NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6459 8.3049 118.3386 55.3150 32.9924 174.1595 2 D 5.0792 8.5109 119.1447 50.8804 44.2955 170.3611 3 V 5.0090 8.5730 121.9545 60.3460 35.2656 173.7914 4 A 4.7366 9.0698 123.5638 50.5019 22.7664 175.3080 5 G 4.1275 8.4851 106.7178 44.5426 0.0000 171.6806 6 L 4.6062 7.8216 122.4295 53.8023 45.9201 174.0609 7 T 5.1133 8.5370 119.3558 60.5974 70.9829 172.2445 8 D 4.7305 8.8697 124.9215 52.9636 44.2248 175.9624 9 C 4.2095 8.9647 125.5060 60.6615 32.0755 174.0074 10 G 4.0421 8.8143 106.5306 44.6159 0.0000 172.3022 11 L 4.3965 8.4017 117.1211 55.4254 42.4960 177.5538 12 I 4.2689 7.6755 117.0420 62.7902 38.7833 176.5345 13 R 4.0980 7.8001 117.3819 56.4223 30.4536 177.1239 14 K 4.2064 8.5981 120.5965 58.6951 32.5324 177.3729 15 S 4.6196 7.6083 110.3263 56.4798 66.0671 172.5187 16 N 4.9788 8.5429 119.1698 51.9745 39.1963 174.1961 17 Q 4.6317 8.5242 123.5127 55.8838 29.9236 175.2979 18 D 5.0303 8.6409 120.1673 54.3362 42.5109 175.2050 19 A 4.9428 9.1565 121.9412 51.1071 23.2145 174.9312 20 F 5.4998 8.2956 112.8210 56.1819 41.3850 172.9843 21 Y 4.7078 9.4394 120.0996 56.1517 42.4539 173.4875 22 I 4.4276 7.2210 126.1030 59.2790 40.1425 175.9939 23 D 4.1103 7.6813 126.7739 53.7127 39.0540 176.2227 24 E 3.9201 7.9621 124.6257 58.3266 30.2616 178.8252 25 K 3.9679 8.1369 119.1865 59.3225 32.2643 177.0668 26 H 4.8243 8.1007 111.2851 54.4983 30.2122 173.6530 27 Q 3.4834 7.8707 117.4619 57.0030 26.9615 174.8396 28 R 4.6048 8.3648 118.1682 57.7207 32.0650 176.9426 29 F 5.8591 6.5471 111.6409 55.6400 41.7446 173.4865 30 F 5.4555 8.8413 117.0846 56.4812 43.6996 173.5002 31 I 5.3766 9.2830 122.7078 59.9056 41.6877 174.3504 32 V 5.1188 9.1588 125.5416 61.1989 35.1176 174.0299 33 A 5.1696 9.3083 127.7584 49.2484 23.1084 174.5497 34 D 5.1725 8.5613 120.9924 51.2923 43.3475 175.7598 35 G 4.3274 8.8269 113.9266 45.6833 0.0000 172.3395 36 M 4.6732 8.4548 115.9194 53.4876 31.0261 176.1849 *41 G 3.9406 7.6653 108.4693 46.3460 0.0000 173.1246 42 G 3.8100 7.6998 109.6794 47.2996 0.0000 172.8314 43 E 3.9977 8.1250 121.3030 58.9467 29.6919 178.2127 44 E 3.8750 8.1563 118.7475 59.1544 29.7115 178.4099 45 A 3.9876 7.8645 120.6286 55.3543 18.5201 179.8439 46 S 4.1453 8.1021 114.0664 60.9742 62.9959 176.6592 47 R 3.8851 8.0254 122.3400 59.1025 29.7490 178.4522 48 L 3.9816 8.3384 119.0383 57.6288 41.5482 179.2216 49 A 3.8870 8.1924 120.8625 55.1829 18.3270 179.7872 50 V 3.4993 7.8051 116.4158 66.3020 31.5755 177.8580 51 D 4.2179 8.1425 118.5751 57.8388 40.6263 178.7137 52 H 4.1298 8.4371 116.7915 58.7089 28.6407 178.0019 53 I 3.5929 7.9051 121.8874 64.1212 36.8060 178.2724 54 R 3.7196 7.9720 119.5605 59.7429 29.9188 178.6434 55 Q 4.0602 8.1812 117.8791 58.9027 28.6579 178.1657 56 Y 3.8071 8.1642 120.6877 60.6454 38.8394 178.1082 57 L 3.9104 7.9852 120.0109 57.7270 41.3825 179.1969 58 E 4.0268 7.9829 117.6173 60.0285 29.5255 179.4353 59 T 3.9204 7.6625 114.2348 65.8610 68.8357 175.6682 60 H 4.6596 7.8583 115.3582 55.0024 29.7388 175.8723 61 L 3.9883 8.1151 126.3848 58.8895 41.6605 179.1553 62 E 3.9755 8.0738 116.0249 61.5881 29.7837 180.3604 63 D 4.7796 8.0540 118.0128 55.8892 41.3365 177.0404 64 L 4.6040 7.8442 116.7900 53.9897 43.0457 177.9711 65 Q 4.2602 8.1033 117.7680 58.4465 28.5200 177.1658 66 H 4.4663 8.0095 113.2111 57.1286 29.6920 174.9171 67 D 4.6554 7.8914 120.3982 50.8119 40.8208 173.7251 68 P 3.9648 0.0000 0.0000 65.2523 31.3574 178.8847 69 V 3.2996 6.9356 117.4571 66.1030 31.4858 177.9913 70 T 3.7564 7.6139 115.5976 66.3274 68.2281 176.3257 71 L 3.9758 7.7642 122.2074 58.3177 42.0624 179.1701 72 L 4.0702 8.0911 119.0997 57.7637 41.4749 179.6328 73 R 3.8046 8.1118 118.2603 59.4924 29.9843 179.2118 74 Q 3.7326 8.1860 117.5931 58.5284 28.6161 178.6547 75 A 3.2484 7.7335 121.8231 55.0060 18.3780 179.7125 76 F 3.8109 8.5269 116.4624 60.6658 38.8658 177.9877 77 L 3.9397 8.2305 118.6022 57.4846 41.3586 179.3681 78 A 3.9259 7.9912 120.7289 55.0456 18.3167 179.5744 79 A 3.8068 7.7903 119.1918 55.1365 18.4455 179.1349 80 N 4.1319 8.3147 115.9420 57.4010 38.9150 176.7419 81 H 4.1344 8.3925 117.3887 58.7663 28.5813 177.6185 82 A 3.9310 7.9572 122.5754 55.1892 18.1184 179.8535 83 I 3.6700 7.7467 118.2814 64.5182 37.2322 178.8000 84 V 3.8679 7.8025 120.4490 65.4996 31.2256 177.8710 85 E 3.9947 8.5583 118.7557 59.5929 29.0708 179.3677 86 Q 4.0174 7.6708 117.0308 58.5458 28.6995 178.2101 87 Q 4.1598 8.1930 119.4016 59.1514 28.5781 179.1984 88 R 4.1120 7.9199 119.9296 59.6878 30.1335 178.8454 *89 Q 4.8379 8.0833 120.9012 56.6836 27.8763 178.4625 *90 N 4.6598 7.9437 118.7357 53.2664 40.0973 179.0507 *91 S 4.3692 8.8185 122.1928 60.3171 62.8258 173.6886 92 A 4.2054 8.1249 122.6308 55.2457 18.3718 179.5602 93 R 4.4818 7.2723 112.1161 56.3402 30.5346 178.9149 94 A 4.0165 8.2310 124.5128 55.0227 18.8056 179.4685 95 D 4.9942 7.8546 112.8490 52.7847 40.9948 180.8497 96 M 4.4538 7.5321 117.6982 57.1916 31.8008 175.7081 97 G 4.2699 8.7054 106.2076 46.2094 0.0000 171.3948 98 T 5.2528 8.5172 113.5554 60.8488 71.0291 173.1725 99 T 4.6933 8.8347 117.1921 61.5861 71.0302 173.0104 100 A 5.0624 9.1143 122.4610 50.7299 23.1539 175.6643 101 V 5.1116 9.2016 114.0528 59.6672 35.7310 175.0696 102 V 5.1570 9.4079 124.1232 61.3392 35.4278 173.8932 103 I 5.2019 9.0803 127.7575 59.5292 40.1796 174.0854 104 L 5.4179 9.1841 129.0727 53.3851 44.2891 175.1593 105 L 5.1999 9.3763 127.5260 53.8855 42.7927 176.5971 106 D 4.7499 8.8031 123.0858 53.2939 40.0912 176.4637 107 E 4.1607 9.0840 118.1320 59.6078 29.5409 178.8720 108 K 3.9230 8.1387 117.8710 58.1489 32.2263 177.5043 109 G 4.1085 9.5603 105.8781 45.0050 0.0000 173.0040 110 D 5.0121 8.1338 118.1102 52.7577 41.1473 175.2538 111 R 5.0056 8.1301 118.6835 54.9410 33.8110 173.3382 112 A 5.2249 8.8595 128.2157 49.9578 21.5115 175.3040 113 W 4.6358 9.5450 124.1840 56.6833 30.7529 175.3374 114 C 5.3639 9.4875 123.1631 57.9757 30.2185 172.8603 115 A 5.3609 9.2304 125.7469 50.5211 22.0048 174.3500 116 H 5.4900 8.8001 115.6294 54.7452 32.7601 172.8376 117 V 4.3204 9.4123 119.3107 62.8536 34.5393 172.8571 118 G 4.0495 9.0847 114.2466 44.4617 0.0000 174.1878 119 D 5.1203 8.6172 124.4710 53.1303 40.1893 176.2623 120 S 4.6086 7.9103 115.8554 58.9894 64.4255 173.2190 121 R 4.7989 9.0442 120.6459 54.4798 34.3432 174.3876 122 I 5.0701 8.1686 121.4947 59.9255 40.0667 174.5497 123 Y 5.2096 9.1512 123.5772 56.1386 42.0072 174.4460 124 R 5.2229 9.1646 121.5895 54.3891 33.4101 173.9571 125 W 5.2636 9.3257 135.0000 55.8704 34.0817 174.4694 126 R 4.0063 8.2420 125.3614 55.6502 33.2274 174.9639 127 K 3.5764 8.3715 127.1795 57.6632 29.4340 174.6518 128 D 4.6569 6.0500 112.1255 54.7416 39.0758 174.2756 129 Q 4.5691 7.0343 118.2988 53.6922 31.5095 174.0448 130 L 5.2388 8.3677 122.8213 53.2827 44.9100 175.0681 131 Q 4.6992 9.2292 127.2123 54.1559 32.0875 173.8746 132 Q 3.7621 8.8015 128.0612 56.2529 29.2005 175.2419 133 I 4.1377 8.4739 128.5332 63.8150 37.9455 176.9388 134 T 4.0920 7.5518 110.2068 60.9145 69.7502 173.8195 135 S 4.5901 8.1735 119.5976 56.5417 64.2738 174.0581 136 D 4.4914 8.6069 125.4241 55.4023 41.4328 177.4890 137 H 4.6129 8.7715 122.9217 54.6717 27.5204 174.2858 138 T 4.7928 7.1537 112.2174 58.7197 73.4453 174.9409 139 W 4.4071 7.8306 122.0614 60.1723 29.1927 179.0591 140 I 3.7768 7.9404 119.0202 64.4437 36.6680 178.2374 141 A 4.0651 8.1826 121.5759 55.1331 18.0723 179.6370 142 Q 3.9883 8.1421 116.3273 58.9233 28.5093 178.9462 143 A 3.9947 7.6062 120.5490 55.2217 18.5962 179.2534 144 V 4.5752 7.4359 118.5709 66.9712 31.5865 178.3006 *145 Q 4.1864 8.2598 121.6338 58.7306 29.3027 179.9834 *146 L 4.8496 9.7404 126.9352 54.1132 39.0052 178.8748 147 G 3.7855 7.7678 113.6716 45.8234 0.0000 171.4279 *148 S 4.4729 8.5374 124.1281 57.7642 62.9078 171.0600 149 L 5.3828 7.8403 135.0000 53.5402 43.7186 170.3615 150 T 4.5338 7.8302 124.0227 62.5259 69.5488 176.7962 151 I 3.8566 8.4513 126.8004 65.8124 35.0387 179.7346 *152 E 4.1669 8.1457 117.1353 61.6007 29.9788 183.3140 153 Q 4.4178 7.9483 116.9494 57.5569 29.2056 177.8395 154 A 4.0737 8.2677 126.2391 55.9444 18.3141 180.1749 *155 R 4.0554 8.0607 119.3771 60.8808 29.5534 179.5489 156 Q 4.7425 7.1865 112.9949 55.6599 30.1876 181.1999 157 H 4.2523 8.0317 117.9175 56.0387 30.3874 174.5086 158 P 4.2872 0.0000 0.0000 65.1934 31.5347 176.9583 159 W 5.1082 8.3818 117.4968 56.9835 29.3349 178.2108 160 R 3.8083 7.6589 121.2621 59.6451 29.5840 177.1373 161 H 4.9389 8.1380 111.5092 55.2379 28.9944 174.4241 162 V 3.9287 8.0205 121.4031 61.2853 31.8178 175.6149 163 L 4.2870 8.4488 125.1191 54.3739 42.2532 176.9526 164 S 3.3110 8.0050 116.5840 58.2804 63.7579 174.3969 165 Q 4.4941 7.3654 119.2079 54.6089 32.4877 173.4254 166 C 4.7738 8.0851 114.9168 56.5902 32.7387 173.6736 167 L 4.0992 8.7696 122.0642 56.2166 41.7083 177.9759 168 G 3.9798 9.1056 111.2003 45.6649 0.0000 173.3297 169 R 4.5734 8.0213 120.1983 54.2329 33.2228 177.0416 170 E 3.9574 9.2151 121.4485 59.2953 29.7798 174.8380 *171 D 4.9275 7.7280 115.5545 52.5916 40.4222 178.9722 172 L 3.9716 7.8296 125.8022 57.2440 42.2201 177.0747 *173 S 4.5473 8.3614 122.0489 58.3155 64.5505 170.4279 174 Q 4.3944 8.0215 121.2631 54.1364 29.8061 174.6171 175 I 4.1351 7.9608 126.4406 59.2187 38.6935 174.7894 176 D 4.5846 8.2609 127.0015 54.0751 41.7562 175.9464 177 I 5.3543 8.2790 123.9725 59.5610 40.6795 174.7597 178 Q 4.8486 9.2471 124.2610 54.1581 32.2302 172.0562 179 P 4.5286 0.0000 0.0000 61.7091 33.0290 175.0244 180 I 4.5415 8.1741 114.8827 59.2171 40.7405 174.2953 181 D 4.9718 8.6753 125.2088 54.0584 41.7423 175.5701 182 L 5.0429 8.8430 121.7456 53.0665 44.8508 175.9268 183 E 4.7522 9.3177 121.3646 53.4434 32.4308 174.0954 184 P 4.5732 0.0000 0.0000 64.6822 31.7212 177.0811 185 G 4.0853 9.1453 111.8275 45.0948 0.0000 173.6177 186 D 4.9129 8.0823 119.8654 54.7480 42.2567 175.6503 187 R 5.2097 9.3922 120.0091 54.4966 33.8242 174.7476 188 L 5.2631 9.0272 122.1237 52.8599 45.2114 175.2007 189 L 5.1521 8.8200 124.2149 53.3396 45.1183 174.8273 190 L 5.3316 8.9443 126.9810 53.3969 43.9709 175.3781 191 C 5.3806 9.0093 117.3823 56.7723 33.5866 173.7003 192 S 4.9595 9.0365 115.2739 57.0610 64.3773 174.9909 193 A 4.5627 8.2217 123.1710 53.4907 17.8916 179.8708 194 G 4.1554 7.9964 104.9532 46.7364 0.0000 175.3816 195 L 4.1323 8.0804 122.8627 58.2312 42.2303 178.6807 196 T 4.3469 7.8136 108.0114 63.6508 69.0004 176.1481 197 E 4.1517 8.3266 121.0244 58.4363 29.5359 177.2166 198 E 4.4161 7.9863 116.8882 56.7650 31.0773 176.0718 199 L 4.5926 7.9293 118.9293 52.6474 43.6497 177.2398 200 T 4.1729 8.1979 114.0717 61.3715 70.8587 175.0176 201 D 4.2745 8.6504 121.5294 57.7560 40.5701 178.7633 202 D 4.3741 8.1269 118.7310 57.4268 40.9495 179.0579 203 V 3.5163 7.6039 117.9930 66.0334 31.6257 177.8086 204 I 3.7191 7.7900 119.6892 64.7967 36.7523 178.1955 205 S 4.2975 8.1680 112.5708 61.4507 62.4453 176.1075 206 I 3.8221 7.4284 122.2643 64.6721 36.9677 178.0804 207 Y 4.1586 7.5148 116.9725 60.8924 37.4351 178.3430 208 L 3.8196 7.6572 118.7508 56.4204 41.6911 178.6220 209 S 3.6659 7.2547 112.9727 57.9346 63.4339 173.7956 210 E 3.9346 7.1591 124.4640 55.5230 29.5108 174.4079 211 P 4.1555 0.0000 0.0000 65.2967 31.7284 176.5093 212 N 4.6074 8.2106 117.2113 52.4215 39.4100 175.9392 213 V 3.5686 8.2527 122.6363 64.4518 31.6879 178.4648 214 Q 3.9352 8.0870 117.4644 58.9274 28.5342 178.8667 215 K 3.9505 8.4225 119.2747 59.2054 32.0737 179.3437 216 A 3.8944 8.2610 121.3236 54.9866 18.2873 179.5775 217 A 3.7773 8.1723 119.3042 55.2442 18.4031 179.6923 218 A 3.8309 7.8811 119.1054 55.2772 18.3303 179.7702 219 A 3.6991 8.0856 119.3900 54.8882 18.3799 179.9318 220 L 3.4060 7.6410 117.5295 57.7132 41.8385 179.8273 221 V 3.5331 7.6098 120.5130 66.6952 31.4257 178.2487 222 D 4.3236 8.2038 120.9051 58.5049 39.5965 180.2662 223 A 4.1796 7.9813 122.4258 54.9186 18.2322 179.6406 224 A 3.9745 7.9344 119.2505 55.0103 18.2899 180.1209 225 K 3.9956 7.8269 116.6720 59.9497 32.0794 179.6000 226 T 3.8724 8.0480 115.1028 66.9298 68.4351 175.5874 227 H 4.5165 8.3238 115.8958 56.6505 29.0027 175.4427 228 G 3.8650 9.1514 117.8343 44.5095 0.0000 173.4644 229 G 4.0736 8.2016 109.7775 46.3222 0.0000 175.2604 230 R 4.2157 8.4413 118.5590 58.0415 30.4084 176.1151 231 D 4.9031 7.5395 115.5140 51.9826 44.9275 174.2816 232 N 4.8452 9.0462 117.9270 53.1035 39.8878 174.7054 233 V 4.6539 9.0730 121.9510 60.3565 35.0216 174.5183 234 T 5.0853 8.6941 119.9982 61.8738 72.7623 173.3491 235 V 4.9465 8.6481 118.1201 59.5315 36.4170 174.5903 236 V 4.6182 8.8215 123.7398 61.0166 34.5506 174.1872 237 V 4.7474 8.8769 127.9879 61.0713 34.2928 174.0383 238 I 4.7302 8.7777 128.6140 59.4434 40.4206 174.1917 239 S 5.0273 9.1632 122.1729 56.4961 64.6664 174.0483 240 V 3.9574 8.9033 126.5895 63.1314 31.4378 175.5030 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 1 M 8.30 4.65 0.00 2.07 2.30 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 2 D 8.51 5.08 0.00 2.55 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.57 5.01 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 0.78 0.00 0.00 0.95 0.00 0.00 4 A 9.07 4.74 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 5 G 8.49 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 0.00 0.00 0.00 6 L 7.82 4.61 0.00 1.59 1.28 0.91 0.44 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 7 T 8.54 5.11 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 1.43 0.00 0.00 8 D 8.87 4.73 0.00 2.70 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.96 4.21 0.00 3.01 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 10 G 8.81 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 11 L 8.40 4.40 0.00 1.72 1.73 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.68 4.27 2.06 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 1.42 0.85 0.92 0.00 0.00 13 R 7.80 4.10 0.00 2.01 2.00 0.00 3.36 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 14 K 8.60 4.21 0.00 1.76 1.87 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.43 7.81 15 S 7.61 4.62 0.00 3.92 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 16 N 8.54 4.98 0.00 2.72 2.80 0.00 0.00 7.25 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 17 Q 8.52 4.63 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 18 D 8.64 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 19 A 9.16 4.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.30 5.50 0.00 3.26 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 21 Y 9.44 4.71 0.00 3.05 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 22 I 7.22 4.43 1.84 0.00 0.00 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 1.50 1.04 1.02 0.00 0.00 23 D 7.68 4.11 0.00 1.58 1.71 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 24 E 7.96 3.92 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.14 0.00 25 K 8.14 3.97 0.00 1.60 1.65 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.02 7.81 26 H 8.10 4.82 0.00 3.34 3.26 0.00 5.86 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 27 Q 7.87 3.48 0.00 2.25 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 28 R 8.36 4.60 0.00 1.94 2.14 0.00 3.37 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 29 F 6.55 5.86 0.00 3.20 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 30 F 8.84 5.46 0.00 3.15 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 31 I 9.28 5.38 2.12 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.16 1.03 0.00 0.00 32 V 9.16 5.12 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 1.12 0.00 0.00 1.03 0.00 0.00 33 A 9.31 5.17 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.56 5.17 0.00 2.81 2.57 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 35 G 8.83 4.33 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 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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 0.00 0.00 57 L 7.99 3.91 0.00 0.69 1.10 0.42 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.98 4.03 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.75 0.00 59 T 7.66 3.92 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 0.79 0.00 0.00 60 H 7.86 4.66 0.00 3.02 3.17 0.00 5.64 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.12 3.99 0.00 2.04 1.69 0.96 0.99 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 62 E 8.07 3.98 0.00 2.11 1.86 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 2.23 1.98 0.00 63 D 8.05 4.78 0.00 2.65 2.78 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 64 L 7.84 4.60 0.00 1.85 1.55 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.11 3.80 0.00 1.88 1.90 0.00 3.05 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 74 Q 8.19 3.73 0.00 2.03 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 75 A 7.73 3.25 1.37 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 76 F 8.53 3.81 0.00 3.21 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 77 L 8.23 3.94 0.00 1.72 1.69 0.87 0.93 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 78 A 7.99 3.93 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 79 A 7.79 3.81 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.31 4.13 0.00 2.85 2.88 0.00 0.00 7.27 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 81 H 8.39 4.13 0.00 3.35 3.29 0.00 5.68 0.00 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0.00 0.00 0.00 0.00 2.29 2.23 0.00 *90 N 7.94 4.66 0.00 2.62 2.70 0.00 0.00 7.19 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *91 S 8.82 4.37 0.00 3.62 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 92 A 8.12 4.21 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 93 R 7.27 4.48 0.00 1.85 1.94 0.00 3.18 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 94 A 8.23 4.02 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 95 D 7.85 4.99 0.00 2.67 2.50 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 96 M 7.53 4.45 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 97 G 8.71 4.27 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 0.00 98 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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 0.00 0.00 0.00 0.00 107 E 9.08 4.16 0.00 2.04 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 2.36 2.51 0.00 108 K 8.14 3.92 0.00 1.74 2.09 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.23 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.68 7.81 109 G 9.56 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 0.00 110 D 8.13 5.01 0.00 2.97 2.87 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 0.00 111 R 8.13 5.01 0.00 1.78 1.76 0.00 3.09 0.00 0.00 2.49 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.37 0.00 112 A 8.86 5.22 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 W 9.54 4.64 0.00 3.51 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 0.00 114 C 9.49 5.36 0.00 2.96 2.87 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 0.00 115 A 9.23 5.36 1.09 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 0.00 0.00 116 H 8.80 5.49 0.00 3.45 3.40 0.00 5.21 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 0.00 117 V 9.41 4.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.06 0.00 0.00 118 G 9.08 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 0.00 119 D 8.62 5.12 0.00 2.82 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 0.00 120 S 7.91 4.61 0.00 3.88 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 0.00 121 R 9.04 4.80 0.00 1.78 1.47 0.00 3.19 0.00 0.00 3.01 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.71 0.00 122 I 8.17 5.07 1.84 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 1.30 0.88 0.99 0.00 0.00 123 Y 9.15 5.21 0.00 2.90 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 9.16 5.22 0.00 1.83 1.76 0.00 3.23 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 125 W 9.33 5.26 0.00 3.34 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 0.00 126 R 8.24 4.01 0.00 1.86 1.48 0.00 3.18 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.52 0.00 127 K 8.37 3.58 0.00 1.85 1.59 0.00 2.03 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.01 7.81 128 D 6.05 4.66 0.00 2.74 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 7.03 4.57 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 130 L 8.37 5.24 0.00 1.75 1.58 1.08 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 9.23 4.70 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 132 Q 8.80 3.76 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.75 0.00 0.00 0.00 0.00 0.00 2.10 1.38 0.00 133 I 8.47 4.14 1.89 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 1.35 0.94 0.87 0.00 0.00 134 T 7.55 4.09 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 1.05 0.00 0.00 135 S 8.17 4.59 0.00 3.84 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 0.00 136 D 8.61 4.49 0.00 2.61 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 0.00 137 H 8.77 4.61 0.00 3.11 3.05 0.00 5.57 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 7.15 4.79 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 0.00 139 W 7.83 4.41 0.00 3.48 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 I 7.94 3.78 1.92 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.31 0.93 0.00 0.00 141 A 8.18 4.07 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 0.00 142 Q 8.14 3.99 0.00 2.47 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 143 A 7.61 3.99 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 V 7.44 4.58 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 0.75 0.00 0.00 1.10 0.00 0.00 *145 Q 8.26 4.19 0.00 2.21 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 *146 L 9.74 4.85 0.00 1.71 1.50 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.77 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 0.00 0.00 0.00 *148 S 8.54 4.47 0.00 3.64 3.69 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 0.00 149 L 7.84 5.38 0.00 1.63 1.63 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 150 T 7.83 4.53 4.54 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 1.24 0.00 0.00 151 I 8.45 3.86 1.87 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 1.50 0.73 0.91 0.00 0.00 *152 E 8.15 4.17 0.00 2.06 1.87 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 2.23 1.94 0.00 153 Q 7.95 4.42 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 154 A 8.27 4.07 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *155 R 8.06 4.06 0.00 1.95 1.86 0.00 3.23 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 156 Q 7.19 4.74 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 157 H 8.03 4.25 0.00 3.37 3.20 0.00 5.56 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 P 0.00 4.29 0.00 1.93 1.99 0.00 3.01 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.47 0.00 159 W 8.38 5.11 0.00 3.57 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 0.00 160 R 7.66 3.81 0.00 2.17 1.98 0.00 3.48 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.90 0.00 161 H 8.14 4.94 0.00 3.25 3.31 0.00 5.75 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.02 3.93 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.15 0.00 0.00 163 L 8.45 4.29 0.00 1.63 1.69 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.00 3.31 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Q 7.37 4.49 0.00 1.81 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 1.97 1.88 0.00 166 C 8.09 4.77 0.00 3.18 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.77 4.10 0.00 1.81 1.60 0.78 1.02 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 0.00 168 G 9.11 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 0.00 0.00 0.00 169 R 8.02 4.57 0.00 1.78 1.78 0.00 3.32 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 170 E 9.22 3.96 0.00 1.98 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 2.23 1.89 0.00 *171 D 7.73 4.93 0.00 2.68 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 0.00 172 L 7.83 3.97 0.00 1.66 1.59 0.98 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8.33 4.15 0.00 2.13 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 2.42 2.49 0.00 198 E 7.99 4.42 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 199 L 7.93 4.59 0.00 1.54 1.55 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 200 T 8.20 4.17 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 1.22 0.00 0.00 201 D 8.65 4.27 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 D 8.13 4.37 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 V 7.60 3.52 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.93 0.00 0.00 204 I 7.79 3.72 1.82 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.82 0.65 0.00 0.00 205 S 8.17 4.30 0.00 4.02 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 0.00 206 I 7.43 3.82 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.79 0.63 0.00 0.00 207 Y 7.51 4.16 0.00 2.96 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 L 7.66 3.82 0.00 1.10 0.77 0.85 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 209 S 7.25 3.67 0.00 4.19 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 0.00 210 E 7.16 3.93 0.00 1.93 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 2.29 2.42 0.00 211 P 0.00 4.16 0.00 2.05 2.10 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 212 N 8.21 4.61 0.00 2.76 2.79 0.00 0.00 7.17 7.38 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 0.00 213 V 8.25 3.57 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 0.71 0.00 0.00 0.86 0.00 0.00 214 Q 8.09 3.94 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 215 K 8.42 3.95 0.00 2.04 1.82 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.33 7.81 216 A 8.26 3.89 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 0.00 217 A 8.17 3.78 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 A 7.88 3.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 A 8.09 3.70 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 0.00 220 L 7.64 3.41 0.00 1.71 1.57 0.81 0.58 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 0.00 221 V 7.61 3.53 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.88 0.00 0.00 222 D 8.20 4.32 0.00 2.70 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 0.00 223 A 7.98 4.18 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 0.00 224 A 7.93 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 K 7.83 4.00 0.00 1.97 1.85 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 226 T 8.05 3.87 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 1.18 0.00 0.00 227 H 8.32 4.52 0.00 3.33 3.49 0.00 5.89 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.15 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 0.00 229 G 8.20 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 R 8.44 4.22 0.00 1.87 2.02 0.00 3.29 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.73 0.00 231 D 7.54 4.90 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 9.05 4.85 0.00 2.70 2.87 0.00 0.00 7.10 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 0.00 233 V 9.07 4.65 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 234 T 8.69 5.09 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 1.21 0.00 0.00 235 V 8.65 4.95 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 0.60 0.00 0.00 0.77 0.00 0.00 236 V 8.82 4.62 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.86 0.00 0.00 237 V 8.88 4.75 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 0.86 0.00 0.00 0.81 0.00 0.00 238 I 8.78 4.73 1.64 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.06 0.69 0.00 0.00 239 S 9.16 5.03 0.00 3.77 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 0.00 240 V 8.90 3.96 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.