NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2662 7.8827 121.4472 61.2271 38.6080 173.7619 17 V 4.4125 8.1482 125.7567 61.0701 32.6477 174.5602 18 G 4.0686 8.5487 114.2246 46.7206 0.0000 173.4184 19 G 4.2679 7.7358 109.7973 44.4135 0.0000 172.4363 20 Y 4.9640 7.8943 117.8145 55.2262 42.2995 175.0181 21 T 4.2470 8.5538 116.6474 64.0904 68.8303 176.0043 22 C 4.1134 8.6516 125.5857 59.5627 37.0858 175.5720 23 G 4.0218 7.8878 103.6146 44.7793 0.0000 172.8522 24 A 4.3236 8.5650 126.0128 53.9354 18.6106 176.8022 25 N 4.2788 8.9536 118.6801 54.4131 36.1713 175.4571 26 T 4.1276 7.7689 108.4630 63.0922 69.7770 175.0811 27 V 4.0859 7.0733 122.0103 60.3238 31.2782 173.6910 28 P 4.4702 0.0000 0.0000 64.3173 32.1434 178.2834 29 Y 5.1838 6.9468 116.0210 57.1926 38.7713 174.5766 30 Q 4.5450 7.4970 123.6645 56.2472 29.5075 175.5188 31 V 4.8531 9.2107 119.6618 59.6703 35.8648 174.2341 32 S 4.9971 8.8019 117.3508 56.6392 64.7496 172.6747 33 L 4.6633 8.5294 127.5581 53.3448 43.2481 175.0081 34 N 5.8589 9.0072 122.6344 49.9959 42.0540 174.9596 *37 S 4.2129 8.4436 120.7350 58.4739 64.1876 174.4104 38 G 4.0010 9.6790 109.4867 46.6279 0.0000 173.3565 39 Y 4.6249 6.6630 114.8468 55.8557 40.1498 173.0983 40 H 4.4764 8.8764 122.0452 56.6750 30.2855 174.8014 41 F 5.1023 7.9413 119.3938 56.6086 39.4698 173.8802 42 C 4.8453 6.9398 114.7292 56.1525 43.4798 173.6366 43 G 4.3134 9.2108 109.8934 45.9990 0.0000 172.2830 44 G 4.3259 8.2857 105.5292 46.2059 0.0000 172.5240 45 S 5.4545 8.8629 115.6647 56.3118 66.5234 173.7487 46 L 4.7694 9.1847 128.2210 55.0814 42.3440 177.1641 47 I 4.5450 8.7088 119.3618 60.9608 39.2836 174.3407 48 N 4.8268 7.6432 117.3329 52.0349 39.5896 174.8412 49 S 4.2846 8.7463 111.7248 60.5684 63.1235 175.1894 50 Q 4.5044 8.9735 119.0054 55.2139 30.3268 174.7629 51 W 5.5345 8.2435 118.1438 54.7792 33.6492 174.2688 52 V 4.9204 9.3027 123.4079 61.1830 34.2903 174.1564 53 V 4.7609 8.9940 127.4379 61.8405 33.5048 174.7572 54 S 5.1796 8.9550 121.3309 57.3966 66.4199 171.9973 55 A 4.8758 8.6915 120.3716 49.9791 20.1722 178.5179 56 A 3.7660 8.1505 124.2592 55.1780 18.4676 179.3103 57 H 4.3255 8.0679 109.9525 57.4524 28.5585 175.4386 58 C 4.6233 7.6848 117.0476 57.3330 40.5177 173.3301 59 Y 4.3351 7.6638 122.1532 57.8790 38.7757 175.2005 60 K 3.2122 7.0965 123.0534 55.7398 34.6731 174.7070 61 S 4.2628 7.9795 114.8774 58.5891 64.0504 173.2719 62 G 3.7327 8.3816 106.2010 46.7674 0.0000 173.7684 63 I 4.2164 7.5598 119.5840 60.3105 39.1240 174.9619 64 Q 4.7370 8.8545 127.5469 54.2624 31.5098 174.2166 65 V 4.3265 8.8863 127.0381 61.8289 33.5970 174.6314 66 R 5.0918 8.9610 126.8917 54.6599 32.6525 174.8661 67 L 4.7634 9.1962 124.7208 52.6009 44.9004 177.5478 *69 G 4.0486 8.3623 108.5129 45.3442 0.0000 172.8257 70 E 4.3498 8.2779 118.4975 55.6010 29.8324 174.1653 71 D 4.8980 7.9534 117.9576 55.3596 44.6948 174.5989 72 N 4.9380 9.0110 119.4648 53.2776 39.2809 175.9703 73 I 4.0763 8.5572 119.6814 61.8078 37.9380 176.1126 74 N 4.7844 8.9222 118.0540 53.0540 39.1641 174.6958 75 V 4.3105 7.4238 118.3845 60.6752 34.2399 175.0386 76 V 4.0562 8.4930 126.9122 62.8611 31.0542 175.1753 77 E 4.3999 9.6541 127.2524 55.8189 30.3402 177.1489 78 G 4.0672 8.5328 106.7976 45.4114 0.0000 173.9186 79 N 4.9130 7.7836 114.4649 52.6489 39.6430 174.3762 80 E 4.4877 7.8771 117.9186 56.4687 30.6955 176.2882 81 Q 4.3888 8.9756 121.0368 54.2257 32.4447 174.1944 82 F 5.5811 8.7187 123.0778 56.0351 40.9276 175.4748 83 I 4.6783 8.8228 124.5104 59.4996 41.3307 175.2387 84 S 4.6929 8.7588 122.7412 58.2445 64.1603 173.4410 85 A 4.6105 8.6609 126.2250 52.2437 18.1945 177.7483 86 S 4.6134 8.9735 116.8912 59.3077 64.5801 174.4615 87 K 4.5911 7.4388 117.2756 56.0587 35.1973 174.5379 88 S 5.3049 8.8044 117.1720 57.0180 66.7179 173.9323 89 I 4.5697 9.1136 123.5305 59.6195 40.3009 174.7778 90 V 4.1603 8.3970 127.4449 62.1148 32.6429 175.2026 91 H 3.5945 8.6149 127.2080 55.8291 29.9832 174.4213 92 P 4.2614 0.0000 0.0000 65.3128 31.1472 177.0996 93 S 4.6463 7.7102 112.3968 57.9573 63.3402 173.2272 94 Y 4.3265 8.0540 123.4972 57.9553 38.9757 174.5729 95 N 4.6162 8.4731 125.8612 51.5172 40.0072 175.0853 96 S 4.1069 7.9035 119.7932 59.1912 63.8764 175.0627 97 E 4.0008 8.6623 123.0387 58.7749 29.4489 177.1913 98 T 3.9512 7.8768 106.4903 60.8780 69.8129 174.6758 99 Y 4.0754 8.1879 118.6017 58.8763 36.2710 169.4686 100 N 4.4576 7.5125 118.9964 54.8710 39.6224 174.5892 101 N 4.9564 8.7536 120.8515 54.2686 36.0456 175.4778 102 D 4.6192 7.7744 118.0880 52.7287 40.2026 174.1097 103 I 4.9314 7.0720 120.9027 59.4832 42.0956 172.8980 104 M 5.4634 9.3221 125.0170 54.0553 35.2015 173.4080 105 L 5.4105 9.2419 120.0848 53.2437 45.3013 175.5592 106 I 5.0716 8.9937 122.8242 59.4943 40.9587 174.2461 107 K 3.8644 8.6043 128.6198 54.6040 33.7695 175.2948 108 L 4.4052 8.2372 130.4343 54.6670 41.7673 177.9751 109 K 4.1776 8.9913 128.1979 57.7442 32.1281 175.0595 110 S 4.5899 7.7419 111.1992 55.8392 66.0927 173.4260 111 A 4.3123 8.4728 123.5600 52.2199 18.6448 177.4053 112 A 4.2078 8.8072 124.0594 51.9622 19.5582 177.6632 113 S 4.4486 8.8838 116.1293 56.9882 62.5726 174.0101 114 L 4.4591 8.4544 128.2755 54.6610 42.3722 176.5274 115 N 4.8229 8.7622 119.2780 52.3595 39.7782 174.8524 116 S 4.2334 8.6944 111.6213 60.7257 63.3179 174.7726 117 R 4.3580 8.6134 118.8722 56.0472 30.8808 176.4286 118 V 4.3821 7.8318 117.5624 60.7582 32.6153 173.4066 119 A 5.1717 8.6441 127.8307 49.8812 22.8628 175.2533 120 S 5.0473 8.7623 114.5237 57.9168 64.7945 173.0506 121 I 4.4285 8.3327 121.6254 59.0957 39.5831 175.5265 122 S 4.3907 8.4167 124.4413 58.4300 64.0096 173.8433 123 L 4.2524 8.3561 123.2517 53.2838 42.4768 175.3163 124 P 4.4501 0.0000 0.0000 63.1528 31.6286 176.3795 125 T 4.1093 8.2648 109.3815 62.7461 69.8712 174.6540 *127 S 4.2532 7.5571 114.5675 57.9065 64.0492 173.9151 128 C 4.3836 8.3644 117.6967 56.6184 40.6030 173.7856 129 A 4.3268 8.0683 125.3699 51.6427 19.3789 176.9676 130 S 4.5030 8.0434 113.2401 56.4425 65.4738 173.2319 *132 A 4.1644 8.1893 123.1793 53.3663 19.1936 177.4543 133 G 3.9928 9.0132 110.1293 45.5102 0.0000 174.4006 134 T 3.9886 7.5139 117.3587 63.8337 69.5293 173.6365 135 Q 4.5460 8.5858 124.8689 55.8865 29.7332 175.9523 136 C 5.2565 9.2050 120.3862 55.0388 45.1039 172.5206 137 L 5.0816 9.0568 123.0909 53.7155 43.5473 175.1024 138 I 5.2019 9.0427 127.6654 58.9513 40.0304 174.9225 139 S 4.8312 8.1979 118.8215 56.6429 66.2861 173.2325 140 G 3.7372 7.4945 108.4544 46.3195 0.0000 172.9171 141 W 4.6363 8.5448 116.8215 56.2735 29.2749 176.8737 142 G 4.0952 8.5127 109.3533 44.2603 0.0000 173.4296 143 N 3.6189 8.3127 118.2293 54.2941 39.1700 174.5275 144 T 4.9663 8.6601 115.5661 61.1586 69.7420 174.4279 145 K 4.5301 7.7380 124.0868 52.9664 33.5653 181.6014 146 S 4.3437 8.7348 118.7993 59.2034 62.7616 174.3507 147 S 4.6016 7.7845 113.8795 57.2439 65.2368 175.0562 148 G 3.8430 9.3421 112.9564 44.9065 0.0000 171.6570 149 T 4.7920 8.0933 114.5450 62.1501 72.5350 174.0516 150 S 4.4658 9.1683 121.0379 57.8011 65.9421 172.2720 151 Y 4.8756 8.7763 125.7340 55.7306 39.2386 174.2119 152 P 4.6800 0.0000 0.0000 62.5642 32.8296 175.6211 153 D 4.7592 8.6290 118.0152 55.2203 42.0009 176.9566 154 V 5.1437 7.5073 111.0587 58.8455 33.7428 175.8300 155 L 3.1963 8.5454 125.7719 55.0516 42.9886 175.9986 156 K 4.9445 8.2709 124.8401 54.8603 35.2771 174.5505 157 C 5.2334 8.5810 119.4717 55.1936 43.0293 172.9847 158 L 4.9483 8.6652 122.7999 53.7064 45.5316 174.3463 159 K 5.0873 8.9880 127.5047 55.4683 33.4190 175.3411 160 A 4.8950 9.2865 127.9264 50.4703 23.1894 173.4609 161 P 5.0724 0.0000 0.0000 61.5535 34.0597 175.1576 162 I 4.3998 8.5261 123.0471 61.6390 37.9251 175.6713 163 L 4.8639 8.6578 127.3228 53.2797 43.2192 177.0743 164 S 4.3522 8.0227 116.0589 58.1608 63.8596 175.3340 165 D 4.4125 8.7437 122.2247 57.5316 40.4158 179.3158 166 S 4.1504 8.0585 114.8350 61.3646 63.2072 176.5708 167 S 4.0889 7.7260 117.4882 61.1413 62.6543 175.5442 168 C 4.2648 8.4898 122.3790 59.6200 41.7196 175.8829 169 K 4.0099 8.8287 120.2671 59.5281 31.3565 179.6535 170 S 4.2249 8.2747 115.0572 61.4620 62.8110 176.2286 171 A 4.0542 7.6940 122.2532 53.7124 19.6909 177.3071 172 Y 4.9090 7.5828 114.3465 55.2290 38.5465 172.9233 173 P 4.5834 0.0000 0.0000 63.4918 32.1001 178.2014 174 G 3.9901 8.9176 108.7352 46.0997 0.0000 173.7441 175 Q 4.4538 8.1060 116.9564 55.7333 30.2168 175.5223 176 I 4.3883 7.8489 119.4790 60.0878 38.4172 175.4258 177 T 4.5851 8.2349 115.7836 59.6662 70.9746 175.1754 178 S 4.3411 8.5269 114.8245 60.4622 63.2327 174.3901 179 N 4.9310 7.9571 117.5681 53.4506 38.4930 173.9300 180 M 5.5950 7.9308 117.1591 53.7011 36.0090 174.6003 181 F 5.1280 8.7941 115.1500 55.8598 42.2457 172.4228 182 C 5.5134 9.0156 116.0563 55.5737 41.4170 172.7932 183 A 5.0101 9.4308 122.4890 50.7422 22.3978 174.4427 184 G 3.8285 7.1891 107.1589 44.5779 0.0000 173.9250 184A Y 4.6677 8.4325 121.1438 56.0333 41.1225 176.3694 185 L 4.1350 8.7946 127.4197 58.0347 42.1143 179.7924 186 E 3.3667 8.1873 113.8043 56.9754 29.9084 181.8751 187 G 3.9237 7.4602 103.0716 45.1073 0.0000 172.2504 188 G 4.0741 9.6346 105.3457 45.0058 0.0000 173.7772 188A K 5.5161 7.3178 117.4758 54.6598 35.6724 175.2253 189 D 4.6696 8.4212 122.8802 53.5762 44.7936 174.8593 190 S 4.8945 8.2027 115.1333 58.3906 64.9544 171.5411 191 C 4.7270 9.2234 118.7076 55.3472 46.8630 172.1745 192 Q 4.2802 8.5992 121.6692 58.1213 28.6778 177.2519 193 G 4.2352 9.3166 113.2988 45.6804 0.0000 173.8501 194 D 4.6914 8.4428 118.7249 55.4607 41.6857 176.8161 195 S 4.6031 8.0737 115.7531 60.3674 63.3393 175.4457 196 G 4.1847 8.8015 112.0022 46.5186 0.0000 173.9037 197 G 4.2581 7.9042 107.4843 44.7823 0.0000 171.1911 198 P 5.0743 0.0000 0.0000 62.4072 33.4332 175.7334 199 V 4.5770 8.7269 121.8701 61.4647 33.8239 174.0531 200 V 4.8981 8.7856 128.9493 61.2431 34.2028 173.7099 201 C 5.0858 8.7623 124.4056 55.5822 43.8728 174.5992 202 S 3.5610 9.7674 120.7360 59.7438 60.0163 173.4083 203 G 3.9333 8.3839 104.8736 45.5280 0.0000 173.6436 204 K 4.7226 7.6519 118.0397 53.1313 35.2776 175.4735 *209 L 4.2775 8.2170 122.6177 55.4738 41.8368 175.8590 210 Q 4.4829 8.8141 125.3331 56.4883 30.5856 175.7075 211 G 5.3018 8.0233 104.8123 45.7099 0.0000 171.4415 212 I 5.2654 8.2511 120.2106 58.8178 40.9176 175.1583 213 V 3.7891 8.9124 127.4240 64.0872 31.8103 174.1617 214 S 4.9939 8.5820 120.6537 58.6451 64.4935 174.1237 215 W 5.0344 7.6964 114.3198 56.1032 32.0621 172.0611 216 G 3.9202 8.2158 106.0029 46.7008 0.0000 172.5290 217 S 4.7275 8.3224 114.3570 56.4633 63.6073 172.2230 *219 G 4.2705 8.1204 118.2038 45.6777 0.0000 171.3769 220 C 4.9500 8.0970 116.4862 56.4349 45.4707 173.9091 221 A 3.9127 9.2242 125.5358 53.3002 16.6402 177.2689 221A Q 4.5915 7.3015 118.0437 56.0591 29.9373 175.8646 222 K 4.2553 8.3727 121.8519 57.8279 32.7636 176.4281 223 N 4.2763 9.7389 122.2285 53.9366 36.8426 175.3417 224 K 4.2646 7.5673 117.7047 53.5521 32.3259 173.9851 225 P 4.6107 0.0000 0.0000 61.9031 33.0621 177.0467 226 G 3.5621 8.4033 106.3989 46.1869 0.0000 172.6490 227 V 4.4160 7.7926 122.1548 60.6432 33.9600 174.0907 228 Y 4.8965 8.1775 124.6631 55.9191 42.0404 175.0824 229 T 4.3516 8.6736 120.1336 63.7420 69.9806 174.2227 230 K 5.1310 9.3434 128.4053 55.4364 31.2961 177.2207 231 V 3.9957 8.8877 126.4427 65.7182 31.4049 174.9347 232 C 4.3755 8.2686 112.8286 58.2334 41.6143 174.8844 233 N 4.1996 8.0222 117.2423 54.6118 38.4356 175.0470 234 Y 4.7643 7.9025 117.7389 57.6423 39.0695 177.7063 235 V 3.7080 7.9020 121.5812 65.9843 31.5369 177.8274 236 S 4.0681 8.0754 112.5078 61.1250 62.3238 175.7239 237 W 4.1712 8.3208 130.5871 60.4679 30.4193 177.7812 238 I 3.0176 8.4457 120.0681 64.2360 36.5910 178.5628 239 K 3.7595 8.0775 119.3549 59.5838 31.6194 179.5322 240 Q 3.9180 7.9015 117.4426 58.9779 28.9285 178.5440 241 T 3.7351 7.5475 117.1828 66.3880 68.3330 176.9526 242 I 2.6120 7.2563 115.0740 63.4655 37.1829 178.1106 243 A 4.0249 7.5875 121.5717 54.1613 18.1619 178.7132 244 S 4.6679 7.2745 110.8434 58.3769 63.2840 174.1017 245 N 4.6730 7.9843 125.1779 53.6590 39.5966 174.1506 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.27 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.72 0.87 0.00 0.00 17 V 8.15 4.41 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 1.15 0.00 0.00 0.98 0.00 0.00 18 G 8.55 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 19 G 7.74 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 20 Y 7.89 4.96 0.00 2.96 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.55 4.25 4.30 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 1.25 0.00 0.00 22 C 8.65 4.11 0.00 2.73 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 23 G 7.89 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.56 4.32 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 25 N 8.95 4.28 0.00 2.87 2.92 0.00 0.00 7.15 7.54 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 26 T 7.77 4.13 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 1.22 0.00 0.00 27 V 7.07 4.09 1.74 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 0.23 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.47 0.00 2.37 2.39 0.00 3.63 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 2.18 1.99 0.00 29 Y 6.95 5.18 0.00 3.26 3.40 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 30 Q 7.50 4.55 0.00 1.78 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.72 0.00 0.00 0.00 0.00 0.00 1.83 2.44 0.00 31 V 9.21 4.85 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 1.01 0.00 0.00 1.03 0.00 0.00 32 S 8.80 5.00 0.00 3.15 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.53 4.66 0.00 0.29 0.95 0.79 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.01 5.86 0.00 2.41 2.47 0.00 0.00 6.78 7.72 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 *37 S 8.44 4.21 0.00 3.70 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.68 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 0.00 0.00 0.00 39 Y 6.66 4.62 0.00 3.16 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 40 H 8.88 4.48 0.00 2.86 3.18 0.00 5.86 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 41 F 7.94 5.10 0.00 3.06 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 42 C 6.94 4.85 0.00 2.36 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.21 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 0.00 0.00 0.00 0.00 44 G 8.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.86 5.45 0.00 3.82 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 46 L 9.18 4.77 0.00 1.87 1.81 1.08 0.89 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 47 I 8.71 4.54 1.90 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 1.56 0.98 1.00 0.00 0.00 48 N 7.64 4.83 0.00 3.00 3.01 0.00 0.00 6.02 7.64 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 49 S 8.75 4.28 0.00 4.24 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.97 4.50 0.00 2.11 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 51 W 8.24 5.53 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 52 V 9.30 4.92 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 1.14 0.00 0.00 0.98 0.00 0.00 53 V 8.99 4.76 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 1.02 0.00 0.00 1.00 0.00 0.00 54 S 8.96 5.18 0.00 3.91 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.69 4.88 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 56 A 8.15 3.77 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.07 4.33 0.00 3.02 2.71 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.68 4.62 0.00 3.22 3.32 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 59 Y 7.66 4.34 0.00 2.85 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.10 3.21 0.00 1.41 1.28 0.00 0.82 0.00 0.00 1.26 0.00 0.00 2.17 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.62 0.94 7.81 61 S 7.98 4.26 0.00 3.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.38 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.56 4.22 1.89 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 1.44 0.75 0.93 0.00 0.00 64 Q 8.85 4.74 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 65 V 8.89 4.33 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 0.99 0.00 0.00 0.90 0.00 0.00 66 R 8.96 5.09 0.00 1.67 1.80 0.00 2.66 0.00 0.00 2.59 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.26 0.00 67 L 9.20 4.76 0.00 1.63 1.62 1.04 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.36 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 70 E 8.28 4.35 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.03 0.00 71 D 7.95 4.90 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.01 4.94 0.00 2.82 2.80 0.00 0.00 7.18 8.57 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 73 I 8.56 4.08 1.43 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.50 -0.39 0.00 0.00 74 N 8.92 4.78 0.00 2.79 2.87 0.00 0.00 6.61 7.55 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 75 V 7.42 4.31 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.49 4.06 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 0.80 0.00 0.00 1.01 0.00 0.00 77 E 9.65 4.40 0.00 1.94 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 2.28 2.46 0.00 78 G 8.53 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 79 N 7.78 4.91 0.00 2.68 2.80 0.00 0.00 7.05 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 80 E 7.88 4.49 0.00 1.37 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 2.46 2.46 0.00 81 Q 8.98 4.39 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 82 F 8.72 5.58 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.82 4.68 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 1.24 0.68 0.93 0.00 0.00 84 S 8.76 4.69 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.66 4.61 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.97 4.61 0.00 3.75 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 87 K 7.44 4.59 0.00 1.85 1.89 0.00 1.54 0.00 0.00 1.90 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.23 1.31 7.81 88 S 8.80 5.30 0.00 3.97 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 89 I 9.11 4.57 2.03 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.02 1.13 0.00 0.00 90 V 8.40 4.16 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 0.64 0.00 0.00 0.71 0.00 0.00 91 H 8.61 3.59 0.00 2.87 3.04 0.00 5.65 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.26 0.00 2.14 2.16 0.00 2.29 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.81 0.00 93 S 7.71 4.65 0.00 3.95 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 94 Y 8.05 4.33 0.00 3.01 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.47 4.62 0.00 2.60 2.49 0.00 0.00 6.61 7.22 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 96 S 7.90 4.11 0.00 4.10 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 97 E 8.66 4.00 0.00 1.82 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 2.18 2.13 0.00 98 T 7.88 3.95 4.12 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 0.00 0.00 1.09 0.00 0.00 99 Y 8.19 4.08 0.00 2.78 3.14 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 0.00 100 N 7.51 4.46 0.00 2.82 2.70 0.00 0.00 7.26 6.59 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 0.00 101 N 8.75 4.96 0.00 3.10 2.75 0.00 0.00 7.23 8.06 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 0.00 102 D 7.77 4.62 0.00 3.21 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 0.00 103 I 7.07 4.93 1.46 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 1.51 1.20 0.02 0.00 0.00 104 M 9.32 5.46 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 105 L 9.24 5.41 0.00 1.68 1.86 0.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.99 5.07 1.93 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 1.21 0.77 0.90 0.00 0.00 107 K 8.60 3.86 0.00 0.79 1.11 0.00 1.09 0.00 0.00 1.33 0.00 0.00 2.62 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.24 4.41 0.00 1.44 1.61 0.92 0.78 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 0.00 109 K 8.99 4.18 0.00 1.50 1.74 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.39 1.28 7.81 110 S 7.74 4.59 0.00 3.87 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 0.00 111 A 8.47 4.31 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.81 4.21 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.88 4.45 0.00 3.89 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 0.00 114 L 8.45 4.46 0.00 1.70 1.61 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.76 4.82 0.00 2.89 2.92 0.00 0.00 6.52 8.57 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 0.00 116 S 8.69 4.23 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.61 4.36 0.00 1.89 2.01 0.00 3.20 0.00 0.00 3.34 7.31 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.25 0.00 4.00 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 0.00 128 C 8.36 4.38 0.00 2.94 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 0.00 129 A 8.07 4.33 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.04 4.50 0.00 3.96 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 *132 A 8.19 4.16 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 0.00 133 G 9.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.51 3.99 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 1.15 0.00 0.00 135 Q 8.59 4.55 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 136 C 9.20 5.26 0.00 2.85 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 9.06 5.08 0.00 1.75 1.59 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.04 5.20 1.87 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 0.74 1.50 0.95 0.00 0.00 139 S 8.20 4.83 0.00 3.55 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.49 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.54 4.64 0.00 3.21 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.51 4.10 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 0.00 0.00 0.00 143 N 8.31 3.62 0.00 2.09 2.57 0.00 0.00 7.10 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.66 4.97 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 145 K 7.74 4.53 0.00 1.78 1.62 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 0.97 7.81 146 S 8.73 4.34 0.00 3.92 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 0.00 147 S 7.78 4.60 0.00 3.97 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 0.00 148 G 9.34 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.09 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 1.44 0.00 0.00 150 S 9.17 4.47 0.00 3.86 3.63 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 0.00 151 Y 8.78 4.88 0.00 2.93 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.68 0.00 2.45 2.08 0.00 4.07 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.02 0.00 153 D 8.63 4.76 0.00 2.79 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.51 5.14 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 1.05 0.00 0.00 0.97 0.00 0.00 155 L 8.55 3.20 0.00 1.20 1.24 -0.66 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.27 4.94 0.00 1.68 1.49 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.46 7.81 157 C 8.58 5.23 0.00 1.51 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 0.00 0.00 0.00 158 L 8.67 4.95 0.00 1.70 1.45 1.04 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.99 5.09 0.00 1.95 1.82 0.00 1.91 0.00 0.00 1.95 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.71 1.50 7.81 160 A 9.29 4.89 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 0.00 161 P 0.00 5.07 0.00 2.02 2.09 0.00 3.13 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.75 0.00 162 I 8.53 4.40 1.77 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.81 0.00 0.00 163 L 8.66 4.86 0.00 1.57 1.60 0.93 0.94 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 0.00 164 S 8.02 4.35 0.00 4.15 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 0.00 165 D 8.74 4.41 0.00 2.77 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 0.00 166 S 8.06 4.15 0.00 4.06 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 0.00 167 S 7.73 4.09 0.00 4.21 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 0.00 168 C 8.49 4.26 0.00 3.19 3.40 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 0.00 169 K 8.83 4.01 0.00 1.92 1.90 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.63 7.81 170 S 8.27 4.22 0.00 4.11 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 0.00 171 A 7.69 4.05 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.58 4.91 0.00 3.05 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 0.00 173 P 0.00 4.58 0.00 2.21 2.11 0.00 3.61 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 8.92 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.11 4.45 0.00 2.45 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.63 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 176 I 7.85 4.39 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.93 1.01 0.00 0.00 177 T 8.23 4.59 4.30 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 1.30 0.00 0.00 178 S 8.53 4.34 0.00 4.02 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 0.00 179 N 7.96 4.93 0.00 3.15 3.13 0.00 0.00 6.61 7.54 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 0.00 180 M 7.93 5.59 0.00 1.88 2.02 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.64 0.00 181 F 8.79 5.13 0.00 3.12 3.11 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 0.00 182 C 9.02 5.51 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.43 5.01 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 0.00 184 G 7.19 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.43 4.67 0.00 3.08 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.79 4.14 0.00 1.74 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.19 3.37 0.00 1.99 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 1.88 0.00 187 G 7.46 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 0.00 188 G 9.63 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 188A K 7.32 5.52 0.00 1.58 1.77 0.00 1.09 0.00 0.00 1.94 0.00 0.00 2.63 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.49 1.13 7.81 189 D 8.42 4.67 0.00 2.82 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 0.00 190 S 8.20 4.89 0.00 3.99 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 0.00 191 C 9.22 4.73 0.00 2.95 3.05 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 0.00 192 Q 8.60 4.28 0.00 2.25 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.15 0.00 0.00 0.00 0.00 0.00 2.76 2.60 0.00 193 G 9.32 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 0.00 194 D 8.44 4.69 0.00 2.96 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 0.00 195 S 8.07 4.60 0.00 4.01 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.80 4.18 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 0.00 197 G 7.90 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 0.00 0.00 0.00 0.00 198 P 0.00 5.07 0.00 2.35 2.38 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 199 V 8.73 4.58 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 0.81 0.00 0.00 0.63 0.00 0.00 200 V 8.79 4.90 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 0.70 0.00 0.00 0.63 0.00 0.00 201 C 8.76 5.09 0.00 2.79 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.77 3.56 0.00 3.94 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 0.00 203 G 8.38 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.65 4.72 0.00 1.72 1.63 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.40 7.81 *209 L 8.22 4.28 0.00 1.51 1.65 0.97 0.76 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 0.00 210 Q 8.81 4.48 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.42 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.02 5.30 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 0.00 212 I 8.25 5.27 1.93 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 1.30 0.79 0.99 0.00 0.00 213 V 8.91 3.79 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 1.05 0.00 0.00 1.17 0.00 0.00 214 S 8.58 4.99 0.00 4.04 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.70 5.03 0.00 3.30 3.18 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 0.00 216 G 8.22 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 0.00 217 S 8.32 4.73 0.00 4.20 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 8.12 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 0.00 220 C 8.10 4.95 0.00 2.94 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 0.00 221 A 9.22 3.91 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 221A Q 7.30 4.59 0.00 2.31 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 222 K 8.37 4.26 0.00 1.72 1.71 0.00 1.91 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.47 7.81 223 N 9.74 4.28 0.00 2.74 2.82 0.00 0.00 6.76 7.49 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 0.00 224 K 7.57 4.26 0.00 1.73 1.78 0.00 1.72 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.41 7.81 225 P 0.00 4.61 0.00 2.12 2.09 0.00 3.59 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 2.09 1.98 0.00 226 G 8.40 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.79 4.42 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 -0.72 0.00 0.00 228 Y 8.18 4.90 0.00 1.44 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.67 4.35 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 1.21 0.00 0.00 230 K 9.34 5.13 0.00 2.18 1.96 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.57 7.81 231 V 8.89 4.00 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 1.24 0.00 0.00 1.11 0.00 0.00 232 C 8.27 4.38 0.00 3.16 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 0.00 233 N 8.02 4.20 0.00 2.19 2.42 0.00 0.00 6.84 7.44 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 0.00 234 Y 7.90 4.76 0.00 3.26 3.28 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 0.00 235 V 7.90 3.71 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.09 0.00 0.00 236 S 8.08 4.07 0.00 3.96 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 0.00 237 W 8.32 4.17 0.00 3.52 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.45 3.02 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.06 0.72 0.00 0.00 239 K 8.08 3.76 0.00 1.72 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.56 7.81 240 Q 7.90 3.92 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 241 T 7.55 3.74 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 242 I 7.26 2.61 0.63 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.37 -0.70 0.00 0.00 243 A 7.59 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 0.00 244 S 7.27 4.67 0.00 3.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.98 4.67 0.00 2.92 2.97 0.00 0.00 6.73 8.81 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 * Residues marked with a * may have inaccurate shift predictions.