NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2955 7.8827 121.4503 61.1813 38.7869 173.7800 17 V 4.4226 8.5884 125.5251 61.6560 33.0583 174.3238 18 G 3.7005 8.4631 113.9519 46.5496 0.0000 173.0830 19 G 4.2449 7.7986 110.0823 43.7394 0.0000 172.3868 20 Y 4.9729 7.8796 116.6350 55.0398 42.2037 174.8766 21 T 4.3224 8.6019 116.8560 63.8902 68.3719 175.3510 22 C 4.3130 8.6673 125.4936 60.3599 36.2214 175.1304 23 G 4.1119 8.6387 106.3624 44.2364 0.0000 172.8406 24 A 3.9442 8.6488 125.7403 53.8278 18.6107 176.8477 25 N 4.2437 8.8453 119.3703 54.5032 36.2414 175.2620 26 T 4.2366 7.5503 107.2896 62.5261 69.9181 175.1683 27 V 4.0713 7.0176 122.0775 60.2013 31.4592 173.6449 28 P 4.5162 0.0000 0.0000 63.8246 32.0176 178.1126 29 Y 5.0145 6.6646 115.7114 56.3249 38.7539 174.6199 30 Q 4.6275 7.3100 123.4239 56.3662 29.2862 175.4065 31 V 4.8677 8.8727 118.5313 59.6420 36.3410 174.1438 32 S 4.9400 8.7810 116.6239 56.5795 65.1535 172.5534 33 L 4.6165 8.4557 127.1982 53.1003 43.4776 174.9895 34 N 5.8428 8.9436 122.3664 49.9848 42.3442 174.8581 *37 S 4.4015 8.4655 119.6193 58.4309 64.2122 174.5227 38 G 4.0291 9.7098 108.9171 46.1907 0.0000 172.8848 39 Y 4.4960 6.7572 115.4954 56.3944 40.0278 172.3586 40 H 4.6707 8.7999 121.1884 55.5887 30.4472 174.5499 41 F 5.0182 7.6199 120.4300 57.1587 39.9413 174.1010 42 C 4.7970 6.8611 114.8934 56.0914 44.9155 173.2796 43 G 4.1908 8.4431 109.1031 45.6060 0.0000 172.1861 44 G 4.5757 7.8626 104.9758 46.5089 0.0000 172.6521 45 S 5.5374 8.6891 115.2884 56.4529 67.0065 173.6028 46 L 4.7145 9.2012 127.2791 54.6462 42.5294 177.0185 47 I 4.5107 8.4660 119.4596 60.8347 38.4964 174.3500 48 N 4.6703 7.4784 117.6217 52.3851 39.4593 174.8921 49 S 3.9882 8.5595 111.6152 60.3720 63.4458 174.6089 50 Q 4.5714 9.1199 121.3473 55.3308 30.7914 174.4077 51 W 5.5508 8.3206 117.3416 55.5870 33.4529 174.3945 52 V 5.2141 9.1427 122.9800 61.0453 34.8072 174.3747 53 V 4.9748 8.7320 125.3771 60.4339 33.8279 174.7619 54 S 5.0982 9.0108 117.5774 57.7063 66.0682 171.9838 55 A 4.7479 8.5074 120.0956 50.5187 20.7244 178.3653 56 A 3.8261 8.2766 124.1692 55.3222 18.4613 179.1384 57 H 4.5373 8.3231 108.9530 57.0284 28.6747 175.2324 58 C 4.7299 7.8123 117.1690 57.1379 40.5668 173.3496 59 Y 4.1242 7.7668 122.3988 57.6254 38.7602 175.0001 60 K 3.7020 6.5980 123.7785 56.4674 34.6711 173.9454 61 S 4.3880 8.1414 114.0419 57.6269 65.0461 173.1181 62 G 3.6359 8.3397 105.8413 46.6960 0.0000 173.6418 63 I 4.3736 7.4474 119.3261 59.6236 39.5661 175.3689 64 Q 4.7625 8.7577 127.8772 54.1875 31.7101 174.1203 65 V 4.3850 8.9547 127.0215 61.8183 33.5648 174.6014 65A R 5.0262 8.8858 127.1970 54.6782 32.4684 175.2078 66 L 4.6979 9.0900 124.8532 52.8020 44.7051 177.2294 *69 G 3.8409 8.2094 105.5495 46.3054 0.0000 172.8548 70 E 4.6566 8.4281 118.7318 55.2270 30.4690 174.1974 71 D 4.7473 7.7640 117.0416 55.2177 43.8950 174.1164 72 N 4.8495 8.7962 119.2082 52.9333 39.2978 176.1111 73 I 3.8783 8.3654 119.5905 61.9782 37.9073 176.1659 74 N 4.7671 8.5569 117.9825 53.0609 39.4972 174.7658 75 V 4.3020 7.3698 116.8806 60.6577 34.0854 174.9146 76 V 4.1089 8.4337 126.9237 62.5393 31.1924 175.1113 77 E 4.4101 9.0852 126.9584 55.3506 30.7887 176.7744 78 G 3.9730 8.3979 106.0960 45.9227 0.0000 174.0063 79 N 4.6238 8.9658 116.8024 52.6003 36.6806 174.5441 80 E 4.5284 7.5931 116.9640 56.3955 30.7040 176.3754 81 Q 4.4266 8.9965 121.0064 54.3332 33.0179 173.9440 82 F 5.5461 8.9329 122.8994 55.9831 40.9874 175.1189 83 I 4.7184 8.8108 124.7049 59.4623 41.0703 175.5310 84 S 4.6977 8.6048 121.2820 57.9996 64.4886 173.1991 85 A 4.4061 8.2394 124.8101 52.1733 18.3868 177.6982 86 S 4.4568 9.1358 117.7267 60.3764 63.4498 174.3341 87 K 4.6715 7.4886 115.8863 55.9451 35.5212 174.7410 88 S 5.2191 8.7936 117.0620 56.9550 66.3271 173.7709 89 I 4.4728 9.2440 125.4836 59.4988 38.8849 175.0172 90 V 4.2002 8.2874 127.2607 62.2449 32.6738 175.2090 91 H 3.9165 8.5593 126.7443 55.8456 30.0163 174.5893 92 P 4.3088 0.0000 0.0000 65.3586 31.3967 177.1810 93 S 4.6917 7.8983 111.9970 58.1730 63.1528 173.3442 94 Y 4.3148 8.0643 123.2354 57.6335 39.0953 174.4294 95 N 4.4968 8.1582 125.3639 51.4641 40.2893 175.0305 96 S 4.0093 7.8592 119.6414 59.1756 63.6508 174.7351 97 N 4.4595 8.5379 119.1212 54.7543 38.8711 175.9927 98 T 4.0510 7.7707 105.8268 60.6530 70.2235 174.8278 99 L 3.8155 7.7996 120.5565 55.4863 39.6631 173.9097 100 N 4.4805 7.7340 117.2027 54.6005 39.5973 174.4824 101 N 4.7324 8.6626 119.7791 54.2579 35.8019 175.6308 102 D 4.7214 7.9128 117.6444 53.0395 39.7834 174.8201 103 I 4.8122 7.1617 120.9441 59.2907 42.3491 172.9429 104 M 5.4140 9.1277 126.4415 54.1818 36.3412 173.2993 105 L 5.4021 9.0838 123.9155 53.1207 45.1915 175.4134 106 I 4.9916 9.1890 123.3875 59.4478 40.6213 174.2810 107 K 3.8061 8.7576 128.4731 54.4959 33.8701 175.2750 108 L 4.6495 8.1215 127.3240 53.6498 42.4549 176.8574 109 K 4.1458 8.8787 124.9793 59.0047 32.4814 177.0321 110 S 4.6801 7.7322 110.8112 55.8385 66.1919 173.1025 111 A 4.4483 8.3111 122.4182 51.9234 18.9339 177.1734 112 A 4.4778 8.7061 122.2668 51.4612 20.2879 177.4347 113 S 4.5594 8.9103 116.4957 57.3978 63.5678 174.5345 114 L 4.6549 8.5064 125.4669 54.1884 42.7918 176.6167 115 N 4.7126 8.8617 118.5872 52.7996 39.5551 175.2001 116 S 4.3639 8.7543 110.7691 60.9194 64.0484 175.1919 117 R 4.2056 8.8477 120.0007 56.6848 30.7517 175.9179 118 V 4.4165 7.7458 117.6826 60.9099 33.5404 173.7488 119 A 5.1352 8.4991 128.0645 50.4016 23.0026 175.0275 120 S 5.1410 8.6919 114.0605 57.4548 65.2263 172.9938 121 I 4.4909 8.1731 120.4724 59.2076 39.7315 175.3689 122 S 4.4683 8.3343 122.7033 57.9304 63.8135 173.9618 123 L 4.3163 8.0798 123.1062 53.3105 42.5523 175.1485 124 P 4.5899 0.0000 0.0000 62.7887 32.6168 176.0667 125 T 4.2296 8.1846 107.9076 62.1249 70.2398 174.4765 *127 S 4.9148 7.5781 114.7180 58.1556 63.9971 173.9459 128 C 4.4556 8.4079 118.0630 56.5634 40.8353 173.2724 129 A 4.5301 7.9438 123.9065 51.2434 20.2007 177.1428 130 S 4.4183 8.0153 115.0387 57.0528 64.8369 173.6712 *132 A 4.2806 8.1580 124.1405 53.3594 19.2634 176.6991 133 G 4.0429 9.1060 109.3898 45.5073 0.0000 174.6923 134 T 3.9166 7.5871 116.8202 63.9425 69.4993 173.1487 135 Q 4.8414 8.5546 126.9941 55.2630 30.4187 175.1022 136 C 5.2824 9.2862 122.7502 55.1164 46.7580 172.2869 137 L 5.2217 8.9506 122.3661 53.5170 44.1921 175.0038 138 I 5.3447 9.0223 127.1589 58.8065 40.0921 174.8423 139 S 4.9429 9.0202 119.3592 56.0747 66.7911 173.0390 140 G 3.8822 7.2963 109.1670 45.8451 0.0000 172.5956 141 W 4.9015 8.3861 117.3930 56.3277 29.4012 177.2091 142 G 4.1606 8.1187 108.6388 44.0857 0.0000 173.6136 143 N 3.8944 8.6708 118.3224 54.4547 38.9200 174.4854 144 T 5.1259 8.1014 112.7547 60.5019 69.5740 174.2366 145 K 4.6378 7.8142 121.4639 54.8064 34.7474 176.1859 146 S 4.4039 8.6395 116.8340 59.8770 63.7886 174.4698 147 S 4.4784 8.1720 116.8735 54.4499 62.4520 172.1715 148 G 3.9933 7.6053 109.9901 43.2200 0.0000 170.2256 149 T 4.6124 8.0865 109.4710 59.7497 71.2467 173.8575 150 S 4.3826 9.4838 121.0827 57.1716 65.3535 171.7760 151 Y 5.0164 8.6151 125.4818 55.8114 39.2778 174.4355 152 P 4.7186 0.0000 0.0000 62.4104 33.1112 175.6362 153 D 4.6352 8.7328 117.5758 56.0048 41.6164 177.3174 154 V 5.7202 7.3984 109.7393 58.5663 34.4370 175.7522 155 L 3.2049 8.3167 124.1053 55.0420 42.9764 175.9164 156 K 4.9325 8.1086 124.5882 54.8386 35.3049 174.5491 157 C 5.3186 8.6072 119.6486 55.1819 44.3673 172.8897 158 L 5.0173 8.5185 122.1479 53.7507 45.6542 174.4490 159 K 5.1346 8.9259 124.8020 54.9478 33.8909 175.5707 160 A 4.9128 9.3453 125.7400 49.5033 23.1868 173.5480 161 P 5.0871 0.0000 0.0000 61.8426 34.1082 174.9032 162 I 4.5279 8.2571 122.0238 61.1299 38.3208 175.9089 163 L 4.8365 8.7210 127.2458 53.2449 43.5273 176.7060 164 S 4.4317 8.3882 114.6343 57.9573 64.0758 175.1020 165 D 4.4453 8.6692 121.4466 57.4961 40.4683 179.2261 166 S 4.1393 8.0088 114.4630 61.6223 63.2287 176.6643 167 S 4.1235 7.9374 118.9504 61.1467 62.5438 175.7991 168 C 4.3230 8.2379 121.2431 59.8765 42.8419 175.9400 169 K 3.9959 8.3938 120.1979 59.5293 31.3659 179.5529 170 S 4.2663 8.1845 114.5015 60.9712 62.7748 175.9950 171 A 4.0617 7.6229 122.7216 53.4473 19.9004 177.2841 172 Y 4.8812 7.8483 113.7668 55.3465 38.2548 173.7697 173 P 4.5543 0.0000 0.0000 63.7405 31.9607 177.5185 174 G 3.9706 9.0696 109.2565 46.0847 0.0000 173.5888 175 Q 4.5632 8.2949 116.0729 55.2086 30.2626 175.2339 176 I 4.4661 7.8667 119.8261 59.8258 38.5876 175.4060 177 T 4.5550 8.2036 115.5427 59.6751 70.8998 175.1494 178 S 4.3970 8.5266 114.5616 60.0539 63.1902 174.2454 179 N 4.9743 8.1319 118.6401 53.4177 38.5151 173.8478 180 M 5.6284 7.7935 117.1370 53.9475 36.2808 174.5283 181 F 5.0775 8.6943 114.2765 56.0871 41.9257 172.4751 182 C 5.8245 9.2929 116.5914 55.0537 42.5011 172.6058 183 A 5.0373 8.7656 121.9240 50.8719 22.3170 176.4601 184 G 4.0312 6.8293 107.7097 44.8655 0.0000 171.9614 184A Y 4.6554 8.2711 119.0198 56.0662 40.9527 176.4747 185 L 4.1533 8.6307 125.3129 57.1276 42.0633 178.7871 186 E 4.1534 8.1951 115.4070 57.2260 29.9680 177.1783 187 G 3.8367 7.5047 106.2030 45.0807 0.0000 171.8987 188 G 4.1380 9.5689 105.3168 44.7081 0.0000 173.7616 188A K 5.4918 7.1651 116.8557 53.7262 35.7258 175.3595 189 D 4.6138 8.3984 122.5949 54.0868 44.8093 174.5051 190 S 4.9493 8.7398 116.3702 57.8449 65.4895 172.9863 191 C 4.7360 9.2324 118.7692 55.4631 45.0156 172.1349 192 Q 4.4061 8.5890 121.2077 57.6850 28.8668 176.8428 193 G 4.3770 9.2361 112.7837 45.9412 0.0000 174.1436 194 D 4.7020 8.4681 118.6598 55.2875 41.7550 176.7702 195 S 4.4656 8.0945 115.1807 60.5170 63.5479 175.4648 196 G 3.9343 8.8720 112.5856 46.4115 0.0000 173.7539 197 G 4.5181 7.8599 107.5538 44.8263 0.0000 171.1456 198 P 5.1562 0.0000 0.0000 62.3162 33.6054 175.8248 199 V 4.5691 8.4016 120.9161 61.4893 34.3916 173.9808 200 V 4.9084 8.7042 128.6272 61.2350 34.2396 173.7039 201 C 5.0968 8.8665 124.4898 55.7217 44.0131 174.5863 202 S 3.7283 9.7564 120.2821 59.7298 60.1268 173.0427 203 G 3.9318 8.3402 103.2228 45.9006 0.0000 173.7109 204 K 4.6738 7.6263 117.6359 52.8983 35.3305 175.5458 *209 L 4.3144 8.2850 122.6939 55.4481 42.1972 175.8490 210 Q 4.4869 8.8100 126.0041 56.7399 30.8104 175.7986 211 G 5.2488 8.0135 104.4511 45.6927 0.0000 171.3454 212 I 5.0640 8.1583 119.1501 58.9310 41.2469 175.4380 213 V 3.7718 8.8993 127.3670 63.7968 31.8103 174.1299 214 S 4.8308 8.4693 120.8460 58.6484 64.4047 174.2896 215 W 5.0419 7.4057 113.9592 56.0713 31.9608 172.3690 216 G 3.9462 8.3932 105.9466 46.6811 0.0000 173.5033 217 S 4.7281 8.2867 117.0061 56.8593 63.2441 173.6385 *219 G 4.2024 8.0002 116.2114 45.5779 0.0000 170.9529 220 C 4.9492 8.2515 116.0256 56.6516 45.6011 173.7737 221 A 3.9970 9.1414 126.1241 53.1901 16.5883 177.0629 221A Q 4.6352 7.2800 117.3278 55.9421 30.1007 175.8943 222 K 4.1223 8.4071 121.3407 57.9599 32.7101 176.0934 223 N 4.2486 9.1500 121.4754 54.0505 37.1049 175.3168 224 K 4.3298 7.4708 116.8493 53.6080 32.1572 173.5526 225 P 4.5803 0.0000 0.0000 62.4210 33.0754 177.3038 226 G 3.7533 8.4500 106.1938 45.7495 0.0000 172.8351 227 V 4.4432 7.5054 121.0465 60.7048 34.2385 174.1220 228 Y 4.8997 8.1188 124.0980 56.0782 42.1851 174.8277 229 T 4.5422 8.5339 119.1390 63.3888 70.1473 174.5591 230 K 5.0575 9.2282 127.9971 55.4535 31.6175 177.3010 231 V 3.9440 8.8662 126.9903 65.8765 31.3871 174.8994 232 C 4.4282 8.4040 112.7351 58.4486 41.3411 174.9549 233 N 4.2355 7.9231 116.7229 54.4681 38.5552 175.0690 234 Y 4.8068 8.0632 117.5492 57.5054 39.2753 177.5248 235 V 3.6954 8.0825 121.2765 66.4368 31.4782 178.0604 236 S 4.1300 8.1138 114.2910 61.1079 62.6282 176.3322 237 W 4.1221 8.2430 130.6402 60.5107 30.5720 177.8469 238 I 3.1529 8.3687 120.0792 64.2270 36.6085 178.4851 239 K 3.7438 8.1316 119.3751 59.6667 31.8459 179.4989 240 Q 3.9004 8.2382 118.5196 59.0947 28.3716 178.8907 241 T 3.5579 7.3899 116.1805 66.4940 68.7569 176.5515 242 I 2.8411 7.2126 121.4869 63.9290 36.7714 178.4159 243 A 4.0384 7.6924 120.6438 54.1035 18.1871 178.7303 244 S 4.6324 7.3008 109.9982 58.2704 63.5563 174.0862 245 N 4.6886 7.8602 125.1469 53.8385 39.1666 174.0311 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 4.30 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 1.48 0.72 0.90 0.00 0.00 17 V 8.59 4.42 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 8.46 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 7.80 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.88 4.97 0.00 2.91 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 21 T 8.60 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 1.26 0.00 0.00 22 C 8.67 4.31 0.00 2.76 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 23 G 8.64 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.65 3.94 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 8.85 4.24 0.00 2.85 2.90 0.00 0.00 7.31 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 7.55 4.24 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 7.02 4.07 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 0.36 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.52 0.00 2.38 2.39 0.00 3.77 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 2.17 1.95 0.00 29 Y 6.66 5.01 0.00 3.18 3.39 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 30 Q 7.31 4.63 0.00 1.82 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.53 0.00 0.00 0.00 0.00 0.00 1.94 2.49 0.00 31 V 8.87 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 0.84 0.00 0.00 0.97 0.00 0.00 32 S 8.78 4.94 0.00 3.08 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.46 4.62 0.00 0.54 0.88 0.81 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.94 5.84 0.00 2.37 2.41 0.00 0.00 6.52 7.86 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 *37 S 8.47 4.40 0.00 3.85 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.71 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 39 Y 6.76 4.50 0.00 3.04 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 40 H 8.80 4.67 0.00 2.85 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.62 5.02 0.00 3.05 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 42 C 6.86 4.80 0.00 2.39 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 43 G 8.44 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 44 G 7.86 4.58 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 0.00 0.00 0.00 45 S 8.69 5.54 0.00 3.82 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 9.20 4.71 0.00 1.86 1.67 1.08 1.09 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 8.47 4.51 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 7.48 4.67 0.00 2.99 3.00 0.00 0.00 6.15 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 49 S 8.56 3.99 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 9.12 4.57 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.95 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 51 W 8.32 5.55 0.00 3.16 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 52 V 9.14 5.21 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 1.08 0.00 0.00 0.98 0.00 0.00 53 V 8.73 4.97 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 0.73 0.00 0.00 1.02 0.00 0.00 54 S 9.01 5.10 0.00 3.89 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 55 A 8.51 4.75 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.28 3.83 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 8.32 4.54 0.00 3.35 3.54 0.00 5.55 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 58 C 7.81 4.73 0.00 3.22 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 59 Y 7.77 4.12 0.00 3.00 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 60 K 6.60 3.70 0.00 1.50 1.35 0.00 0.81 0.00 0.00 1.31 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.69 0.96 7.81 61 S 8.14 4.39 0.00 3.93 3.84 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 62 G 8.34 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 0.00 0.00 0.00 63 I 7.45 4.37 1.84 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 1.39 0.67 0.90 0.00 0.00 64 Q 8.76 4.76 0.00 1.99 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.89 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 65 V 8.95 4.39 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 0.93 0.00 0.00 0.89 0.00 0.00 65A R 8.89 5.03 0.00 1.50 1.69 0.00 2.65 0.00 0.00 2.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.12 0.00 66 L 9.09 4.70 0.00 1.62 1.62 0.95 0.61 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 3.84 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 0.00 0.00 0.00 70 E 8.43 4.66 0.00 2.10 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 2.50 2.08 0.00 71 D 7.76 4.75 0.00 2.72 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 72 N 8.80 4.85 0.00 2.85 2.81 0.00 0.00 7.22 7.92 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 73 I 8.37 3.88 1.41 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.52 -0.54 0.00 0.00 74 N 8.56 4.77 0.00 2.82 2.88 0.00 0.00 6.63 8.28 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 75 V 7.37 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 4.11 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 9.09 4.41 0.00 1.99 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 2.27 2.44 0.00 78 G 8.40 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 79 N 8.97 4.62 0.00 2.90 3.18 0.00 0.00 6.93 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 7.59 4.53 0.00 1.54 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 0.00 2.68 2.45 0.00 81 Q 9.00 4.43 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.93 5.55 0.00 2.76 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 83 I 8.81 4.72 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 0.84 0.95 0.00 0.00 84 S 8.60 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 8.24 4.41 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 9.14 4.46 0.00 3.80 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 4.67 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 2.76 0.00 0.00 0.00 0.00 1.31 1.36 7.81 88 S 8.79 5.22 0.00 4.11 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 4.47 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.19 1.10 0.00 0.00 90 V 8.29 4.20 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 0.72 0.00 0.00 91 H 8.56 3.92 0.00 2.83 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.72 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 4.31 0.00 2.06 2.13 0.00 3.12 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 93 S 7.90 4.69 0.00 3.92 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 94 Y 8.06 4.31 0.00 2.92 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.16 4.50 0.00 2.59 2.44 0.00 0.00 6.60 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 96 S 7.86 4.01 0.00 3.95 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.54 4.46 0.00 2.69 2.79 0.00 0.00 6.75 7.43 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 98 T 7.77 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 1.16 0.00 0.00 99 L 7.80 3.82 0.00 1.60 1.94 0.77 0.97 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 0.00 100 N 7.73 4.48 0.00 2.77 2.65 0.00 0.00 7.27 7.93 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 0.00 101 N 8.66 4.73 0.00 2.94 2.61 0.00 0.00 7.22 8.25 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 0.00 102 D 7.91 4.72 0.00 3.08 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 0.00 103 I 7.16 4.81 1.44 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.19 0.10 0.00 0.00 104 M 9.13 5.41 0.00 2.25 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 2.76 2.64 0.00 105 L 9.08 5.40 0.00 1.81 1.83 0.22 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.19 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 0.92 0.88 0.00 0.00 107 K 8.76 3.81 0.00 0.79 1.11 0.00 1.28 0.00 0.00 1.33 0.00 0.00 2.58 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.63 0.21 7.81 108 L 8.12 4.65 0.00 1.46 1.55 0.96 0.75 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 0.00 109 K 8.88 4.15 0.00 1.78 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.73 4.68 0.00 3.93 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 0.00 111 A 8.31 4.45 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 8.71 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 8.91 4.56 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 8.51 4.65 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 1.66 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.86 4.71 0.00 2.86 2.89 0.00 0.00 6.77 7.69 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 0.00 116 S 8.75 4.36 0.00 4.01 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 8.85 4.21 0.00 2.03 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 4.91 0.00 4.00 3.94 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 0.00 128 C 8.41 4.46 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 4.53 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 8.02 4.42 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 8.16 4.28 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 9.11 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.59 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 4.84 0.00 2.03 1.99 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 2.31 2.46 0.00 136 C 9.29 5.28 0.00 2.79 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 0.00 137 L 8.95 5.22 0.00 1.76 1.56 1.04 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.02 5.34 1.87 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 0.75 1.81 1.01 0.00 0.00 139 S 9.02 4.94 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 7.30 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 0.00 141 W 8.39 4.90 0.00 3.18 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 8.12 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.67 3.89 0.00 2.24 2.64 0.00 0.00 7.01 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.10 5.13 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 145 K 7.81 4.64 0.00 1.82 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.64 4.40 0.00 4.00 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 8.17 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 7.61 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 0.00 149 T 8.09 4.61 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 1.25 0.00 0.00 150 S 9.48 4.38 0.00 3.76 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 8.62 5.02 0.00 2.96 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 0.00 152 P 0.00 4.72 0.00 2.46 2.12 0.00 4.18 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.05 0.00 153 D 8.73 4.64 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 5.72 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 0.70 0.00 0.00 0.97 0.00 0.00 155 L 8.32 3.20 0.00 1.45 1.27 -0.82 0.20 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 4.93 0.00 1.70 1.50 0.00 1.61 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 1.41 1.47 7.81 157 C 8.61 5.32 0.00 1.58 2.19 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 0.00 158 L 8.52 5.02 0.00 1.71 1.44 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.93 5.13 0.00 1.81 1.81 0.00 1.88 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.65 7.81 160 A 9.35 4.91 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.09 0.00 2.02 2.25 0.00 3.16 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.75 0.00 162 I 8.26 4.53 1.74 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 1.05 0.52 0.79 0.00 0.00 163 L 8.72 4.84 0.00 1.55 1.61 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.39 4.43 0.00 4.00 3.98 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 0.00 165 D 8.67 4.45 0.00 2.76 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 8.01 4.14 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 7.94 4.12 0.00 3.85 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 8.24 4.32 0.00 3.20 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 8.39 4.00 0.00 1.97 1.90 0.00 1.85 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 1.62 7.81 170 S 8.18 4.27 0.00 4.02 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 0.00 171 A 7.62 4.06 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 3.13 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 0.00 173 P 0.00 4.55 0.00 2.21 2.12 0.00 3.59 0.00 0.00 4.49 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 9.07 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 8.29 4.56 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 176 I 7.87 4.47 1.98 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 1.88 0.98 1.00 0.00 0.00 177 T 8.20 4.56 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 1.27 0.00 0.00 178 S 8.53 4.40 0.00 4.00 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 4.97 0.00 3.03 3.08 0.00 0.00 6.64 9.06 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 0.00 180 M 7.79 5.63 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 2.58 0.00 181 F 8.69 5.08 0.00 2.98 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 0.00 182 C 9.29 5.82 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 8.77 5.04 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 0.00 184 G 6.83 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 184A Y 8.27 4.66 0.00 2.98 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 0.00 185 L 8.63 4.15 0.00 1.73 1.73 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 2.12 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 2.33 2.27 0.00 187 G 7.50 3.84 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 0.00 0.00 0.00 188 G 9.57 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 188A K 7.17 5.49 0.00 1.43 1.63 0.00 0.91 0.00 0.00 2.05 0.00 0.00 2.43 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.19 0.96 7.81 189 D 8.40 4.61 0.00 2.78 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 0.00 190 S 8.74 4.95 0.00 4.00 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 4.74 0.00 2.94 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.59 4.41 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 5.57 0.00 0.00 0.00 0.00 0.00 2.70 2.63 0.00 193 G 9.24 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.47 4.70 0.00 2.94 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 8.09 4.47 0.00 3.98 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 0.00 196 G 8.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.86 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.16 0.00 2.30 2.33 0.00 3.70 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 2.24 0.00 199 V 8.40 4.57 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 0.83 0.00 0.00 0.70 0.00 0.00 200 V 8.70 4.91 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 0.86 0.00 0.00 0.63 0.00 0.00 201 C 8.87 5.10 0.00 2.78 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 9.76 3.73 0.00 3.93 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 8.34 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.63 4.67 0.00 1.71 1.63 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.28 4.31 0.00 1.50 1.63 1.00 0.75 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 8.81 4.49 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.33 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 211 G 8.01 5.25 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 0.00 212 I 8.16 5.06 1.91 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 0.87 1.00 0.00 0.00 213 V 8.90 3.77 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.19 0.00 0.00 214 S 8.47 4.83 0.00 3.88 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 0.00 215 W 7.41 5.04 0.00 3.39 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 0.00 216 G 8.39 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 0.00 217 S 8.29 4.73 0.00 4.09 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 *219 G 8.00 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 0.00 0.00 0.00 0.00 220 C 8.25 4.95 0.00 2.95 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 0.00 221 A 9.14 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.28 4.64 0.00 2.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 222 K 8.41 4.12 0.00 1.72 1.71 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.57 7.81 223 N 9.15 4.25 0.00 2.80 2.80 0.00 0.00 6.77 7.63 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 0.00 224 K 7.47 4.33 0.00 1.67 1.81 0.00 1.64 0.00 0.00 1.35 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.49 7.81 225 P 0.00 4.58 0.00 2.14 2.12 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 226 G 8.45 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 0.00 0.00 0.00 227 V 7.51 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 0.42 0.00 0.00 -0.77 0.00 0.00 228 Y 8.12 4.90 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.53 4.54 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 1.24 0.00 0.00 230 K 9.23 5.06 0.00 2.11 1.91 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.62 7.81 231 V 8.87 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 1.11 0.00 0.00 1.12 0.00 0.00 232 C 8.40 4.43 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 7.92 4.24 0.00 2.35 2.40 0.00 0.00 6.94 8.68 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 0.00 234 Y 8.06 4.81 0.00 3.09 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 0.00 235 V 8.08 3.70 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 8.11 4.13 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 8.24 4.12 0.00 3.50 3.67 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 0.00 238 I 8.37 3.15 2.02 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.97 0.75 0.00 0.00 239 K 8.13 3.74 0.00 1.84 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.61 7.81 240 Q 8.24 3.90 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 241 T 7.39 3.56 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 242 I 7.21 2.84 1.42 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.21 0.41 0.00 0.00 243 A 7.69 4.04 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 0.00 244 S 7.30 4.63 0.00 3.99 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 7.86 4.69 0.00 3.07 3.07 0.00 0.00 6.76 7.17 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 * Residues marked with a * may have inaccurate shift predictions.