NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2938 7.8827 121.4481 61.1697 38.8048 173.7903 17 V 4.4406 8.5921 125.2270 61.6357 33.1305 174.3156 18 G 3.7023 8.4229 113.8241 46.4111 0.0000 173.2876 19 G 4.1891 7.7860 110.1119 44.0950 0.0000 172.4091 20 Y 4.9706 7.7442 116.8692 55.1302 42.2905 174.7734 21 T 4.3235 8.5918 116.7838 63.8364 68.3885 175.4697 22 C 4.3139 8.6994 125.3699 60.3283 37.8839 175.0484 23 G 4.1361 8.5548 106.0555 44.1537 0.0000 172.8602 24 A 4.0176 8.5770 125.5305 53.5699 18.6925 176.9757 25 N 4.2393 8.8093 119.6232 54.5063 36.2474 175.2395 26 T 4.2538 7.4999 106.9203 62.4425 69.9669 175.1467 27 V 4.0951 7.0106 122.0442 60.1398 31.3545 173.6689 28 P 4.5370 0.0000 0.0000 63.8680 31.9771 178.1241 29 Y 4.9379 6.8072 115.7206 56.4145 38.8193 174.7759 30 Q 4.5954 7.2944 123.2733 56.3944 29.2989 175.3841 31 V 4.8694 8.8085 118.2541 59.6629 36.4758 174.1219 32 S 4.9662 8.8517 116.6268 56.5828 65.2641 172.5644 33 L 4.5909 8.3551 127.0454 53.1799 43.5076 175.0003 34 N 5.7593 9.0258 122.3157 50.0066 42.2882 174.9094 *37 S 4.4361 8.4972 119.9786 58.5202 64.2356 174.5096 38 G 4.0510 9.4475 108.9135 46.2901 0.0000 173.0280 39 Y 4.4923 6.7762 115.5876 56.4201 40.0228 172.3298 40 H 4.6776 8.7990 121.1106 55.4758 30.4546 174.6906 41 F 4.9288 7.5467 119.8913 56.8971 39.6040 173.7704 42 C 4.7285 6.6384 116.8260 56.2145 44.8870 172.9666 43 G 4.3744 8.4261 108.8539 45.5321 0.0000 172.0466 44 G 4.5679 7.8430 104.5779 46.5195 0.0000 172.6228 45 S 5.4685 8.8078 115.3951 56.4722 67.0596 173.6120 46 L 4.7477 9.0900 127.0434 54.6018 42.5336 177.0059 47 I 4.5251 8.5296 119.4884 60.8626 38.8712 174.3590 48 N 4.6896 7.5091 117.6594 52.2565 39.4787 174.9487 49 S 4.2045 8.5677 111.7265 60.2524 63.3512 174.5807 50 Q 4.5660 9.2150 121.4014 55.3250 30.8658 174.3545 51 W 5.5463 8.3503 117.2881 55.6197 33.4042 174.4001 52 V 5.1808 9.0187 122.7152 61.0606 34.7097 174.3883 53 V 4.9803 8.8480 125.7981 60.4617 34.1493 174.8290 54 S 4.8035 9.0588 117.0951 57.7656 66.1184 171.8196 55 A 4.8003 8.4992 120.5885 50.4140 20.7104 178.1907 56 A 3.8010 8.3670 124.8030 55.4306 18.3957 179.1535 57 H 4.5149 8.3503 108.9567 57.2366 28.6405 175.2464 58 C 4.7244 7.8888 117.2458 57.0918 40.5263 173.3185 59 Y 4.0987 7.8378 122.3370 57.6363 38.7549 175.0517 60 K 3.7174 6.5228 123.7089 56.5397 34.6017 173.8435 61 S 4.4213 8.2001 113.9146 57.6271 65.0356 173.1852 62 G 3.6501 8.4236 106.0190 46.6809 0.0000 173.4432 63 I 4.5294 7.5027 119.3781 59.5718 39.5777 175.1069 64 Q 4.7898 8.7215 127.6062 54.1957 31.8727 174.0811 65 V 4.4675 8.8954 126.7447 61.6633 33.6563 174.6027 65A R 4.9949 8.8536 126.9526 54.6763 32.5362 175.0703 66 L 4.6952 8.9741 124.6750 52.7641 44.7230 177.2487 *69 G 3.8165 8.2134 105.7020 46.3182 0.0000 172.8263 70 E 4.6733 8.4364 118.7227 55.1805 30.7209 174.2398 71 D 4.7536 7.8104 117.0045 55.2284 43.9218 174.1584 72 N 4.9360 8.4565 118.4019 53.0370 39.4224 175.9465 73 I 4.0677 8.3793 119.3909 61.8356 37.8766 176.0988 74 N 4.8073 8.7812 117.9958 53.0482 39.5611 174.6829 75 V 4.3015 7.3902 116.7713 60.6952 34.1904 174.9615 76 V 4.1342 8.4263 126.8435 62.4580 31.0809 175.0771 77 E 4.3884 8.9984 127.1821 55.3279 30.7380 176.6306 78 G 4.0004 8.6341 106.0667 45.6751 0.0000 174.0669 79 N 4.6216 8.9970 116.6703 52.6466 36.6709 174.5440 80 E 4.5642 7.6105 117.0033 56.4104 30.6780 176.3541 81 Q 4.4461 8.9849 120.9600 54.3130 33.1118 173.9526 82 F 5.4879 8.9455 122.6814 55.9803 41.1634 174.9397 83 I 4.7011 8.7252 124.6662 59.4429 40.9158 175.5565 84 S 4.6984 8.5930 121.3207 57.9719 64.4557 173.3129 85 A 4.3994 8.1951 124.5960 52.2108 18.4543 177.6160 86 S 4.4796 9.0339 116.9507 60.2592 63.4994 174.3719 87 K 4.6751 7.4931 115.9147 55.9316 35.5495 174.7332 88 S 5.1972 8.7933 117.0834 56.9873 66.2138 173.9029 89 I 4.4769 9.2371 125.5795 59.4177 38.6846 174.9392 90 V 4.1137 8.2608 127.0460 62.2218 32.6028 175.2927 91 H 4.0112 8.5949 126.5543 55.6817 30.1373 174.6709 92 P 4.3396 0.0000 0.0000 65.2727 31.3589 177.2123 93 S 4.7078 7.9231 112.1552 58.1620 63.0125 173.3134 94 Y 4.3202 7.9136 122.5896 57.5961 39.0029 174.7902 95 N 4.5120 8.2164 125.6795 51.4246 40.1553 175.1676 96 S 3.8248 7.9236 120.6057 60.0775 63.6328 174.9852 97 N 4.4183 8.5347 119.2366 55.0437 38.6769 176.0159 98 T 4.0507 7.7484 105.6470 60.6061 70.1495 174.7128 99 L 3.7916 7.8147 120.8491 55.5976 39.6755 173.9204 100 N 4.5117 7.6916 117.3443 54.4822 39.7068 174.4101 101 N 4.6106 8.6284 119.3984 54.1698 35.7984 175.7328 102 D 4.6908 7.8572 117.7533 52.9755 39.8645 174.9219 103 I 4.8078 7.1443 120.9283 59.2403 42.3478 172.9884 104 M 5.4126 9.2384 126.7177 54.1262 36.3596 173.3409 105 L 5.4467 8.9763 123.7304 53.0999 45.4045 175.4225 106 I 4.9893 9.1540 123.4031 59.4560 40.6011 174.3586 107 K 3.8010 8.7467 128.4471 54.5812 33.8993 175.1913 108 L 4.6736 8.0577 127.0112 53.4712 42.5703 176.7272 109 K 4.1197 8.8526 125.2139 59.0367 32.4301 176.9061 110 S 4.6906 7.7386 110.6400 55.8013 66.2038 173.0540 111 A 4.4640 8.2983 122.2694 51.8944 18.9150 177.1868 112 A 4.4757 8.6976 122.2816 51.4825 20.2088 177.4313 113 S 4.5432 8.9718 116.7622 57.4953 63.5617 174.5227 114 L 4.6553 8.5042 125.3757 54.1931 43.2028 176.6036 115 N 4.6791 8.6324 118.6551 52.8840 39.6798 174.6039 116 S 4.3309 8.7656 110.6303 61.0218 63.6574 175.3375 117 R 4.1865 8.8417 119.9920 56.8586 30.6430 175.9824 118 V 4.5645 7.8786 116.9971 60.8998 33.6791 173.5951 119 A 5.1197 8.5682 128.1826 50.5081 23.0394 175.1640 120 S 5.0696 8.6676 114.3890 57.4706 65.2700 172.8654 121 I 4.5005 8.1053 120.0783 59.1672 40.0155 175.2355 122 S 4.4996 8.3086 122.3760 57.7806 63.8772 174.0022 123 L 4.2722 8.0946 123.1785 53.4669 42.4221 175.2597 124 P 4.5762 0.0000 0.0000 62.8225 32.5433 176.0811 125 T 4.2207 8.1932 108.0733 62.1966 70.2136 174.5384 *127 S 4.8264 7.5773 114.6628 58.1177 63.9875 173.9730 128 C 4.4549 8.4220 118.1936 56.6197 40.8241 173.2047 129 A 4.5469 7.9368 123.8303 51.1968 20.3030 177.0904 130 S 4.4296 8.0104 115.0152 57.0213 64.8702 173.6679 *132 A 4.3377 8.1671 124.1851 53.4071 19.2830 176.4936 133 G 4.0576 9.0598 109.4600 45.5386 0.0000 174.7087 134 T 3.9244 7.6815 116.6645 63.8977 69.4927 173.2249 135 Q 4.8338 8.5456 126.9138 55.2773 30.5028 175.0953 136 C 5.2614 9.2361 122.5440 55.1877 46.8428 172.2525 137 L 5.2525 8.9575 122.4383 53.5009 44.1486 175.0092 138 I 5.3454 9.0529 127.0738 58.7315 40.1582 174.8148 139 S 4.9738 9.1401 119.5694 56.0109 66.8118 173.0529 140 G 3.8668 7.2885 109.1234 45.8705 0.0000 172.6395 141 W 4.8468 8.4026 117.3922 56.2912 29.4597 177.0938 142 G 4.1526 8.1013 108.6179 43.9460 0.0000 173.6013 143 N 3.8282 8.5937 118.1754 54.4649 38.9018 174.4754 144 T 5.1183 8.0687 112.7005 60.5169 69.6340 174.2837 145 K 4.6510 7.7949 121.4053 54.7823 34.8846 176.1533 146 S 4.3963 8.6419 116.6537 59.9392 63.7672 174.4664 147 S 4.4778 8.2077 116.9126 54.6057 62.4541 172.1942 148 G 4.0477 7.6596 110.0067 43.1448 0.0000 170.4271 149 T 4.5874 8.1615 109.8285 59.7808 70.8314 173.7567 150 S 4.5394 9.6171 121.6782 56.6655 65.4918 171.8842 151 Y 5.0305 8.7257 125.3205 55.6072 39.4986 174.4482 152 P 4.6993 0.0000 0.0000 62.5132 33.0119 175.5514 153 D 4.6649 8.7208 117.1406 55.6801 41.7517 177.2801 154 V 5.6272 7.4026 109.8440 58.4935 34.5410 175.7200 155 L 3.2447 8.3596 123.1769 55.0160 42.9473 175.8920 156 K 4.9572 8.1086 124.4390 54.8222 35.4016 174.5089 157 C 5.2763 8.5263 119.5118 55.2257 44.1836 172.8944 158 L 5.0035 8.5870 122.0643 53.8027 45.6626 174.3886 159 K 5.1315 8.9322 124.8983 54.9478 33.8407 175.6011 160 A 4.8643 9.4028 125.9733 49.3465 23.1594 173.5386 161 P 5.0658 0.0000 0.0000 61.9103 34.0235 174.9747 162 I 4.5213 8.2717 122.2080 61.1926 38.2782 175.9967 163 L 4.8169 8.7369 127.4620 53.3415 43.5345 176.6703 164 S 4.4586 8.3849 114.6189 57.8926 64.1142 175.1074 165 D 4.4563 8.6327 121.2401 57.3664 40.3764 179.2381 166 S 4.1305 7.9964 114.5333 61.6714 63.2646 176.6575 167 S 4.0966 7.8146 118.3548 61.0933 62.5392 175.8799 168 C 4.3211 8.1708 121.0936 59.8538 41.7141 175.9384 169 K 3.9959 8.3972 120.1900 59.4620 31.3653 179.5549 170 S 4.2123 8.2828 114.7705 60.9706 62.7700 176.0210 171 A 4.0445 7.6176 122.8203 53.5276 19.8806 177.3467 172 Y 4.8831 7.8452 113.7117 55.3620 38.2036 173.7914 173 P 4.5805 0.0000 0.0000 63.7389 31.9728 177.5186 174 G 3.9666 9.0766 109.3394 46.0945 0.0000 173.5678 175 Q 4.5741 8.3272 115.9161 55.2150 30.0916 175.1585 176 I 4.4972 7.8695 119.8126 59.7807 38.7503 175.3650 177 T 4.5743 8.1969 115.4956 59.6554 70.9769 175.0651 178 S 4.3776 8.5341 114.5698 60.1323 63.2366 174.2500 179 N 4.9961 8.1311 118.6375 53.4002 38.5284 173.8524 180 M 6.0558 8.0246 116.9904 52.9446 36.3743 174.4401 181 F 5.0784 8.2330 113.8299 56.0765 41.7734 173.5719 182 C 5.5654 9.0539 116.5496 55.6547 42.2781 172.6823 183 A 5.0449 9.2704 122.4484 50.7894 22.5227 176.8748 184 G 4.0472 6.8206 107.3623 44.8468 0.0000 171.7352 184A Y 4.6888 8.2215 118.1522 56.1252 41.1797 176.4748 185 L 4.2601 8.6355 124.7654 56.9876 42.1031 178.6148 186 E 4.1544 8.2012 115.4148 57.1271 29.9994 177.3050 187 G 3.8759 7.4577 105.4453 45.1697 0.0000 171.7523 188 G 4.1520 9.5361 105.3896 44.7253 0.0000 173.8714 188A K 4.8780 7.2156 116.8634 54.5825 35.7284 175.4019 189 D 4.5856 8.5759 123.0326 54.1842 45.7788 174.9188 190 S 4.9465 8.7569 116.4436 57.8591 65.4800 172.9800 191 C 4.7680 9.2259 118.9694 55.3739 44.1141 172.3354 192 Q 4.4546 8.5769 118.2916 57.7586 28.2912 177.0330 193 G 4.4888 9.2180 109.3899 45.8849 0.0000 174.1309 194 D 4.7105 8.3564 118.7618 55.3184 41.8368 176.8055 195 S 4.4567 8.0807 114.9668 60.5089 63.5720 175.2980 196 G 3.9602 8.9176 112.6398 46.4449 0.0000 173.8018 197 G 4.4972 7.8717 107.4221 44.9379 0.0000 171.1424 198 P 5.1695 0.0000 0.0000 62.2526 33.6832 175.8061 199 V 4.5981 8.4011 120.8306 61.5232 34.4024 173.9111 200 V 4.9008 8.7001 128.6769 61.2431 34.0781 173.7237 201 C 5.1150 8.7928 124.3984 55.8085 44.0632 174.5673 202 S 3.6636 9.8185 119.7656 59.6967 60.1917 173.0306 203 G 3.9204 8.3830 103.4055 45.9127 0.0000 173.8971 204 K 4.6722 7.6730 117.6552 52.9026 35.2853 175.5730 *209 L 4.2606 8.2791 122.7211 55.4289 42.1502 175.8148 210 Q 4.4767 8.8213 126.0794 56.7691 30.7725 175.8467 211 G 5.2888 8.0244 104.3902 45.6631 0.0000 171.3660 212 I 5.0728 8.1599 119.1643 58.9500 41.3578 175.3916 213 V 3.6948 8.9185 127.2921 63.7073 31.7940 174.0691 214 S 4.8677 8.5333 121.0525 58.6226 64.5008 174.7204 215 W 5.1163 7.6406 114.1408 56.1199 32.0663 172.7346 216 G 4.0339 8.4063 106.3620 46.8673 0.0000 173.2744 217 S 4.7184 8.1687 116.6553 56.8511 63.2642 173.6769 *219 G 4.1889 8.0006 116.0375 45.5838 0.0000 170.9238 220 C 4.9479 8.1793 115.6828 56.5881 44.4114 173.7613 221 A 4.0260 9.2083 125.5758 53.1675 16.5858 177.1314 221A Q 4.5499 7.3264 117.2030 56.2324 29.8182 175.8711 222 K 4.0896 8.4156 121.5919 57.9018 32.7108 176.2338 223 N 4.2399 9.2361 121.5403 54.0170 37.1139 175.2630 224 K 4.3192 7.4309 117.1133 53.5536 32.0950 173.4505 225 P 4.5709 0.0000 0.0000 62.4572 32.9883 177.2502 226 G 3.7609 8.4583 106.2621 45.7053 0.0000 172.8693 227 V 4.4424 7.3404 121.0809 60.6941 34.1967 174.1281 228 Y 4.9148 8.2108 124.2648 56.0971 42.1768 174.7676 229 T 4.5763 8.5804 119.0866 63.2871 70.2625 174.6600 230 K 5.0746 9.2402 128.1498 55.5314 31.5054 177.2654 231 V 3.9356 8.8600 126.7095 65.8499 31.4274 174.8437 232 C 4.5265 8.4197 112.6610 58.4539 41.3023 174.9136 233 N 4.2625 7.9582 116.5404 54.3470 38.5573 175.0637 234 Y 4.8014 8.1290 117.6216 57.5125 39.2194 177.5769 235 V 3.6818 8.0390 121.5988 66.3671 31.5473 178.1216 236 S 4.1408 8.1008 114.3966 61.1325 62.6861 176.2844 237 W 4.1320 8.2487 130.6443 60.4928 30.5040 177.9100 238 I 3.1612 8.3770 120.0595 64.1961 36.6087 178.4724 239 K 3.7352 8.1716 119.5052 59.6088 31.8713 179.4859 240 Q 3.8707 8.2911 118.4875 59.1619 28.4116 178.8352 241 T 3.5374 7.4049 115.8558 66.5436 68.7689 176.4321 242 I 2.8338 7.2404 121.4324 63.9854 36.7874 178.4206 243 A 4.0287 7.6520 120.5211 54.1810 18.1910 178.7308 244 S 4.6266 7.3283 109.8250 58.3142 63.5834 174.0975 245 N 4.6832 7.8756 125.1966 53.8360 39.2334 174.0112 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.29 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 1.36 0.78 0.89 0.00 0.00 17 V 8.59 4.44 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 1.03 0.00 0.00 0.95 0.00 0.00 18 G 8.42 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 19 G 7.79 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 0.00 0.00 0.00 0.00 20 Y 7.74 4.97 0.00 2.92 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 21 T 8.59 4.32 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 1.23 0.00 0.00 22 C 8.70 4.31 0.00 2.75 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 23 G 8.55 4.14 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 0.00 0.00 0.00 24 A 8.58 4.02 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.81 4.24 0.00 2.85 2.90 0.00 0.00 7.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.50 4.25 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 1.33 0.00 0.00 27 V 7.01 4.10 1.74 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 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.54 0.00 2.38 2.40 0.00 3.81 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 2.20 1.96 0.00 29 Y 6.81 4.94 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 30 Q 7.29 4.60 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.51 0.00 0.00 0.00 0.00 0.00 1.92 2.48 0.00 31 V 8.81 4.87 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 0.88 0.00 0.00 0.96 0.00 0.00 32 S 8.85 4.97 0.00 3.07 3.30 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 33 L 8.36 4.59 0.00 0.52 0.87 0.82 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.03 5.76 0.00 2.36 2.41 0.00 0.00 6.52 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 8.50 4.44 0.00 3.84 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.45 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 39 Y 6.78 4.49 0.00 3.04 2.93 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 40 H 8.80 4.68 0.00 2.85 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.55 4.93 0.00 3.17 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 42 C 6.64 4.73 0.00 2.39 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 43 G 8.43 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 44 G 7.84 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.81 5.47 0.00 3.81 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.09 4.75 0.00 1.87 1.67 1.08 0.96 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 47 I 8.53 4.53 1.90 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 1.54 0.90 0.95 0.00 0.00 48 N 7.51 4.69 0.00 2.99 3.00 0.00 0.00 6.13 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.57 4.20 0.00 4.05 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 0.00 50 Q 9.22 4.57 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.03 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 51 W 8.35 5.55 0.00 3.40 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.02 5.18 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 1.14 0.00 0.00 0.98 0.00 0.00 53 V 8.85 4.98 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 0.85 0.00 0.00 1.02 0.00 0.00 54 S 9.06 4.80 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 55 A 8.50 4.80 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 56 A 8.37 3.80 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.35 4.51 0.00 3.36 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.89 4.72 0.00 3.21 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.84 4.10 0.00 3.01 2.93 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 60 K 6.52 3.72 0.00 1.51 1.36 0.00 0.81 0.00 0.00 1.32 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 0.93 7.81 61 S 8.20 4.42 0.00 3.92 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 62 G 8.42 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 0.00 0.00 0.00 63 I 7.50 4.53 1.84 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 1.39 1.18 0.90 0.00 0.00 64 Q 8.72 4.79 0.00 2.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.87 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 65 V 8.90 4.47 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 0.92 0.00 0.00 0.88 0.00 0.00 65A R 8.85 4.99 0.00 1.59 1.65 0.00 2.64 0.00 0.00 2.27 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.12 0.00 66 L 8.97 4.70 0.00 1.64 1.62 0.96 1.04 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 *69 G 8.21 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.44 4.67 0.00 2.11 1.90 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 2.51 2.09 0.00 71 D 7.81 4.75 0.00 2.72 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 72 N 8.46 4.94 0.00 2.86 2.84 0.00 0.00 7.22 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 73 I 8.38 4.07 1.40 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.52 -0.56 0.00 0.00 74 N 8.78 4.81 0.00 2.78 2.87 0.00 0.00 6.62 7.96 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 75 V 7.39 4.30 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.43 4.13 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 0.75 0.00 0.00 0.94 0.00 0.00 77 E 9.00 4.39 0.00 2.00 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 2.27 2.43 0.00 78 G 8.63 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 79 N 9.00 4.62 0.00 2.91 3.16 0.00 0.00 6.92 7.67 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 80 E 7.61 4.56 0.00 1.56 1.73 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 2.69 2.46 0.00 81 Q 8.98 4.45 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 82 F 8.95 5.49 0.00 2.75 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.73 4.70 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.75 0.94 0.00 0.00 84 S 8.59 4.70 0.00 3.75 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 85 A 8.20 4.40 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.03 4.48 0.00 3.72 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 87 K 7.49 4.68 0.00 1.87 1.85 0.00 1.58 0.00 0.00 1.92 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.36 7.81 88 S 8.79 5.20 0.00 4.10 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 89 I 9.24 4.48 2.06 0.00 0.00 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 1.25 0.90 1.08 0.00 0.00 90 V 8.26 4.11 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 0.61 0.00 0.00 0.74 0.00 0.00 91 H 8.59 4.01 0.00 2.79 3.06 0.00 5.65 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 92 P 0.00 4.34 0.00 2.08 2.14 0.00 3.18 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 93 S 7.92 4.71 0.00 3.91 3.87 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 94 Y 7.91 4.32 0.00 2.94 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 95 N 8.22 4.51 0.00 2.59 2.45 0.00 0.00 6.58 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 96 S 7.92 3.82 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.53 4.42 0.00 2.69 2.79 0.00 0.00 6.77 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.75 4.05 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 1.15 0.00 0.00 99 L 7.81 3.79 0.00 1.59 1.94 0.75 1.40 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 0.00 100 N 7.69 4.51 0.00 2.74 2.64 0.00 0.00 7.27 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.63 4.61 0.00 3.04 2.58 0.00 0.00 7.21 8.30 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 0.00 102 D 7.86 4.69 0.00 3.08 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 0.00 103 I 7.14 4.81 1.43 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 1.34 1.21 0.13 0.00 0.00 104 M 9.24 5.41 0.00 2.23 1.83 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 105 L 8.98 5.45 0.00 1.83 1.86 0.26 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.15 4.99 1.92 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 1.20 0.86 0.88 0.00 0.00 107 K 8.75 3.80 0.00 0.79 1.11 0.00 1.30 0.00 0.00 1.34 0.00 0.00 2.60 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.66 0.21 7.81 108 L 8.06 4.67 0.00 1.48 1.54 0.97 0.71 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 0.00 109 K 8.85 4.12 0.00 1.81 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.74 4.69 0.00 3.94 3.75 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 0.00 111 A 8.30 4.46 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.70 4.48 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 0.00 113 S 8.97 4.54 0.00 3.76 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 0.00 114 L 8.50 4.66 0.00 1.66 1.62 0.96 1.07 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 0.00 115 N 8.63 4.68 0.00 2.73 2.75 0.00 0.00 6.98 7.61 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 0.00 116 S 8.77 4.33 0.00 4.02 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 0.00 117 R 8.84 4.19 0.00 2.05 2.02 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.83 0.00 4.00 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 0.00 128 C 8.42 4.45 0.00 2.94 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 0.00 129 A 7.94 4.55 1.04 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 0.00 130 S 8.01 4.43 0.00 3.84 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 *132 A 8.17 4.34 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.06 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.68 3.92 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 1.14 0.00 0.00 135 Q 8.55 4.83 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 136 C 9.24 5.26 0.00 2.79 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 0.00 137 L 8.96 5.25 0.00 1.76 1.56 1.04 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.05 5.35 1.87 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 0.77 1.51 0.97 0.00 0.00 139 S 9.14 4.97 0.00 3.49 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.29 3.87 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 0.00 0.00 0.00 141 W 8.40 4.85 0.00 3.19 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.10 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 0.00 143 N 8.59 3.83 0.00 2.21 2.63 0.00 0.00 7.02 7.77 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 0.00 144 T 8.07 5.12 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 1.27 0.00 0.00 145 K 7.79 4.65 0.00 1.84 1.69 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.30 1.33 7.81 146 S 8.64 4.40 0.00 3.99 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 0.00 147 S 8.21 4.48 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 7.66 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 0.00 149 T 8.16 4.59 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 1.28 0.00 0.00 150 S 9.62 4.54 0.00 3.78 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 0.00 151 Y 8.73 5.03 0.00 2.94 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.70 0.00 2.44 2.12 0.00 4.15 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 153 D 8.72 4.66 0.00 2.80 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.40 5.63 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.97 0.00 0.00 155 L 8.36 3.24 0.00 1.41 1.27 -0.90 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.11 4.96 0.00 1.68 1.49 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.46 7.81 157 C 8.53 5.28 0.00 1.60 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 0.00 0.00 0.00 0.00 158 L 8.59 5.00 0.00 1.70 1.44 1.03 0.71 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 0.00 159 K 8.93 5.13 0.00 1.82 1.81 0.00 1.88 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.65 7.81 160 A 9.40 4.86 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 0.00 161 P 0.00 5.07 0.00 2.02 2.28 0.00 3.12 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 162 I 8.27 4.52 1.75 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.52 0.76 0.00 0.00 163 L 8.74 4.82 0.00 1.55 1.61 0.93 0.79 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 0.00 164 S 8.38 4.46 0.00 4.01 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 0.00 165 D 8.63 4.46 0.00 2.77 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 0.00 166 S 8.00 4.13 0.00 4.05 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 0.00 167 S 7.81 4.10 0.00 3.92 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 0.00 168 C 8.17 4.32 0.00 3.21 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.40 4.00 0.00 1.96 1.90 0.00 1.86 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 1.54 1.63 7.81 170 S 8.28 4.21 0.00 4.01 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 0.00 171 A 7.62 4.04 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.85 4.88 0.00 3.14 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 0.00 173 P 0.00 4.58 0.00 2.21 2.12 0.00 3.59 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 174 G 9.08 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 0.00 0.00 0.00 175 Q 8.33 4.57 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 176 I 7.87 4.50 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.00 1.00 0.00 0.00 177 T 8.20 4.57 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 1.28 0.00 0.00 178 S 8.53 4.38 0.00 4.01 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 0.00 179 N 8.13 5.00 0.00 3.04 3.11 0.00 0.00 6.62 8.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 8.02 6.06 0.00 1.78 1.98 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 181 F 8.23 5.08 0.00 2.96 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 0.00 182 C 9.05 5.57 0.00 2.98 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 0.00 183 A 9.27 5.04 1.14 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 0.00 0.00 184 G 6.82 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 184A Y 8.22 4.69 0.00 2.97 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 0.00 185 L 8.64 4.26 0.00 1.74 1.72 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.20 4.15 0.00 2.10 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 2.32 2.25 0.00 187 G 7.46 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 0.00 188 G 9.54 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 188A K 7.22 4.88 0.00 1.53 1.68 0.00 0.94 0.00 0.00 1.43 0.00 0.00 2.46 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.12 7.81 189 D 8.58 4.59 0.00 2.81 2.55 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 0.00 190 S 8.76 4.95 0.00 3.99 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 0.00 191 C 9.23 4.77 0.00 2.93 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 0.00 192 Q 8.58 4.45 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 5.56 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 193 G 9.22 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 0.00 0.00 0.00 0.00 194 D 8.36 4.71 0.00 2.95 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 0.00 195 S 8.08 4.46 0.00 3.98 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 0.00 196 G 8.92 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 0.00 197 G 7.87 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.17 0.00 2.31 2.34 0.00 3.69 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 2.23 2.23 0.00 199 V 8.40 4.60 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.72 0.00 0.00 200 V 8.70 4.90 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 0.85 0.00 0.00 0.66 0.00 0.00 201 C 8.79 5.12 0.00 2.79 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.82 3.66 0.00 3.92 3.87 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 0.00 203 G 8.38 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 0.00 204 K 7.67 4.67 0.00 1.70 1.64 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.28 4.26 0.00 1.51 1.64 1.01 0.76 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 0.00 210 Q 8.82 4.48 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.34 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.02 5.29 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 0.00 212 I 8.16 5.07 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 1.03 0.00 0.00 213 V 8.92 3.69 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 0.94 0.00 0.00 1.18 0.00 0.00 214 S 8.53 4.87 0.00 3.88 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 0.00 215 W 7.64 5.12 0.00 3.36 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.41 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.17 4.72 0.00 4.12 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 *219 G 8.00 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 0.00 0.00 0.00 0.00 220 C 8.18 4.95 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 9.21 4.03 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 221A Q 7.33 4.55 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.42 4.09 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 223 N 9.24 4.24 0.00 2.81 2.81 0.00 0.00 6.78 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.43 4.32 0.00 1.69 1.81 0.00 1.66 0.00 0.00 1.35 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.49 7.81 225 P 0.00 4.57 0.00 2.13 2.12 0.00 3.64 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 2.11 1.99 0.00 226 G 8.46 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 0.00 227 V 7.34 4.44 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 -0.69 0.00 0.00 228 Y 8.21 4.91 0.00 1.43 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.58 4.58 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 1.23 0.00 0.00 230 K 9.24 5.07 0.00 2.11 1.92 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.63 7.81 231 V 8.86 3.94 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 1.01 0.00 0.00 1.13 0.00 0.00 232 C 8.42 4.53 0.00 3.16 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 0.00 233 N 7.96 4.26 0.00 2.42 2.37 0.00 0.00 6.98 7.37 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 0.00 234 Y 8.13 4.80 0.00 3.08 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.04 3.68 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 1.13 0.00 0.00 1.11 0.00 0.00 236 S 8.10 4.14 0.00 3.97 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 0.00 237 W 8.25 4.13 0.00 3.48 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.38 3.16 2.02 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 1.67 1.02 0.76 0.00 0.00 239 K 8.17 3.74 0.00 1.89 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.59 7.81 240 Q 8.29 3.87 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 241 T 7.40 3.54 3.49 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 0.74 0.00 0.00 242 I 7.24 2.83 1.43 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.31 0.45 0.00 0.00 243 A 7.65 4.03 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 0.00 244 S 7.33 4.63 0.00 4.00 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 0.00 245 N 7.88 4.68 0.00 3.07 3.05 0.00 0.00 6.76 7.09 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 * Residues marked with a * may have inaccurate shift predictions.