NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *3 K 4.3020 8.3031 122.1372 54.0907 34.4897 176.6140 4 G 3.7862 7.8276 103.1207 47.0990 0.0000 172.1833 5 E 4.1090 8.4959 122.8463 59.9015 29.7013 178.4339 *6 E 4.0190 8.2763 116.4856 60.9380 29.7208 180.6354 7 L 4.3134 7.9311 115.5374 55.9073 41.8028 177.3986 8 F 4.9289 7.9709 117.2372 57.3542 39.5124 176.5522 9 T 4.2241 8.2486 113.6896 63.3738 69.5272 174.5270 10 G 4.3277 7.6856 111.0960 44.1293 0.0000 171.8925 11 V 4.2317 8.3403 120.4539 62.5525 32.6133 176.9723 12 V 4.6717 8.9980 128.1286 60.2904 34.3701 172.9980 13 P 4.8733 0.0000 0.0000 62.9080 32.9413 175.1107 14 I 5.1035 8.7775 122.0576 59.5694 41.2626 174.2287 15 L 5.0971 8.7798 125.8916 53.3737 45.9800 175.1534 16 V 4.9832 8.8489 125.0489 61.2044 34.8128 173.8754 17 E 5.2300 9.2368 126.6030 54.4876 33.2908 174.4359 18 L 5.2316 9.3090 126.3471 53.3527 45.6985 174.4895 19 D 5.2331 8.9904 125.9803 52.5192 43.2405 175.6540 20 G 3.3730 8.1923 110.3413 44.2050 0.0000 171.9940 21 D 4.5363 8.2771 121.0920 53.2392 44.0625 174.0988 22 V 4.7499 8.8040 127.5322 61.0790 33.6999 175.3531 23 N 4.3416 10.2617 128.2749 54.3391 36.6344 175.8388 24 G 3.8788 8.2855 105.8928 45.6037 0.0000 173.9007 25 H 4.6007 8.0296 118.0936 55.0099 28.8684 174.3515 26 K 5.0185 8.5456 124.7691 55.6366 33.2520 176.2220 27 F 5.0685 8.2396 117.7564 55.9431 41.9589 173.1054 28 S 5.2190 9.3066 115.2585 56.7962 66.8693 173.3085 29 V 5.1552 8.8842 122.8189 61.3460 34.5573 174.2489 30 S 5.3665 9.0745 123.4172 56.7517 65.8062 173.3442 31 G 4.1670 9.2261 111.0197 44.3487 0.0000 171.5432 32 E 4.9496 8.1338 119.1098 54.1368 33.3832 174.6763 33 G 4.3958 8.3002 111.3374 45.7342 0.0000 172.7381 34 E 4.8875 8.4735 121.8438 55.1315 33.4375 174.5952 35 G 3.4889 8.9033 107.4359 44.3919 0.0000 171.4317 36 D 5.1765 9.3445 121.9134 52.0098 42.7245 175.7749 37 A 4.7148 9.0260 128.4151 54.3704 19.0735 179.7484 38 T 3.8188 7.7596 111.2712 66.6434 68.4706 174.6753 39 Y 4.3086 8.0897 115.9150 57.2842 38.8221 176.4942 40 G 3.9919 8.2773 108.5353 45.7131 0.0000 172.3687 41 K 4.7525 8.0057 120.2984 54.1929 34.9304 174.8546 42 L 5.0503 8.4955 125.9578 53.1458 45.9153 175.5633 43 T 4.9480 8.6450 118.8801 61.7778 71.8907 173.0573 44 L 4.8591 8.9344 125.7919 52.6924 46.5718 175.3234 45 K 4.6982 8.5464 123.4872 54.4683 35.5827 174.7222 46 F 5.1546 9.1309 125.0187 55.6032 42.8239 174.0597 47 I 4.9584 8.8678 123.0669 59.5963 40.7633 174.3751 48 C 4.8604 9.4353 128.0637 59.1981 31.5862 174.0560 49 T 4.3631 8.9665 117.6406 63.0317 69.0318 175.6225 50 T 4.4327 8.4114 111.0639 61.2192 70.4249 173.3217 51 G 4.1126 6.7162 108.6853 44.6124 0.0000 176.2319 52 K 4.2446 8.5042 125.6474 55.3836 32.5852 176.0923 53 L 3.6696 8.8296 126.6987 53.8862 41.9394 175.1607 54 P 4.2965 0.0000 0.0000 63.9374 31.7659 176.1606 55 V 4.1752 6.4621 111.1027 58.4053 35.3172 173.3244 56 P 4.4477 0.0000 0.0000 61.9624 32.1347 177.6157 57 W 4.5824 9.0614 122.8234 60.0308 28.9665 177.0936 58 P 4.5624 0.0000 0.0000 65.2691 30.5903 178.2890 59 T 4.3330 8.0273 107.6984 63.5018 69.2279 175.5490 60 L 4.3451 8.1412 120.9844 54.2786 42.5555 178.0350 61 V 3.6213 7.5689 120.1915 66.6258 31.1295 178.0634 62 T 3.9275 7.9749 106.9923 64.8985 68.7900 176.2749 63 T 4.1118 7.1384 115.9798 66.1424 69.5544 177.0018 64 F 4.8769 7.6147 119.4449 56.8776 37.6184 177.5081 *68 V 4.1322 7.2452 112.3059 61.9037 32.7303 177.0407 69 Q 4.0920 7.8276 118.7761 56.8354 29.2651 178.2273 70 C 4.0356 7.4517 112.9046 60.5025 29.6501 174.4833 71 F 4.5547 8.1560 118.6723 57.5540 38.7139 175.5127 72 S 4.4810 7.5103 117.3131 58.5046 63.6114 174.2561 73 R 4.3580 8.9175 124.8435 55.9885 30.7208 174.8770 74 Y 4.3413 8.5299 125.4250 55.8579 38.7385 174.2703 75 P 4.3345 0.0000 0.0000 62.6009 32.1967 176.9895 76 D 4.4195 8.8218 120.5948 57.9138 40.7827 178.0226 77 H 4.4738 8.1793 112.1784 57.3462 29.1824 175.5961 78 M 4.5662 8.2067 122.3503 55.5960 32.5687 178.4744 79 K 3.9482 7.9472 123.5222 57.4470 31.9595 183.1046 80 R 4.0934 7.7212 112.9874 58.2650 29.6157 176.6820 81 H 4.6082 7.7948 115.2601 56.3623 29.2578 176.4554 82 D 3.5678 7.2981 120.9664 52.3359 38.8218 175.7245 83 F 4.1056 7.8140 127.3234 60.0358 39.4916 176.0691 84 F 3.6031 7.4153 115.6537 60.5120 39.0429 177.3998 85 K 4.1344 8.4078 118.3087 59.1097 31.5891 179.4220 86 S 4.0012 7.6326 113.8043 61.4689 62.9269 175.9928 87 A 4.0706 7.5361 121.9403 52.5212 18.1468 177.1063 88 M 4.8154 7.4176 117.6491 53.6535 33.4815 174.8894 89 P 4.7985 0.0000 0.0000 64.5057 32.2684 178.3032 90 E 3.8719 8.2384 118.8981 59.3298 30.0463 175.4784 91 G 3.8590 8.6919 103.5290 44.2722 0.0000 171.4884 92 Y 5.3573 8.0961 115.3242 55.7292 42.2197 174.0267 93 V 4.7511 9.1635 121.1753 61.7680 33.7225 174.2520 94 Q 5.3979 9.5661 129.1745 54.4631 31.7493 173.7389 95 E 5.4168 9.5765 126.0097 54.7706 33.0977 175.3096 96 R 5.9565 9.2187 121.7439 53.5855 35.2836 174.0033 97 T 5.0886 8.5361 110.8866 60.0311 71.9339 172.7845 98 I 4.6036 9.2290 126.6226 59.6443 40.0098 174.6408 99 S 4.7962 8.4978 124.5074 56.6978 64.8246 173.7396 100 F 4.6490 8.9268 125.5604 56.2155 39.7812 175.3191 101 K 3.8009 8.3215 125.3239 57.6991 32.4543 175.9691 102 D 4.4595 8.8905 126.2803 54.8159 38.6632 172.7614 103 D 4.3442 7.9012 118.4580 53.6040 43.8574 173.6723 104 G 2.7346 8.0094 106.4101 45.9324 0.0000 172.2025 105 N 5.6395 8.1097 114.9410 51.7655 41.1189 173.1658 106 Y 5.6481 9.3594 118.1523 56.5557 41.3841 174.7973 107 K 5.2385 9.7882 122.7310 54.8593 35.6213 175.3291 108 T 5.1924 9.3437 115.0981 59.8214 72.3709 172.8351 109 R 5.1434 8.9548 123.4120 54.6477 33.4900 173.7968 110 A 5.8181 9.0039 126.7573 49.4192 23.0717 174.1963 111 E 4.9659 8.7950 120.4197 54.6198 32.3673 175.0804 112 V 4.7142 8.3263 125.0370 61.2345 33.5928 174.3104 113 K 4.8007 8.3767 125.9881 55.6280 36.2752 174.9386 114 F 4.5303 8.7470 121.0400 57.4759 39.7294 175.3792 115 E 4.5246 9.3406 123.4585 55.0631 31.5863 176.3961 116 G 3.9026 8.3402 116.7464 47.0170 0.0000 173.3529 117 D 4.6973 8.8966 124.0347 53.8388 40.0468 175.8397 118 T 4.7502 7.6553 118.2984 61.7240 71.3510 173.2931 119 L 3.7715 8.6398 129.0954 54.6575 43.2411 175.4095 120 V 4.7686 8.6074 127.6857 61.1368 34.0342 173.7457 121 N 5.0554 9.6975 127.5944 52.1664 40.9518 173.2306 122 R 5.1926 9.0416 126.6217 54.5221 32.9315 175.2713 123 I 5.0062 8.9100 124.9313 59.4777 41.0378 174.2540 124 E 5.0581 9.3437 126.2448 54.5190 31.9085 174.6548 125 L 5.1800 9.1208 129.0714 53.6893 45.4412 175.8364 126 K 4.9706 9.1037 128.3708 53.5068 35.7170 173.4404 127 G 5.0578 9.4934 113.8218 43.6098 0.0000 172.0584 128 I 5.2213 8.4160 116.3045 59.2053 41.9548 174.5027 129 D 4.5877 8.7637 118.7294 55.3432 38.1901 174.3642 130 F 4.3682 8.2187 116.7678 56.9025 39.8073 175.7094 131 K 4.2389 8.9174 126.1124 56.3561 32.5618 178.8073 132 E 3.9991 9.1210 122.6790 59.0413 29.7426 174.8505 *133 D 4.9817 7.9254 113.4167 52.7318 41.6877 181.9205 134 G 3.9950 8.0330 108.7458 45.3819 0.0000 174.1951 135 N 4.4588 8.2569 116.0623 56.5637 38.4139 176.6006 136 I 3.8168 7.6345 121.5211 62.9548 37.0993 177.6258 137 L 3.9611 7.7049 123.0552 57.6949 41.9227 178.7164 138 G 3.6902 7.9035 105.1150 45.3818 0.0000 172.9495 139 H 3.9518 7.9225 116.7127 57.2416 26.4607 174.7830 140 K 4.5691 8.2211 116.2476 56.0662 34.2454 178.1327 141 L 4.6655 7.8545 121.2212 54.4022 42.0965 177.0128 142 E 4.1262 8.8217 123.3811 56.8603 30.4352 177.2234 143 Y 4.5407 8.5124 124.3480 55.2840 37.4299 173.9620 144 N 4.5775 7.5054 119.5850 53.0850 40.0703 173.5742 145 Y 4.3521 7.9547 115.7029 57.2919 41.2199 172.6165 146 N 5.1357 8.1129 121.7261 51.0781 42.2426 173.6604 147 S 4.8710 8.2522 113.6961 58.3356 64.3562 173.2954 148 H 5.0579 8.8533 118.5004 54.2190 33.2547 171.7065 149 N 5.2687 8.6495 116.5745 51.5638 41.6205 173.8259 150 V 4.0928 8.6046 124.7009 61.2951 33.1292 174.2735 151 Y 4.7368 8.6654 127.1212 57.7707 39.0690 174.5995 152 I 4.7747 8.9442 126.6973 59.9365 39.3921 175.0786 153 T 5.0114 8.7699 116.2406 59.3437 72.0732 173.4834 154 A 4.3108 8.6840 125.0347 52.7082 19.6643 177.1223 155 D 4.5594 8.7674 118.8754 51.8835 41.6581 176.0121 156 K 3.7923 8.7724 125.4726 59.8545 32.4962 179.5806 *157 Q 3.8930 8.2383 117.3358 59.1987 27.9378 181.2352 *158 K 4.1392 8.5280 119.2428 55.0517 32.0401 178.5733 159 N 4.3772 8.2317 114.4836 54.7978 38.4361 173.7201 160 G 3.6270 7.7182 107.3575 44.9751 0.0000 172.5931 161 I 5.1627 8.0224 116.4473 59.2993 41.7513 174.5853 162 K 5.2311 9.0406 120.8527 55.7358 36.4447 174.8394 163 A 5.2577 9.0481 121.2077 51.2707 23.0257 174.9709 164 N 5.2047 8.5088 116.1363 51.6096 40.4260 173.4868 165 F 4.9467 8.4426 117.1417 56.6029 41.9650 173.3859 166 K 4.9483 8.5987 123.3212 53.6175 33.5161 176.7728 167 I 3.7329 8.8586 127.7131 59.8469 38.5053 175.4030 168 R 4.4611 8.7063 126.4963 55.5352 31.0284 175.7297 169 H 4.7600 8.9474 123.3052 54.0320 30.4226 174.7008 170 N 4.8154 8.7718 121.8222 53.3823 39.8830 174.3712 171 I 4.9687 8.7373 126.1299 60.0357 39.5966 177.6392 172 E 4.0698 8.9305 121.5345 58.5461 29.6851 177.8696 173 D 4.7046 8.1293 114.9168 53.7173 39.6199 177.3815 174 G 3.9498 8.3603 109.7637 45.4311 0.0000 174.1613 175 S 4.5859 8.9781 115.5395 57.6940 65.3550 173.1866 176 V 4.6767 8.0825 119.4125 61.0800 33.6656 174.2977 177 Q 4.4036 9.1769 130.5834 55.2787 30.3038 174.6623 178 L 4.7868 8.5943 126.7499 54.3081 43.7598 175.7337 179 A 4.6619 9.2379 124.6195 50.0824 22.0479 174.3472 180 D 4.8424 8.6987 123.8430 53.4632 42.9020 174.7322 181 H 4.9875 8.8565 124.2393 54.1966 31.2368 173.4637 182 Y 4.4766 8.7531 120.8275 56.1390 40.5083 174.4862 183 Q 5.4213 9.5116 126.3139 54.2718 32.7169 174.1374 184 Q 5.1620 9.3456 122.7151 54.7356 32.5428 173.3699 185 N 6.3000 8.8835 118.6459 51.1033 42.6421 173.6103 186 T 5.1136 8.5174 117.6879 61.0674 72.9401 171.8599 187 P 4.9267 0.0000 0.0000 63.6279 31.7894 176.1595 188 I 4.1334 8.3599 121.7438 63.6872 38.2058 176.9612 189 G 3.9205 7.9172 108.7087 45.0752 0.0000 172.5406 190 D 4.5765 8.5039 117.3051 54.3576 41.1819 177.0625 191 G 3.8784 7.8146 108.6948 44.5704 0.0000 171.2619 192 P 4.5937 0.0000 0.0000 62.4846 32.2142 176.2560 193 V 4.3355 7.9498 114.2904 60.1465 35.4913 175.6057 *194 L 4.0870 8.5447 124.6742 54.1575 40.8398 174.7044 195 L 4.4997 8.4451 125.4899 52.2351 42.4492 174.9558 196 P 4.8065 0.0000 0.0000 61.4100 32.8360 175.4649 197 D 4.6086 8.3910 119.7146 53.9706 41.5086 175.9444 198 N 4.8661 8.5261 118.4498 54.4747 39.4525 174.3380 199 H 4.8281 8.4934 116.4205 55.8835 32.7305 171.8570 200 Y 5.0469 7.8520 114.3979 55.7463 41.7971 173.9346 201 L 4.6714 8.8435 121.4601 53.2686 43.8265 175.8325 202 S 4.9538 8.7390 120.1595 57.8861 63.1553 172.4227 203 H 5.3233 9.2261 125.3629 54.5512 31.3829 174.2063 204 Q 4.9117 8.7238 118.9218 55.1004 33.4894 173.9221 205 S 5.2357 8.6826 116.5169 57.6458 67.4414 173.6269 206 A 4.6915 8.9033 123.8308 50.7485 22.5144 175.1577 207 L 5.1365 8.5095 122.4710 53.3314 44.5896 176.0206 208 S 4.8832 9.1451 115.7487 57.7313 66.6325 172.5359 209 K 4.8788 8.4542 117.1083 54.9136 36.3614 176.0082 210 D 4.6040 8.7991 122.2044 52.5514 41.3286 175.5441 211 P 4.3072 0.0000 0.0000 65.1429 31.4734 176.9350 212 N 4.7109 8.3077 113.6436 52.6480 38.6964 173.8574 213 E 4.4969 7.9468 120.4216 54.4507 30.7521 175.8212 214 K 4.3124 8.4747 125.0002 57.3867 33.1289 177.4404 215 R 4.1434 7.7855 117.5562 55.8859 30.7813 175.4806 216 D 4.8987 8.6612 120.3913 54.6103 42.3825 174.7685 217 H 4.8535 8.5050 119.7033 55.1791 31.7679 172.3416 218 M 4.4950 7.9794 117.6476 53.3589 35.9333 173.3844 219 V 4.5290 8.4592 126.1255 61.3646 33.6271 174.0665 220 L 5.1809 8.9391 129.9911 53.2203 45.1660 174.7302 221 L 5.0824 8.8190 126.0423 52.9862 44.5354 175.3848 222 E 5.1705 8.7368 121.9122 54.4935 34.1589 174.6511 223 F 5.2707 8.9622 120.8595 55.7510 42.6999 174.3815 224 V 5.3472 9.0357 123.0075 60.5124 34.6515 174.0856 225 T 4.9867 8.3148 123.5281 61.3119 72.1815 173.3020 226 A 4.1758 8.3422 128.0534 52.1387 19.3839 176.6080 227 A 4.0387 8.0251 121.9990 50.7747 23.2796 176.5550 228 G 4.1309 9.1394 103.9281 46.5959 0.0000 173.9202 229 I 4.2180 7.5401 125.3659 61.2389 38.2709 175.2539 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 *3 K 8.30 4.30 0.00 1.79 1.80 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.02 7.81 4 G 7.83 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.50 4.11 0.00 2.12 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 2.41 1.98 0.00 *6 E 8.28 4.02 0.00 2.06 1.89 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 2.24 1.99 0.00 7 L 7.93 4.31 0.00 1.34 0.95 0.40 0.15 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 8 F 7.97 4.93 0.00 3.17 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 9 T 8.25 4.22 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 1.30 0.00 0.00 10 G 7.69 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 11 V 8.34 4.23 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 1.00 0.00 0.00 12 V 9.00 4.67 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 1.19 0.00 0.00 1.09 0.00 0.00 13 P 0.00 4.87 0.00 2.14 2.14 0.00 3.87 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 2.22 2.01 0.00 14 I 8.78 5.10 1.71 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.75 0.92 0.00 0.00 15 L 8.78 5.10 0.00 1.67 1.41 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.85 4.98 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 1.05 0.00 0.00 1.07 0.00 0.00 17 E 9.24 5.23 0.00 1.94 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 2.24 2.38 0.00 18 L 9.31 5.23 0.00 1.95 1.76 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.99 5.23 0.00 2.56 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.19 3.37 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 0.00 21 D 8.28 4.54 0.00 2.57 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.80 4.75 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 0.67 0.00 0.00 0.95 0.00 0.00 23 N 10.26 4.34 0.00 2.90 2.89 0.00 0.00 7.21 7.46 0.00 0.00 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 G 8.29 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 0.00 0.00 0.00 25 H 8.03 4.60 0.00 3.47 3.32 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.55 5.02 0.00 1.91 1.69 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.40 1.00 7.81 27 F 8.24 5.07 0.00 3.09 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 28 S 9.31 5.22 0.00 3.81 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.88 5.16 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 1.26 0.00 0.00 30 S 9.07 5.37 0.00 3.84 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 31 G 9.23 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 0.00 0.00 0.00 32 E 8.13 4.95 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 33 G 8.30 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 0.00 0.00 0.00 0.00 34 E 8.47 4.89 0.00 2.01 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 2.07 2.15 0.00 35 G 8.90 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.34 5.18 0.00 2.73 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 37 A 9.03 4.71 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.76 3.82 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 0.85 0.00 0.00 39 Y 8.09 4.31 0.00 3.15 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 40 G 8.28 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 41 K 8.01 4.75 0.00 1.96 1.67 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.74 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.09 0.56 7.81 42 L 8.50 5.05 0.00 1.43 1.32 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.64 4.95 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 1.09 0.00 0.00 44 L 8.93 4.86 0.00 1.42 0.81 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.55 4.70 0.00 1.56 1.50 0.00 1.46 0.00 0.00 1.52 0.00 0.00 2.72 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.13 1.22 7.81 46 F 9.13 5.15 0.00 2.51 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 47 I 8.87 4.96 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 1.09 0.99 1.00 0.00 0.00 48 C 9.44 4.86 0.00 3.15 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 49 T 8.97 4.36 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 1.34 0.00 0.00 50 T 8.41 4.43 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 1.26 0.00 0.00 51 G 6.72 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.50 4.24 0.00 1.71 1.67 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.32 7.81 53 L 8.83 3.67 0.00 0.97 0.94 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.30 0.00 2.01 1.98 0.00 2.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.90 0.00 55 V 6.46 4.18 1.84 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 0.44 0.00 0.00 0.40 0.00 0.00 56 P 0.00 4.45 0.00 2.18 2.02 0.00 3.44 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 1.98 2.04 0.00 57 W 9.06 4.58 0.00 3.77 3.52 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 0.00 0.00 0.00 0.00 58 P 0.00 4.56 0.00 2.31 2.54 0.00 3.74 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.27 0.00 59 T 8.03 4.33 4.52 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 0.00 0.00 0.00 1.04 0.00 0.00 60 L 8.14 4.35 0.00 1.21 0.49 0.67 0.67 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 61 V 7.57 3.62 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 0.45 0.00 0.00 0.87 0.00 0.00 62 T 7.97 3.93 4.45 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 1.41 0.00 0.00 63 T 7.14 4.11 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 1.15 0.00 0.00 64 F 7.61 4.88 0.00 3.04 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 *68 V 7.25 4.13 2.52 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 0.93 0.00 0.00 1.13 0.00 0.00 69 Q 7.83 4.09 0.00 1.38 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 70 C 7.45 4.04 0.00 2.52 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.16 4.55 0.00 3.32 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.51 4.48 0.00 3.84 3.62 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 73 R 8.92 4.36 0.00 2.07 1.79 0.00 3.21 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 74 Y 8.53 4.34 0.00 2.88 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 75 P 0.00 4.33 0.00 1.97 1.96 0.00 3.47 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 2.04 2.02 0.00 76 D 8.82 4.42 0.00 2.68 2.77 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 77 H 8.18 4.47 0.00 3.27 3.41 0.00 5.49 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.21 4.57 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.41 0.00 79 K 7.95 3.95 0.00 1.68 1.82 0.00 1.79 0.00 0.00 1.87 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.00 7.81 80 R 7.72 4.09 0.00 1.81 1.99 0.00 2.93 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.36 0.00 81 H 7.79 4.61 0.00 3.29 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.30 3.57 0.00 1.89 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 0.00 0.00 0.00 0.00 83 F 7.81 4.11 0.00 3.04 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.42 3.60 0.00 3.11 3.12 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 85 K 8.41 4.13 0.00 1.63 1.82 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.30 1.19 7.81 86 S 7.63 4.00 0.00 3.92 4.03 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 87 A 7.54 4.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 M 7.42 4.82 0.00 2.39 2.36 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.22 3.10 0.00 89 P 0.00 4.80 0.00 2.26 2.08 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.88 0.00 90 E 8.24 3.87 0.00 2.00 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 2.34 2.40 0.00 91 G 8.69 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 0.00 0.00 0.00 92 Y 8.10 5.36 0.00 3.40 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 93 V 9.16 4.75 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 1.05 0.00 0.00 1.01 0.00 0.00 94 Q 9.57 5.40 0.00 2.55 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 95 E 9.58 5.42 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 96 R 9.22 5.96 0.00 1.82 1.81 0.00 3.24 0.00 0.00 3.39 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 97 T 8.54 5.09 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 1.24 0.00 0.00 98 I 9.23 4.60 1.76 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 0.67 0.57 0.02 0.00 0.00 99 S 8.50 4.80 0.00 3.63 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.93 4.65 0.00 3.01 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 0.00 101 K 8.32 3.80 0.00 1.79 1.78 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.45 7.81 102 D 8.89 4.46 0.00 2.86 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 7.90 4.34 0.00 2.60 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 0.00 104 G 8.01 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 0.00 0.00 0.00 105 N 8.11 5.64 0.00 2.92 2.78 0.00 0.00 7.29 6.85 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 0.00 106 Y 9.36 5.65 0.00 2.96 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 0.00 107 K 9.79 5.24 0.00 1.66 1.72 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.41 7.81 108 T 9.34 5.19 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 1.25 0.00 0.00 109 R 8.95 5.14 0.00 1.91 1.79 0.00 3.06 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 110 A 9.00 5.82 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 0.00 111 E 8.80 4.97 0.00 1.92 1.84 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 2.33 2.30 0.00 112 V 8.33 4.71 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.84 0.00 0.00 113 K 8.38 4.80 0.00 2.12 1.87 0.00 1.38 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.30 1.41 7.81 114 F 8.75 4.53 0.00 2.98 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 0.00 115 E 9.34 4.52 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 116 G 8.34 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 0.00 0.00 0.00 117 D 8.90 4.70 0.00 2.84 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 0.00 118 T 7.66 4.75 4.36 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 1.21 0.00 0.00 119 L 8.64 3.77 0.00 1.20 1.62 1.06 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.61 4.77 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 0.92 0.00 0.00 0.96 0.00 0.00 121 N 9.70 5.06 0.00 2.90 2.77 0.00 0.00 6.65 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 9.04 5.19 0.00 1.77 1.83 0.00 3.13 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 123 I 8.91 5.01 1.95 0.00 0.00 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 1.33 1.09 0.94 0.00 0.00 124 E 9.34 5.06 0.00 1.94 1.81 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 2.23 2.09 0.00 125 L 9.12 5.18 0.00 1.49 1.23 0.35 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.10 4.97 0.00 1.43 1.61 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.26 1.23 7.81 127 G 9.49 5.06 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 0.00 128 I 8.42 5.22 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.71 0.98 0.00 0.00 129 D 8.76 4.59 0.00 2.67 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 0.00 130 F 8.22 4.37 0.00 3.08 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 0.00 131 K 8.92 4.24 0.00 1.84 1.74 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.40 7.81 132 E 9.12 4.00 0.00 1.98 1.89 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 2.23 1.89 0.00 *133 D 7.93 4.98 0.00 2.63 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 8.03 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 0.00 135 N 8.26 4.46 0.00 3.03 2.86 0.00 0.00 7.46 7.20 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 0.00 136 I 7.63 3.82 1.62 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.23 0.00 0.00 137 L 7.70 3.96 0.00 1.78 1.69 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.90 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 7.92 3.95 0.00 3.21 3.30 0.00 5.62 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 0.00 140 K 8.22 4.57 0.00 1.78 1.81 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.38 7.81 141 L 7.85 4.67 0.00 1.55 1.67 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.82 4.13 0.00 2.05 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 2.41 2.32 0.00 143 Y 8.51 4.54 0.00 3.10 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 0.00 144 N 7.51 4.58 0.00 2.83 2.81 0.00 0.00 6.11 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 0.00 145 Y 7.95 4.35 0.00 2.90 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 0.00 146 N 8.11 5.14 0.00 2.54 2.60 0.00 0.00 6.95 7.57 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 0.00 147 S 8.25 4.87 0.00 4.01 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 0.00 148 H 8.85 5.06 0.00 3.07 3.23 0.00 5.76 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 0.00 149 N 8.65 5.27 0.00 2.47 2.13 0.00 0.00 6.33 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.60 4.09 1.85 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 0.70 0.00 0.00 -0.12 0.00 0.00 151 Y 8.67 4.74 0.00 2.99 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 0.00 152 I 8.94 4.77 1.61 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.77 0.87 0.00 0.00 153 T 8.77 5.01 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 1.30 0.00 0.00 154 A 8.68 4.31 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 0.00 155 D 8.77 4.56 0.00 2.61 2.40 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 0.00 156 K 8.77 3.79 0.00 1.94 1.85 0.00 1.88 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.53 1.02 7.81 *157 Q 8.24 3.89 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.07 0.00 0.00 0.00 0.00 0.00 2.30 1.97 0.00 *158 K 8.53 4.14 0.00 1.77 1.75 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.39 1.25 7.81 159 N 8.23 4.38 0.00 2.86 2.96 0.00 0.00 6.88 7.30 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 0.00 160 G 7.72 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 0.00 0.00 0.00 161 I 8.02 5.16 1.66 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.42 0.30 0.00 0.00 162 K 9.04 5.23 0.00 1.87 1.88 0.00 1.43 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.25 7.81 163 A 9.05 5.26 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 8.51 5.20 0.00 1.44 1.49 0.00 0.00 5.87 7.43 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 0.00 165 F 8.44 4.95 0.00 3.13 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 0.00 166 K 8.60 4.95 0.00 1.54 1.63 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.65 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.27 1.01 7.81 167 I 8.86 3.73 1.80 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 1.06 0.94 0.52 0.00 0.00 168 R 8.71 4.46 0.00 1.67 1.86 0.00 3.18 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 169 H 8.95 4.76 0.00 3.25 3.26 0.00 5.62 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.77 4.82 0.00 2.76 2.79 0.00 0.00 6.95 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 0.00 171 I 8.74 4.97 2.02 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 1.29 1.28 0.96 0.00 0.00 172 E 8.93 4.07 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 173 D 8.13 4.70 0.00 2.78 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 0.00 174 G 8.36 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 0.00 0.00 0.00 175 S 8.98 4.59 0.00 3.89 4.03 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 0.00 176 V 8.08 4.68 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 0.81 0.00 0.00 0.94 0.00 0.00 177 Q 9.18 4.40 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 178 L 8.59 4.79 0.00 1.64 1.53 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 179 A 9.24 4.66 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.70 4.84 0.00 2.72 2.48 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 0.00 181 H 8.86 4.99 0.00 1.40 2.34 0.00 5.81 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.75 4.48 0.00 2.93 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 0.00 183 Q 9.51 5.42 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 184 Q 9.35 5.16 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.51 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 185 N 8.88 6.30 0.00 2.47 2.81 0.00 0.00 6.63 6.33 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 0.00 186 T 8.52 5.11 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 1.30 0.00 0.00 187 P 0.00 4.93 0.00 2.16 2.14 0.00 3.93 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 188 I 8.36 4.13 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.60 0.95 0.00 0.00 189 G 7.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.50 4.58 0.00 2.69 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 0.00 191 G 7.81 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 0.00 0.00 0.00 192 P 0.00 4.59 0.00 2.18 2.06 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 193 V 7.95 4.34 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 0.65 0.00 0.00 1.07 0.00 0.00 *194 L 8.54 4.09 0.00 1.59 1.58 0.92 0.46 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 0.00 195 L 8.45 4.50 0.00 1.63 1.62 0.90 1.17 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 0.00 196 P 0.00 4.81 0.00 2.29 2.37 0.00 3.68 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 1.94 1.96 0.00 197 D 8.39 4.61 0.00 2.54 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 N 8.53 4.87 0.00 2.65 2.86 0.00 0.00 6.78 8.16 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 0.00 199 H 8.49 4.83 0.00 3.24 3.34 0.00 5.23 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 7.85 5.05 0.00 2.25 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 0.00 0.00 0.00 201 L 8.84 4.67 0.00 1.53 1.48 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.74 4.95 0.00 4.05 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 0.00 203 H 9.23 5.32 0.00 3.21 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 8.72 4.91 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 205 S 8.68 5.24 0.00 3.73 3.48 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 0.00 206 A 8.90 4.69 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 0.00 207 L 8.51 5.14 0.00 0.68 1.09 0.63 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.15 4.88 0.00 3.85 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 0.00 209 K 8.45 4.88 0.00 1.58 1.67 0.00 1.40 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.21 1.12 7.81 210 D 8.80 4.60 0.00 2.61 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 0.00 211 P 0.00 4.31 0.00 2.07 2.10 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 212 N 8.31 4.71 0.00 2.84 2.80 0.00 0.00 6.79 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 0.00 213 E 7.95 4.50 0.00 1.72 1.69 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 1.80 2.23 0.00 214 K 8.47 4.31 0.00 2.04 1.84 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.01 7.81 215 R 7.79 4.14 0.00 1.96 1.94 0.00 3.19 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 216 D 8.66 4.90 0.00 2.94 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 0.00 217 H 8.50 4.85 0.00 3.22 3.20 0.00 5.55 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 7.98 4.49 0.00 1.35 0.86 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 219 V 8.46 4.53 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 0.65 0.00 0.00 0.91 0.00 0.00 220 L 8.94 5.18 0.00 1.92 1.74 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.82 5.08 0.00 1.60 1.39 0.84 0.69 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 0.00 222 E 8.74 5.17 0.00 1.86 1.73 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 2.21 2.12 0.00 223 F 8.96 5.27 0.00 2.98 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 0.00 224 V 9.04 5.35 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.80 0.00 0.00 225 T 8.31 4.99 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 226 A 8.34 4.18 0.18 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 0.00 227 A 8.03 4.04 0.56 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 0.00 228 G 9.14 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 I 7.54 4.22 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.76 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.