40.9744 177.0603 216 W 4.6201 8.1591 120.8482 57.3909 29.8225 178.4361 217 K 4.0215 8.3758 117.5016 59.8856 31.5710 178.0029 218 G 3.9564 8.0915 106.1370 47.4155 0.0000 173.5146 219 H 4.9719 7.7810 116.5914 55.2892 29.5823 173.5845 220 I 4.3433 8.1526 120.2544 59.7964 38.4161 173.7971 221 P 4.5196 0.0000 0.0000 61.6393 32.3446 174.4489 222 E 3.9500 8.0174 120.4690 53.7452 30.1912 176.3458 223 L 3.5630 7.7153 119.6786 57.3446 39.7835 174.8227 224 S 4.8056 7.6416 109.4427 58.4930 63.9504 174.0247 225 K 4.6627 8.0745 118.3549 56.6369 33.1107 175.4161 226 I 4.7360 7.3082 110.2030 58.7976 40.5565 173.2452 227 P 4.5606 0.0000 0.0000 63.1308 32.0123 174.8348 228 C 4.7673 8.0982 112.7110 57.0887 33.6168 172.2295 229 I 4.5708 8.6257 120.6780 59.6062 39.4190 174.6926 230 F 5.1428 8.5934 125.0513 55.6593 41.4490 174.7496 231 L 5.3482 8.7505 122.3787 52.9555 45.5964 175.3850 232 L 5.2572 8.8715 123.3223 53.6028 44.9115 175.3026 233 Y 4.6759 8.0392 122.4970 57.1103 43.0020 171.8262 234 K 4.5906 6.0826 118.2905 54.3101 36.0455 176.1284 235 L 4.1573 8.1924 120.4821 55.3971 42.1056 176.1313 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 2 E 8.44 4.30 0.00 1.99 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 2.22 2.42 0.00 3 T 7.61 4.30 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 1.22 0.00 0.00 4 A 8.47 4.29 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.76 4.38 0.00 1.71 1.55 0.94 1.13 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 6 Y 8.49 4.65 0.00 3.04 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 7 L 9.02 4.86 0.00 1.70 1.68 0.98 0.32 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 8 L 8.85 5.03 0.00 1.68 1.73 1.21 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 9 P 0.00 4.86 0.00 2.08 2.06 0.00 3.81 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 10 V 7.31 4.38 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 0.79 0.00 0.00 11 T 8.38 4.21 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 1.37 0.00 0.00 12 L 8.44 4.22 0.00 1.63 1.75 0.89 0.79 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 13 G 7.41 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 14 D 8.53 4.67 0.00 2.64 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 15 T 7.32 4.77 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 16 P 0.00 4.41 0.00 2.23 2.22 0.00 3.83 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.99 0.00 17 L 8.59 4.03 0.00 1.73 1.74 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.11 4.26 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 19 Q 7.85 4.28 0.00 2.07 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 20 V 7.72 4.40 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 21 L 8.04 4.75 0.00 1.81 1.65 1.21 1.01 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 22 P 0.00 4.47 0.00 2.30 2.22 0.00 3.80 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.02 0.00 23 S 8.95 4.06 0.00 4.10 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 0.00 24 Y 8.31 4.19 0.00 3.07 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 25 N 8.61 4.35 0.00 3.01 2.94 0.00 0.00 7.02 6.83 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 26 T 8.10 3.84 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 1.16 0.00 0.00 27 E 7.99 3.89 0.00 1.82 1.92 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 2.30 2.54 0.00 28 I 7.29 3.59 1.20 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.46 0.05 0.00 0.00 29 I 7.57 3.87 2.11 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.92 0.97 0.00 0.00 30 R 8.02 4.38 0.00 1.94 1.95 0.00 3.16 0.00 0.00 3.20 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 31 G 7.76 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 0.00 0.00 0.00 0.00 32 I 7.59 4.49 1.45 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.69 0.16 0.00 0.00 33 R 7.97 4.55 0.00 1.64 1.74 0.00 3.04 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 34 H 7.86 5.31 0.00 2.84 3.28 0.00 5.83 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 35 F 9.07 5.19 0.00 3.26 3.14 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 36 I 9.98 4.79 2.00 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 1.29 0.45 1.12 0.00 0.00 37 V 8.65 4.78 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.99 0.00 0.00 38 E 8.90 4.07 0.00 2.03 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 2.51 2.32 0.00 39 D 7.71 5.01 0.00 2.72 2.47 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 40 V 8.28 3.32 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 0.67 0.00 0.00 0.69 0.00 0.00 41 R 7.84 3.85 0.00 1.84 1.90 0.00 3.14 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 42 S 8.09 4.31 0.00 4.09 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.73 3.90 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 44 R 7.44 3.70 0.00 1.58 1.90 0.00 3.05 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 45 R 7.52 3.86 0.00 2.15 2.13 0.00 3.31 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 46 F 8.34 4.25 0.00 3.16 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 47 L 8.66 3.85 0.00 1.72 1.66 0.64 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.66 3.96 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.56 7.81 49 K 7.67 3.98 0.00 1.80 1.68 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.37 7.81 50 V 6.98 3.87 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 0.61 0.00 0.00 0.80 0.00 0.00 51 D 7.17 4.21 0.00 2.62 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 52 R 8.88 3.96 0.00 1.79 1.96 0.00 3.29 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 53 E 8.34 4.06 0.00 2.28 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 2.30 2.39 0.00 54 I 7.21 3.87 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.59 0.94 0.00 0.00 55 D 8.40 4.62 0.00 2.75 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 56 I 8.02 3.76 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.87 0.93 0.00 0.00 57 D 8.10 4.49 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.67 4.71 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.23 4.68 0.00 0.96 0.96 1.01 0.97 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 60 T 8.61 4.08 4.01 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 0.77 0.00 0.00 61 F 8.18 5.28 0.00 2.89 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 62 Y 8.97 4.23 0.00 2.73 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 5.42 0.00 2.02 2.04 0.00 3.62 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 64 L 8.35 4.89 0.00 1.77 1.87 1.11 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 *69 S 8.53 4.18 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.31 0.00 2.27 2.28 0.00 3.71 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 2.05 2.01 0.00 71 E 7.96 4.05 0.00 2.18 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 2.30 2.34 0.00 72 D 7.78 4.12 0.00 2.68 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 0.00 0.00 0.00 73 I 7.50 3.35 1.78 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 1.34 1.24 0.88 0.00 0.00 74 S 7.42 4.20 0.00 3.86 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 75 G 7.52 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.03 4.14 0.00 2.87 2.47 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 77 L 7.80 4.14 0.00 1.95 1.67 0.91 1.17 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 78 K 7.85 3.86 0.00 1.92 1.87 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.75 7.81 79 P 0.00 4.25 0.00 1.92 1.84 0.00 3.56 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 2.03 2.15 0.00 80 L 7.96 4.23 0.00 1.69 1.89 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.83 4.05 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.30 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.52 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 84 A 8.41 4.56 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 85 S 8.63 4.31 0.00 3.71 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *87 G 8.40 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 88 V 9.21 5.48 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 1.00 0.00 0.00 1.01 0.00 0.00 89 I 8.91 5.10 1.82 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 0.82 1.72 1.00 0.00 0.00 90 S 8.13 5.34 0.00 3.90 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 91 E 9.03 3.87 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.24 0.00 *99 D 7.50 4.44 0.00 2.82 2.66 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 0.00 100 P 0.00 4.95 0.00 2.12 2.05 0.00 3.97 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 2.06 2.11 0.00 101 G 7.85 4.15 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 0.00 102 A 7.90 4.00 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 0.00 103 D 8.05 4.36 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.66 3.59 2.27 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 1.08 0.00 0.00 1.00 0.00 0.00 105 V 8.10 3.58 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 1.03 0.00 0.00 1.03 0.00 0.00 106 A 8.36 3.98 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 0.00 107 I 8.02 3.68 1.85 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 1.44 0.64 0.89 0.00 0.00 108 A 7.95 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.22 3.92 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.74 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 110 R 7.81 3.94 0.00 1.80 2.13 0.00 3.24 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 111 Q 8.04 4.40 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.39 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 112 K 7.80 3.89 0.00 1.81 1.82 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.38 7.81 113 L 7.99 4.50 0.00 1.54 1.56 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.47 4.12 0.00 1.84 1.76 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.38 7.81 115 V 8.32 4.71 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 0.87 0.00 0.00 0.96 0.00 0.00 116 I 8.12 4.53 1.56 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.09 -0.21 0.00 0.00 117 P 0.00 4.99 0.00 2.14 2.05 0.00 3.78 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 1.96 1.99 0.00 118 L 8.52 4.77 0.00 1.87 1.80 1.04 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.54 3.70 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 0.80 0.00 0.00 0.96 0.00 0.00 120 G 7.91 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.41 0.00 2.18 2.06 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 122 S 8.28 4.50 0.00 3.81 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 0.00 123 S 8.58 4.11 0.00 3.95 4.01 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 7.40 3.32 1.66 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.77 0.59 0.00 0.00 125 I 7.07 3.68 1.79 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 1.45 0.45 0.88 0.00 0.00 126 L 7.54 4.03 0.00 1.63 1.68 0.91 0.83 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 0.00 127 S 7.80 4.21 0.00 3.91 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 0.00 128 V 6.85 3.45 1.80 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 0.54 0.00 0.00 0.02 0.00 0.00 *130 A 7.93 4.20 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 0.00 131 S 7.11 3.77 0.00 3.12 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 0.00 132 G 8.07 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 0.00 0.00 0.00 133 F 7.27 4.98 0.00 2.98 2.51 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 0.00 134 N 7.92 4.27 0.00 2.52 2.08 0.00 0.00 6.91 7.98 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 0.00 135 G 8.59 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Q 8.37 3.99 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 137 S 7.57 4.48 0.00 3.69 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 0.00 138 F 7.77 5.64 0.00 3.03 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 0.00 139 A 9.47 4.77 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 F 9.10 5.42 0.00 3.04 3.06 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 0.00 141 H 8.25 4.50 0.00 3.03 3.19 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 5.38 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Y 8.36 4.89 0.00 2.99 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 0.00 144 L 8.01 4.56 0.00 1.40 1.35 -0.11 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 145 P 0.00 4.25 0.00 2.06 1.98 0.00 3.56 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 146 I 8.31 3.80 1.85 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 1.26 0.70 0.89 0.00 0.00 147 E 8.01 3.93 0.00 2.02 1.83 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 2.36 2.37 0.00 148 P 0.00 4.45 0.00 2.06 1.98 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 149 G 8.92 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 0.00 150 E 7.91 3.87 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 151 R 7.88 3.83 0.00 1.99 1.84 0.00 3.07 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 152 A 7.88 4.03 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 0.00 153 K 7.87 4.13 0.00 2.06 1.88 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.42 7.81 154 K 7.99 3.90 0.00 1.90 1.64 0.00 1.61 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.28 1.38 7.81 155 L 7.52 3.87 0.00 1.63 1.70 0.87 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 0.00 156 K 7.55 3.85 0.00 1.91 1.97 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 157 T 7.94 3.88 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 1.21 0.00 0.00 158 L 8.52 4.03 0.00 1.96 1.81 0.83 0.97 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 0.00 159 E 8.86 4.07 0.00 2.17 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 0.00 2.59 2.51 0.00 160 Q 8.39 4.24 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.69 0.00 161 R 8.15 4.13 0.00 2.12 2.04 0.00 3.19 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 162 V 7.55 4.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.07 0.00 0.00 163 Y 7.66 4.00 0.00 3.09 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 A 8.58 4.10 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 165 E 8.21 4.45 0.00 2.10 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 2.28 2.29 0.00 166 S 7.75 3.95 0.00 4.09 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 0.00 167 Q 7.88 4.89 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 168 T 8.76 4.16 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 1.20 0.00 0.00 169 Q 8.93 5.27 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.49 2.64 0.00 170 L 9.26 5.78 0.00 1.96 1.60 1.16 0.89 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 0.00 171 F 7.75 5.45 0.00 3.23 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 0.00 172 I 8.92 5.36 1.81 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.17 1.07 0.00 0.00 173 E 8.28 5.17 0.00 2.19 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 2.35 2.32 0.00 174 T 9.19 4.22 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 0.82 0.00 0.00 175 P 0.00 4.23 0.00 2.47 2.27 0.00 3.85 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 176 Y 7.95 4.59 0.00 3.12 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 0.00 177 R 8.02 4.55 0.00 1.69 1.71 0.00 2.87 0.00 0.00 2.93 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.50 0.00 178 N 8.10 4.52 0.00 2.83 3.02 0.00 0.00 6.94 7.55 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 0.00 179 H 8.19 4.37 0.00 3.21 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 7.76 4.24 0.00 1.86 1.89 0.00 1.53 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.57 7.81 *182 I 7.78 3.89 1.74 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 1.42 0.97 0.87 0.00 0.00 183 E 8.36 3.93 0.00 2.26 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 0.00 2.31 2.39 0.00 184 D 8.51 4.37 0.00 2.60 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 0.00 185 I 7.43 3.77 1.96 0.00 0.00 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 1.58 1.04 0.97 0.00 0.00 186 L 8.04 4.37 0.00 1.84 1.87 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 7.63 4.53 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.62 0.00 188 N 7.96 4.80 0.00 2.84 2.83 0.00 0.00 6.96 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 C 7.77 4.85 0.00 3.19 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 R 9.73 4.14 0.00 1.93 1.88 0.00 2.96 0.00 0.00 2.97 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 191 P 0.00 4.28 0.00 2.20 2.15 0.00 3.59 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 192 Q 7.92 4.48 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 193 T 7.86 4.36 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 1.28 0.00 0.00 194 K 9.46 5.14 0.00 1.81 2.12 0.00 1.83 0.00 0.00 1.80 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.43 7.81 195 L 9.85 5.57 0.00 1.91 1.92 1.14 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 196 C 9.67 5.52 0.00 2.68 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 0.00 197 I 8.68 4.56 1.90 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.32 0.79 0.00 0.00 198 A 8.51 5.04 1.07 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 0.00 199 A 9.02 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 N 8.86 4.61 0.00 2.92 2.81 0.00 0.00 6.81 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 0.00 201 I 7.43 3.58 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.84 0.00 0.00 202 T 9.45 3.59 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 1.18 0.00 0.00 203 C 7.92 4.23 0.00 3.14 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 E 7.92 3.66 0.00 2.15 1.98 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 2.43 2.38 0.00 205 G 8.28 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 0.00 0.00 0.00 0.00 206 E 7.65 4.18 0.00 2.18 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.14 0.00 207 F 8.89 4.63 0.00 3.15 2.88 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 0.00 208 I 8.22 5.51 1.73 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.12 0.76 0.00 0.00 209 Q 8.10 4.51 0.00 1.85 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.86 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 210 T 8.24 5.30 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 211 R 9.41 4.58 0.00 0.67 1.05 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.78 0.00 212 T 8.26 4.54 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 1.35 0.00 0.00 213 V 8.97 3.90 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 1.04 0.00 0.00 1.15 0.00 0.00 214 K 8.12 3.93 0.00 1.93 1.89 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.47 7.81 215 D 7.77 4.83 0.00 2.58 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 W 8.16 4.62 0.00 3.68 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 0.00 217 K 8.38 4.02 0.00 1.82 1.98 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.65 1.53 7.81 218 G 8.09 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 H 7.78 4.97 0.00 3.24 3.39 0.00 5.85 0.00 0.00 0.00 0.00 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 I 8.15 4.34 2.28 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.70 1.07 0.00 0.00 221 P 0.00 4.52 0.00 1.80 1.68 0.00 3.87 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.44 0.00 222 E 8.02 3.95 0.00 1.93 1.80 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 2.30 2.38 0.00 223 L 7.72 3.56 0.00 1.79 1.61 0.82 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 224 S 7.64 4.81 0.00 3.97 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 0.00 225 K 8.07 4.66 0.00 1.75 1.78 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.41 7.81 226 I 7.31 4.74 1.87 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 1.45 1.22 0.93 0.00 0.00 227 P 0.00 4.56 0.00 2.22 2.14 0.00 3.75 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 1.98 1.97 0.00 228 C 8.10 4.77 0.00 2.70 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 0.00 229 I 8.63 4.57 1.65 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.73 0.72 0.00 0.00 230 F 8.59 5.14 0.00 2.22 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 0.00 231 L 8.75 5.35 0.00 1.96 1.82 0.88 0.50 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 0.00 232 L 8.87 5.26 0.00 1.57 1.56 1.18 0.70 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 0.00 233 Y 8.04 4.68 0.00 1.67 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 0.00 234 K 6.08 4.59 0.00 1.41 0.82 0.00 1.41 0.00 0.00 1.29 0.00 0.00 2.44 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.55 7.81 235 L 8.19 4.16 0.00 1.64 1.59 0.94 0.83 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 * Residues marked with a * may have inaccurate shift predictions.