NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 3.0738 8.1693 122.3652 54.1392 42.7628 176.5700 4 S 4.1538 8.1975 120.9606 56.8861 63.9001 171.9968 5 P 4.3145 0.0000 0.0000 65.9316 32.3098 180.0938 6 S 4.3285 7.5455 109.1688 60.0326 62.6470 175.4803 *8 L 4.2207 7.9251 123.3319 55.2711 43.5765 178.3368 9 D 4.4353 8.2918 118.3869 57.4652 40.8028 179.1487 10 K 4.0129 8.2984 118.8405 59.5931 32.1415 179.4430 11 L 4.3086 7.9842 118.7204 57.8432 41.6792 179.3918 12 L 4.4832 8.4096 120.8053 57.4524 41.3207 179.8071 13 R 4.0327 8.2099 117.4966 59.0304 30.1088 178.5894 14 L 4.2618 7.7975 116.9536 55.4608 41.7112 177.7829 15 G 4.0501 7.6383 106.4123 45.3125 0.0000 173.6585 16 Y 4.4911 8.0680 118.3283 57.2673 38.9980 175.5470 17 S 4.4175 8.3058 118.0187 57.6241 65.6276 175.2942 18 K 3.9522 8.5081 122.9720 59.3575 31.7804 178.7018 19 L 3.9582 7.8552 120.2852 58.3825 42.1153 178.9253 20 F 3.9364 8.2890 117.0177 60.2347 38.7369 177.6218 21 A 3.9956 8.2769 120.6216 55.3386 18.2430 179.4727 22 D 4.4050 8.4534 117.7078 57.4005 40.8618 179.2394 23 R 4.2223 8.2185 118.8160 59.7242 30.0449 178.7462 24 Y 4.6046 8.0552 116.8579 61.2509 37.8393 178.5449 25 F 4.3290 8.5754 121.7199 61.3566 39.2759 177.2991 26 Q 4.1850 8.2745 117.0112 58.4022 28.5330 178.0298 27 L 3.6519 7.3040 119.2999 55.7654 41.9618 177.5322 28 W 4.7372 7.8670 115.4002 54.9395 31.6995 176.4287 29 G 3.0025 8.0586 108.7048 45.7807 0.0000 176.1968 30 E 4.0810 8.5779 117.8492 59.4504 29.3647 179.1629 31 R 3.8942 7.8706 119.3831 58.5136 30.0037 177.9291 32 A 4.0563 8.1906 121.5208 55.5943 18.2811 179.4036 33 I 3.7117 7.5905 116.2157 64.3667 38.0548 178.3478 34 R 3.9249 7.8571 118.4753 59.1047 29.6747 179.0530 35 I 3.5657 7.6053 118.7672 64.1308 37.1851 177.8932 36 A 4.2495 7.7295 120.2212 55.4245 18.3451 179.2951 37 E 4.1595 8.2768 115.6235 59.0907 29.6062 180.7113 38 A 4.2085 7.9636 122.9243 51.6792 18.0423 178.9022 *40 E 4.2990 8.1922 121.8260 57.2169 31.8082 177.0628 41 K 4.3362 7.4824 117.4756 54.8734 32.9599 175.2425 42 P 4.4531 0.0000 0.0000 62.5553 31.9735 176.2935 43 L 4.4929 8.0788 120.7765 53.0516 42.9378 175.0707 44 P 4.4629 0.0000 0.0000 62.4519 32.1513 175.7707 45 R 4.4393 8.3679 120.3092 55.8270 31.2170 175.8226 46 C 5.6056 8.8255 122.9202 55.1758 44.9200 172.6101 47 F 5.2304 8.7018 114.9297 55.3792 41.7225 173.1291 48 R 4.9370 9.1841 120.2996 54.3690 32.6677 174.8428 49 V 3.9870 8.8305 127.4650 62.8375 32.5461 175.6531 50 N 5.0128 9.4194 127.3821 51.8764 37.4770 175.2935 51 T 5.0199 8.0692 113.4875 62.3383 69.1338 175.8580 52 L 4.1925 8.0505 122.5352 56.6761 41.8500 177.7197 53 K 4.5084 7.6162 115.6024 56.2529 34.5463 175.8904 54 I 4.2701 7.0677 116.2756 58.5257 40.7447 173.6140 55 S 4.6652 8.2652 121.1307 58.0251 65.1138 175.6138 56 V 3.6451 8.2545 122.0444 66.1477 31.2562 177.9366 57 Q 4.0026 8.1107 118.8596 59.4546 28.9270 178.0591 58 D 4.3449 8.1736 119.8141 57.1843 40.8857 178.4829 59 L 3.8739 7.9180 120.9284 58.0997 42.0448 179.1273 60 V 3.6826 7.8995 118.1880 66.0528 31.4392 178.1638 61 K 3.9997 7.8940 118.1722 59.4541 31.6434 179.5802 62 R 3.9357 7.7449 117.3723 59.3002 30.3367 178.8709 63 L 4.1700 8.0615 118.7414 57.8433 41.6487 179.2123 64 N 4.9207 8.4857 117.9446 55.8044 38.2604 177.3347 65 K 4.0149 7.9902 119.9289 59.0248 32.3400 178.0472 66 K 4.4676 7.7996 116.3361 56.2804 32.4836 177.4344 67 G 4.0183 8.0657 107.3564 44.8891 0.0000 174.2153 68 F 4.6965 8.2516 118.8957 57.4166 40.5286 174.5480 69 Q 4.5310 9.0112 120.5228 54.3270 32.8578 174.2018 70 F 5.3227 7.4805 115.0813 56.2477 40.8749 173.0324 71 K 4.8688 9.0151 118.9040 54.4409 35.3155 176.2883 72 R 4.0221 8.5327 121.3869 56.2602 31.2920 176.5165 73 V 3.3411 7.6801 116.2799 59.6101 32.2087 175.1529 74 P 3.7328 0.0000 0.0000 65.1715 31.1401 177.1774 75 W 3.4888 6.0835 110.5807 55.7024 28.4873 175.8522 76 A 4.3842 7.2789 123.6073 50.6558 20.5756 177.5346 77 K 3.8137 8.6986 122.9895 60.1082 32.8937 177.6806 78 E 4.3553 8.1858 117.1710 56.5938 30.7451 176.0269 79 G 4.0847 7.4997 108.3105 44.6123 0.0000 173.1255 80 F 5.0535 8.2825 120.7224 55.6387 44.0553 172.7459 81 C 5.3073 9.0846 119.0800 54.7718 43.1152 173.6747 82 L 5.0080 8.9814 124.8310 55.5055 41.2775 177.1152 83 T 4.5963 9.2159 112.4806 61.6116 71.4271 174.1936 84 R 4.3150 7.9831 122.6010 55.1585 33.0234 173.0070 85 E 4.8106 8.6706 128.8170 52.7778 28.9353 173.2707 86 P 3.9562 0.0000 0.0000 64.6573 31.6948 177.3410 87 F 4.9215 6.8093 113.2857 52.9137 41.1808 174.7573 88 S 4.1679 8.7547 114.5865 58.8638 62.2904 174.9861 89 I 3.3356 9.0589 128.6147 63.8203 37.8439 177.1283 90 T 3.1259 7.0631 107.1411 62.2061 68.6970 175.1091 91 S 4.6576 7.7581 117.8738 58.9381 63.8212 175.0061 92 T 4.4825 7.4489 112.7450 60.7146 70.8477 173.9241 93 P 4.3241 0.0000 0.0000 65.5100 31.4000 178.7713 94 E 3.8634 8.1437 117.2750 59.5322 29.3649 179.1244 95 F 3.9904 7.9331 119.8967 61.2335 39.2856 177.3033 96 L 4.0707 8.0794 117.5628 56.8260 41.3855 178.4662 97 T 4.4605 7.7409 108.1346 60.7624 69.0499 174.6868 98 G 3.8064 7.3716 107.3070 47.3090 0.0000 175.1810 99 L 4.4113 8.3237 122.1047 55.8663 42.7829 176.7683 100 I 5.1823 7.4220 110.2338 59.3480 41.1749 173.8741 101 Y 4.7084 9.0256 123.8648 55.9504 42.0724 174.0045 102 I 4.8783 7.9119 127.4182 60.5799 38.1736 174.9519 103 Q 4.7141 8.2715 123.5710 55.1822 31.7467 174.1233 104 E 4.1270 8.7798 119.4497 56.1800 30.3658 178.0969 105 A 4.0506 8.8030 125.5929 55.4883 18.6292 179.3262 106 S 3.8749 8.2594 109.0256 61.3244 63.1497 176.4908 107 S 4.4034 7.4427 117.2501 57.9045 61.8792 174.5061 *109 Y 4.9594 7.9496 123.0242 58.5202 40.6680 174.4176 110 P 4.2086 0.0000 0.0000 65.4096 31.4630 176.7054 111 P 4.1405 0.0000 0.0000 65.5131 31.0239 178.8902 112 V 3.3766 7.3902 115.1637 65.8594 31.6021 177.4061 113 A 4.2296 8.3228 119.9074 55.1673 18.2898 179.0892 114 L 3.8994 8.0386 118.0565 55.9333 43.2268 176.4223 115 D 4.3096 7.8006 116.7078 54.4740 39.8928 171.8451 116 P 4.5346 0.0000 0.0000 62.7698 32.7245 176.6870 117 K 4.6672 8.9339 121.1497 53.5403 34.5725 174.2805 118 P 4.4165 0.0000 0.0000 64.6060 31.5549 177.0634 119 G 3.9915 8.9236 111.2925 45.0808 0.0000 173.3611 120 E 4.4528 8.0179 119.2913 56.2249 31.4271 176.0381 121 I 4.6289 9.2448 123.2307 60.2756 38.5515 175.2016 122 V 5.3248 9.4058 127.2755 61.0212 35.3008 174.0667 123 A 5.2599 8.6556 125.9854 50.3860 22.2727 175.0925 124 D 4.9886 9.1203 121.4805 52.3213 44.6194 174.7577 *126 A 4.2833 8.3398 120.7289 51.8648 19.4988 176.7965 127 A 4.1878 8.6419 122.8720 54.2733 19.0063 178.1308 128 A 4.7354 7.5061 117.4577 48.9899 18.8036 173.3696 129 P 4.4847 0.0000 0.0000 62.1152 34.2423 174.9715 130 G 3.9303 8.8669 117.0395 45.2220 0.0000 175.6144 131 G 3.2482 9.1950 109.5129 47.8314 0.0000 175.0111 132 K 4.1841 8.0264 120.6442 59.1854 32.1634 179.5419 133 T 3.9050 7.8257 116.0708 66.6272 68.4930 176.6864 134 S 4.1413 7.9539 115.9859 61.1189 63.0220 175.9836 135 Y 4.0693 7.6383 123.4322 60.6069 38.3334 177.5527 136 L 3.9851 7.9029 118.5997 57.8057 42.0376 179.0348 137 A 4.1551 7.8978 120.7147 55.2969 18.2215 179.7399 138 Q 4.0911 8.1676 116.0339 58.9288 28.5786 178.6370 139 L 4.4549 7.7916 120.3254 54.4145 42.2402 177.4443 *141 R 4.0906 8.0133 114.5562 56.8756 31.3541 175.8275 142 N 4.5856 8.1625 109.1894 54.2348 37.0609 174.0000 143 D 4.8595 7.3462 115.3276 53.2127 44.4567 176.7394 144 G 3.8684 9.0133 110.0016 44.6806 0.0000 172.6011 145 V 4.6286 8.2618 117.0195 61.3441 35.7566 175.2856 146 I 5.1352 8.5193 126.9025 59.8721 40.4598 173.8677 147 Y 4.7332 9.3981 125.5196 56.5110 39.8242 174.8333 148 A 5.3928 8.3456 124.1999 49.1326 23.2514 174.7168 149 F 5.4448 8.9808 117.1646 55.8899 42.9331 174.3103 150 D 4.8163 9.1222 122.0262 53.2015 44.1243 176.3768 151 V 3.8380 8.9270 118.9087 62.8536 32.2453 176.0599 152 D 4.7333 8.6618 120.6560 52.5623 41.4819 175.9149 153 E 3.8041 8.6407 128.8110 59.3550 29.6910 178.1776 154 N 4.3219 8.1957 115.9989 56.3732 38.6029 177.2247 155 R 3.9234 8.6438 120.3730 59.2440 30.1956 178.2553 156 L 3.9658 8.2229 120.4332 58.2201 41.8382 179.2107 157 R 3.9314 8.1318 117.5340 59.0901 30.1536 178.3231 158 E 4.0897 8.1278 119.1334 59.6670 29.5984 178.9918 159 T 3.8969 8.2419 116.1145 66.7020 68.6344 176.5640 160 R 3.8564 8.1506 120.5378 59.3461 29.9905 178.6436 161 L 4.0330 7.6999 118.8337 57.6016 41.6526 179.0430 162 N 4.3320 8.0848 115.9773 56.4209 38.5464 177.2071 163 L 3.9609 8.2147 120.6382 57.7751 41.7025 179.6199 164 S 4.0230 7.8587 112.6809 61.4180 61.9619 176.2169 165 R 3.8779 8.1303 121.4014 59.1264 29.5905 177.7803 166 L 4.3247 7.8407 116.6438 54.5509 41.8738 177.3793 167 G 3.7840 7.6389 106.7852 46.1418 0.0000 173.6209 168 V 3.9520 7.8129 119.9663 62.1361 31.7672 175.7885 169 L 4.6348 9.5499 126.3546 54.5222 43.2032 176.4848 170 N 4.8841 7.9987 115.9121 52.4184 38.6403 173.7636 171 V 4.5810 7.6974 118.4565 61.7414 33.7306 174.8343 172 I 4.2299 8.4510 127.8607 59.3345 39.8437 174.2390 173 L 4.7528 8.2261 126.9681 52.9629 43.4599 175.8127 174 F 5.1441 8.6277 122.9126 56.1523 41.8589 174.8833 175 H 5.7251 8.8301 123.4189 53.5847 28.1476 173.2408 176 S 4.6271 7.9394 116.2340 57.4273 65.9667 173.9483 177 S 4.6301 8.5183 116.4199 57.0745 63.1896 174.8415 178 S 2.8723 8.4039 120.2908 59.9398 62.8784 176.0487 179 L 3.9140 7.3707 120.5079 57.3706 41.4924 177.3343 180 H 4.6934 7.9279 115.2902 55.5929 29.1217 176.5734 181 I 3.7623 7.4651 122.4050 64.3661 37.4438 178.0034 182 G 3.7374 8.0584 105.6797 47.3719 0.0000 174.7165 183 E 4.2656 8.1773 119.1988 57.9334 29.6188 178.3079 184 L 4.1408 7.8809 118.6325 54.9180 42.0120 176.3268 185 N 4.1895 7.7894 114.6866 54.2483 36.7247 173.9717 186 V 4.1858 7.7346 115.8046 60.7384 33.7717 173.8803 187 E 4.7157 8.2931 124.3599 55.0053 31.0281 175.1116 188 F 4.8692 9.1097 123.1662 56.2711 41.2828 176.6362 189 D 4.5382 9.4001 122.6230 56.6412 42.2322 176.8045 190 K 5.2156 8.0675 115.7787 54.7574 36.9972 175.6394 191 I 4.9236 8.7939 123.4614 59.4709 41.3128 173.9243 192 L 4.6095 8.9211 129.6263 53.5374 43.4391 175.9994 193 L 4.6547 9.0823 130.8044 52.8744 42.2394 172.4940 194 D 5.3232 8.4029 120.9795 50.1833 41.1343 176.3199 195 A 4.4188 8.3236 125.6278 49.9889 19.9965 175.3460 196 P 4.2285 0.0000 0.0000 63.3310 32.1479 178.5341 197 C 4.7203 8.5726 123.7740 55.9078 41.6754 173.0832 198 T 4.7617 7.0464 105.3547 60.0346 70.9595 175.8997 199 G 3.9663 7.8432 112.0907 45.3525 0.0000 174.1951 200 S 4.5014 8.8970 114.6888 61.2347 63.0839 176.1662 201 G 3.7851 8.5700 109.9303 47.7791 0.0000 176.1877 202 T 3.8004 8.6812 111.1897 64.0703 69.8432 174.7617 203 I 3.1966 8.7445 119.1660 61.7791 35.9286 173.0867 204 H 4.1978 7.8932 112.1981 56.5691 26.0507 175.3607 *213 R 4.3718 7.5575 117.9122 56.6313 32.4957 176.7728 214 T 4.4347 8.2617 109.2389 62.3533 68.5924 175.6409 *216 D 4.6217 8.9443 118.2909 54.3763 42.6260 176.9962 217 D 4.4711 8.0448 118.7554 57.4599 40.6482 179.0078 218 I 3.8223 7.8926 120.1711 64.2078 36.9987 178.6431 219 K 3.9860 7.9781 118.9333 59.3020 31.9383 178.8610 220 F 4.1369 8.4589 120.9909 61.7289 39.3330 177.0137 221 C 4.0153 8.2383 116.2424 62.6997 27.6722 175.8464 222 Q 4.0302 8.0988 120.4676 59.0852 28.7067 178.3931 223 G 3.5354 7.9444 105.7681 47.6911 0.0000 175.1234 224 L 3.9708 7.6934 123.2720 57.5939 41.8936 179.5063 225 Q 4.3063 8.3670 115.1558 56.6411 28.4221 178.4143 *227 R 4.3204 7.9220 120.9614 56.4307 32.2956 178.0216 228 L 3.9516 8.2087 117.8928 57.7333 41.4976 179.3420 229 L 3.9811 8.4564 120.7265 58.0840 42.0305 178.6667 230 E 3.5877 8.3051 118.8130 59.1978 29.5573 178.7845 231 K 4.0899 8.2362 118.7323 59.2116 31.8217 179.6698 232 G 3.5037 8.0013 105.3398 47.8833 0.0000 175.5734 233 L 3.9887 7.8587 121.9998 57.0752 41.2290 179.1951 234 E 3.9246 7.8521 118.7489 59.0109 29.8394 178.4660 235 V 4.1322 7.4290 109.8764 60.4837 32.1063 175.1980 236 L 4.8653 7.0741 122.0410 54.2221 42.7600 176.8025 237 K 4.3443 9.0488 125.5445 56.0115 34.1575 174.5356 238 P 4.4708 0.0000 0.0000 63.9990 31.5999 177.2584 239 G 3.9039 9.3829 112.7621 45.2136 0.0000 173.8923 240 G 3.9534 8.0796 107.6807 46.1168 0.0000 172.7295 241 I 5.1425 8.3593 120.6384 59.1477 40.6289 174.6925 242 L 5.1188 9.0555 127.8633 53.2415 45.4990 174.9468 243 V 4.7549 8.7330 126.1631 61.3116 33.8803 173.3453 244 Y 5.2367 8.8385 129.6714 55.9082 40.4702 174.4441 245 S 4.9807 8.3563 120.1694 57.2874 67.1761 172.8101 246 T 4.4655 8.2571 110.4758 60.2343 72.9883 172.5604 247 C 5.4095 8.4546 116.6955 56.2606 40.6913 173.8786 248 S 5.2800 7.9754 111.6291 56.6231 64.8059 173.4242 249 L 4.4763 8.3747 123.9973 55.3735 42.6731 177.0068 250 E 4.1253 8.0785 120.4412 55.4093 29.8509 176.2319 251 P 4.3153 0.0000 0.0000 64.8825 31.0361 178.5636 252 E 3.6869 7.6027 116.2175 58.6518 29.4611 178.0293 253 E 4.4597 7.6986 115.6907 55.2621 30.5050 175.8740 254 N 4.0798 7.6760 114.1333 52.8914 40.2142 176.1212 255 E 3.9846 8.6129 123.9119 60.3870 30.3987 178.3486 256 F 4.4000 8.5119 117.8990 60.6268 38.9150 177.9676 257 V 3.7788 7.7808 117.4582 66.0443 31.3933 178.0599 258 I 3.6510 7.8629 119.6587 64.3208 36.9424 178.1710 259 Q 3.9582 8.6665 120.9181 58.8798 28.8717 178.0710 260 W 4.1531 8.4187 129.1812 60.4596 30.7131 177.7806 261 A 3.7296 8.2359 120.7061 55.1414 17.6054 179.6318 262 L 3.9641 7.8644 116.5241 57.9627 41.7171 179.1212 263 D 4.3826 7.8517 118.0338 56.5486 40.9260 177.5921 264 N 4.0813 7.7356 116.6264 53.3567 39.2271 174.2217 265 F 4.8788 7.5035 117.2331 55.5157 42.9019 175.5067 266 D 4.7884 8.3109 122.3340 53.3454 38.9797 175.8325 267 V 5.1182 7.5767 113.6393 59.4989 36.7317 174.4650 268 E 4.8445 8.9318 118.4280 54.9892 33.2029 174.3476 269 L 4.9583 9.0952 121.4937 53.9148 43.1371 176.1281 270 L 4.8217 8.4954 122.3269 52.1153 44.2118 174.8498 271 P 4.5796 0.0000 0.0000 62.3472 31.9643 175.7479 272 L 4.7932 7.8109 123.3025 53.0851 44.2535 176.8962 273 K 3.8751 8.9550 124.1724 59.1508 32.5475 176.8452 274 Y 4.4929 7.5927 114.3917 57.7166 39.1665 175.9472 275 G 3.8165 8.9785 108.1247 44.5648 0.0000 172.2634 276 E 4.8210 8.6457 117.5618 53.9209 32.2199 174.4369 277 P 4.6854 0.0000 0.0000 62.5664 32.0570 176.4215 278 A 4.4559 8.4209 125.1995 51.7252 19.5207 177.1690 279 L 4.2255 9.1505 120.6277 54.8650 42.3210 177.7314 280 T 4.5385 8.5037 111.9255 61.6156 70.2254 173.8968 281 N 5.7163 7.7989 120.9316 51.2425 39.4386 172.2745 282 P 4.0591 0.0000 0.0000 63.7518 31.9891 176.4809 283 F 3.8801 9.1220 120.1115 58.3761 36.3134 176.0874 284 G 3.8602 8.2164 107.2258 45.5739 0.0000 174.1877 285 I 4.0771 7.6964 121.8186 59.8530 37.0053 174.9890 286 E 4.4887 8.7228 126.3322 56.4655 29.6458 176.8359 287 L 4.7142 8.7594 125.1878 52.5693 44.7002 176.6796 288 S 4.2072 9.5444 116.8864 58.7371 63.2476 175.9343 289 E 3.8861 9.0706 124.0984 59.3002 29.3584 178.6359 290 E 3.9012 8.2862 118.8966 59.2209 29.4746 178.5754 291 I 3.8390 7.9485 119.7328 63.7626 36.8876 177.7835 292 K 4.1755 7.9734 118.2460 58.2208 31.8091 178.2774 293 N 4.4745 8.3825 117.3959 54.8093 38.6676 174.9644 294 A 4.4493 7.5668 122.3350 51.7137 20.0464 176.7190 295 R 5.1513 8.5326 117.7214 54.5054 34.8999 174.8678 296 R 4.9962 8.9068 118.6440 54.5177 34.7122 174.2799 297 L 4.7891 8.5891 122.3800 53.0662 44.7796 175.0087 298 Y 5.1187 8.6749 120.1596 55.3443 40.6424 175.2572 299 P 5.0352 0.0000 0.0000 64.7604 31.6029 176.9443 300 D 4.6174 8.0088 116.9174 54.4336 40.0188 177.2542 301 V 4.2880 7.6865 110.2906 61.7265 34.1482 175.7550 302 H 4.8443 8.8007 114.3374 54.7372 29.2887 174.2454 303 E 3.8563 8.3361 117.8839 57.5366 27.1068 173.4603 304 T 4.7293 7.4695 106.5287 59.8988 72.3071 172.6120 305 S 4.8718 8.4470 117.9344 57.5125 64.3138 174.6309 306 G 3.7624 8.9313 109.1860 46.7965 0.0000 172.7356 307 F 5.3481 9.0555 125.7538 56.4967 43.7502 172.9421 308 F 5.0273 7.7113 125.2726 56.5380 43.1129 173.0920 309 I 4.6456 7.4697 124.4421 59.3051 41.7623 173.3025 310 A 4.6839 8.8686 129.6236 49.9305 23.0487 174.6451 311 K 4.5820 8.5301 122.3759 54.8249 34.5100 174.6315 312 I 4.8928 8.8428 129.2359 59.5167 39.9316 174.5920 313 R 4.9784 8.9182 127.4502 54.3316 32.6683 174.5168 314 K 4.5454 8.8574 128.3285 55.7244 33.6895 176.5520 315 L 4.2917 8.8621 126.8321 55.0541 41.2555 176.8050 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 3 L 8.17 3.07 0.00 0.78 1.28 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.20 4.15 0.00 4.08 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 5 P 0.00 4.31 0.00 2.19 2.13 0.00 3.58 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 2.10 2.08 0.00 6 S 7.55 4.33 0.00 3.88 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 *8 L 7.93 4.22 0.00 1.79 1.91 0.92 1.22 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 9 D 8.29 4.44 0.00 2.97 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 10 K 8.30 4.01 0.00 1.86 1.93 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.63 7.81 11 L 7.98 4.31 0.00 1.97 1.88 1.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.41 4.48 0.00 1.87 1.76 1.05 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.21 4.03 0.00 1.98 2.03 0.00 3.20 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 14 L 7.80 4.26 0.00 2.05 1.90 1.14 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.64 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 16 Y 8.07 4.49 0.00 3.37 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 17 S 8.31 4.42 0.00 3.95 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 18 K 8.51 3.95 0.00 1.85 1.85 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.51 7.81 19 L 7.86 3.96 0.00 1.82 1.71 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.29 3.94 0.00 3.05 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 21 A 8.28 4.00 1.44 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 0.00 0.00 0.00 22 D 8.45 4.40 0.00 2.91 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 23 R 8.22 4.22 0.00 1.71 1.96 0.00 2.95 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.64 0.00 24 Y 8.06 4.60 0.00 3.05 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 8.58 4.33 0.00 3.18 3.25 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 26 Q 8.27 4.18 0.00 2.43 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.70 0.00 0.00 0.00 0.00 0.00 2.56 2.85 0.00 27 L 7.30 3.65 0.00 0.38 0.13 0.27 -0.42 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 28 W 7.87 4.74 0.00 3.34 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.58 4.08 0.00 2.24 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 2.37 2.34 0.00 31 R 7.87 3.89 0.00 1.81 2.13 0.00 2.94 0.00 0.00 2.84 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.50 0.00 32 A 8.19 4.06 1.64 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 0.00 0.00 33 I 7.59 3.71 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 1.01 0.00 0.00 34 R 7.86 3.92 0.00 1.97 1.92 0.00 3.16 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 35 I 7.61 3.57 1.67 0.00 0.00 -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 1.06 0.23 0.56 0.00 0.00 36 A 7.73 4.25 1.51 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 0.00 0.00 37 E 8.28 4.16 0.00 1.98 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 2.41 2.59 0.00 38 A 7.96 4.21 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *40 E 8.19 4.30 0.00 2.14 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 2.49 2.35 0.00 41 K 7.48 4.34 0.00 1.91 1.75 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.43 7.81 42 P 0.00 4.45 0.00 2.05 1.99 0.00 3.68 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 2.04 2.12 0.00 43 L 8.08 4.49 0.00 1.65 1.61 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.46 0.00 2.05 2.01 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 45 R 8.37 4.44 0.00 1.90 1.83 0.00 3.24 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 46 C 8.83 5.61 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 47 F 8.70 5.23 0.00 2.97 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 48 R 9.18 4.94 0.00 1.69 1.73 0.00 2.21 0.00 0.00 2.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.91 0.00 49 V 8.83 3.99 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 0.79 0.00 0.00 1.21 0.00 0.00 50 N 9.42 5.01 0.00 2.77 2.88 0.00 0.00 6.83 6.76 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 51 T 8.07 5.02 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 52 L 8.05 4.19 0.00 1.85 1.75 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.62 4.51 0.00 1.67 1.78 0.00 1.89 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.29 7.81 54 I 7.07 4.27 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 1.46 1.09 0.89 0.00 0.00 55 S 8.27 4.67 0.00 4.11 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 56 V 8.25 3.65 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 1.04 0.00 0.00 57 Q 8.11 4.00 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 58 D 8.17 4.34 0.00 2.75 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 59 L 7.92 3.87 0.00 1.75 1.77 0.67 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 60 V 7.90 3.68 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 1.17 0.00 0.00 0.72 0.00 0.00 61 K 7.89 4.00 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.68 7.81 62 R 7.74 3.94 0.00 1.94 1.97 0.00 3.15 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 63 L 8.06 4.17 0.00 1.80 1.81 -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.49 4.92 0.00 2.99 2.84 0.00 0.00 6.22 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 65 K 7.99 4.01 0.00 1.94 2.07 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.51 7.81 66 K 7.80 4.47 0.00 2.35 2.26 0.00 1.89 0.00 0.00 2.04 0.00 0.00 3.13 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.60 1.82 7.81 67 G 8.07 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 8.25 4.70 0.00 3.34 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 69 Q 9.01 4.53 0.00 1.91 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 70 F 7.48 5.32 0.00 3.13 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 71 K 9.02 4.87 0.00 1.68 1.70 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.40 7.81 72 R 8.53 4.02 0.00 1.59 1.56 0.00 2.24 0.00 0.00 2.61 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 73 V 7.68 3.34 0.97 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 0.37 0.00 0.00 0.40 0.00 0.00 74 P 0.00 3.73 0.00 1.59 1.97 0.00 2.20 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.83 0.00 75 W 6.08 3.49 0.00 2.37 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 76 A 7.28 4.38 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.70 3.81 0.00 1.84 1.92 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.49 7.81 78 E 8.19 4.36 0.00 1.97 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 0.00 2.40 2.42 0.00 79 G 7.50 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.28 5.05 0.00 1.51 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 C 9.08 5.31 0.00 2.73 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 82 L 8.98 5.01 0.00 1.73 1.78 1.13 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 83 T 9.22 4.60 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 84 R 7.98 4.31 0.00 1.92 1.85 0.00 3.26 0.00 0.00 3.35 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 85 E 8.67 4.81 0.00 2.04 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 86 P 0.00 3.96 0.00 2.26 1.97 0.00 2.57 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.21 0.00 87 F 6.81 4.92 0.00 3.17 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 88 S 8.75 4.17 0.00 3.89 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 89 I 9.06 3.34 1.71 0.00 0.00 -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 0.92 0.62 0.77 0.00 0.00 90 T 7.06 3.13 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 91 S 7.76 4.66 0.00 4.30 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 7.45 4.48 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 1.01 0.00 0.00 93 P 0.00 4.32 0.00 2.19 2.15 0.00 3.67 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 2.15 2.22 0.00 94 E 8.14 3.86 0.00 1.86 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 2.20 2.33 0.00 95 F 7.93 3.99 0.00 2.97 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 96 L 8.08 4.07 0.00 1.70 1.73 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 97 T 7.74 4.46 4.20 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 1.24 0.00 0.00 98 G 7.37 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 0.00 0.00 0.00 99 L 8.32 4.41 0.00 1.60 1.65 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.42 5.18 1.83 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 1.09 0.64 0.67 0.00 0.00 101 Y 9.03 4.71 0.00 2.94 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 0.00 102 I 7.91 4.88 1.74 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 1.49 0.71 0.94 0.00 0.00 103 Q 8.27 4.71 0.00 2.16 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 104 E 8.78 4.13 0.00 2.11 1.95 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 2.44 2.36 0.00 105 A 8.80 4.05 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 8.26 3.87 0.00 2.99 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 0.00 107 S 7.44 4.40 0.00 4.06 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *109 Y 7.95 4.96 0.00 2.36 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 0.00 110 P 0.00 4.21 0.00 2.24 2.10 0.00 3.88 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 111 P 0.00 4.14 0.00 1.52 1.95 0.00 3.58 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 2.17 2.15 0.00 112 V 7.39 3.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.57 0.00 0.00 113 A 8.32 4.23 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 0.00 114 L 8.04 3.90 0.00 1.70 1.84 0.98 1.17 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 0.00 115 D 7.80 4.31 0.00 2.95 2.64 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 0.00 116 P 0.00 4.53 0.00 2.09 1.99 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 117 K 8.93 4.67 0.00 1.76 1.69 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.53 7.81 118 P 0.00 4.42 0.00 2.04 2.01 0.00 3.67 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 2.04 2.11 0.00 119 G 8.92 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.02 4.45 0.00 2.07 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 2.35 2.47 0.00 121 I 9.24 4.63 1.87 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 1.12 0.98 0.84 0.00 0.00 122 V 9.41 5.32 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 1.05 0.00 0.00 1.01 0.00 0.00 123 A 8.66 5.26 0.57 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 0.00 124 D 9.12 4.99 0.00 2.70 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 0.00 0.00 0.00 0.00 *126 A 8.34 4.28 1.45 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 0.00 0.00 127 A 8.64 4.19 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.51 4.74 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 0.00 129 P 0.00 4.48 0.00 2.07 2.04 0.00 3.96 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 2.11 2.29 0.00 130 G 8.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 2.67 2.55 0.00 139 L 7.79 4.45 0.00 1.85 1.74 0.61 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 *141 R 8.01 4.09 0.00 1.90 1.98 0.00 3.29 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 142 N 8.16 4.59 0.00 2.86 2.86 0.00 0.00 6.53 8.08 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 0.00 143 D 7.35 4.86 0.00 2.42 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 0.00 144 G 9.01 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 0.00 145 V 8.26 4.63 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 0.39 0.00 0.00 0.89 0.00 0.00 146 I 8.52 5.14 1.79 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 1.25 0.50 0.90 0.00 0.00 147 Y 9.40 4.73 0.00 3.14 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 A 8.35 5.39 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 0.00 149 F 8.98 5.44 0.00 2.87 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 0.00 150 D 9.12 4.82 0.00 2.77 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.93 3.84 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 0.83 0.00 0.00 1.00 0.00 0.00 152 D 8.66 4.73 0.00 2.74 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 E 8.64 3.80 0.00 1.86 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 2.32 2.42 0.00 154 N 8.20 4.32 0.00 2.95 2.87 0.00 0.00 6.77 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 0.00 155 R 8.64 3.92 0.00 1.90 2.20 0.00 3.15 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.67 0.00 156 L 8.22 3.97 0.00 1.91 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0.00 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 R 8.13 3.88 0.00 1.86 2.02 0.00 2.98 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 166 L 7.84 4.32 0.00 1.75 1.64 0.84 0.82 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 0.00 167 G 7.64 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 0.00 0.00 0.00 168 V 7.81 3.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.87 0.00 0.00 169 L 9.55 4.63 0.00 1.56 1.61 0.90 1.20 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 0.00 170 N 8.00 4.88 0.00 2.85 2.94 0.00 0.00 5.75 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 0.00 171 V 7.70 4.58 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 0.69 0.00 0.00 0.86 0.00 0.00 172 I 8.45 4.23 1.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.12 0.27 0.00 0.00 173 L 8.23 4.75 0.00 1.41 1.51 0.88 0.77 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 0.00 174 F 8.63 5.14 0.00 2.60 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 H 8.83 5.73 0.00 3.20 3.30 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 S 7.94 4.63 0.00 3.97 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 0.00 177 S 8.52 4.63 0.00 3.93 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 0.00 178 S 8.40 2.87 0.00 3.63 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 0.00 179 L 7.37 3.91 0.00 1.49 1.61 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 180 H 7.93 4.69 0.00 3.30 3.42 0.00 5.64 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 I 7.47 3.76 1.58 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.81 0.00 0.00 182 G 8.06 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 0.00 183 E 8.18 4.27 0.00 2.11 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 2.36 2.38 0.00 184 L 7.88 4.14 0.00 1.81 1.68 1.24 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 185 N 7.79 4.19 0.00 2.81 2.87 0.00 0.00 6.74 8.97 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 0.00 186 V 7.73 4.19 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.76 0.00 0.00 187 E 8.29 4.72 0.00 1.97 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 188 F 9.11 4.87 0.00 3.00 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 0.00 189 D 9.40 4.54 0.00 2.76 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 P 0.00 4.06 0.00 1.82 1.87 0.00 4.10 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.09 0.00 283 F 9.12 3.88 0.00 3.30 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 0.00 284 G 8.22 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 285 I 7.70 4.08 2.09 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 1.67 1.59 0.81 0.00 0.00 286 E 8.72 4.49 0.00 1.83 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 287 L 8.76 4.71 0.00 1.57 1.77 1.07 0.91 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 0.00 288 S 9.54 4.21 0.00 3.74 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 0.00 289 E 9.07 3.89 0.00 2.07 1.95 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 2.38 2.44 0.00 290 E 8.29 3.90 0.00 2.07 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 2.38 2.40 0.00 291 I 7.95 3.84 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.87 1.02 0.00 0.00 292 K 7.97 4.18 0.00 1.83 1.88 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.62 7.81 293 N 8.38 4.47 0.00 2.87 3.00 0.00 0.00 6.78 7.08 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 0.00 294 A 7.57 4.45 1.18 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 0.00 295 R 8.53 5.15 0.00 1.53 1.83 0.00 3.19 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.89 0.00 296 R 8.91 5.00 0.00 1.64 1.14 0.00 3.31 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 297 L 8.59 4.79 0.00 1.53 1.39 -0.14 0.48 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 0.00 298 Y 8.67 5.12 0.00 2.88 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 P 0.00 5.04 0.00 2.19 2.33 0.00 3.44 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 300 D 8.01 4.62 0.00 2.76 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 0.00 301 V 7.69 4.29 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 0.73 0.00 0.00 0.87 0.00 0.00 302 H 8.80 4.84 0.00 3.25 3.57 0.00 6.00 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 303 E 8.34 3.86 0.00 2.14 2.05 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 2.25 2.31 0.00 304 T 7.47 4.73 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 305 S 8.45 4.87 0.00 3.86 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 0.00 306 G 8.93 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 0.00 307 F 9.06 5.35 0.00 3.10 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 0.00 308 F 7.71 5.03 0.00 2.97 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 0.00 309 I 7.47 4.65 1.23 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.10 0.32 0.00 0.00 310 A 8.87 4.68 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 311 K 8.53 4.58 0.00 1.75 1.78 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.40 7.81 312 I 8.84 4.89 1.93 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 1.07 0.54 0.86 0.00 0.00 313 R 8.92 4.98 0.00 1.81 1.74 0.00 3.08 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 314 K 8.86 4.55 0.00 1.83 1.64 0.00 1.72 0.00 0.00 1.91 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.39 7.81 315 L 8.86 4.29 0.00 1.66 1.55 0.96 0.85 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 * Residues marked with a * may have inaccurate shift predictions.