NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.0801 8.3149 121.7967 56.1823 33.2462 174.8251 3 I 4.3537 8.1356 127.3112 59.3278 37.9027 173.7481 4 W 4.6920 9.1192 129.4564 55.8998 30.1425 176.9290 5 S 4.4823 9.4325 120.2120 57.9884 63.7860 175.2297 6 K 3.8851 9.2927 122.1255 60.1112 31.7814 178.5713 7 E 3.9977 8.2898 118.7619 59.3794 29.6037 178.4364 8 E 4.1185 8.5043 118.7720 59.3109 29.4276 179.5394 9 V 3.8534 8.3692 118.4912 66.0218 31.6952 178.2360 10 V 3.5892 8.0070 118.0207 66.1565 31.3820 177.6694 11 N 4.3800 8.4624 116.3275 56.3238 38.3470 177.3571 12 K 4.2062 8.2661 122.3060 58.8873 32.2232 178.8174 13 L 3.9234 8.2703 119.6907 58.1558 41.5482 179.2535 14 H 4.1430 8.1781 115.9854 58.8203 28.0843 177.6892 15 E 3.9947 8.2119 120.4250 59.4567 29.3903 179.4962 16 I 3.6990 8.0326 120.1871 64.2697 37.1788 178.3861 17 K 4.2824 8.1211 121.8201 59.1254 31.8252 178.4814 18 N 4.5285 8.1283 115.2725 55.5459 38.5053 176.9445 19 K 4.1716 7.8149 118.8697 58.5744 32.6941 179.1669 20 G 3.5454 8.1688 107.2904 45.5867 0.0000 172.7265 21 Y 4.2328 8.6061 120.5114 58.0109 38.5737 175.4714 22 L 4.8358 9.4719 125.6772 53.5695 43.7863 176.4295 23 S 5.0993 8.7052 117.4955 56.9455 65.7020 173.5246 24 V 4.2116 8.2340 120.4414 60.7383 31.8589 174.0267 25 P 4.4607 0.0000 0.0000 62.9170 31.9083 176.5568 26 T 4.1160 8.6820 118.5304 67.1902 68.4476 176.5544 27 D 4.5430 7.8779 119.2563 54.1661 40.1472 175.7232 *29 F 4.6191 8.0019 120.5687 58.3213 40.1260 175.5554 30 R 4.0311 7.4143 124.5656 55.7634 29.6637 175.0583 31 T 3.3688 5.7900 111.0214 65.4542 65.7529 171.7041 32 D 4.6468 7.2564 119.1949 52.2222 44.2689 175.3212 33 D 4.5726 9.1160 127.2967 57.6026 41.1483 177.8740 34 G 3.8719 8.9723 106.6225 46.0181 0.0000 175.6720 35 V 3.6268 7.8413 121.8899 64.6056 31.1682 178.5627 36 V 2.8173 7.6991 119.5067 64.5861 30.9188 178.5315 37 G 3.5561 8.0382 106.1983 47.3977 0.0000 175.8487 38 Q 3.9886 7.8404 119.8904 58.8091 28.7874 178.7079 39 I 3.7196 7.9465 121.1099 64.2200 37.0120 178.2636 40 L 3.5680 7.8260 121.1513 58.0135 41.8333 178.6905 41 E 3.9460 8.2657 118.6598 59.5430 29.3983 179.2796 42 R 3.9074 7.9596 118.5144 59.7325 29.8916 178.6277 43 Q 4.0023 7.7026 116.2013 58.0938 28.6754 177.6516 44 F 4.3996 7.6084 116.5554 56.0918 39.2113 175.9341 45 G 3.9398 7.8584 106.3730 46.4627 0.0000 174.4696 46 V 3.9509 8.0348 120.7770 61.9638 30.8734 175.5373 47 Q 4.3605 8.5751 126.2754 57.4549 29.5450 175.2870 48 E 4.6743 7.5154 113.6668 54.8694 31.9504 174.2407 49 N 4.4034 8.6085 118.6623 53.5728 38.2961 173.4354 50 N 4.9497 8.4586 123.0713 51.4691 40.7194 175.6588 51 I 4.0327 8.3830 119.1710 63.8582 38.2001 177.3374 52 T 4.1609 8.2903 117.3478 65.0254 68.7795 174.8623 53 L 4.8260 7.2506 117.1000 52.0031 45.2485 176.5892 54 G 3.9256 8.4414 109.2745 45.8320 0.0000 174.1830 55 D 4.3200 8.4019 120.2291 56.8045 41.0068 178.0341 56 L 4.5269 8.0283 116.8449 53.8767 42.1795 177.1980 57 G 4.3189 7.6662 111.0948 45.4780 0.0000 174.7270 58 E 3.8176 7.9969 123.9789 57.0509 30.9042 176.7044 59 F 5.2878 7.2913 116.2485 55.4334 42.9025 173.9125 60 E 4.7016 9.0417 123.3217 55.0954 31.2258 174.3927 61 L 4.8418 8.2373 128.6250 53.5968 43.5429 175.7236 62 K 4.5366 8.9796 125.0793 54.6812 36.2930 175.8305 63 G 4.6028 8.4127 110.7708 44.4019 0.0000 172.2386 *65 R 4.3678 8.2215 116.9557 56.0297 31.0288 175.1438 66 N 4.7433 9.1931 121.8546 52.9186 36.9513 174.8420 67 R 4.1101 7.8667 124.4428 57.6596 30.8406 177.4923 68 K 3.9792 7.8531 124.7582 57.0525 31.0274 174.6402 69 A 4.8012 8.1663 125.5712 50.1006 20.1862 176.2403 70 K 4.2167 7.3072 125.3290 58.7382 33.8993 176.8576 71 S 4.2749 7.7660 118.7463 57.4766 63.2525 173.7008 72 N 4.6262 8.7973 122.6342 53.2217 39.6205 174.3523 73 L 4.3277 8.9287 124.3906 54.8045 43.5403 175.7540 74 T 4.5241 8.4548 123.5107 63.6148 68.6895 174.4538 75 L 4.3873 8.9380 127.9022 56.4848 42.6022 176.6056 76 F 4.7371 6.6988 110.8643 57.0073 40.7096 171.6949 77 H 5.9019 9.0535 114.8097 53.4255 31.9205 173.7669 78 K 4.7829 8.5245 120.5656 55.4088 34.9719 175.5000 79 K 4.4007 8.9215 126.9852 55.5910 33.5568 175.0208 80 P 3.1852 0.0000 0.0000 62.3928 31.5639 176.8756 81 V 3.7299 8.0363 119.9484 63.6224 32.1534 175.9671 82 A 4.5193 7.3952 121.4742 51.5867 22.5268 176.1188 83 G 4.0228 8.5146 105.4080 44.6769 0.0000 173.3268 84 Q 4.1876 8.1275 121.1015 56.1081 29.4361 177.1575 85 T 4.1676 8.7548 113.0767 61.0212 71.1300 176.1843 86 V 3.6467 8.1822 120.6355 66.3216 31.4569 178.1162 87 I 3.8155 7.7445 119.0507 64.5133 36.8978 178.2483 88 Q 4.0136 8.2270 118.9265 58.9058 28.4181 178.8700 89 I 3.9084 8.0588 120.9572 64.4223 37.1691 178.1305 90 F 4.2473 8.6930 121.8382 61.4895 38.9571 176.7553 91 N 4.0338 8.3028 115.1969 56.3195 38.4129 177.0245 92 R 3.7378 7.4801 118.3933 58.4755 30.3181 177.5413 93 F 4.8329 8.0657 114.7855 56.5809 40.3135 176.2435 94 G 3.6415 7.3077 106.1623 46.2157 0.0000 172.6198 95 Y 5.0059 7.8267 117.8234 55.0627 41.9380 174.1557 96 V 4.6236 8.4104 121.2850 62.1290 32.5828 174.9698 97 K 4.6482 8.9017 127.4226 54.6685 35.5061 173.3714 98 P 4.6658 0.0000 0.0000 62.3622 32.1388 176.0546 99 S 4.1607 8.8391 117.9246 59.3702 62.1487 175.0881 100 S 4.3263 8.8575 122.1123 61.2479 63.0959 175.7420 101 R 4.1958 7.9508 118.2021 57.8652 30.4539 175.9803 102 N 4.9003 8.2470 115.3015 50.2362 39.5585 172.9541 103 P 4.3695 0.0000 0.0000 65.0267 31.6822 177.5582 104 E 4.1993 8.1231 115.4651 57.1643 30.1874 176.2424 105 V 4.2613 7.6862 120.1828 61.1011 34.0125 174.1566 *107 K 5.1517 8.0720 116.3896 56.7074 34.0449 174.5928 108 K 4.9533 8.4559 122.6360 54.9126 34.4004 175.1214 109 K 4.9485 8.8632 125.7781 54.6993 36.9585 175.4876 110 L 4.4564 8.8304 124.5515 53.5701 44.3007 174.3219 111 F 5.3954 9.1582 124.4326 55.8883 40.6562 174.7216 112 T 4.7884 8.8268 118.0557 60.7157 71.3087 172.3323 113 T 4.9633 8.4628 123.8546 61.2364 70.2754 173.7845 114 I 4.6619 8.2866 127.1135 59.3182 39.7138 174.9612 115 K 4.6025 8.3359 124.1312 55.0318 36.3484 175.6319 116 G 4.0087 8.4981 108.0741 47.1591 0.0000 174.3146 117 G 4.0880 10.7314 109.7339 45.0284 0.0000 173.4987 118 R 4.5240 7.1325 116.9150 55.0982 32.8752 173.7149 119 L 4.4756 8.2518 124.2275 53.7567 42.7756 176.8852 120 N 4.7444 8.6790 121.4754 51.6596 38.7354 175.4782 121 N 4.3557 8.5711 114.6377 55.2329 37.3869 175.5943 122 L 4.3878 8.1622 117.2152 54.6699 42.2909 177.1613 123 G 3.9075 8.6976 108.2642 45.3375 0.0000 172.7280 124 L 5.1343 8.0566 119.5516 53.7296 43.8214 175.5849 125 T 5.0587 8.7903 115.8060 61.1977 71.7476 171.9487 126 L 5.5183 8.3690 123.7898 52.9637 45.3597 175.4329 127 N 5.6936 9.2570 117.9972 51.4649 41.6183 172.7298 128 A 5.0950 9.1321 119.9319 50.8625 21.7276 176.2720 129 K 4.1832 8.9591 121.1944 57.8972 33.5693 176.2993 130 H 4.9730 7.6022 113.0919 53.6784 33.0277 173.9435 131 A 4.0800 8.6771 122.7429 54.8940 18.1838 179.0700 132 S 4.9483 8.0579 108.2218 57.8820 63.9754 173.1546 133 E 4.9314 8.3348 122.8582 54.5116 30.3313 171.7642 134 I 5.0142 9.1069 123.8089 59.2068 39.8209 173.9529 135 N 5.7480 9.5227 125.1723 51.5272 41.5924 173.4411 136 L 5.1289 9.2710 125.4926 54.0801 44.1218 174.7704 137 Y 5.1280 9.1638 123.4157 56.3465 42.1254 173.9020 138 Y 5.0132 9.0346 124.2008 56.0920 40.6661 176.5701 139 Q 3.0648 8.6300 128.1180 57.5734 28.7225 174.5566 140 D 4.7313 8.9697 125.0954 54.8371 41.1752 175.0502 141 E 4.5141 8.7999 122.9567 54.6491 29.9902 174.9413 142 Y 3.3064 8.7282 128.0558 57.7670 39.4684 173.8708 143 L 4.2926 7.7343 125.5738 55.6669 44.0332 176.3867 144 S 4.7690 6.8258 112.0913 57.4293 68.0076 172.5083 145 T 5.4078 8.6731 117.5455 61.8417 72.2596 173.1689 146 W 4.8321 10.0815 125.6829 55.0855 32.3196 174.7425 147 D 5.4236 8.7059 123.0856 51.7568 42.0487 173.8846 148 L 4.7548 8.3687 123.7233 53.3982 43.2533 175.7795 149 N 4.7770 8.6078 121.3983 52.0810 40.4558 174.1399 150 L 4.4220 8.2729 124.2736 54.4808 42.6284 177.9875 151 S 4.2399 8.5038 115.8973 61.4953 62.2670 176.8248 152 K 4.0266 7.9292 117.6178 58.6334 31.9378 177.6262 153 I 4.4713 7.4646 110.2767 60.5105 37.7896 176.3099 154 E 4.2592 7.9982 122.7263 59.3191 29.6310 177.6126 155 K 5.0459 7.9707 116.3870 54.5483 36.3668 175.5638 156 L 5.1578 8.7488 123.7904 52.8630 45.0146 176.2187 157 V 4.2605 8.8017 122.3389 61.1547 33.8003 173.9011 158 L 4.9256 8.7810 131.1592 53.2086 44.4560 175.0677 159 V 4.8739 8.5527 126.2168 61.1339 34.7037 173.9341 160 F 5.1956 9.6785 126.3654 55.7648 41.7100 174.4137 161 A 5.0534 8.5880 123.7906 50.1157 21.8306 175.4820 162 E 4.6964 9.0159 122.0924 56.0926 31.2416 175.8588 163 T 5.7839 8.6906 111.3209 58.9394 72.0123 172.9537 164 I 4.4248 7.9723 115.1390 60.0856 41.2764 175.8999 165 G 4.1484 8.7143 107.4932 45.1686 0.0000 173.2249 166 R 3.8726 8.1528 119.0670 55.4830 30.6660 175.8652 167 A 4.4101 8.4686 127.0803 53.3576 18.6531 176.7290 168 N 4.4705 9.3536 119.2058 54.1842 37.0250 174.4461 169 S 4.8881 7.6721 112.2642 55.8497 65.1266 173.4222 170 P 3.5054 0.0000 0.0000 64.8272 30.9806 177.3265 171 E 4.2585 7.3961 115.7997 56.2230 29.9338 176.0755 172 E 4.1621 8.0115 122.1747 56.5209 30.7812 175.6641 173 Q 5.0594 8.8725 124.7831 54.1514 33.6007 174.2588 174 F 5.0852 9.3124 119.4167 56.0271 43.0605 173.3207 175 H 4.8878 8.9263 124.3604 54.1653 31.7601 172.9916 176 F 4.9547 8.7809 126.2581 57.4666 39.2103 176.1212 177 T 4.4580 8.9116 113.8885 61.3577 70.9752 174.5277 178 K 4.7749 8.0256 120.1875 54.9152 36.9497 175.0108 179 A 5.1240 7.9058 122.7754 51.3153 22.6419 174.5978 180 Y 5.0939 8.7429 118.6851 55.8198 42.6750 174.4183 *182 L 4.4280 8.4877 122.1040 55.9418 43.6294 176.4206 183 T 4.9883 8.5792 113.4124 59.9971 73.1819 172.7121 184 E 3.8744 8.6465 117.6064 57.4124 26.0621 174.1781 185 I 4.1715 7.4752 118.7082 61.0959 39.2970 175.8949 186 N 4.8001 8.6377 126.3909 52.0503 39.9268 174.5975 187 D 4.5519 8.6116 121.0069 54.8709 41.7786 176.8062 188 I 4.1627 8.4543 117.6866 61.6598 38.2843 177.8841 189 T 3.8490 7.9504 118.9576 67.1351 68.3668 176.4188 190 S 4.1555 8.0059 115.3144 61.3438 63.0361 176.2316 191 L 3.9962 7.7235 122.2383 57.3141 41.5441 179.2918 192 I 3.6292 8.1524 120.3543 64.5944 36.9217 178.2240 193 N 4.2894 8.0271 115.7576 56.1529 38.4405 175.6082 194 D 4.4744 8.2290 114.9873 53.8425 41.4001 176.4128 195 G 3.8489 7.8163 105.2075 47.2474 0.0000 175.6029 196 V 3.6917 7.7996 120.4353 65.2923 31.7232 176.7598 197 L 4.5641 7.5155 117.8993 54.4481 43.3917 176.8275 198 V 4.2539 8.1199 117.2162 60.6883 35.8200 174.7566 *200 D 4.8033 8.6600 125.1857 55.2969 42.7294 174.3952 201 L 4.5941 8.6025 122.8290 53.6494 44.0899 176.0364 202 C 4.9634 8.2386 119.2292 57.8197 29.2369 171.8049 203 I 4.7606 7.9203 121.8942 59.1792 40.4375 174.8336 204 D 5.0389 8.2957 124.5156 52.6689 43.8986 173.7092 205 Q 4.6084 8.7432 118.8413 55.1877 32.9766 173.2036 206 D 4.8598 8.8949 126.6065 53.3419 40.5031 176.2763 207 L 4.0774 8.3548 127.4970 57.4485 42.2763 179.9524 208 S 4.1276 8.2865 113.7681 61.3855 62.7914 175.1634 209 K 4.3246 8.5827 116.7899 55.4609 32.1420 176.6551 210 S 3.6950 7.6244 113.9226 59.6188 60.7071 172.1606 211 K 4.4927 8.1250 118.0575 54.6221 34.1260 177.2611 212 G 3.9407 8.2121 110.1387 44.0382 0.0000 171.6819 213 P 4.4368 0.0000 0.0000 62.9388 32.5031 175.8087 214 H 4.6912 9.4378 122.9048 54.6382 31.4521 172.1681 215 D 4.6461 8.4360 126.2938 53.2118 41.5079 176.0446 216 R 4.1838 8.4965 124.5594 56.2773 30.7015 176.5347 217 G 4.0754 8.8631 110.0320 44.8572 0.0000 171.9454 218 P 4.5512 0.0000 0.0000 63.3803 32.5305 174.7408 219 H 5.0438 9.0620 122.6330 54.1572 30.2551 174.5143 220 L 4.2254 8.2649 126.6631 54.6097 43.0646 175.8185 221 R 5.1402 8.9481 124.3343 54.7933 35.3892 173.8122 222 I 4.7651 8.4411 119.5582 58.9260 41.9681 172.6442 223 P 4.6319 0.0000 0.0000 62.4359 32.2379 177.3931 224 I 3.7420 8.6204 123.2813 64.6067 37.1796 178.4362 225 S 4.2259 8.0890 112.9899 60.2132 63.0710 174.7659 226 K 4.5183 8.0097 119.8638 56.0105 32.4928 177.8960 227 L 4.1167 7.9252 122.0643 57.7243 41.6094 178.9497 228 D 4.6432 8.0324 116.4193 55.1723 39.6020 177.2626 229 K 4.1637 7.9568 119.2076 58.1206 32.7232 177.6879 230 L 4.0931 7.7900 120.1613 56.0802 42.6374 175.6328 231 Y 5.1490 7.9937 115.5676 56.1454 40.3513 176.0605 232 R 4.1901 8.9652 123.7745 57.7687 30.8477 176.1101 233 N 5.0720 8.4204 117.0447 51.7142 42.1340 173.1022 234 I 4.8701 8.5438 125.9545 59.5522 40.5695 174.1822 235 E 4.7247 8.7069 127.8699 53.9925 32.5251 174.9211 236 R 4.0999 8.7703 127.3992 56.2431 30.7735 175.6562 237 L 4.4424 8.4559 125.2535 55.4465 43.3317 176.3572 238 L 4.0399 7.2507 123.7800 55.1843 42.1469 175.1485 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 K 8.31 4.08 0.00 1.66 1.86 0.00 1.26 0.00 0.00 0.87 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.67 1.12 7.81 3 I 8.14 4.35 1.85 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 1.33 0.31 0.88 0.00 0.00 4 W 9.12 4.69 0.00 3.30 3.41 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 5 S 9.43 4.48 0.00 4.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 K 9.29 3.89 0.00 2.05 1.97 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.40 7.81 7 E 8.29 4.00 0.00 2.12 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 0.00 2.42 2.44 0.00 8 E 8.50 4.12 0.00 2.52 2.31 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 2.35 2.37 0.00 9 V 8.37 3.85 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 0.95 0.00 0.00 1.14 0.00 0.00 10 V 8.01 3.59 2.25 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 1.04 0.00 0.00 0.98 0.00 0.00 11 N 8.46 4.38 0.00 2.99 2.91 0.00 0.00 6.72 7.14 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 12 K 8.27 4.21 0.00 2.07 1.91 0.00 1.26 0.00 0.00 1.63 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.30 0.32 7.81 13 L 8.27 3.92 0.00 1.81 1.63 0.86 1.17 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 14 H 8.18 4.14 0.00 3.42 3.36 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.21 3.99 0.00 2.17 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 2.34 2.55 0.00 16 I 8.03 3.70 1.91 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.02 0.91 0.00 0.00 17 K 8.12 4.28 0.00 1.87 1.94 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.39 7.81 18 N 8.13 4.53 0.00 2.92 2.89 0.00 0.00 7.10 6.89 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 19 K 7.81 4.17 0.00 1.98 1.90 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.49 1.71 7.81 20 G 8.17 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 8.61 4.23 0.00 2.85 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 22 L 9.47 4.84 0.00 1.81 1.74 1.17 0.94 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 23 S 8.71 5.10 0.00 3.92 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 24 V 8.23 4.21 2.25 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 1.07 0.00 0.00 1.28 0.00 0.00 25 P 0.00 4.46 0.00 2.14 2.03 0.00 3.83 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 26 T 8.68 4.12 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 1.26 0.00 0.00 27 D 7.88 4.54 0.00 2.70 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 *29 F 8.00 4.62 0.00 3.07 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.41 4.03 0.00 1.74 1.77 0.00 3.18 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.50 0.00 31 T 5.79 3.37 4.12 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.89 1.83 0.00 66 N 9.19 4.74 0.00 2.78 2.93 0.00 0.00 7.25 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 7.87 4.11 0.00 2.00 1.86 0.00 3.42 0.00 0.00 3.26 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 68 K 7.85 3.98 0.00 1.81 1.79 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.45 7.81 69 A 8.17 4.80 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 70 K 7.31 4.22 0.00 2.00 1.91 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.58 7.81 71 S 7.77 4.27 0.00 3.80 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 72 N 8.80 4.63 0.00 2.60 2.83 0.00 0.00 7.10 7.85 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 73 L 8.93 4.33 0.00 1.73 1.70 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.45 4.52 4.23 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 1.06 0.00 0.00 75 L 8.94 4.39 0.00 1.21 1.74 0.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 76 F 6.70 4.74 0.00 3.11 3.16 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 77 H 9.05 5.90 0.00 3.06 3.30 0.00 5.99 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.52 4.78 0.00 2.08 2.04 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.60 1.74 7.81 79 K 8.92 4.40 0.00 1.88 1.84 0.00 1.58 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.38 7.81 80 P 0.00 3.19 0.00 1.48 0.49 0.00 3.60 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.33 0.00 81 V 8.04 3.73 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 0.73 0.00 0.00 0.91 0.00 0.00 82 A 7.40 4.52 1.24 0.00 0.00 0.00 0.00 0.00 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1.39 0.00 0.00 1.34 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.98 1.31 7.81 109 K 8.86 4.95 0.00 1.25 1.62 0.00 2.00 0.00 0.00 2.01 0.00 0.00 2.95 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.53 1.43 7.81 110 L 8.83 4.46 0.00 1.72 1.57 1.17 1.11 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 0.00 111 F 9.16 5.40 0.00 3.14 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 0.00 112 T 8.83 4.79 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 113 T 8.46 4.96 4.23 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 1.20 0.00 0.00 114 I 8.29 4.66 1.75 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.88 0.00 0.00 115 K 8.34 4.60 0.00 1.72 1.79 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.41 7.81 116 G 8.50 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 0.00 0.00 0.00 117 G 10.73 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 0.00 0.00 0.00 118 R 7.13 4.52 0.00 1.71 1.73 0.00 3.21 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 119 L 8.25 4.48 0.00 1.63 1.54 0.83 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 0.00 120 N 8.68 4.74 0.00 2.94 2.96 0.00 0.00 6.46 6.65 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 0.00 121 N 8.57 4.36 0.00 2.85 2.99 0.00 0.00 5.93 7.79 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 0.00 122 L 8.16 4.39 0.00 1.79 1.84 1.07 1.01 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 0.00 123 G 8.70 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.06 5.13 0.00 1.65 1.50 0.62 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 125 T 8.79 5.06 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 1.22 0.00 0.00 126 L 8.37 5.52 0.00 1.54 1.51 0.82 0.95 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 0.00 127 N 9.26 5.69 0.00 2.84 2.84 0.00 0.00 6.73 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 9.13 5.10 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 0.00 129 K 8.96 4.18 0.00 1.63 1.62 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.63 7.81 130 H 7.60 4.97 0.00 3.22 3.17 0.00 5.62 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 0.00 131 A 8.68 4.08 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 0.00 132 S 8.06 4.95 0.00 4.09 4.17 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 0.00 133 E 8.33 4.93 0.00 2.16 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 2.30 2.36 0.00 134 I 9.11 5.01 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 0.95 0.00 0.00 135 N 9.52 5.75 0.00 3.01 3.04 0.00 0.00 6.12 6.49 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 0.00 136 L 9.27 5.13 0.00 2.03 1.80 0.97 0.94 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 0.00 137 Y 9.16 5.13 0.00 2.90 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 0.00 138 Y 9.03 5.01 0.00 3.12 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Q 8.63 3.06 0.00 1.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.74 0.00 0.00 0.00 0.00 0.00 1.87 1.16 0.00 140 D 8.97 4.73 0.00 2.70 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 0.00 141 E 8.80 4.51 0.00 2.15 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 0.00 2.37 2.36 0.00 142 Y 8.73 3.31 0.00 2.64 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 0.00 143 L 7.73 4.29 0.00 1.51 1.49 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 144 S 6.83 4.77 0.00 3.54 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 0.00 145 T 8.67 5.41 4.32 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 1.42 0.00 0.00 146 W 10.08 4.83 0.00 3.32 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 0.00 147 D 8.71 5.42 0.00 2.82 2.58 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 0.00 148 L 8.37 4.75 0.00 1.80 1.89 1.00 1.28 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 0.00 149 N 8.61 4.78 0.00 2.60 2.55 0.00 0.00 7.03 7.78 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 0.00 150 L 8.27 4.42 0.00 1.80 1.69 1.17 0.75 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 0.00 151 S 8.50 4.24 0.00 3.88 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 0.00 152 K 7.93 4.03 0.00 1.69 1.84 0.00 1.89 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.35 7.81 153 I 7.46 4.47 2.11 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.80 1.15 0.00 0.00 154 E 8.00 4.26 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 155 K 7.97 5.05 0.00 2.03 1.94 0.00 1.80 0.00 0.00 2.13 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.55 7.81 156 L 8.75 5.16 0.00 1.19 1.41 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.80 4.26 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.49 0.00 0.00 158 L 8.78 4.93 0.00 1.67 1.50 0.62 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 159 V 8.55 4.87 2.02 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 1.05 0.00 0.00 0.79 0.00 0.00 160 F 9.68 5.20 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 0.00 161 A 8.59 5.05 0.70 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 0.00 162 E 9.02 4.70 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 163 T 8.69 5.78 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 164 I 7.97 4.42 1.59 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.99 0.38 0.00 0.00 165 G 8.71 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 R 8.15 3.87 0.00 1.83 1.79 0.00 3.21 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 167 A 8.47 4.41 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 0.00 168 N 9.35 4.47 0.00 2.98 3.04 0.00 0.00 6.95 7.51 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 0.00 169 S 7.67 4.89 0.00 3.96 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 0.00 170 P 0.00 3.51 0.00 1.70 1.54 0.00 3.35 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.70 0.00 171 E 7.40 4.26 0.00 1.82 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 2.23 2.20 0.00 172 E 8.01 4.16 0.00 2.31 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 1.54 2.05 0.00 173 Q 8.87 5.06 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.54 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 174 F 9.31 5.09 0.00 2.79 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 0.00 0.00 0.00 0.00 175 H 8.93 4.89 0.00 1.40 2.30 0.00 5.59 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 F 8.78 4.95 0.00 3.03 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 0.00 177 T 8.91 4.46 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 0.88 0.00 0.00 178 K 8.03 4.77 0.00 1.84 1.67 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.38 7.81 179 A 7.91 5.12 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 0.00 180 Y 8.74 5.09 0.00 2.85 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 *182 L 8.49 4.43 0.00 0.83 0.43 0.80 0.38 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 0.00 183 T 8.58 4.99 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 184 E 8.65 3.87 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 185 I 7.48 4.17 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.22 0.92 0.00 0.00 186 N 8.64 4.80 0.00 2.53 2.68 0.00 0.00 6.92 7.60 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 0.00 187 D 8.61 4.55 0.00 2.67 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 0.00 188 I 8.45 4.16 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.07 0.94 0.00 0.00 189 T 7.95 3.85 4.32 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 1.21 0.00 0.00 190 S 8.01 4.16 0.00 4.03 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 0.00 191 L 7.72 4.00 0.00 1.80 1.71 0.89 0.93 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 0.00 192 I 8.15 3.63 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.41 0.89 0.00 0.00 193 N 8.03 4.29 0.00 2.70 2.86 0.00 0.00 7.05 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 0.00 194 D 8.23 4.47 0.00 2.66 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 0.00 195 G 7.82 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.80 3.69 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 0.76 0.00 0.00 0.91 0.00 0.00 197 L 7.52 4.56 0.00 1.61 1.48 0.86 0.79 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 0.00 198 V 8.12 4.25 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 0.71 0.00 0.00 0.86 0.00 0.00 *200 D 8.66 4.80 0.00 2.60 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 0.00 201 L 8.60 4.59 0.00 1.58 1.55 0.96 0.78 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 0.00 202 C 8.24 4.96 0.00 2.84 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 I 7.92 4.76 1.38 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 1.04 0.40 -0.16 0.00 0.00 204 D 8.30 5.04 0.00 2.85 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 0.00 205 Q 8.74 4.61 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 206 D 8.89 4.86 0.00 2.75 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.35 4.08 0.00 1.78 1.71 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 208 S 8.29 4.13 0.00 4.02 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 0.00 209 K 8.58 4.32 0.00 1.74 1.83 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.61 7.81 210 S 7.62 3.70 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 K 8.12 4.49 0.00 1.82 1.72 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.51 7.81 212 G 8.21 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 0.00 0.00 0.00 213 P 0.00 4.44 0.00 1.74 1.90 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 214 H 9.44 4.69 0.00 3.11 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 D 8.44 4.65 0.00 2.56 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 0.00 216 R 8.50 4.18 0.00 1.97 2.00 0.00 3.40 0.00 0.00 3.27 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.40 0.00 217 G 8.86 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 0.00 218 P 0.00 4.55 0.00 2.50 2.10 0.00 3.93 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.39 0.00 219 H 9.06 5.04 0.00 2.82 3.11 0.00 5.84 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 8.26 4.23 0.00 1.15 0.56 0.77 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 221 R 8.95 5.14 0.00 1.65 1.79 0.00 3.14 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 222 I 8.44 4.77 1.83 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 1.23 1.28 0.93 0.00 0.00 223 P 0.00 4.63 0.00 2.21 1.95 0.00 3.71 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 2.09 2.09 0.00 224 I 8.62 3.74 1.92 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 1.55 1.45 0.99 0.00 0.00 225 S 8.09 4.23 0.00 3.96 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 0.00 226 K 8.01 4.52 0.00 1.91 1.81 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.36 7.81 227 L 7.93 4.12 0.00 1.86 1.84 0.95 1.16 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 0.00 228 D 8.03 4.64 0.00 2.80 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 K 7.96 4.16 0.00 1.86 1.88 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.50 7.81 230 L 7.79 4.09 0.00 1.60 1.67 0.69 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 231 Y 7.99 5.15 0.00 2.98 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 R 8.97 4.19 0.00 2.00 2.02 0.00 3.12 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 233 N 8.42 5.07 0.00 3.07 2.67 0.00 0.00 6.77 7.76 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 0.00 234 I 8.54 4.87 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 0.93 0.00 0.00 235 E 8.71 4.72 0.00 2.02 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 236 R 8.77 4.10 0.00 1.78 1.78 0.00 2.52 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.46 0.00 237 L 8.46 4.44 0.00 1.47 1.58 0.74 0.74 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 0.00 238 L 7.25 4.04 0.00 1.35 1.39 0.67 0.79 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 * Residues marked with a * may have inaccurate shift predictions.