NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4142 8.3349 115.2922 56.0680 64.7962 172.8099 3 K 4.4427 7.5583 121.7395 51.8694 34.7529 174.0773 4 P 4.5498 0.0000 0.0000 61.6084 33.2827 175.3191 5 Q 3.9663 8.6566 119.4176 56.0387 29.1324 174.5336 6 P 4.8915 0.0000 0.0000 63.1588 33.0711 174.9727 7 I 5.0266 8.6654 120.5847 59.4549 41.1643 174.5251 8 A 5.2023 8.7913 127.2325 50.2616 21.5243 174.7034 9 A 5.2734 9.4903 124.7335 50.5101 22.0945 174.6344 10 A 4.6735 9.0058 125.0415 50.0741 21.1899 175.1430 11 N 4.9093 9.4797 123.8347 52.0169 39.7823 174.8877 12 W 4.6940 8.9903 135.0000 56.6372 29.8528 175.6413 13 K 3.9547 8.8147 127.1883 57.8085 32.4567 177.2805 *15 S 4.0566 7.7370 112.2268 58.3012 63.0705 173.4242 *20 S 4.7692 8.2049 119.1075 57.5314 64.0929 175.1851 21 L 3.6783 7.5476 121.2474 58.6935 41.7402 178.4927 22 S 3.9768 7.8021 112.6976 61.3866 62.4841 175.5961 23 E 3.8754 8.0578 120.8129 59.3158 29.1378 179.1610 24 L 3.4978 7.1388 118.7998 58.0239 42.1073 178.9097 25 I 3.4599 7.8128 120.0434 64.3376 37.1000 177.8537 26 D 4.2942 8.2299 120.0717 57.5008 40.4794 178.7758 27 L 3.9001 7.3697 118.9807 58.2362 42.3109 178.8328 28 F 4.7168 7.6781 117.5787 60.7455 38.6217 177.3932 29 N 4.3887 8.2786 115.6303 56.0482 38.4384 176.6994 30 S 4.6162 7.7700 112.3692 58.1132 63.7500 174.1306 31 T 4.3048 7.2178 120.2822 62.5627 68.6592 174.6995 32 S 4.2456 8.7476 123.7715 58.4664 63.2147 173.7070 33 I 4.3325 8.4298 126.6742 60.0768 37.9068 174.8240 34 N 4.9217 8.7215 122.8891 52.8870 38.7247 174.2164 35 H 4.8952 7.5165 112.5070 53.6365 31.7756 172.0340 36 D 4.5035 8.5892 120.0300 53.8849 41.2005 175.6762 37 V 4.5110 7.7932 124.4028 60.6998 34.4139 172.7529 38 Q 4.2055 8.9203 126.1462 55.3757 30.1703 174.2026 39 C 4.8667 8.4041 124.9303 58.5136 30.5539 173.1267 40 V 4.6511 8.4153 120.9964 61.1981 35.0070 174.0992 41 V 4.6311 8.8198 127.6942 61.1575 33.5315 173.8819 42 A 5.0685 9.0836 131.9323 51.1245 20.1168 176.1542 43 S 5.0891 9.0420 116.6036 56.4906 67.5295 173.9705 44 T 4.0473 7.9003 116.4503 62.7996 69.2098 175.3856 45 F 3.9710 8.8456 124.8127 62.0339 38.9082 177.8303 46 V 3.4343 7.7966 116.9433 64.6185 31.2804 176.7475 47 H 4.6670 7.5679 113.8897 55.6170 28.8364 177.0303 48 L 4.1065 7.9022 123.8741 57.3419 41.5915 179.1517 49 A 4.2548 7.6758 120.2528 55.1083 18.3833 179.1784 50 M 3.9827 7.9806 116.3114 59.1790 32.3887 178.2564 51 T 3.9288 7.9193 115.7817 66.7903 68.5053 176.5052 52 K 3.9484 8.2281 120.1463 59.1152 32.1853 177.9893 53 E 4.2155 7.8526 116.6549 58.4484 30.0565 178.1374 54 R 4.4035 7.8956 117.3991 55.9961 30.8903 176.3710 55 L 4.3548 7.7413 121.6771 54.3675 42.0798 176.1358 56 S 4.5935 8.8783 119.0577 57.5317 64.4245 173.5948 57 H 4.1676 8.2573 122.7007 55.8791 29.6653 173.8917 58 P 4.4516 0.0000 0.0000 64.9450 31.4866 177.1489 59 K 4.2303 8.4649 117.7210 57.2042 32.4976 175.7749 60 F 5.1450 8.2528 118.1066 55.8420 41.1016 175.6228 61 V 4.6096 8.2767 114.1146 59.6166 35.8580 174.8096 62 I 4.7430 8.4215 123.2040 60.6713 38.4093 175.1019 63 A 5.2883 8.8948 126.9089 50.2149 22.3603 175.9918 64 A 4.8988 8.8324 123.0861 51.3909 20.7416 176.1603 65 Q 4.7625 7.9900 116.2723 55.2789 32.4809 176.4917 66 N 4.0858 9.1288 118.5527 53.5001 37.2445 174.5697 67 A 4.0371 7.4214 120.9970 52.4077 18.7658 178.1050 68 G 3.9988 8.3499 107.4178 44.5428 0.0000 171.7231 69 N 4.7920 7.7310 118.9238 51.2322 40.8731 175.1976 70 A 4.0463 8.5979 128.2165 55.4473 19.1371 179.3679 71 D 4.3934 8.0162 114.2944 57.2435 41.2451 178.7715 72 A 3.9281 7.7990 121.9336 54.8062 19.0568 179.2763 *80 L 4.2943 7.9556 114.5248 54.9815 43.8465 178.7380 81 A 4.1018 8.4579 120.5797 55.6050 18.0987 179.9174 82 S 4.1556 8.1122 113.1348 61.5999 62.8827 176.8660 83 L 4.1517 7.9242 121.5184 57.9391 41.4959 179.2904 84 K 3.8328 8.1899 119.5498 59.0202 31.8354 178.3665 85 D 4.4368 8.1237 116.9064 57.7449 41.2023 178.0385 86 F 4.4426 8.4615 118.6659 58.8214 39.5610 175.4701 87 G 3.7410 8.6607 106.1222 46.5596 0.0000 173.1594 88 V 4.3934 8.3938 120.1516 61.1146 32.8091 175.3053 89 N 4.6815 8.9357 122.2077 52.4225 40.9979 173.7236 90 W 5.4643 8.4360 118.7948 55.0180 33.2425 174.1969 91 I 5.2270 8.9482 121.8243 59.6438 41.6920 173.5516 92 V 4.8603 8.7864 128.3554 61.3533 33.5467 174.5055 93 L 4.9314 8.7033 126.7451 53.9551 46.0833 177.6966 94 G 3.9849 8.9781 108.6419 45.7367 0.0000 173.4467 95 H 4.1083 7.9772 119.5347 56.1407 30.5858 175.5717 96 S 4.2246 8.6940 120.8465 62.0952 62.5133 176.9608 97 E 2.5400 8.2146 120.9547 58.1460 29.0641 179.0049 98 R 4.0487 8.0323 119.3358 58.9822 30.1812 179.0396 99 R 4.4072 7.9032 118.7481 58.1451 30.4044 178.6981 100 W 4.5264 8.1308 114.7275 58.4043 28.4572 176.1994 101 Y 4.2592 6.9665 119.2461 59.4819 38.9755 176.3242 102 Y 4.0160 7.6205 114.9911 58.8857 38.3596 176.7888 103 G 3.8117 7.7123 106.7495 45.4514 0.0000 173.1908 104 E 3.9112 8.3309 120.4549 56.3420 29.4269 177.3948 105 T 4.4236 8.2480 115.3232 60.7218 71.4620 174.9135 106 N 4.2909 8.6241 117.6504 56.5874 38.4572 177.4112 107 E 3.9124 8.0908 119.1023 59.5532 29.7683 178.9260 108 I 3.6405 7.5476 119.6142 64.8175 37.1583 178.5945 109 V 3.5501 7.8660 118.4102 65.8592 31.2633 177.9701 110 A 3.9407 8.0084 120.6493 55.1542 18.1361 179.3556 111 D 4.2600 8.6704 117.8443 57.3866 40.8723 179.2003 112 K 3.8796 7.9685 118.9993 59.2316 32.0198 179.5702 113 V 3.4184 7.9260 118.4364 65.9836 31.4025 177.9486 114 A 3.8966 8.1450 120.4090 55.0335 18.2030 179.4877 115 A 3.8631 8.1959 119.2151 55.2062 18.3709 179.8061 116 A 3.7516 7.8282 119.2967 55.0292 18.4101 179.9774 117 V 3.4783 7.8755 116.5922 66.2626 31.4298 178.1790 118 A 4.0668 7.9893 119.0335 54.9557 18.2695 178.8964 119 S 4.5448 7.9808 111.2905 58.9530 63.2152 174.9852 120 G 3.9825 8.0921 110.5396 45.2673 0.0000 173.4167 121 F 4.7545 8.1966 117.5809 56.1563 40.6605 175.7674 122 M 4.0665 8.6456 122.6818 55.0861 33.0127 175.4121 123 V 4.7310 9.0791 124.4964 61.1393 34.4285 174.3225 124 I 4.8041 8.8794 129.5250 60.3246 38.3597 174.4914 125 A 4.9723 9.1661 130.7222 50.5085 20.7866 175.1800 126 C 5.1021 8.8228 121.7202 58.6777 29.6185 173.4336 127 I 4.7482 9.4549 116.0755 58.5286 41.2390 174.2737 128 G 5.0461 8.8838 115.4718 45.9287 0.0000 171.7280 129 E 5.0760 8.2260 119.9208 54.7212 32.9667 175.5270 130 T 4.6012 9.1689 111.8367 60.2918 70.7963 175.4976 131 L 3.8693 8.8491 122.2328 58.6415 41.7323 178.6642 132 Q 3.9304 8.0647 116.9229 59.1699 28.7524 178.4487 133 E 3.9785 7.8297 118.3695 59.5507 29.4127 179.4794 134 R 4.1264 8.1406 119.8420 59.1456 29.9479 178.5125 135 E 3.9949 7.9527 117.0402 58.6303 29.4473 178.3014 136 S 4.6531 7.8699 112.6399 57.6041 63.3464 174.3242 137 G 3.9157 7.6136 108.9905 47.6629 0.0000 175.2962 138 R 4.5758 7.9970 116.3031 55.8625 30.3695 177.7202 139 T 3.9685 8.0284 117.7113 66.9561 68.3573 175.8790 140 A 3.9998 7.9711 121.8236 55.2008 18.6383 179.7915 141 V 3.5367 7.7570 117.1540 64.9333 31.4037 178.3929 142 V 3.5256 7.8773 118.8984 65.8138 31.3345 178.2282 143 V 3.6305 8.1433 118.2512 65.9922 31.4382 177.9012 144 L 3.5571 8.1499 118.6030 57.1391 41.3863 179.6330 145 T 3.8173 7.6944 116.0935 66.5704 68.4915 176.4917 146 Q 4.0876 7.9565 120.0475 59.3092 28.7233 179.2469 147 I 3.8645 7.3175 118.4868 63.1194 38.2609 177.5243 148 A 4.1706 7.5767 121.6277 54.9317 17.9028 179.3613 149 A 3.9879 7.7992 118.6610 55.4146 18.8316 179.6835 150 I 3.7707 7.3281 117.3686 64.5671 36.8351 178.6613 151 A 4.4180 8.5693 121.5278 54.7981 18.0286 179.4676 152 K 4.1147 8.1148 117.3930 58.6116 32.2510 177.5284 153 K 4.5235 7.6145 115.9709 55.8467 32.3614 175.6892 154 L 4.9517 7.5461 117.6686 52.9452 45.5765 175.9454 155 K 4.6824 9.1944 120.0647 54.4560 34.7710 177.6016 156 K 3.9724 8.9663 121.0485 60.2828 32.0262 178.5684 157 A 4.1222 8.2271 119.9316 55.3862 18.1294 179.0417 158 D 4.4648 8.3746 117.1311 56.8329 40.8701 178.6071 159 W 4.0427 8.5694 119.2083 58.8710 28.8229 178.0894 160 A 4.1844 7.6924 119.0150 54.2232 17.9595 177.9182 161 K 4.2693 8.0469 115.5416 56.2064 33.4415 176.1529 162 V 4.6674 7.4704 120.6973 60.9504 33.7062 175.0659 163 V 4.6038 9.1009 126.6568 61.2163 35.1497 173.8514 164 I 4.9827 8.7749 127.8346 59.6232 39.6721 174.2679 165 A 5.0495 8.9028 129.2851 50.3024 21.1849 175.0019 166 Y 4.6708 9.1380 125.8286 57.5550 39.6416 174.4136 167 E 4.6651 8.9971 127.5678 52.3963 32.3988 173.5929 168 P 4.0621 0.0000 0.0000 61.5983 31.9452 178.2749 169 V 3.4643 8.2718 123.8890 65.4968 31.6000 177.8676 170 W 4.2541 7.7105 114.8884 58.1043 28.2653 176.3714 171 A 5.0751 6.7438 120.3818 51.9031 18.8279 177.0718 172 I 3.6652 7.2228 118.2452 61.8132 36.8155 176.5383 173 G 4.0709 8.7662 113.1233 46.3787 0.0000 173.4479 174 T 4.1953 7.6831 108.3214 61.4204 69.5277 176.0918 175 G 3.8487 8.0092 109.3043 44.9939 0.0000 173.0126 176 K 4.4681 7.6806 121.5181 54.6161 32.4547 175.4023 177 V 4.7031 8.2490 126.0846 59.7893 33.0132 175.8770 178 A 4.6166 8.9909 125.6312 52.0502 18.8932 178.4578 179 T 4.0884 8.7724 113.2233 61.2995 70.7144 173.4260 180 P 4.1957 0.0000 0.0000 65.9208 31.2144 178.9643 181 Q 3.9859 8.0072 116.1885 59.1730 28.2315 178.7727 182 Q 4.0364 8.0393 118.3344 58.8945 28.7034 178.6849 183 A 4.1606 8.0518 121.8194 55.1751 18.3503 179.5024 184 Q 3.7908 8.1568 118.0691 59.1634 29.1820 177.8962 185 E 3.8632 8.3628 120.2285 59.2476 29.6728 178.5523 186 A 3.7509 7.8424 120.5906 55.5115 18.2655 179.3592 187 H 4.0354 8.4260 114.5245 58.9112 28.6991 177.7889 188 A 4.0676 8.3945 123.0215 55.1328 18.1375 179.4716 189 L 3.8934 7.9743 118.5987 58.3001 42.1465 179.0112 190 I 3.7258 7.6318 119.7385 64.6413 37.1284 178.3669 191 R 3.9027 8.2467 119.4341 59.5606 29.9882 178.4805 192 S 4.1742 8.4653 113.2761 60.9614 62.3250 175.9036 193 W 4.0395 8.4716 131.3042 60.4171 30.3618 178.1964 194 V 3.2771 8.2421 118.3668 65.9141 30.9661 177.8136 195 S 4.0392 8.3894 113.2904 61.5203 61.9182 176.4880 196 S 3.9208 7.5776 116.5549 61.2812 62.7011 176.1210 197 K 3.8726 7.2787 119.0531 57.0193 32.1737 177.4277 198 I 3.9868 8.5655 118.1314 61.0136 39.0870 175.8918 199 G 4.2114 6.0960 108.8166 44.1214 0.0000 173.2339 200 A 4.0290 7.8581 123.1122 54.2906 18.6130 180.0258 201 D 4.2657 7.9118 117.8068 56.6481 39.5914 178.9180 202 V 3.6187 7.5932 119.1177 65.5374 31.4293 177.6580 203 A 4.0409 7.7801 119.4359 55.1678 18.2659 179.6036 204 G 3.6502 7.8022 102.7948 47.4669 0.0000 175.0797 205 E 4.4229 7.5874 117.6736 56.0948 30.1708 176.6014 206 L 4.1017 7.2236 121.6534 55.0890 42.7474 176.2124 207 R 4.5125 8.7406 125.4186 55.8871 31.6277 175.2705 208 I 4.9872 9.3525 125.9517 59.6927 39.5629 174.9387 209 L 4.9622 9.3294 128.0577 53.7721 44.0623 175.1516 210 Y 5.2423 9.0030 123.7439 56.3181 40.8950 174.6048 211 G 4.3366 7.8185 112.8270 43.3589 0.0000 170.6843 212 G 3.5755 9.9685 111.4386 45.5885 0.0000 173.3184 213 S 3.8851 8.4628 124.2541 59.1519 60.0041 171.5810 214 V 4.0969 7.8652 119.5425 62.6256 32.2055 174.4001 215 N 5.1398 8.8441 122.6593 50.8279 40.7589 175.3782 216 G 3.7767 8.4682 107.7364 48.8546 0.0000 174.6185 217 K 3.7296 7.7890 119.8239 59.6226 32.5274 177.5356 218 N 4.5777 7.9176 115.2119 54.1604 37.7801 176.9888 219 A 3.5125 7.6142 123.7924 55.1301 18.3206 179.1017 220 R 4.0915 8.0007 116.6979 60.2587 29.8292 178.3412 221 T 3.9439 7.9358 113.1776 66.8460 68.8131 175.9183 222 L 4.1574 7.9769 120.5707 58.1148 41.4977 178.9605 223 Y 4.0488 8.4143 118.0637 60.0743 38.8338 177.3082 224 Q 4.1208 7.7562 117.8225 57.1918 29.3500 176.5696 225 Q 4.0868 7.4603 120.1980 55.2932 29.5059 176.8923 226 R 3.7891 8.6563 122.2911 59.3900 29.9420 176.9337 227 D 4.7779 8.4656 113.9914 53.7795 41.2148 175.7211 228 V 4.1200 7.1388 120.3596 61.6828 32.4002 175.4011 229 N 4.9770 9.3886 124.5508 52.6554 39.5296 173.8072 230 G 4.2449 6.9519 104.9157 45.0332 0.0000 173.0125 231 F 5.6014 8.5270 116.6000 55.9195 43.6027 173.3134 232 L 5.3515 8.9755 123.4322 53.6129 44.5213 175.3108 233 A 4.7938 9.2495 127.3640 50.4769 23.3194 175.0573 234 G 3.6785 8.5870 103.9993 46.5366 0.0000 173.2567 *238 L 4.4670 8.1908 122.0551 54.6502 42.1028 175.6946 239 K 4.7114 7.7453 122.0700 52.4541 36.5925 175.6744 240 P 4.3476 0.0000 0.0000 65.5586 31.2056 178.0930 241 E 4.2766 8.1703 114.4430 57.3257 29.8031 177.9832 242 F 4.2125 8.4220 122.9895 61.7296 39.2343 176.9081 243 V 3.5618 7.8682 117.5545 66.2568 31.3377 177.7263 244 D 4.3016 7.9923 117.9143 57.4288 40.4407 178.7928 245 I 3.4700 7.2302 118.9002 64.1070 37.4355 177.9971 246 I 3.5328 7.3445 121.0460 64.5369 36.7368 178.5750 247 K 3.9377 7.8675 117.2645 59.2962 31.9324 178.7916 248 A 4.1565 7.6812 119.6444 53.6438 18.7183 177.2112 249 T 3.0836 7.3571 108.2621 60.3400 69.3134 175.0445 250 Q 4.0363 7.2631 124.4794 57.7472 28.2679 174.0461 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 S 8.33 4.41 0.00 3.86 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 3 K 7.56 4.44 0.00 1.88 1.72 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.99 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.29 1.45 7.81 4 P 0.00 4.55 0.00 2.24 2.12 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 5 Q 8.66 3.97 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 6 P 0.00 4.89 0.00 2.10 2.27 0.00 3.86 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 7 I 8.67 5.03 1.96 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.93 0.00 0.00 8 A 8.79 5.20 0.98 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 9 A 9.49 5.27 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 9.01 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 N 9.48 4.91 0.00 2.66 2.75 0.00 0.00 7.18 5.12 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 12 W 8.99 4.69 0.00 3.24 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 13 K 8.81 3.95 0.00 1.85 1.84 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.38 7.81 *15 S 7.74 4.06 0.00 4.06 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 *20 S 8.20 4.77 0.00 3.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.55 3.68 0.00 1.18 1.48 0.47 1.11 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 22 S 7.80 3.98 0.00 3.88 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.06 3.88 0.00 1.96 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 2.33 2.36 0.00 24 L 7.14 3.50 0.00 1.71 1.37 0.66 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.81 3.46 1.86 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 1.47 0.53 0.84 0.00 0.00 26 D 8.23 4.29 0.00 2.69 2.65 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 27 L 7.37 3.90 0.00 1.53 1.54 0.91 0.63 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 28 F 7.68 4.72 0.00 2.69 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.28 4.39 0.00 2.78 2.88 0.00 0.00 7.07 7.19 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 30 S 7.77 4.62 0.00 4.06 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 31 T 7.22 4.30 4.41 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 1.29 0.00 0.00 32 S 8.75 4.25 0.00 3.89 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 33 I 8.43 4.33 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.61 0.75 0.00 0.00 34 N 8.72 4.92 0.00 2.72 2.83 0.00 0.00 6.93 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 9.04 5.09 0.00 3.84 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 44 T 7.90 4.05 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 1.11 0.00 0.00 45 F 8.85 3.97 0.00 3.01 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 46 V 7.80 3.43 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 0.47 0.00 0.00 0.79 0.00 0.00 47 H 7.57 4.67 0.00 2.78 3.22 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.90 4.11 0.00 1.65 1.52 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.68 4.25 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 50 M 7.98 3.98 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.76 0.00 51 T 7.92 3.93 4.48 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 1.30 0.00 0.00 52 K 8.23 3.95 0.00 1.98 2.23 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.26 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.21 1.42 7.81 53 E 7.85 4.22 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 54 R 7.90 4.40 0.00 1.90 1.99 0.00 3.30 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 55 L 7.74 4.35 0.00 1.59 1.74 0.53 1.21 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 56 S 8.88 4.59 0.00 3.96 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 57 H 8.26 4.17 0.00 3.13 3.33 0.00 5.67 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.45 0.00 2.25 2.19 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 59 K 8.46 4.23 0.00 1.85 1.69 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.54 7.81 60 F 8.25 5.14 0.00 3.04 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 61 V 8.28 4.61 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 0.76 0.00 0.00 0.03 0.00 0.00 62 I 8.42 4.74 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.57 1.03 0.00 0.00 63 A 8.89 5.29 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 64 A 8.83 4.90 1.36 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 0.00 0.00 65 Q 7.99 4.76 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.13 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 66 N 9.13 4.09 0.00 2.73 2.76 0.00 0.00 6.97 6.96 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 67 A 7.42 4.04 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 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 1.02 1.75 0.76 0.00 0.00 92 V 8.79 4.86 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 1.01 0.00 0.00 1.03 0.00 0.00 93 L 8.70 4.93 0.00 1.52 1.42 0.82 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.98 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 95 H 7.98 4.11 0.00 3.14 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.69 4.22 0.00 4.47 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 97 E 8.21 2.54 0.00 1.49 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 98 R 8.03 4.05 0.00 1.90 2.31 0.00 3.21 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 99 R 7.90 4.41 0.00 2.03 2.02 0.00 3.44 0.00 0.00 3.39 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 100 W 8.13 4.53 0.00 3.53 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 0.00 101 Y 6.97 4.26 0.00 1.54 2.16 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 0.00 102 Y 7.62 4.02 0.00 3.14 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 0.00 103 G 7.71 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.33 3.91 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 105 T 8.25 4.42 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 1.21 0.00 0.00 106 N 8.62 4.29 0.00 2.75 2.91 0.00 0.00 6.82 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.09 3.91 0.00 2.05 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 2.40 2.47 0.00 108 I 7.55 3.64 1.94 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 1.38 0.89 0.88 0.00 0.00 109 V 7.87 3.55 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 1.05 0.00 0.00 0.97 0.00 0.00 110 A 8.01 3.94 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 0.00 111 D 8.67 4.26 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 K 7.97 3.88 0.00 1.94 1.75 0.00 1.59 0.00 0.00 1.47 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.55 7.81 113 V 7.93 3.42 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 0.83 0.00 0.00 0.91 0.00 0.00 114 A 8.15 3.90 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 0.00 115 A 8.20 3.86 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 0.00 116 A 7.83 3.75 1.08 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 0.00 117 V 7.88 3.48 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.88 0.00 0.00 118 A 7.99 4.07 1.36 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 0.00 0.00 119 S 7.98 4.54 0.00 4.12 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 0.00 120 G 8.09 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 0.00 121 F 8.20 4.75 0.00 2.85 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 0.00 122 M 8.65 4.07 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.06 0.00 123 V 9.08 4.73 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.84 0.00 0.00 124 I 8.88 4.80 2.01 0.00 0.00 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 1.42 0.87 1.01 0.00 0.00 125 A 9.17 4.97 1.17 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 0.00 0.00 126 C 8.82 5.10 0.00 2.97 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 0.00 127 I 9.45 4.75 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.11 0.92 0.00 0.00 128 G 8.88 5.05 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 0.00 129 E 8.23 5.08 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 130 T 9.17 4.60 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 1.32 0.00 0.00 131 L 8.85 3.87 0.00 1.87 1.75 0.74 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.06 3.93 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.63 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 133 E 7.83 3.98 0.00 2.28 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 2.38 2.38 0.00 134 R 8.14 4.13 0.00 2.24 1.96 0.00 3.60 0.00 0.00 3.62 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.46 0.00 135 E 7.95 3.99 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 136 S 7.87 4.65 0.00 4.04 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 0.00 137 G 7.61 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.00 4.58 0.00 1.88 1.94 0.00 3.17 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 139 T 8.03 3.97 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 1.38 0.00 0.00 140 A 7.97 4.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.76 3.54 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 0.86 0.00 0.00 0.94 0.00 0.00 142 V 7.88 3.53 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 1.07 0.00 0.00 1.02 0.00 0.00 143 V 8.14 3.63 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 0.99 0.00 0.00 1.15 0.00 0.00 144 L 8.15 3.56 0.00 1.59 1.12 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 145 T 7.69 3.82 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 1.20 0.00 0.00 146 Q 7.96 4.09 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.74 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 147 I 7.32 3.86 1.78 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 1.62 1.73 0.29 0.00 0.00 148 A 7.58 4.17 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.99 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 I 7.33 3.77 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.05 0.74 0.00 0.00 151 A 8.57 4.42 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 0.00 0.00 0.00 0.00 0.00 152 K 8.11 4.11 0.00 2.04 2.09 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.54 7.81 153 K 7.61 4.52 0.00 1.78 1.78 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.52 7.81 154 L 7.55 4.95 0.00 1.61 1.41 0.16 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 155 K 9.19 4.68 0.00 1.76 1.75 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.51 7.81 156 K 8.97 3.97 0.00 1.84 1.88 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.57 7.81 157 A 8.23 4.12 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 0.00 158 D 8.37 4.46 0.00 2.85 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 0.00 159 W 8.57 4.04 0.00 3.54 3.35 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 0.00 160 A 7.69 4.18 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 K 8.05 4.27 0.00 1.71 1.87 0.00 1.49 0.00 0.00 1.49 0.00 0.00 2.73 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.45 7.81 162 V 7.47 4.67 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 0.44 0.00 0.00 0.50 0.00 0.00 163 V 9.10 4.60 2.30 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 0.98 0.00 0.00 1.03 0.00 0.00 164 I 8.77 4.98 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.22 1.00 0.00 0.00 165 A 8.90 5.05 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 0.00 166 Y 9.14 4.67 0.00 3.03 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 0.00 167 E 9.00 4.67 0.00 1.63 1.53 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 1.92 1.92 0.00 168 P 0.00 4.06 0.00 0.49 1.28 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.71 0.00 169 V 8.27 3.46 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 0.92 0.00 0.00 1.02 0.00 0.00 170 W 7.71 4.25 0.00 3.59 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 6.74 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 7.22 3.67 1.97 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.05 0.97 0.00 0.00 173 G 8.77 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 0.00 174 T 7.68 4.20 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 1.31 0.00 0.00 175 G 8.01 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 0.00 176 K 7.68 4.47 0.00 2.14 2.15 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.64 1.63 7.81 177 V 8.25 4.70 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.16 0.00 0.00 178 A 8.99 4.62 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 0.00 179 T 8.77 4.09 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 180 P 0.00 4.20 0.00 2.17 2.14 0.00 3.61 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 2.12 2.19 0.00 181 Q 8.01 3.99 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 182 Q 8.04 4.04 0.00 2.42 2.39 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 2.46 2.45 0.00 183 A 8.05 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Q 8.16 3.79 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 185 E 8.36 3.86 0.00 2.21 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 2.30 2.33 0.00 186 A 7.84 3.75 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.43 4.04 0.00 3.14 3.48 0.00 5.65 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 0.00 188 A 8.39 4.07 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 0.00 189 L 7.97 3.89 0.00 1.78 1.90 0.94 0.78 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 0.00 190 I 7.63 3.73 2.01 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.42 1.00 0.00 0.00 191 R 8.25 3.90 0.00 2.00 1.94 0.00 3.16 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 192 S 8.47 4.17 0.00 3.92 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 0.00 193 W 8.47 4.04 0.00 3.50 3.34 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 0.00 194 V 8.24 3.28 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 0.58 0.00 0.00 1.07 0.00 0.00 195 S 8.39 4.04 0.00 3.88 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 0.00 196 S 7.58 3.92 0.00 3.92 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 0.00 197 K 7.28 3.87 0.00 0.79 0.93 0.00 0.97 0.00 0.00 0.61 0.00 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.98 7.81 198 I 8.57 3.99 1.27 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 0.70 -0.09 0.30 0.00 0.00 199 G 6.10 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 0.00 0.00 0.00 0.00 200 A 7.86 4.03 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 0.00 201 D 7.91 4.27 0.00 2.86 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 0.00 202 V 7.59 3.62 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 0.64 0.00 0.00 0.82 0.00 0.00 203 A 7.78 4.04 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 0.00 204 G 7.80 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 E 7.59 4.42 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 206 L 7.22 4.10 0.00 1.87 1.82 1.23 1.14 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 0.00 207 R 8.74 4.51 0.00 1.97 1.95 0.00 3.40 0.00 0.00 3.56 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 208 I 9.35 4.99 2.09 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 1.31 0.80 0.77 0.00 0.00 209 L 9.33 4.96 0.00 1.63 1.74 1.08 0.83 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 0.00 210 Y 9.00 5.24 0.00 3.27 3.08 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 0.00 211 G 7.82 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 0.00 0.00 0.00 0.00 212 G 9.97 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 0.00 0.00 0.00 213 S 8.46 3.89 0.00 4.22 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 0.00 214 V 7.87 4.10 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 0.36 0.00 0.00 1.22 0.00 0.00 215 N 8.84 5.14 0.00 3.20 2.91 0.00 0.00 6.60 6.39 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 0.00 216 G 8.47 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 K 7.79 3.73 0.00 1.69 1.80 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.52 7.81 218 N 7.92 4.58 0.00 3.04 3.05 0.00 0.00 5.92 7.94 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 0.00 219 A 7.61 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 R 8.00 4.09 0.00 1.93 1.98 0.00 3.42 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.86 0.00 221 T 7.94 3.94 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 1.23 0.00 0.00 222 L 7.98 4.16 0.00 2.27 1.96 1.08 0.55 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 0.00 223 Y 8.41 4.05 0.00 3.32 3.36 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 0.00 224 Q 7.76 4.12 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.63 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 225 Q 7.46 4.09 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.70 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 226 R 8.66 3.79 0.00 1.72 1.94 0.00 3.18 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 227 D 8.47 4.78 0.00 2.79 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 0.00 228 V 7.14 4.12 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.73 0.00 0.00 229 N 9.39 4.98 0.00 2.88 2.82 0.00 0.00 6.59 7.74 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 0.00 230 G 6.95 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 0.00 231 F 8.53 5.60 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 L 8.98 5.35 0.00 1.83 1.53 1.04 0.89 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 0.00 233 A 9.25 4.79 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 0.00 234 G 8.59 3.68 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 0.00 0.00 0.00 *238 L 8.19 4.47 0.00 1.55 1.40 0.94 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 239 K 7.75 4.71 0.00 1.84 1.63 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.41 7.81 240 P 0.00 4.35 0.00 2.15 2.07 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 241 E 8.17 4.28 0.00 2.21 2.22 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 2.41 2.42 0.00 242 F 8.42 4.21 0.00 3.35 3.47 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 0.00 0.00 0.00 0.00 243 V 7.87 3.56 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 1.10 0.00 0.00 1.31 0.00 0.00 244 D 7.99 4.30 0.00 2.86 2.65 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 0.00 245 I 7.23 3.47 1.71 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.32 0.72 0.00 0.00 246 I 7.34 3.53 1.76 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.07 0.67 0.00 0.00 247 K 7.87 3.94 0.00 1.85 1.83 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.58 7.81 248 A 7.68 4.16 1.31 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 0.00 0.00 249 T 7.36 3.08 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 250 Q 7.26 4.04 0.00 2.03 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.68 0.00 0.00 0.00 0.00 0.00 1.92 2.21 0.00 * Residues marked with a * may have inaccurate shift predictions.