NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4301 8.2148 119.3756 56.5061 33.9339 175.5471 3 Y 4.0244 7.9971 118.8892 57.9312 38.4267 174.8264 4 K 4.5248 9.4726 123.1503 57.4724 34.6997 176.1023 5 A 5.2577 7.9869 120.8890 50.1694 23.1750 174.6849 6 A 4.9035 9.3870 122.6062 50.1053 22.2957 175.0448 7 I 4.8977 8.3860 123.7438 59.5943 39.9883 174.7165 8 F 4.7101 9.0859 126.3816 55.4128 40.6376 176.6363 9 D 5.2979 8.0616 122.2662 53.6722 42.7916 174.0395 *11 D 4.6397 8.6426 115.8661 55.7412 42.1056 176.7079 12 G 4.0233 9.5090 112.4552 45.7431 0.0000 173.8768 13 T 4.2121 7.6129 112.4867 64.4634 70.9806 175.7814 14 I 4.5742 7.6395 114.0652 61.1560 40.1462 174.3916 15 L 5.1206 8.1636 124.9182 53.2221 44.9501 174.9713 16 D 4.6472 8.9683 127.5143 53.4863 40.9166 176.2888 17 T 4.6119 8.4624 115.1341 61.5208 70.0445 176.0315 18 S 4.1144 8.1299 117.3377 61.0856 63.1279 176.1824 19 A 3.9729 7.8927 124.4096 55.3349 18.3736 179.1602 20 D 4.4291 8.0803 116.9819 57.4708 40.8890 178.7356 21 L 3.8332 8.1332 119.5506 58.0890 41.5288 179.8305 22 T 3.9412 7.8384 115.1925 66.6339 68.3996 176.7504 23 S 4.1961 8.2960 114.8481 61.4600 62.4190 176.1118 24 A 4.2919 8.4144 123.5145 55.1418 18.1499 179.4186 25 L 4.3801 8.7260 119.2682 58.5686 42.1678 178.9118 26 N 4.5431 8.5817 116.5352 56.4384 38.4507 176.6614 27 Y 3.9045 8.3716 120.7409 60.6885 38.4728 178.1944 28 A 4.0150 8.5276 121.6830 55.1676 18.5114 179.5537 29 F 3.9714 9.0884 116.8253 60.6650 39.0574 177.4317 30 E 3.8540 8.5989 119.2155 59.5177 29.2173 178.9613 31 Q 3.9848 7.8373 116.5992 57.8581 28.6305 177.2911 32 T 4.3346 7.1166 107.0858 61.1045 68.9721 174.7722 33 G 3.7368 8.0230 108.7534 46.6680 0.0000 173.4336 34 H 4.8417 8.0945 116.8027 52.9798 30.9235 174.9111 35 R 4.1107 8.5835 117.7823 57.3491 29.5617 176.7513 36 H 4.9501 7.9533 114.3690 55.0759 28.2451 173.1199 37 D 4.9298 7.4758 114.8508 53.9206 40.0475 175.9541 38 F 4.6509 8.0173 118.3209 58.8989 39.6318 175.8483 39 T 4.4899 8.9906 115.2070 60.2320 71.8296 176.2433 40 V 3.7461 8.0370 121.4236 65.5702 31.2085 177.4253 41 E 3.7131 7.9346 117.2932 59.2039 29.7418 177.9082 42 D 3.7327 7.8155 118.8065 57.2893 40.8571 178.9219 43 I 3.3856 7.2078 119.9057 64.1769 36.8217 178.5938 44 K 2.9266 7.2454 118.0301 58.2759 31.8077 178.2035 45 N 4.4021 7.2280 115.0558 53.8928 39.1156 176.5501 46 F 4.6283 7.1738 118.8703 58.5524 39.7710 176.1769 47 F 4.5926 7.5929 115.3895 56.7107 39.8645 174.7928 48 G 4.1354 8.8236 110.8616 46.0923 0.0000 175.1276 49 S 4.6325 8.2887 114.7606 57.9417 63.7708 175.2011 50 G 4.1909 8.2543 104.7915 45.5939 0.0000 175.6456 51 V 3.6060 8.2602 118.7400 64.5426 31.2096 178.8695 52 V 3.4972 7.6787 118.4702 65.8418 31.5803 177.9593 53 V 3.5697 7.7577 117.3100 65.7940 31.2745 177.4757 54 A 4.1174 7.6474 121.7326 54.6073 18.0179 179.7593 55 V 3.3304 7.5172 116.5590 66.2669 31.4862 178.3727 56 T 3.8616 7.9537 115.4356 66.6916 68.3032 176.7527 57 R 3.5167 8.3708 120.0403 59.0614 29.9720 178.9842 58 A 2.5800 7.2253 120.3800 54.5370 18.2069 179.6298 59 L 4.0976 8.1328 117.3476 57.9671 41.6791 179.6005 60 A 4.1116 8.2477 120.7219 55.3532 18.3834 179.0273 61 Y 4.2261 8.4109 118.4181 60.9450 38.7178 177.7219 62 E 4.0169 8.5347 118.9252 59.3924 29.8501 178.1247 63 A 4.2713 7.8399 117.8156 52.6921 18.5925 177.9382 64 G 3.9686 7.7860 105.3736 44.8929 0.0000 174.7077 65 S 4.3330 7.9322 116.4433 58.0985 63.4968 175.1102 66 S 4.5015 8.4694 118.8701 58.2534 64.8295 175.6650 67 R 3.9058 8.6825 122.1853 59.3107 29.9587 178.6102 68 E 4.1568 8.2434 119.0299 59.4193 29.2368 178.9537 69 S 4.2361 8.3943 114.3008 61.4367 63.0097 176.4014 70 L 3.1893 7.5754 122.6513 57.0169 40.9532 179.3454 71 V 3.6478 7.3534 117.8306 66.0311 31.6654 177.3128 72 A 4.3257 7.8555 117.1198 52.1530 18.6033 177.3043 73 F 4.1811 7.8196 117.2184 58.9308 39.4224 175.8566 74 G 3.9752 9.9349 113.4468 45.5390 0.0000 172.6012 75 T 4.7683 7.5494 109.4320 58.8789 71.9860 174.9578 76 K 3.9690 8.6584 120.1998 59.5131 32.4031 177.3008 77 D 4.7567 7.8203 118.0904 53.7279 41.0178 176.3831 78 E 4.1374 7.8591 118.3221 56.4166 29.9430 177.1371 79 Q 4.3949 8.4651 120.8403 54.1148 29.2526 173.6333 80 I 4.1517 7.6230 122.3258 58.4882 38.8612 174.5428 81 P 4.4228 0.0000 0.0000 62.4872 31.8102 177.3900 82 E 3.9527 8.8023 120.8970 59.2826 29.5940 178.5587 83 A 3.9476 7.9731 120.5849 54.4029 18.5614 177.3603 84 V 3.9279 7.7099 115.9339 62.3338 30.6480 175.7196 85 T 4.6167 7.8685 117.7575 59.5643 72.4380 174.6819 86 Q 3.9102 8.4751 122.2943 59.7249 28.9530 178.6803 87 T 3.8316 7.8875 116.1198 66.9159 68.5555 175.9732 88 E 3.9260 8.2014 120.9364 58.8810 29.5730 178.8538 89 V 3.5184 7.9506 118.6073 66.1240 31.6398 177.8247 90 N 4.3577 8.4048 116.3816 56.3076 38.0948 177.5284 91 R 3.9421 8.1624 119.6065 59.3156 30.1508 179.3211 92 V 3.6549 7.7758 117.8881 66.0045 31.4960 178.0369 93 L 4.2350 8.1799 118.8600 58.0282 41.2467 179.3970 94 E 4.1062 8.2584 117.5068 58.8826 29.4600 179.0826 95 V 4.0619 7.4361 118.2413 65.2607 31.9292 177.7534 96 F 4.3256 8.8096 120.7546 61.3502 39.3969 176.8667 97 K 4.0918 8.7779 118.7661 59.3761 31.7724 177.5889 98 P 4.3306 0.0000 0.0000 65.7692 31.5821 177.6113 99 Y 4.0273 7.8409 119.5672 60.7803 38.8345 177.0549 100 Y 4.0140 8.1792 120.6621 60.6057 38.5448 177.7385 101 A 3.7707 7.6081 120.5157 55.0262 18.5610 178.5268 102 D 4.4634 7.4097 113.5603 54.8902 41.4168 176.4936 103 H 4.6952 7.6341 117.3585 55.6110 29.9445 173.5399 104 C 4.3843 7.8697 111.5514 57.9855 30.1872 173.3617 105 Q 4.5264 7.4158 118.0465 55.9124 28.7609 175.4096 106 I 4.1164 7.5592 118.8748 62.4897 38.8429 177.8748 107 K 4.2226 8.7603 121.2332 58.2748 32.8253 178.0623 108 T 4.2404 7.3922 115.4305 63.4431 69.1784 173.8262 109 G 4.1193 8.1225 111.3169 44.4254 0.0000 170.2115 110 P 5.0617 0.0000 0.0000 62.4307 32.2780 176.6205 111 F 4.2472 8.8133 120.4319 56.7613 40.0989 173.3377 112 P 4.3016 0.0000 0.0000 64.3873 31.7419 177.1016 113 G 4.0117 8.8457 109.8138 46.3681 0.0000 175.7838 114 I 3.7188 7.4427 119.8699 64.2667 37.0789 177.9638 115 L 4.1588 7.8097 118.5559 57.8336 41.7472 178.7380 116 D 4.5201 8.0037 118.3113 57.1955 40.7137 178.5366 117 L 3.9797 7.7923 117.8268 56.2316 42.2696 178.2330 *119 K 4.1384 7.9167 119.3830 56.3045 34.2047 177.5520 120 N 4.3461 8.4186 116.3242 56.3341 38.4699 177.3722 121 L 4.0339 8.1586 120.5686 57.8926 41.7629 179.6212 122 R 3.9230 7.9300 118.0747 59.5491 29.8591 178.3675 123 Q 4.0697 7.9598 116.9605 58.6350 28.7765 178.0429 124 K 4.3704 7.7643 116.3722 56.3180 32.3347 177.9075 125 G 3.9366 8.0293 108.2229 44.8886 0.0000 173.9336 126 V 4.0279 7.4027 120.4442 62.5226 32.1017 176.0665 127 K 4.5734 9.0799 127.9314 56.4381 33.5894 176.0182 128 L 5.6259 9.4995 122.8095 53.2141 45.6389 175.5262 129 A 5.9400 9.6564 124.0186 49.3747 23.4560 174.9921 130 V 4.7600 7.9585 118.0754 59.8754 34.5622 174.9593 131 V 5.4881 8.6318 115.8635 58.9313 35.8938 174.4643 132 S 4.6285 8.2060 115.9772 56.8896 65.8987 173.6308 133 N 5.0066 8.7521 121.7374 53.8640 38.7802 175.1460 134 K 4.6114 7.9564 118.9700 54.2839 34.6895 174.6863 135 P 4.6408 0.0000 0.0000 62.9778 32.1190 176.9536 136 N 4.2334 9.0863 121.1624 57.1057 38.8031 176.6151 137 E 3.8805 8.3130 119.6208 59.5096 29.6227 178.6749 138 A 3.9821 7.9151 120.0529 54.9990 18.4463 179.5689 139 V 3.5096 7.7417 116.7504 66.3335 31.6162 178.3086 140 Q 3.9511 8.2000 117.8282 58.8774 28.5236 179.0387 141 V 3.5651 7.7177 119.0497 66.0218 31.5221 178.1891 142 L 4.0319 7.9789 118.8152 57.6789 41.3933 179.6024 143 V 3.9047 8.1852 118.6413 66.1554 31.2648 177.7799 144 E 3.9702 8.0290 118.0408 59.0658 29.5361 178.0850 145 E 4.0513 8.1667 118.6622 58.6241 29.9032 177.7900 146 L 4.3361 8.0239 116.4350 54.3567 43.9061 176.4649 147 F 4.8989 8.3681 118.1988 55.7447 39.8559 173.4748 148 P 4.5204 0.0000 0.0000 64.2003 31.6204 177.0600 149 G 3.9926 9.0102 111.1418 45.5860 0.0000 174.2725 150 S 4.0745 8.1288 115.8406 60.1736 63.0837 174.5887 151 F 4.9627 7.7170 116.6753 55.6644 41.4181 174.9601 152 D 4.7855 9.1724 123.7213 56.5219 41.7259 176.6918 153 F 5.1773 8.1872 119.0460 56.8226 43.0335 172.9094 154 A 4.9097 7.4906 125.3603 50.1981 22.3492 175.0867 155 L 4.4321 8.4850 122.2533 53.8883 46.1320 174.9154 156 G 4.7276 8.8172 112.8728 43.7101 0.0000 171.6540 157 E 4.5495 8.8010 119.5936 56.6737 30.6206 176.8675 158 K 4.8176 8.6438 121.5662 55.9194 36.7567 174.7756 159 S 4.1800 8.7214 116.1682 60.6395 62.8341 175.6636 160 G 3.9168 9.1446 112.6470 45.4817 0.0000 173.3081 161 I 4.4753 7.9939 120.4335 59.5440 38.5896 175.3252 162 R 4.6329 8.8846 125.1927 54.2075 31.7832 177.1104 163 R 4.2230 8.1524 115.3210 55.7944 30.0566 176.5060 164 K 4.4203 8.7529 120.1215 56.5687 32.4823 175.1043 165 P 4.9086 0.0000 0.0000 61.8119 31.9041 175.9344 166 A 4.0527 7.7138 122.5943 52.4551 18.7667 177.0153 167 P 4.5596 0.0000 0.0000 63.3460 31.8118 177.7900 168 D 4.5483 7.6787 115.6248 56.2870 40.7235 178.1603 *170 T 4.3729 7.8824 111.9236 61.8339 70.8820 176.2307 171 S 4.1217 8.3390 118.4882 61.5883 62.6702 176.5172 172 E 3.9808 8.2744 121.2134 59.4543 29.1755 179.2075 173 C 3.9633 8.0047 116.4236 62.7060 28.4032 176.0685 174 V 3.5677 7.8854 119.8254 65.7706 30.8778 177.9480 175 K 3.8380 7.6402 118.1211 59.6139 32.1524 178.6594 176 V 3.5735 7.4208 117.2101 65.7714 31.4610 177.7430 177 L 4.1859 8.1958 118.1645 55.2902 41.4920 177.6660 178 G 3.8277 7.8139 105.8178 46.3231 0.0000 173.0832 179 V 4.3731 7.5535 118.1909 59.5623 33.6829 173.6534 180 P 4.3764 0.0000 0.0000 62.4422 32.2835 177.0143 181 R 3.8629 8.9036 122.2587 59.7953 29.8640 177.6081 182 D 4.6939 8.0963 113.2901 54.4250 39.6999 176.2345 183 K 4.6996 8.3947 119.1655 56.6118 33.5943 175.0542 184 C 5.3820 8.1110 118.0977 58.0915 30.2582 173.6432 185 V 4.3185 8.1821 121.1101 59.8604 34.3435 173.5930 186 Y 4.8124 8.5981 123.8580 55.8259 41.5504 174.2678 187 I 4.9484 6.3530 126.2228 58.4980 41.0632 174.9238 188 G 4.6510 7.9861 112.1514 45.6925 0.0000 172.6801 189 D 5.1484 8.8285 117.0044 52.2711 41.2251 175.8013 190 S 4.9614 8.2446 114.0847 55.7617 66.5448 174.4522 191 E 4.1087 8.8285 117.4927 59.5166 29.1530 178.9921 192 I 3.7540 7.7549 120.7621 64.3162 37.1079 178.0470 193 D 4.6027 7.9698 119.4579 57.1946 40.7991 178.5458 194 I 3.7298 7.6695 119.9291 64.6479 37.1092 178.5416 195 Q 3.9717 8.2335 118.7664 59.0918 28.6210 178.6885 196 T 3.6547 8.2666 117.0202 66.5950 68.2308 176.3161 197 A 3.7770 7.5271 120.9430 55.0034 18.7300 179.2116 198 R 3.9534 7.7892 117.1131 59.9004 29.9861 178.5740 199 N 4.4356 8.3045 114.5556 55.4872 38.5681 176.5553 200 S 4.5384 7.7225 114.4244 56.7212 64.4478 173.6310 201 E 3.5593 7.4877 121.2715 56.8770 26.6107 173.2436 *203 D 4.5457 7.6378 120.1549 53.9052 43.1195 173.7247 204 E 5.1602 8.6378 120.4474 54.5181 33.3577 174.7136 205 I 4.6843 8.6854 125.7259 59.4644 40.4704 174.3524 206 A 5.0036 8.9068 128.9541 50.4624 21.3227 176.0404 207 V 4.3943 8.0066 113.6746 59.2108 35.1129 175.9708 208 N 4.8418 8.0298 120.1029 52.3963 38.3236 175.8173 209 W 4.7790 7.4470 115.2784 56.7207 29.7674 177.0853 210 G 4.5108 6.9298 107.7798 45.4637 0.0000 176.4226 211 F 4.5909 9.9172 123.3778 58.4771 39.2428 175.7314 212 R 4.4333 7.1476 119.2863 53.5227 33.2530 176.0225 213 S 4.5065 8.1443 115.6688 57.4613 65.5550 175.5635 214 V 3.5753 8.2403 121.2675 65.9780 31.2274 176.2157 215 P 4.5319 0.0000 0.0000 64.8288 31.2733 178.2582 216 F 4.0724 8.2634 119.3173 61.4989 39.3652 177.2896 217 L 4.1406 8.3976 118.6388 57.7381 41.1108 179.5849 218 Q 3.9633 8.5246 118.5786 58.9013 28.4812 178.5612 219 K 3.8995 7.9263 119.3211 59.3363 32.1577 177.4185 220 H 4.5461 7.5213 113.2980 55.2723 28.8947 175.7549 221 G 3.9399 7.7790 109.0517 44.8978 0.0000 174.1150 222 A 4.1169 7.8060 122.9209 52.3887 18.7493 178.0852 223 T 4.3804 8.4270 110.7003 61.3533 70.7591 174.4205 224 V 4.4088 7.6313 122.0280 61.0802 34.3512 174.1246 225 I 5.0504 8.4482 128.0018 59.6275 40.2079 175.3061 226 V 4.7345 8.9674 119.9724 59.4797 35.3157 175.8896 227 D 5.8500 9.1982 119.3711 51.9081 40.5248 175.8885 228 T 4.6268 7.7555 109.5127 59.2918 73.2593 174.3245 229 A 4.0150 8.1198 123.3185 55.2655 18.3736 180.0294 230 E 3.9235 8.0441 116.7716 59.6286 29.6489 179.5625 231 K 4.2673 8.2591 118.5606 59.2152 32.0656 179.2500 232 L 4.0547 8.2040 120.8692 58.0139 42.0595 178.4791 233 E 3.9875 8.5569 119.5658 59.5156 29.5549 178.6158 234 E 3.9919 8.2784 118.2124 59.5841 29.3386 179.3719 235 A 4.1727 8.0545 119.5069 55.1145 18.6920 179.4148 236 I 4.1305 7.9360 118.4945 64.3323 36.8000 178.3356 237 L 4.3194 8.2571 119.6105 55.7435 41.2909 177.6250 238 G 3.8331 7.9508 108.9678 45.8065 0.0000 174.3145 239 E 4.2963 8.6085 122.5970 55.6748 30.1009 179.7648 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 8.21 4.43 0.00 1.91 2.07 0.00 1.20 0.00 0.00 1.72 0.00 0.00 3.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.44 7.81 3 Y 8.00 4.02 0.00 3.04 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 4 K 9.47 4.52 0.00 1.75 1.88 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.42 7.81 5 A 7.99 5.26 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 6 A 9.39 4.90 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.39 4.90 1.97 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 1.33 0.83 1.11 0.00 0.00 8 F 9.09 4.71 0.00 2.87 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 9 D 8.06 5.30 0.00 2.87 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *11 D 8.64 4.64 0.00 2.73 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 12 G 9.51 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 13 T 7.61 4.21 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 1.34 0.00 0.00 14 I 7.64 4.57 1.81 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.66 0.86 0.00 0.00 15 L 8.16 5.12 0.00 1.96 1.64 1.09 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.97 4.65 0.00 1.58 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.46 4.61 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 1.31 0.00 0.00 18 S 8.13 4.11 0.00 3.89 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 19 A 7.89 3.97 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 20 D 8.08 4.43 0.00 2.84 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.13 3.83 0.00 1.48 1.20 0.52 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.84 3.94 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 1.25 0.00 0.00 23 S 8.30 4.20 0.00 4.00 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 24 A 8.41 4.29 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.73 4.38 0.00 2.14 1.87 0.85 0.67 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 26 N 8.58 4.54 0.00 3.01 3.06 0.00 0.00 6.68 6.83 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 27 Y 8.37 3.90 0.00 2.88 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 28 A 8.53 4.02 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 9.09 3.97 0.00 3.30 3.42 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 30 E 8.60 3.85 0.00 1.81 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 2.09 2.03 0.00 31 Q 7.84 3.98 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 32 T 7.12 4.33 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 1.18 0.00 0.00 33 G 8.02 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 34 H 8.09 4.84 0.00 3.18 3.47 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.58 4.11 0.00 1.78 1.91 0.00 2.99 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.14 0.00 36 H 7.95 4.95 0.00 3.36 3.44 0.00 5.47 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.48 4.93 0.00 2.70 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 38 F 8.02 4.65 0.00 3.23 2.89 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 39 T 8.99 4.49 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 40 V 8.04 3.75 2.03 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 1.29 0.00 0.00 0.96 0.00 0.00 41 E 7.93 3.71 0.00 1.89 1.83 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 2.11 2.25 0.00 42 D 7.82 3.73 0.00 2.64 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 I 7.21 3.39 1.77 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 1.61 0.98 0.71 0.00 0.00 44 K 7.25 2.93 0.00 1.51 1.66 0.00 1.50 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.31 1.11 7.81 45 N 7.23 4.40 0.00 2.20 2.55 0.00 0.00 6.94 7.06 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 46 F 7.17 4.63 0.00 2.81 2.42 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 47 F 7.59 4.59 0.00 3.30 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 48 G 8.82 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.29 4.63 0.00 3.86 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 50 G 8.25 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.26 3.61 2.29 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 0.88 0.00 0.00 0.98 0.00 0.00 52 V 7.68 3.50 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.95 0.00 0.00 53 V 7.76 3.57 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.95 0.00 0.00 54 A 7.65 4.12 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 55 V 7.52 3.33 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 1.00 0.00 0.00 0.77 0.00 0.00 56 T 7.95 3.86 4.47 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 1.24 0.00 0.00 57 R 8.37 3.52 0.00 1.59 1.64 0.00 3.19 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.73 0.00 58 A 7.23 2.58 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.13 4.10 0.00 1.88 1.76 0.84 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.25 4.11 1.63 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 0.00 0.00 61 Y 8.41 4.23 0.00 3.18 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 62 E 8.53 4.02 0.00 2.44 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 2.41 2.45 0.00 63 A 7.84 4.27 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 64 G 7.79 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.93 4.33 0.00 3.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.47 4.50 0.00 4.11 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.68 3.91 0.00 1.82 1.99 0.00 3.17 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.73 0.00 68 E 8.24 4.16 0.00 2.13 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 2.49 0.00 69 S 8.39 4.24 0.00 4.23 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 70 L 7.58 3.19 0.00 1.63 1.44 0.90 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.35 3.65 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 1.00 0.00 0.00 1.20 0.00 0.00 72 A 7.86 4.33 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 73 F 7.82 4.18 0.00 3.00 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 74 G 9.93 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 75 T 7.55 4.77 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 76 K 8.66 3.97 0.00 1.87 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.47 7.81 77 D 7.82 4.76 0.00 2.74 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 7.86 4.14 0.00 1.69 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 2.28 2.06 0.00 79 Q 8.47 4.39 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 80 I 7.62 4.15 1.64 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 -0.23 0.78 0.00 0.00 81 P 0.00 4.42 0.00 2.22 2.01 0.00 3.72 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 82 E 8.80 3.95 0.00 1.95 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 2.30 2.31 0.00 83 A 7.97 3.95 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 84 V 7.71 3.93 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 85 T 7.87 4.62 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 86 Q 8.48 3.91 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 87 T 7.89 3.83 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 88 E 8.20 3.93 0.00 2.07 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 2.30 2.27 0.00 89 V 7.95 3.52 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 1.03 0.00 0.00 0.96 0.00 0.00 90 N 8.40 4.36 0.00 2.97 2.86 0.00 0.00 7.08 8.44 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 91 R 8.16 3.94 0.00 2.00 1.96 0.00 3.10 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 92 V 7.78 3.65 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.61 0.00 0.00 93 L 8.18 4.24 0.00 1.95 1.81 1.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.26 4.11 0.00 2.16 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 2.56 2.50 0.00 95 V 7.44 4.06 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 1.17 0.00 0.00 0.98 0.00 0.00 96 F 8.81 4.33 0.00 3.27 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 97 K 8.78 4.09 0.00 2.02 2.00 0.00 1.85 0.00 0.00 1.82 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.84 7.81 98 P 0.00 4.33 0.00 2.29 2.24 0.00 3.97 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.11 0.00 99 Y 7.84 4.03 0.00 3.16 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.18 4.01 0.00 2.01 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 0.00 101 A 7.61 3.77 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 0.00 102 D 7.41 4.46 0.00 2.46 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 0.00 0.00 0.00 103 H 7.63 4.70 0.00 2.60 2.97 0.00 5.82 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 0.00 104 C 7.87 4.38 0.00 2.45 1.63 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 0.00 105 Q 7.42 4.53 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.93 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 106 I 7.56 4.12 2.07 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 0.46 0.90 0.00 0.00 107 K 8.76 4.22 0.00 1.80 1.84 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.55 7.81 108 T 7.39 4.24 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 109 G 8.12 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 0.00 0.00 0.00 0.00 110 P 0.00 5.06 0.00 2.09 1.87 0.00 3.60 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.70 0.00 111 F 8.81 4.25 0.00 2.97 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 0.00 112 P 0.00 4.30 0.00 1.95 1.95 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 113 G 8.85 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 0.00 114 I 7.44 3.72 2.12 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 1.67 1.09 1.03 0.00 0.00 115 L 7.81 4.16 0.00 1.58 1.69 0.80 0.98 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 0.00 116 D 8.00 4.52 0.00 2.81 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 0.00 117 L 7.79 3.98 0.00 1.85 1.84 1.08 0.85 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 *119 K 7.92 4.14 0.00 1.81 1.96 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.45 7.81 120 N 8.42 4.35 0.00 2.97 2.96 0.00 0.00 7.10 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 0.00 121 L 8.16 4.03 0.00 1.71 1.80 1.13 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 122 R 7.93 3.92 0.00 1.85 2.06 0.00 3.16 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 123 Q 7.96 4.07 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 124 K 7.76 4.37 0.00 1.94 1.86 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.62 7.81 125 G 8.03 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 0.00 126 V 7.40 4.03 2.26 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 0.92 0.00 0.00 1.00 0.00 0.00 127 K 9.08 4.57 0.00 1.79 1.78 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.60 7.81 128 L 9.50 5.63 0.00 1.64 1.76 0.89 1.42 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 0.00 129 A 9.66 5.94 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 0.00 130 V 7.96 4.76 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 -0.07 0.00 0.00 0.58 0.00 0.00 131 V 8.63 5.49 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 0.80 0.00 0.00 1.16 0.00 0.00 132 S 8.21 4.63 0.00 3.81 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.75 5.01 0.00 2.71 2.87 0.00 0.00 6.94 7.61 0.00 0.00 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 K 7.96 4.61 0.00 1.78 1.80 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.51 7.81 135 P 0.00 4.64 0.00 2.21 2.02 0.00 3.72 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 2.16 0.00 136 N 9.09 4.23 0.00 3.07 2.84 0.00 0.00 6.65 7.91 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 0.00 137 E 8.31 3.88 0.00 2.04 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 2.34 0.00 138 A 7.92 3.98 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 0.00 139 V 7.74 3.51 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.96 0.00 0.00 140 Q 8.20 3.95 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 141 V 7.72 3.57 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 0.99 0.00 0.00 0.94 0.00 0.00 142 L 7.98 4.03 0.00 1.80 1.78 0.94 0.75 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 0.00 143 V 8.19 3.90 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.91 0.00 0.00 144 E 8.03 3.97 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.18 0.00 145 E 8.17 4.05 0.00 1.97 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 2.52 2.31 0.00 146 L 8.02 4.34 0.00 1.46 1.00 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 147 F 8.37 4.90 0.00 3.33 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 0.00 148 P 0.00 4.52 0.00 2.18 2.26 0.00 3.81 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 149 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 0.00 150 S 8.13 4.07 0.00 3.53 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 0.00 151 F 7.72 4.96 0.00 3.04 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 0.00 152 D 9.17 4.79 0.00 2.80 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 0.00 153 F 8.19 5.18 0.00 3.10 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 0.00 154 A 7.49 4.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.49 4.43 0.00 1.21 1.31 0.92 0.88 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 0.00 156 G 8.82 4.73 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 0.00 157 E 8.80 4.55 0.00 2.06 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 2.33 2.13 0.00 158 K 8.64 4.82 0.00 1.76 1.90 0.00 1.35 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.46 1.41 7.81 159 S 8.72 4.18 0.00 3.89 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 G 9.14 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 0.00 161 I 7.99 4.48 2.07 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 1.33 1.85 0.94 0.00 0.00 162 R 8.88 4.63 0.00 1.79 1.87 0.00 3.17 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 163 R 8.15 4.22 0.00 2.22 2.08 0.00 3.03 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 164 K 8.75 4.42 0.00 1.85 1.75 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.38 7.81 165 P 0.00 4.91 0.00 2.13 2.10 0.00 3.38 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 166 A 7.71 4.05 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 0.00 167 P 0.00 4.56 0.00 2.20 2.39 0.00 3.69 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 1.95 0.00 168 D 7.68 4.55 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *170 T 7.88 4.37 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 171 S 8.34 4.12 0.00 4.11 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 0.00 172 E 8.27 3.98 0.00 2.18 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 0.00 2.62 2.60 0.00 173 C 8.00 3.96 0.00 3.24 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 0.00 174 V 7.89 3.57 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.98 0.00 0.00 175 K 7.64 3.84 0.00 1.76 1.89 0.00 1.82 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.39 7.81 176 V 7.42 3.57 1.11 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 0.59 0.00 0.00 0.38 0.00 0.00 177 L 8.20 4.19 0.00 1.66 1.73 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 178 G 7.81 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 0.00 179 V 7.55 4.37 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 0.91 0.00 0.00 nan 0.00 0.00 180 P 0.00 4.38 0.00 2.39 1.97 0.00 3.70 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 181 R 8.90 3.86 0.00 1.84 1.96 0.00 3.17 0.00 0.00 3.56 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 182 D 8.10 4.69 0.00 2.84 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 0.00 183 K 8.39 4.70 0.00 1.85 1.88 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.55 7.81 184 C 8.11 5.38 0.00 3.02 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 0.00 185 V 8.18 4.32 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 0.20 0.00 0.00 0.45 0.00 0.00 186 Y 8.60 4.81 0.00 3.01 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 I 6.35 4.95 1.13 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.20 0.82 0.00 0.00 188 G 7.99 4.65 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 0.00 189 D 8.83 5.15 0.00 2.46 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.24 4.96 0.00 4.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 8.83 4.11 0.00 2.16 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 2.42 2.37 0.00 192 I 7.75 3.75 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.98 0.92 0.00 0.00 193 D 7.97 4.60 0.00 2.90 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 0.00 194 I 7.67 3.73 2.02 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 1.68 0.96 0.98 0.00 0.00 195 Q 8.23 3.97 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 196 T 8.27 3.65 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 197 A 7.53 3.78 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 0.00 198 R 7.79 3.95 0.00 1.89 2.08 0.00 3.08 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 199 N 8.30 4.44 0.00 2.80 2.82 0.00 0.00 7.09 7.11 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 0.00 200 S 7.72 4.54 0.00 3.88 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 0.00 201 E 7.49 3.56 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 *203 D 7.64 4.55 0.00 2.59 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 0.00 204 E 8.64 5.16 0.00 1.93 1.76 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 2.49 2.48 0.00 205 I 8.69 4.68 1.72 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 1.12 0.98 0.86 0.00 0.00 206 A 8.91 5.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 V 8.01 4.39 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 0.29 0.00 0.00 -0.16 0.00 0.00 208 N 8.03 4.84 0.00 2.68 2.96 0.00 0.00 6.77 9.17 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 0.00 209 W 7.45 4.78 0.00 3.13 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 0.00 210 G 6.93 4.51 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 0.00 0.00 0.00 211 F 9.92 4.59 0.00 2.86 3.13 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 0.00 212 R 7.15 4.43 0.00 2.03 1.61 0.00 2.21 0.00 0.00 2.75 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 213 S 8.14 4.51 0.00 4.08 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 0.00 214 V 8.24 3.58 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 1.14 0.00 0.00 0.94 0.00 0.00 215 P 0.00 4.53 0.00 2.26 2.12 0.00 3.98 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 216 F 8.26 4.07 0.00 3.10 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 0.00 217 L 8.40 4.14 0.00 1.89 1.73 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 218 Q 8.52 3.96 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 219 K 7.93 3.90 0.00 1.74 1.83 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.69 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.12 1.34 7.81 220 H 7.52 4.55 0.00 3.10 3.21 0.00 5.67 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 G 7.78 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 0.00 222 A 7.81 4.12 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 0.00 223 T 8.43 4.38 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 224 V 7.63 4.41 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.96 0.00 0.00 225 I 8.45 5.05 1.86 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 1.32 0.77 0.87 0.00 0.00 226 V 8.97 4.73 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 0.98 0.00 0.00 1.02 0.00 0.00 227 D 9.20 5.85 0.00 2.88 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 0.00 228 T 7.76 4.63 4.35 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 1.24 0.00 0.00 229 A 8.12 4.02 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 0.00 230 E 8.04 3.92 0.00 2.08 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 0.00 2.40 2.46 0.00 231 K 8.26 4.27 0.00 2.07 1.93 0.00 1.85 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.49 7.81 232 L 8.20 4.05 0.00 2.17 2.08 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 233 E 8.56 3.99 0.00 2.21 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 2.36 2.42 0.00 234 E 8.28 3.99 0.00 2.28 2.03 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 2.36 2.37 0.00 235 A 8.05 4.17 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 0.00 236 I 7.94 4.13 1.98 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.19 1.03 0.00 0.00 237 L 8.26 4.32 0.00 1.80 1.74 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 238 G 7.95 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 0.00 239 E 8.61 4.30 0.00 1.94 1.70 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 2.17 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.