NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 D 4.5962 8.2076 120.1885 53.3074 41.8758 175.9735 -1 P 4.0711 0.0000 0.0000 64.8044 30.8034 176.5969 0 M 4.0086 8.5430 119.0084 58.5102 32.5303 179.5113 1 V 3.5849 7.8181 118.0182 65.9605 31.8059 177.5168 2 S 4.2213 8.2999 113.2345 61.4720 62.2029 176.2137 3 K 3.9871 8.0157 121.7838 59.4007 31.9609 179.0816 4 G 3.7049 7.7538 104.7182 47.9055 0.0000 175.5093 5 E 4.0608 8.3391 121.3114 59.3178 29.2913 179.4483 6 E 3.9512 8.6673 117.6585 59.1920 29.5286 179.0717 7 L 3.8387 7.6620 118.2009 56.5584 40.5145 178.2970 8 F 4.7257 8.0489 115.8716 57.0482 39.0562 177.3071 9 T 4.0992 7.3385 110.9587 64.7840 68.7935 174.1032 10 G 4.1823 7.8284 109.7459 45.1667 0.0000 174.1588 11 V 4.4717 8.4970 125.6095 61.4643 32.7045 174.6950 12 V 4.6637 8.9156 128.5672 60.2472 33.9494 173.1232 13 P 4.9032 0.0000 0.0000 63.0316 32.8568 175.1430 14 I 5.1320 8.7304 122.1736 59.5291 41.3571 174.1488 15 L 5.1326 8.8570 126.5711 53.2839 45.5447 175.2143 16 V 5.0182 8.8874 125.5411 61.2207 35.1104 173.9908 17 E 5.1518 9.3352 125.9311 54.6238 33.5761 174.1557 18 L 5.2913 9.4491 126.6983 53.3269 45.5432 174.5132 19 D 5.0947 9.0047 125.8814 52.4481 43.5279 175.5632 20 G 3.4310 8.4618 110.0839 44.0539 0.0000 171.3093 21 D 5.0475 8.6105 122.0399 52.6251 44.7147 174.1853 22 V 4.7389 9.0252 127.2941 61.1994 33.8898 175.1772 23 N 4.3169 10.2931 127.8174 54.3907 36.6526 176.0029 24 G 3.8331 8.7267 105.3844 45.8210 0.0000 174.3540 25 H 4.4489 8.1756 118.0878 55.3655 28.0162 174.5149 26 K 4.9341 8.3746 124.4627 55.8943 33.2844 176.4517 27 F 4.8803 8.1336 116.0346 56.4168 41.6000 172.9341 28 S 5.2453 8.9698 115.6629 56.9085 67.1288 173.3055 29 V 5.1884 8.9519 121.8104 61.4224 35.3239 174.2389 30 S 5.3923 9.2714 122.5969 56.7673 66.1467 173.3693 31 G 4.0504 9.4374 110.4910 44.3633 0.0000 171.3152 32 E 5.0397 8.9192 120.5188 53.7401 33.9363 176.2952 33 G 4.0460 7.6227 108.6286 46.2408 0.0000 171.2417 34 E 5.0095 8.0328 118.9711 55.0825 33.5397 175.0184 35 G 3.6052 8.9266 107.6751 44.5084 0.0000 171.3359 36 D 5.1667 9.1240 120.9167 51.9228 42.3724 175.6144 37 A 4.4695 9.0763 128.1783 54.9706 19.0656 179.8401 38 T 3.7013 8.1665 111.8001 66.5790 68.3824 174.3201 39 Y 4.4298 7.8023 115.0599 56.9556 39.0870 175.8283 40 G 4.3746 8.0890 108.2697 46.2834 0.0000 172.5115 41 K 4.6843 8.1896 120.9139 54.0891 34.6510 174.8278 42 L 4.9819 8.4744 126.6404 53.1111 45.7635 175.5180 43 T 4.9517 8.5689 119.0372 61.7584 71.8999 173.0881 44 L 4.8807 8.8531 125.2723 52.8113 46.8965 175.1060 45 K 4.7020 8.4481 123.0728 54.5559 35.2216 174.6794 46 F 5.0142 9.0305 126.0371 55.6137 42.0644 174.5890 47 I 4.9544 8.9237 123.2215 59.5052 40.5938 174.2777 48 C 5.0941 9.6145 128.8275 59.5990 31.3000 173.3938 49 T 4.3526 9.0118 117.1494 62.4938 69.0154 175.4186 50 T 4.4950 7.7131 111.3259 61.0967 70.5815 173.8783 51 G 4.1792 7.7452 107.8889 44.6894 0.0000 176.8072 52 K 4.2809 8.7111 126.2920 55.1811 32.4667 175.6510 53 L 3.7622 9.4470 129.2819 54.2946 42.2467 175.1118 54 P 4.5618 0.0000 0.0000 62.7460 31.6560 175.5814 55 V 4.1113 6.1537 111.1123 58.5255 35.4601 173.5682 56 P 4.3722 0.0000 0.0000 62.1278 32.0437 177.6019 57 W 4.3325 9.1337 123.0166 59.9237 28.8881 176.9488 58 P 4.5676 0.0000 0.0000 65.7214 30.5711 178.3222 59 T 4.2735 7.8852 107.2666 63.5364 68.9870 175.4531 60 L 4.3283 8.0729 121.0730 54.4790 41.2220 178.1207 61 V 3.6098 7.5906 119.8929 66.5079 31.1855 178.0327 62 T 4.0660 7.9461 107.1095 64.9665 68.6942 176.1302 63 T 4.0876 7.0031 115.1338 65.9833 69.6186 176.5475 64 F 4.8024 7.6827 119.9378 56.7581 37.2630 176.5440 *68 L 4.3735 7.4122 118.4725 55.1809 43.2701 178.9907 69 M 3.9087 7.7788 119.5295 57.8778 32.5050 178.9016 70 C 4.1193 7.6420 112.6188 60.1023 29.8847 174.2501 71 F 4.4677 8.3829 119.2142 57.4480 38.7747 175.2867 72 A 4.3390 7.5410 123.3756 52.0237 19.2062 178.0106 73 R 4.3349 8.9511 122.1175 55.6016 30.9884 175.0643 74 Y 4.4082 8.5780 125.3995 56.1861 38.6437 174.2910 75 P 4.3073 0.0000 0.0000 62.6778 32.6511 176.5719 76 D 4.4004 9.0585 120.4599 58.1118 40.7915 178.6488 77 H 4.4607 8.3504 112.2913 57.6259 28.8045 175.8885 78 M 4.5716 7.9332 120.8727 55.0019 32.4948 177.2763 79 K 3.8110 7.9563 120.1304 59.7160 32.0653 178.4428 80 Q 4.0100 7.9664 115.5301 57.9899 28.7251 176.3228 81 H 4.6547 8.0567 114.5200 55.4682 28.8958 175.1267 82 D 3.7898 7.0794 122.0826 52.1511 39.5886 176.2997 83 F 4.1607 8.0381 128.3799 60.1338 39.2898 176.3331 84 F 3.9639 7.6940 115.8476 60.5990 39.1011 177.4692 85 K 4.1874 8.4949 118.2738 59.1608 31.5562 179.5989 86 S 4.0301 7.2738 112.5137 60.9808 63.0573 175.7626 87 A 4.0934 7.4857 123.1339 52.6643 18.3471 177.1825 88 M 4.7025 7.3582 117.3756 54.0629 33.0471 174.8865 89 P 4.8007 0.0000 0.0000 64.4259 32.4054 178.1615 90 E 3.8464 8.3090 118.8264 59.8822 29.7365 175.2794 91 G 3.7701 8.4763 103.4441 44.0808 0.0000 171.5130 92 Y 5.4514 7.9352 115.3063 55.4975 42.2186 174.3266 93 V 4.6793 9.1639 120.9731 62.3010 33.5403 174.4761 94 Q 5.2475 9.4947 128.7774 54.5880 31.6728 173.7091 95 E 5.3305 9.5215 126.4068 54.7966 33.0534 175.4840 96 R 5.2577 8.9612 120.7132 54.9379 35.4163 174.0393 97 T 4.8280 8.7176 117.2757 61.7989 71.8904 173.1083 98 I 4.5022 8.5851 127.3115 59.4522 40.0173 174.5999 99 F 4.7958 8.9678 127.3711 55.8240 40.6804 175.1668 100 F 4.7204 8.8787 124.4169 55.9653 40.0647 175.8412 101 K 4.1535 8.8335 126.2897 57.8294 32.4468 175.9771 102 D 4.5482 9.1447 123.8512 54.9217 38.6008 173.2318 103 D 4.3310 7.8090 118.4209 53.9999 43.8750 173.5696 104 G 2.8767 7.5328 106.7392 44.3278 0.0000 171.5812 105 N 5.4064 7.8308 114.9416 51.3391 41.0420 173.1013 106 Y 5.5345 8.9791 118.4129 56.7537 40.7450 174.7477 107 K 5.1481 9.4418 122.3984 54.7687 35.6986 175.2802 108 T 5.1221 9.0008 114.5897 59.8087 72.2331 172.7305 109 R 5.0653 8.9648 123.9507 54.5792 33.1848 173.9088 110 A 5.3741 9.1792 126.8717 50.2293 23.3928 174.2694 111 E 5.0137 9.1009 118.9721 54.5003 33.0929 175.1927 112 V 4.7897 8.3519 125.4058 61.1009 33.6677 174.5159 113 K 4.6060 8.5222 125.6362 55.9990 36.2574 174.5351 114 F 4.6732 8.5100 120.2640 57.2799 40.0612 176.0995 115 E 4.5229 9.3542 122.6555 54.9905 31.1431 176.8128 116 G 3.9192 8.2966 116.6512 46.9992 0.0000 173.2640 117 D 4.6008 8.8474 123.5764 55.1628 41.4541 175.7495 118 T 4.7696 7.9381 117.6395 61.7807 71.0352 173.4074 119 L 4.1633 8.7864 128.8313 53.8341 43.4568 175.1616 120 V 4.8248 8.6423 127.1817 61.1020 34.4617 173.9555 121 N 5.2786 9.1386 126.0025 52.1331 41.2163 172.7060 122 R 5.0707 8.8203 126.3084 54.6744 32.3562 175.7697 123 I 5.0938 9.0629 124.7805 59.4864 41.2565 174.2053 124 E 5.0519 9.1857 125.5585 54.4100 32.5000 174.7035 125 L 5.1233 8.8258 125.9416 53.0686 45.5884 175.0482 126 K 5.0370 9.2382 125.3078 54.5117 35.5156 175.2727 127 G 5.0218 9.5268 112.4715 44.5580 0.0000 171.9638 128 I 5.1294 8.7191 115.8487 59.5094 41.6839 174.8751 129 D 4.4563 8.8316 120.2782 55.3651 38.2048 174.2938 130 F 4.4511 8.3114 117.2082 56.9438 39.8235 175.5456 131 K 4.2999 9.6636 124.1340 55.8811 32.4145 178.4897 132 E 4.0491 9.0154 123.9956 58.6411 29.5824 177.4498 133 D 4.8809 8.0395 115.6904 52.8032 40.2261 176.7129 134 G 4.0049 7.8544 110.4981 45.2342 0.0000 174.2870 135 N 4.3843 7.9646 112.6131 55.7354 38.6092 176.7929 136 I 3.8111 7.1709 118.8903 63.2150 38.0272 177.8630 137 L 3.7652 7.5511 121.2512 57.1921 41.7764 178.3921 138 G 3.7363 7.8994 105.7792 45.1836 0.0000 173.2383 139 H 3.9203 7.5020 116.0937 57.1579 26.6055 174.7514 140 K 4.7489 8.4052 115.0725 56.1855 33.9466 177.4578 141 L 5.0183 7.7045 120.2367 53.1955 43.1111 176.4849 142 E 4.1089 8.9592 123.1038 56.7148 30.3151 177.4532 143 Y 4.5320 8.6851 125.1079 55.5625 37.4065 173.7221 144 N 4.9093 7.5978 119.3053 52.9035 40.0783 173.6676 145 Y 4.2690 8.1779 115.8983 57.1616 41.5836 173.6718 146 N 4.8872 8.0874 124.2325 51.9158 40.4392 174.9020 147 S 4.7318 8.2838 116.4470 59.2752 63.7801 173.4209 148 H 5.0284 8.9706 118.8459 54.5596 33.4808 172.1263 149 N 5.2801 8.7020 117.5448 51.9188 40.7102 174.6603 150 V 3.8629 8.2390 121.9472 61.2404 34.0918 173.7679 151 Y 4.9169 8.3957 126.1664 56.8335 39.8371 174.6304 152 I 4.7273 8.9610 125.9214 59.6579 39.8249 174.6966 153 M 5.2739 8.8804 123.2161 52.9750 34.7749 174.8905 154 A 4.1992 8.6053 121.5560 52.0978 19.6959 177.1876 155 D 4.7501 8.6338 120.0960 52.1762 40.4910 176.5528 156 K 4.0012 8.1941 122.3388 59.1092 32.8485 179.5728 157 Q 3.9822 8.1694 116.4562 58.3024 28.6807 177.4664 158 K 4.4146 7.9756 114.3024 55.1412 32.4574 175.1752 159 N 4.3037 8.2393 116.1608 54.0799 38.6546 173.9501 160 G 3.7644 7.7741 105.5442 44.9029 0.0000 172.3813 161 I 5.0769 7.8837 115.0363 59.0745 41.6824 174.9903 162 K 5.1114 8.9277 121.4798 54.9061 36.5566 175.6603 163 V 5.1100 8.6082 121.4131 61.3298 35.2323 173.0914 164 N 5.3671 8.7133 125.1650 51.8473 42.7662 172.6417 165 F 4.6950 7.8577 118.4801 56.6647 41.8014 172.3238 166 K 4.9617 9.0214 118.6095 54.6968 34.5326 175.7151 167 I 4.1590 8.4954 125.2981 59.4766 39.8600 174.8240 168 R 4.8659 8.5990 125.3303 54.9506 31.9207 175.0739 169 H 4.7084 8.8787 122.8056 54.0617 30.5947 174.8607 170 N 4.8702 8.7880 121.4988 53.6912 39.6648 174.3416 171 I 4.7706 8.8108 125.0043 59.6438 38.9036 176.7392 172 E 3.9616 9.1310 124.1367 59.5401 29.2090 177.8506 173 D 4.5646 8.0492 116.1573 53.3391 39.7728 176.7983 174 G 3.9498 8.3097 109.5319 45.4198 0.0000 173.7832 175 S 4.6460 8.4660 114.6515 57.5039 65.0557 172.8619 176 V 4.9529 8.2360 111.2204 59.7030 35.3966 175.3969 177 Q 4.5807 9.1394 125.3507 54.2145 30.8686 174.6746 178 L 4.5581 8.5867 127.3608 54.7044 43.2980 176.1513 179 A 4.5574 9.2720 125.2918 50.1132 21.5399 174.6084 180 D 4.7518 8.9677 123.2058 54.6130 42.4880 175.6968 181 H 4.9189 8.8889 122.2283 54.4776 30.6557 173.8201 182 Y 4.7487 9.1085 121.4408 56.1719 40.8051 174.6884 183 Q 5.2266 9.1699 123.9524 54.7859 33.2953 173.4995 184 Q 5.1580 9.2878 122.7681 54.4167 33.7478 173.8035 185 N 6.3000 9.2976 118.3688 50.8619 43.1227 173.6346 186 T 5.2308 8.5099 111.1515 59.2356 72.6333 171.4004 187 P 4.9580 0.0000 0.0000 63.4026 31.7734 176.4059 188 I 3.9865 8.8736 123.4291 63.9434 37.4841 177.1306 189 G 3.8963 7.8215 107.5494 45.1580 0.0000 172.4669 190 D 4.6125 8.4376 116.9780 53.9882 41.6134 176.6053 191 G 3.8261 7.7986 107.0577 45.3987 0.0000 171.5571 192 P 4.5237 0.0000 0.0000 62.4695 32.1202 175.6655 193 V 4.4145 7.7758 111.1933 59.4212 35.4389 175.2337 194 L 4.3151 8.6419 121.9594 53.8750 41.7543 176.3420 195 L 4.6268 8.4040 124.7083 52.8453 42.7663 174.7915 196 P 4.8356 0.0000 0.0000 61.4701 32.8732 175.5320 197 D 4.5832 8.4998 119.3975 53.8974 41.4590 175.9933 198 N 4.7254 8.5433 118.4126 55.0518 39.2162 174.0189 199 H 4.9902 8.7540 117.6681 55.3656 32.4677 171.5819 200 Y 5.1904 8.4597 115.2820 55.5001 41.8753 174.0041 201 L 4.8823 8.6483 120.0346 53.2163 44.4623 175.6780 202 S 5.0739 9.0133 120.2352 57.2915 64.9030 172.7192 203 Y 5.2724 9.1560 122.7677 56.2965 40.9211 174.7941 204 Q 5.0369 9.1246 121.4587 54.3679 32.5742 174.7308 205 S 5.2166 8.9293 118.0129 56.8095 67.1773 173.1662 206 A 4.7985 9.2248 125.4494 50.1348 21.8275 174.7423 207 L 5.1389 8.5699 122.2780 53.2431 44.3840 175.9340 208 S 4.8912 9.0254 116.2439 57.5232 66.8777 172.4512 209 K 4.8923 8.5319 117.4148 54.7434 35.9363 175.9485 210 D 4.6288 8.8858 122.7527 52.3562 41.3941 175.5326 211 P 4.3668 0.0000 0.0000 65.1372 31.5769 176.6408 212 N 4.6932 8.2649 115.7052 52.7920 38.4849 173.8378 213 E 4.5196 7.9233 120.1838 54.3908 31.0192 175.9385 214 K 4.2507 8.5156 124.8255 57.2994 32.9865 177.0902 215 R 4.3373 8.0338 118.1773 55.0098 31.1754 175.1476 216 D 4.8660 8.5713 119.3144 54.7148 42.2167 174.6455 217 H 4.6819 8.3485 119.6333 55.1630 31.6867 172.4601 218 M 4.6136 8.0370 117.9354 53.1070 35.7017 173.4418 219 V 4.6448 8.7026 126.1573 61.2707 33.8874 174.0489 220 L 5.1633 9.1141 129.7895 53.1007 45.2271 174.4904 221 L 5.0217 8.8474 127.9771 53.2978 44.7764 174.8299 222 E 5.1850 8.7655 124.8288 54.5861 34.0790 174.5579 223 F 5.2345 9.1389 121.5242 55.6920 43.0302 174.5194 224 V 4.4871 8.7634 122.0327 61.5409 34.8108 173.9510 225 T 4.9670 8.4666 123.9862 61.4674 71.8478 173.5430 226 A 4.2666 8.4337 128.3957 52.0139 19.4553 176.1226 227 A 4.0220 8.4796 121.4404 50.9057 23.3595 177.1841 228 G 4.0483 9.0613 105.2410 45.3964 0.0000 173.6362 229 I 4.4050 7.1675 119.5764 59.0578 38.7794 175.6104 230 T 4.0764 8.5072 114.7137 61.8284 68.6757 174.4662 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 D 8.21 4.60 0.00 2.67 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 -1 P 0.00 4.07 0.00 2.37 2.28 0.00 3.74 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 2.06 2.07 0.00 0 M 8.54 4.01 0.00 2.27 2.07 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 1 V 7.82 3.58 2.17 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 0.98 0.00 0.00 0.93 0.00 0.00 2 S 8.30 4.22 0.00 3.90 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 3 K 8.02 3.99 0.00 1.88 1.96 0.00 1.67 0.00 0.00 1.63 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 4 G 7.75 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.34 4.06 0.00 2.19 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 2.35 2.50 0.00 6 E 8.67 3.95 0.00 1.85 1.96 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 2.33 2.51 0.00 7 L 7.66 3.84 0.00 1.67 1.01 0.85 -0.03 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 8 F 8.05 4.73 0.00 3.31 3.09 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 9 T 7.34 4.10 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 1.30 0.00 0.00 10 G 7.83 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.50 4.47 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 0.84 0.00 0.00 0.99 0.00 0.00 12 V 8.92 4.66 2.60 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 1.34 0.00 0.00 1.10 0.00 0.00 13 P 0.00 4.90 0.00 2.16 2.16 0.00 3.94 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 14 I 8.73 5.13 1.76 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 1.17 0.86 0.93 0.00 0.00 15 L 8.86 5.13 0.00 1.70 1.45 1.01 0.66 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 16 V 8.89 5.02 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 1.28 0.00 0.00 1.13 0.00 0.00 17 E 9.34 5.15 0.00 1.92 1.82 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 2.25 2.40 0.00 18 L 9.45 5.29 0.00 2.00 1.78 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 19 D 9.00 5.09 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 20 G 8.46 3.43 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 0.00 21 D 8.61 5.05 0.00 2.59 2.40 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 22 V 9.03 4.74 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 0.72 0.00 0.00 0.92 0.00 0.00 23 N 10.29 4.32 0.00 2.95 2.93 0.00 0.00 7.12 7.21 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 24 G 8.73 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 0.00 0.00 0.00 25 H 8.18 4.45 0.00 3.35 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.37 4.93 0.00 1.65 1.69 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.62 7.81 27 F 8.13 4.88 0.00 3.02 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.97 5.25 0.00 3.82 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 29 V 8.95 5.19 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 1.26 0.00 0.00 1.31 0.00 0.00 30 S 9.27 5.39 0.00 3.81 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 31 G 9.44 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 32 E 8.92 5.04 0.00 1.74 1.67 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 2.13 2.12 0.00 33 G 7.62 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 34 E 8.03 5.01 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 2.08 2.17 0.00 35 G 8.93 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.12 5.17 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 37 A 9.08 4.47 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 38 T 8.17 3.70 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 0.52 0.00 0.00 39 Y 7.80 4.43 0.00 3.12 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 40 G 8.09 4.37 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 41 K 8.19 4.68 0.00 2.03 1.73 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 0.90 7.81 42 L 8.47 4.98 0.00 1.47 1.32 0.87 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.57 4.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 44 L 8.85 4.88 0.00 1.47 0.71 1.06 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.45 4.70 0.00 1.59 1.37 0.00 1.47 0.00 0.00 1.51 0.00 0.00 2.70 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.13 1.24 7.81 46 F 9.03 5.01 0.00 2.64 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.92 4.95 1.91 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 1.09 0.68 0.98 0.00 0.00 48 C 9.61 5.09 0.00 3.26 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 9.01 4.35 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 50 T 7.71 4.50 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 51 G 7.75 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.71 4.28 0.00 1.72 1.69 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 1.41 7.81 53 L 9.45 3.76 0.00 1.21 0.99 0.05 -1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.56 0.00 1.93 1.95 0.00 2.48 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.90 0.00 55 V 6.15 4.11 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 0.41 0.00 0.00 56 P 0.00 4.37 0.00 2.13 2.00 0.00 3.35 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 57 W 9.13 4.33 0.00 3.79 3.55 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 0.00 0.00 0.00 0.00 58 P 0.00 4.57 0.00 2.26 2.38 0.00 3.72 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 59 T 7.89 4.27 4.40 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 1.00 0.00 0.00 60 L 8.07 4.33 0.00 1.71 0.51 0.68 0.28 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 61 V 7.59 3.61 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.89 0.00 0.00 62 T 7.95 4.07 4.43 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 1.37 0.00 0.00 63 T 7.00 4.09 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 1.08 0.00 0.00 64 F 7.68 4.80 0.00 2.70 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 *68 L 7.41 4.37 0.00 1.96 2.12 1.06 1.11 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 69 M 7.78 3.91 0.00 0.70 0.89 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 70 C 7.64 4.12 0.00 2.45 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 71 F 8.38 4.47 0.00 3.25 3.05 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 72 A 7.54 4.34 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.95 4.33 0.00 1.94 1.78 0.00 3.05 0.00 0.00 3.23 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 74 Y 8.58 4.41 0.00 2.83 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 75 P 0.00 4.31 0.00 1.99 2.00 0.00 3.44 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 2.01 0.00 76 D 9.06 4.40 0.00 2.79 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 77 H 8.35 4.46 0.00 3.36 3.39 0.00 5.54 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 7.93 4.57 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.47 0.00 79 K 7.96 3.81 0.00 1.77 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.73 7.81 80 Q 7.97 4.01 0.00 1.77 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 81 H 8.06 4.65 0.00 3.21 3.25 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.08 3.79 0.00 1.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.04 4.16 0.00 3.02 2.35 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 84 F 7.69 3.96 0.00 3.14 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 85 K 8.49 4.19 0.00 1.67 1.85 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.46 1.19 7.81 86 S 7.27 4.03 0.00 3.95 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 87 A 7.49 4.09 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 M 7.36 4.70 0.00 2.40 2.46 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.18 3.04 0.00 89 P 0.00 4.80 0.00 2.25 2.13 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.91 0.00 90 E 8.31 3.85 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 2.34 2.40 0.00 91 G 8.48 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 0.00 0.00 0.00 92 Y 7.94 5.45 0.00 3.43 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 93 V 9.16 4.68 2.23 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 1.03 0.00 0.00 1.02 0.00 0.00 94 Q 9.49 5.25 0.00 2.53 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 95 E 9.52 5.33 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 96 R 8.96 5.26 0.00 1.74 1.80 0.00 3.16 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 97 T 8.72 4.83 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 0.24 0.00 0.00 98 I 8.59 4.50 1.65 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 0.68 0.65 -0.05 0.00 0.00 99 F 8.97 4.80 0.00 2.82 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 0.00 100 F 8.88 4.72 0.00 3.18 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 0.00 101 K 8.83 4.15 0.00 1.70 1.75 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 102 D 9.14 4.55 0.00 2.89 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 7.81 4.33 0.00 2.64 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 0.00 104 G 7.53 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 0.00 0.00 0.00 105 N 7.83 5.41 0.00 2.43 2.63 0.00 0.00 7.34 6.98 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 0.00 106 Y 8.98 5.53 0.00 2.92 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 9.44 5.15 0.00 1.61 1.65 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.25 1.44 7.81 108 T 9.00 5.12 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 0.00 109 R 8.96 5.07 0.00 1.90 1.79 0.00 3.27 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 110 A 9.18 5.37 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 0.00 111 E 9.10 5.01 0.00 1.90 1.82 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 2.25 2.24 0.00 112 V 8.35 4.79 0.98 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 0.81 0.00 0.00 0.96 0.00 0.00 113 K 8.52 4.61 0.00 2.05 1.83 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.26 1.37 7.81 114 F 8.51 4.67 0.00 2.90 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 0.00 115 E 9.35 4.52 0.00 1.93 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 2.22 2.36 0.00 116 G 8.30 3.92 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 0.00 0.00 0.00 117 D 8.85 4.60 0.00 2.72 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.94 4.77 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 119 L 8.79 4.16 0.00 1.21 1.61 0.98 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.64 4.82 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 0.96 0.00 0.00 0.92 0.00 0.00 121 N 9.14 5.28 0.00 2.93 2.77 0.00 0.00 6.92 7.20 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 0.00 122 R 8.82 5.07 0.00 1.83 1.85 0.00 3.13 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 123 I 9.06 5.09 1.94 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 0.96 0.00 0.00 124 E 9.19 5.05 0.00 1.84 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 2.20 2.21 0.00 125 L 8.83 5.12 0.00 1.47 1.19 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.24 5.04 0.00 1.65 1.66 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.48 7.81 127 G 9.53 5.02 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 0.00 128 I 8.72 5.13 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 0.97 0.00 0.00 129 D 8.83 4.46 0.00 2.72 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 0.00 130 F 8.31 4.45 0.00 3.26 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 9.66 4.30 0.00 1.81 1.93 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.41 7.81 132 E 9.02 4.05 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 133 D 8.04 4.88 0.00 2.72 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 0.00 134 G 7.85 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 0.00 135 N 7.96 4.38 0.00 2.86 2.87 0.00 0.00 7.41 7.20 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 0.00 136 I 7.17 3.81 1.61 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 0.34 0.26 0.18 0.00 0.00 137 L 7.55 3.77 0.00 1.77 1.62 1.03 0.68 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 0.00 138 G 7.90 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 0.00 0.00 0.00 139 H 7.50 3.92 0.00 3.22 3.27 0.00 5.62 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 0.00 140 K 8.41 4.75 0.00 1.80 1.89 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.50 7.81 141 L 7.70 5.02 0.00 1.55 1.61 0.83 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.96 4.11 0.00 2.07 1.96 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 2.40 2.28 0.00 143 Y 8.69 4.53 0.00 3.05 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 0.00 144 N 7.60 4.91 0.00 2.85 2.83 0.00 0.00 6.10 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 0.00 145 Y 8.18 4.27 0.00 2.95 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 0.00 146 N 8.09 4.89 0.00 2.57 2.58 0.00 0.00 7.10 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 0.00 147 S 8.28 4.73 0.00 3.78 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 0.00 148 H 8.97 5.03 0.00 3.04 3.14 0.00 5.79 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.70 5.28 0.00 2.15 2.08 0.00 0.00 6.68 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.24 3.86 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 0.76 0.00 0.00 -0.16 0.00 0.00 151 Y 8.40 4.92 0.00 3.07 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 0.00 152 I 8.96 4.73 1.65 0.00 0.00 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 1.40 0.78 0.89 0.00 0.00 153 M 8.88 5.27 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 154 A 8.61 4.20 1.28 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 0.00 0.00 0.00 155 D 8.63 4.75 0.00 2.57 2.43 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 0.00 156 K 8.19 4.00 0.00 1.86 1.84 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.46 7.81 157 Q 8.17 3.98 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.20 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 158 K 7.98 4.41 0.00 1.71 1.81 0.00 2.08 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.39 7.81 159 N 8.24 4.30 0.00 2.82 2.90 0.00 0.00 6.79 7.53 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 0.00 160 G 7.77 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 I 7.88 5.08 1.67 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.41 0.22 0.00 0.00 162 K 8.93 5.11 0.00 1.68 1.83 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.32 7.81 163 V 8.61 5.11 2.26 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 1.49 0.00 0.00 1.05 0.00 0.00 164 N 8.71 5.37 0.00 2.52 2.56 0.00 0.00 6.82 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 F 7.86 4.70 0.00 3.10 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 0.00 166 K 9.02 4.96 0.00 1.67 1.73 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.41 7.81 167 I 8.50 4.16 1.73 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 1.11 1.00 0.47 0.00 0.00 168 R 8.60 4.87 0.00 1.68 1.85 0.00 3.20 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 169 H 8.88 4.71 0.00 3.23 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.79 4.87 0.00 2.89 2.85 0.00 0.00 7.07 7.22 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 0.00 171 I 8.81 4.77 2.03 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 1.32 1.16 1.06 0.00 0.00 172 E 9.13 3.96 0.00 2.05 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 2.50 2.29 0.00 173 D 8.05 4.56 0.00 2.80 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 0.00 174 G 8.31 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 0.00 175 S 8.47 4.65 0.00 3.91 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 0.00 176 V 8.24 4.95 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 0.79 0.00 0.00 0.94 0.00 0.00 177 Q 9.14 4.58 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 178 L 8.59 4.56 0.00 1.65 1.56 0.93 0.68 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 0.00 179 A 9.27 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.97 4.75 0.00 2.73 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 H 8.89 4.92 0.00 1.59 2.36 0.00 5.76 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 9.11 4.75 0.00 3.18 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 0.00 183 Q 9.17 5.23 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 184 Q 9.29 5.16 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 185 N 9.30 6.30 0.00 2.35 2.69 0.00 0.00 6.39 6.57 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 0.00 186 T 8.51 5.23 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 1.29 0.00 0.00 187 P 0.00 4.96 0.00 2.34 2.15 0.00 3.91 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 188 I 8.87 3.99 2.13 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 1.30 0.65 0.95 0.00 0.00 189 G 7.82 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.44 4.61 0.00 2.64 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 0.00 191 G 7.80 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 0.00 0.00 0.00 192 P 0.00 4.52 0.00 2.18 2.07 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 193 V 7.78 4.41 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 0.66 0.00 0.00 1.08 0.00 0.00 194 L 8.64 4.32 0.00 1.58 1.69 0.80 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.40 4.63 0.00 1.64 1.60 0.93 1.15 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 0.00 196 P 0.00 4.84 0.00 2.32 2.37 0.00 3.71 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 1.95 1.94 0.00 197 D 8.50 4.58 0.00 2.44 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 0.00 198 N 8.54 4.73 0.00 2.66 2.88 0.00 0.00 6.76 8.16 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 0.00 199 H 8.75 4.99 0.00 3.35 3.38 0.00 5.20 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.46 5.19 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.65 4.88 0.00 1.67 1.40 0.96 0.81 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 0.00 202 S 9.01 5.07 0.00 3.81 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 0.00 203 Y 9.16 5.27 0.00 3.01 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 0.00 204 Q 9.12 5.04 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 205 S 8.93 5.22 0.00 3.63 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 9.22 4.80 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.57 5.14 0.00 0.91 0.85 0.70 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.03 4.89 0.00 3.88 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 0.00 209 K 8.53 4.89 0.00 1.60 1.69 0.00 1.37 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.22 1.15 7.81 210 D 8.89 4.63 0.00 2.61 2.39 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 0.00 211 P 0.00 4.37 0.00 2.21 2.16 0.00 3.79 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 1.97 1.98 0.00 212 N 8.26 4.69 0.00 2.71 2.84 0.00 0.00 6.74 7.25 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 0.00 213 E 7.92 4.52 0.00 1.84 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.30 0.00 214 K 8.52 4.25 0.00 1.77 1.84 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.38 7.81 215 R 8.03 4.34 0.00 1.93 1.95 0.00 3.19 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 216 D 8.57 4.87 0.00 2.95 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 0.00 217 H 8.35 4.68 0.00 3.16 3.14 0.00 5.54 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.04 4.61 0.00 1.52 1.10 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 219 V 8.70 4.64 2.21 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 0.92 0.00 0.00 0.90 0.00 0.00 220 L 9.11 5.16 0.00 1.86 1.69 0.84 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.85 5.02 0.00 1.72 1.46 0.63 0.80 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 0.00 222 E 8.77 5.19 0.00 1.83 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 2.22 2.25 0.00 223 F 9.14 5.23 0.00 2.94 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 0.00 224 V 8.76 4.49 1.72 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 0.01 0.00 0.00 0.23 0.00 0.00 225 T 8.47 4.97 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 1.09 0.00 0.00 226 A 8.43 4.27 0.13 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 0.00 227 A 8.48 4.02 0.63 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 0.00 0.00 228 G 9.06 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 I 7.17 4.41 1.84 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.70 0.93 0.00 0.00 230 T 8.51 4.08 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 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.