NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *13 H 4.7323 8.4449 117.3731 54.3340 29.3781 172.8097 14 S 4.2609 8.3222 121.4839 54.6309 64.4888 172.5601 15 P 3.5361 0.0000 0.0000 61.3253 29.8994 174.4050 16 A 4.6875 6.3587 121.9433 50.2821 23.0640 177.0024 17 S 4.4460 9.0545 115.6721 58.8526 62.6975 174.8804 18 G 2.9450 8.8418 114.3034 45.2848 0.0000 173.2683 19 R 3.7789 7.6653 118.4987 57.3764 28.2586 178.1488 20 Y 4.0630 7.7525 115.8349 61.1373 38.4376 178.2945 21 I 3.8871 8.4186 120.3657 64.5165 37.5969 177.1223 22 Q 4.0833 8.3397 120.8319 59.4603 29.0891 178.9887 23 Q 4.2625 8.0185 113.5396 56.8751 28.5675 178.3306 *25 L 4.1430 8.0268 120.2184 54.9950 43.8028 178.9725 26 D 4.3763 8.3331 118.3798 57.5888 40.7099 178.9137 27 Q 4.2770 8.0462 119.8023 58.4487 28.6150 178.9016 28 R 3.8899 7.9034 119.2392 59.6382 30.1722 179.0969 29 C 4.3121 8.5217 116.6421 60.0524 38.2951 176.0826 30 Q 3.9632 8.3250 119.8248 58.8538 28.2411 178.4949 31 E 3.9484 8.1815 120.2841 59.2940 29.6366 178.9021 32 I 3.8219 8.0239 119.7915 64.3647 37.1117 178.0730 33 A 3.9625 8.4047 121.7567 55.3445 18.2178 179.5329 34 A 3.9371 8.0168 119.0706 55.3566 18.4597 179.7841 35 E 3.9333 8.4308 117.2020 59.5059 29.5375 179.5400 36 L 3.9892 8.1972 119.3092 57.7344 41.5788 178.5425 37 C 4.3467 8.4427 118.7189 60.1148 43.3694 175.9011 38 Q 3.7843 7.8316 117.6255 58.6245 28.3334 178.1613 39 S 4.4308 7.6698 114.2216 58.6599 63.2133 174.8085 40 G 4.0148 7.9659 109.4159 45.1069 0.0000 174.8229 41 L 4.2348 7.7350 122.0257 53.9048 40.3637 176.0606 42 R 4.1006 8.5340 123.7859 58.8296 30.4574 179.8570 43 K 4.1982 7.6772 117.4028 56.5786 31.3623 178.8531 *45 C 4.5273 7.8629 116.0132 58.0751 40.5074 173.7191 46 V 4.6538 7.5209 115.0383 58.2272 35.8955 173.7743 47 P 4.5299 0.0000 0.0000 62.5047 32.1412 177.5972 48 S 4.1919 8.7185 115.6626 61.7309 62.8811 177.0943 49 S 4.2360 8.0681 113.5321 60.7857 62.9085 175.0949 50 R 4.3647 8.0681 118.5414 55.9798 30.3232 175.4393 51 I 5.1603 7.6813 119.3371 59.5705 39.7337 175.3957 52 V 4.7898 8.8120 118.7404 59.5154 36.4576 174.1598 53 A 5.2339 9.2429 124.9044 51.3130 19.8654 177.2452 54 R 4.9866 9.5422 120.7738 54.4657 35.1836 173.8694 55 N 4.7142 8.3869 121.2468 52.3399 40.4017 173.6458 56 A 4.6103 8.4079 126.5481 51.1011 23.5900 175.3995 57 V 4.2394 7.9832 113.0197 60.5258 32.3734 177.7344 58 G 4.1282 8.6606 111.6378 45.7095 0.0000 173.6696 59 I 4.2769 9.0052 119.9630 59.7238 38.7916 175.3335 60 T 3.8939 7.8496 116.7188 66.0141 68.4384 174.7320 61 H 4.5092 8.9289 121.2277 56.3207 27.6234 175.9483 62 Q 4.3494 7.9502 120.1682 54.7414 26.8589 175.5636 63 N 4.8683 8.1588 114.3598 52.9664 39.3542 174.9477 64 T 4.6274 7.3154 109.2488 59.6707 71.9678 173.7753 65 L 4.5065 8.2945 123.1661 55.0431 42.1303 176.4749 66 Q 4.5320 8.8267 122.1303 53.5662 33.8990 174.4459 67 W 4.9542 9.0462 121.2760 56.8757 30.3617 175.7263 68 R 5.0238 9.4465 123.0197 54.7209 34.7632 173.8041 69 C 5.1810 9.1783 120.0943 56.0639 40.9402 172.6376 70 F 5.2609 9.2373 123.9615 55.5216 41.4804 175.0150 71 D 5.0654 9.1424 123.9055 54.1014 40.9191 177.1234 72 T 3.8767 9.4092 118.0632 64.6043 68.8937 176.3742 73 A 4.0870 8.3130 124.5087 54.3299 18.4105 178.0749 74 S 4.5758 7.9366 108.6936 58.4997 63.8736 174.6180 75 L 4.3860 7.3505 121.4176 54.2307 42.4123 176.7886 76 L 4.3116 8.8739 124.8751 54.8643 42.4007 179.0018 77 E 4.0039 8.7639 119.4095 59.1506 29.9501 178.5503 78 S 4.7759 7.7441 114.0013 57.6001 66.9188 177.0623 79 N 5.1269 8.1910 115.9310 52.3264 39.6349 175.1304 *83 N 4.7011 8.6303 116.9866 54.3581 39.7368 175.0192 84 G 4.0115 8.2123 105.8008 47.0770 0.0000 173.6681 85 V 4.4580 7.8997 112.8985 59.4844 34.3112 174.9012 86 N 5.2400 8.6158 119.9687 51.8782 42.1153 173.6874 87 C 4.9859 8.6965 120.5205 55.3035 43.5086 172.5403 88 V 5.2789 8.4294 118.9739 60.2945 33.6797 175.9132 89 D 4.9069 9.2538 124.0203 52.7178 40.6333 176.4112 90 D 4.8485 8.6557 116.6838 55.4843 40.7284 177.7853 91 C 4.7713 8.5832 115.6364 56.6026 40.5765 174.2716 92 G 3.9537 8.4423 107.4579 46.0890 0.0000 172.9913 93 H 5.0670 8.7434 117.5971 54.2895 30.6326 174.4886 94 T 4.8898 8.5794 113.5157 61.3422 70.1149 174.2140 95 I 4.7323 8.7880 125.3417 58.7603 42.0654 172.7796 96 P 4.7810 0.0000 0.0000 62.9789 32.0977 176.0358 97 C 5.4057 8.6518 120.9648 53.9805 43.6826 172.2465 98 P 4.2316 0.0000 0.0000 63.4710 31.1047 175.6874 99 G 3.8941 8.5267 107.8601 44.0196 0.0000 172.3594 100 G 4.1034 8.6763 105.0846 44.3210 0.0000 172.0937 101 V 4.2292 8.7379 122.2887 62.3158 32.7508 175.2336 102 H 4.5645 8.8616 128.0235 55.2779 30.1743 175.9576 103 R 4.1474 8.8547 126.1596 58.4681 30.4158 178.7494 104 Q 4.2718 8.3446 115.5451 56.9907 29.8418 176.0286 105 N 4.7674 7.9255 111.3640 52.5615 39.2815 174.8514 106 S 4.1737 7.9413 113.9688 58.6316 63.0017 173.2265 107 N 4.9658 9.0846 126.4516 52.4312 39.9549 172.6964 108 H 5.3289 8.1802 119.7691 54.1300 32.4019 172.6505 109 A 4.5725 8.6883 120.0508 50.2395 21.6722 175.6249 110 T 4.2680 8.6025 119.9377 63.2701 69.2236 176.0582 111 R 4.7183 8.6730 126.5253 54.6297 31.3293 175.9119 112 H 4.3979 8.2405 120.2876 59.3179 30.4777 176.0012 113 E 3.9345 8.1302 119.9252 59.5112 29.5056 179.0125 114 I 3.6792 7.6506 118.0996 64.0850 38.1799 177.7778 115 L 3.8033 7.7435 119.5180 57.7304 41.4233 179.5702 116 S 4.0960 8.1711 115.2889 61.4208 62.7352 176.7044 117 K 3.9454 8.1517 122.2927 59.4712 31.8620 178.8540 118 L 3.9537 7.9559 119.3148 57.6133 41.3898 179.6517 119 V 3.5260 7.6620 118.1130 66.0346 31.0619 177.7102 120 E 3.9749 8.1754 118.2080 59.7076 28.9618 179.3443 121 E 4.1105 8.3885 118.4640 59.3858 29.4744 179.7187 122 G 3.8441 8.4638 106.0650 47.7443 0.0000 175.7393 123 V 3.7148 8.2000 121.0411 66.0667 31.2893 178.0354 124 Q 3.9847 7.4764 115.1187 59.0750 28.7435 179.0610 125 R 3.7494 7.5448 117.5627 58.6683 29.9052 178.3408 126 F 5.0100 8.1408 114.4305 56.4974 40.2869 174.9350 127 C 4.5979 7.9215 119.6325 55.1656 40.7913 173.6078 128 S 4.2484 8.7340 121.9497 58.1444 63.1556 172.8914 129 P 4.4182 0.0000 0.0000 65.7943 31.0343 178.4206 130 Y 3.8734 7.9456 115.2701 61.0556 37.8714 177.9505 131 Q 4.0404 8.1766 119.8816 58.9787 29.0740 177.8394 132 A 4.0527 8.5507 122.3308 55.3118 18.3587 179.5394 133 S 3.9813 8.0852 111.1946 61.5274 62.6077 176.1285 134 A 3.9613 7.8426 123.1251 55.3513 17.9919 179.4121 135 N 4.4042 8.7018 115.3666 56.2761 38.5976 177.6053 136 K 3.9428 8.4449 121.3914 59.5367 32.2285 177.9858 137 Y 4.0743 8.2181 119.9015 61.1355 38.6720 177.6943 138 C 4.3093 8.2958 116.9117 60.1484 34.9796 175.7428 139 N 4.4267 8.5018 118.8199 56.6329 38.2842 176.7221 140 D 4.2435 7.9654 119.7981 57.0583 40.9625 178.3108 141 K 3.8671 7.3200 118.6913 57.5287 33.0911 176.8095 142 F 4.5591 8.3511 119.7099 54.0415 39.9480 171.4949 143 P 4.9000 0.0000 0.0000 63.5701 31.6219 177.0304 144 G 4.0703 9.9149 112.2140 45.2206 0.0000 173.7694 145 T 4.8488 7.4929 109.5835 61.3004 70.2956 174.0483 146 I 4.8789 8.7650 115.0471 59.1627 41.6194 173.7191 147 A 5.4388 9.0898 124.9875 51.3089 20.1216 177.0260 148 R 4.8309 9.2612 119.2803 54.9141 35.5032 174.6461 149 R 4.3202 7.7362 122.7458 55.3844 30.1250 174.7296 150 S 4.4897 8.4528 121.5147 57.2961 65.9973 173.2690 151 K 4.9793 8.1476 117.7989 55.7551 33.3444 177.4982 152 G 4.1627 8.1619 110.2220 44.9841 0.0000 172.1572 153 F 4.5665 9.0134 125.0191 58.2473 40.0694 176.3400 154 G 3.3824 8.3273 117.5439 45.5172 0.0000 173.6909 155 N 4.5002 7.8248 119.2652 52.7776 40.4641 173.4022 156 N 4.8028 8.6693 122.8577 52.7294 37.8819 175.2854 157 V 4.0717 8.0875 117.6730 64.7950 33.1364 175.6589 158 E 4.1631 8.2849 120.9510 56.2584 30.4325 175.3949 159 V 5.2027 8.4685 119.0397 59.3009 34.7758 174.5836 160 A 4.5882 7.9607 122.3503 50.5977 22.9663 175.4393 161 W 4.8371 9.3782 120.4474 56.9194 30.2095 176.1021 162 R 5.0671 9.3102 123.0588 54.6325 34.7771 173.8522 163 C 5.1382 9.2789 119.7899 56.4910 42.7891 172.2714 164 Y 4.9573 9.2919 122.9905 56.0669 39.9768 175.4445 165 E 4.4185 8.9653 124.1297 56.3438 30.2651 178.5021 166 K 3.9709 9.1113 123.7614 59.4400 32.4640 179.0674 167 A 4.0809 8.0728 120.6915 54.6470 18.3327 178.0476 168 S 4.4713 8.0113 108.6689 58.8671 63.7522 174.2937 169 L 4.5978 7.5269 121.2986 53.4079 43.2657 175.7501 170 L 4.7041 8.3705 121.0859 52.9522 42.3356 177.3799 171 Y 4.1180 9.0278 126.5274 60.4998 38.9080 177.9309 172 S 4.0855 8.1563 112.5173 59.6875 63.8912 173.5820 173 V 4.2783 7.0382 123.0114 61.5178 32.6779 174.4750 174 Y 4.6178 8.7313 125.8279 57.8113 38.8286 174.7550 175 A 4.8571 8.9383 123.9580 49.7325 23.5809 174.9773 176 E 4.2032 8.7491 120.4975 56.8513 30.9379 174.8176 177 C 5.7191 9.1946 120.0553 54.2793 46.2805 171.8546 178 A 5.1094 9.3925 121.5790 50.5530 19.7847 177.8149 179 S 3.8357 9.0183 118.6805 57.3396 64.7771 174.5880 180 N 4.8453 8.0175 114.6164 53.7163 36.9143 176.0457 181 C 4.5907 7.6482 114.1359 56.2950 40.9532 173.6956 182 G 2.9970 6.9806 107.4560 46.6411 0.0000 173.4860 183 T 4.7045 7.3572 108.6314 58.8978 72.7261 173.0794 184 T 4.2364 8.4790 118.0221 64.2272 68.9230 173.6648 185 W 5.2776 8.5611 134.3067 56.4195 35.2748 172.6013 186 Y 5.2828 8.1768 119.6176 56.4088 41.1657 174.2982 187 C 5.1788 9.3039 120.4050 53.9529 44.7965 171.9373 188 P 3.4190 0.0000 0.0000 63.7668 31.5663 176.9702 189 G 4.0067 8.9619 110.4150 46.4756 0.0000 172.6071 190 G 4.0167 8.8909 114.1018 44.3393 0.0000 169.1121 191 R 4.8147 7.8129 117.0425 54.4388 32.6327 176.7762 192 R 4.1618 8.4939 118.1150 56.1011 30.9788 177.6531 193 G 4.0414 8.4382 105.7236 46.4594 0.0000 173.8101 194 T 4.4235 7.4926 110.5973 61.1152 70.1744 174.1475 195 S 4.0504 8.0682 114.9700 57.8023 63.4427 174.0598 196 T 4.4158 8.2306 111.1420 60.1316 71.0589 175.6384 197 E 3.9697 8.7730 121.8093 59.5589 29.5271 178.5688 198 L 4.0634 7.5338 119.3385 57.9645 41.4795 178.8281 199 D 4.6950 7.9283 116.5513 55.9846 40.8314 177.6774 200 K 4.2937 7.9728 118.1356 56.5799 34.1091 177.4596 201 R 4.2707 7.7705 121.4907 54.0400 28.1651 174.4971 202 H 4.6267 6.6389 115.2482 54.7647 32.2976 174.2114 203 Y 4.3716 8.3493 115.7577 56.2514 41.2258 175.2229 204 T 4.2503 8.5785 122.0953 63.0137 69.1474 175.6917 205 E 4.8893 8.9662 126.4561 54.2729 31.1840 175.8980 206 E 4.1663 8.5357 125.7178 60.3375 30.2197 179.9210 207 E 4.0547 8.1926 117.7159 61.1207 29.9678 181.0513 208 G 3.6538 7.8120 108.0188 46.8695 0.0000 175.8304 209 I 3.2328 7.6129 122.3123 63.9485 37.0951 178.6548 210 R 3.5905 7.6349 118.9045 59.1616 29.8105 178.9318 211 Q 3.8201 7.9632 119.0447 59.0019 28.8215 178.0283 212 A 3.9058 7.3201 120.6863 55.2302 18.5288 179.4265 213 I 3.8949 7.7612 118.4586 64.4368 37.0081 178.8046 214 G 3.7486 8.0313 104.9745 46.7276 0.0000 175.0900 215 S 4.3398 7.5929 114.6532 58.7032 63.7571 174.5306 216 V 3.6280 6.8340 123.4997 62.2440 31.8247 175.2003 217 D 4.4843 8.2895 127.1822 53.6451 41.4394 176.2563 218 S 4.6517 8.8309 118.0017 57.3497 62.8307 172.5196 219 P 4.4281 0.0000 0.0000 64.4302 31.5320 176.6322 220 C 5.0765 7.8359 116.4360 54.7609 38.2362 173.5427 221 S 4.4860 8.8477 117.0061 57.7145 63.4441 175.1073 222 E 4.1421 8.6657 119.5565 58.2488 29.4116 178.2528 223 V 4.5821 7.7286 118.7855 61.1227 31.8629 174.7913 224 E 5.1363 7.7918 118.1956 55.5327 33.7432 175.0400 225 V 4.2074 8.7741 122.9261 61.6645 33.4925 173.8325 226 C 4.9730 8.8011 128.4863 55.8385 44.6553 172.3513 227 L 4.8718 9.0478 127.8126 52.1607 43.2029 174.6421 228 P 4.7611 0.0000 0.0000 62.7415 32.3200 175.7602 229 K 4.8857 8.7185 119.7688 54.7799 36.0516 176.7909 230 D 5.0023 8.9997 118.3657 54.2273 39.7579 175.5533 231 E 5.0258 7.6927 119.4495 54.8215 33.0464 174.5460 232 N 4.7581 8.9277 123.0059 52.5514 39.4667 173.3727 233 P 4.7833 0.0000 0.0000 61.0276 33.4830 173.2194 234 P 4.5876 0.0000 0.0000 62.1092 32.9518 175.2108 235 L 4.2422 8.7937 122.4460 54.9886 43.2064 174.7892 236 C 5.3898 8.8476 123.5807 55.4739 39.7257 172.9370 237 L 4.7663 8.6258 124.9325 52.6946 43.5544 176.2584 238 D 4.6502 8.8194 122.8583 54.8103 41.1645 176.3146 239 E 4.0825 8.6211 124.8049 56.2351 30.4673 176.6153 240 S 4.1910 8.6273 120.2337 57.9156 63.0863 174.3008 241 G 3.8572 8.3769 116.2966 45.2328 0.0000 174.2419 242 Q 4.3010 8.3280 121.0404 56.1563 26.7214 177.5065 243 I 3.9949 7.3803 118.8492 60.0744 35.6107 177.5339 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 *13 H 8.44 4.73 0.00 2.95 2.96 0.00 7.16 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 14 S 8.32 4.26 0.00 3.76 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 15 P 0.00 3.54 0.00 1.84 2.08 0.00 3.47 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 2.05 1.96 0.00 16 A 6.36 4.69 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 9.05 4.45 0.00 4.07 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.84 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 0.00 0.00 0.00 19 R 7.67 3.78 0.00 2.00 2.07 0.00 2.95 0.00 0.00 3.07 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 20 Y 7.75 4.06 0.00 1.48 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.42 3.89 1.94 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.89 0.00 0.00 22 Q 8.34 4.08 0.00 2.40 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 7.14 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 23 Q 8.02 4.26 0.00 2.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.16 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 *25 L 8.03 4.14 0.00 1.69 1.47 -0.26 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.33 4.38 0.00 2.87 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 27 Q 8.05 4.28 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 28 R 7.90 3.89 0.00 1.89 2.00 0.00 3.22 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 29 C 8.52 4.31 0.00 3.25 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 30 Q 8.33 3.96 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 31 E 8.18 3.95 0.00 2.06 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 2.31 2.35 0.00 32 I 8.02 3.82 2.00 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 1.46 0.58 0.91 0.00 0.00 33 A 8.40 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.02 3.94 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.43 3.93 0.00 2.18 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 2.33 2.48 0.00 36 L 8.20 3.99 0.00 1.83 1.71 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 37 C 8.44 4.35 0.00 3.04 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 38 Q 7.83 3.78 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.72 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 39 S 7.67 4.43 0.00 4.03 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 40 G 7.97 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 41 L 7.73 4.23 0.00 1.64 1.69 0.91 0.82 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 42 R 8.53 4.10 0.00 1.83 2.00 0.00 3.27 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 43 K 7.68 4.20 0.00 1.86 1.90 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.71 7.81 *45 C 7.86 4.53 0.00 3.11 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.52 4.65 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 0.78 0.00 0.00 0.95 0.00 0.00 47 P 0.00 4.53 0.00 2.23 2.19 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 48 S 8.72 4.19 0.00 3.92 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 49 S 8.07 4.24 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 50 R 8.07 4.36 0.00 2.04 2.18 0.00 3.25 0.00 0.00 3.28 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 51 I 7.68 5.16 1.91 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 1.26 0.91 1.00 0.00 0.00 52 V 8.81 4.79 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 0.79 0.00 0.00 1.02 0.00 0.00 53 A 9.24 5.23 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 54 R 9.54 4.99 0.00 1.69 1.64 0.00 3.15 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.45 0.00 55 N 8.39 4.71 0.00 1.44 1.77 0.00 0.00 7.00 7.29 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 56 A 8.41 4.61 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.98 4.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.94 0.00 0.00 58 G 8.66 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 59 I 9.01 4.28 1.97 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 1.52 0.57 0.96 0.00 0.00 60 T 7.85 3.89 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 1.02 0.00 0.00 61 H 8.93 4.51 0.00 3.35 3.51 0.00 5.69 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 62 Q 7.95 4.35 0.00 2.38 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 63 N 8.16 4.87 0.00 2.71 2.84 0.00 0.00 7.14 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 64 T 7.32 4.63 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 1.20 0.00 0.00 65 L 8.29 4.51 0.00 1.46 1.70 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.83 4.53 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.01 0.00 0.00 0.00 0.00 0.00 2.18 2.41 0.00 67 W 9.05 4.95 0.00 3.39 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 68 R 9.45 5.02 0.00 1.17 1.34 0.00 2.70 0.00 0.00 2.89 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.81 0.00 69 C 9.18 5.18 0.00 2.81 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 70 F 9.24 5.26 0.00 3.02 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 71 D 9.14 5.07 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 9.41 3.88 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 1.29 0.00 0.00 73 A 8.31 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.94 4.58 0.00 4.20 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 75 L 7.35 4.39 0.00 1.81 1.56 0.76 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.87 4.31 0.00 1.74 1.56 0.86 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.76 4.00 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 1.87 0.00 78 S 7.74 4.78 0.00 3.55 3.60 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 79 N 8.19 5.13 0.00 2.71 2.62 0.00 0.00 6.65 7.99 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 *83 N 8.63 4.70 0.00 2.76 3.08 0.00 0.00 5.88 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 84 G 8.21 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 85 V 7.90 4.46 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 0.27 0.00 0.00 0.83 0.00 0.00 86 N 8.62 5.24 0.00 2.45 2.68 0.00 0.00 7.06 7.24 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 87 C 8.70 4.99 0.00 1.23 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 0.00 0.00 0.00 88 V 8.43 5.28 2.70 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 0.89 0.00 0.00 1.21 0.00 0.00 89 D 9.25 4.91 0.00 3.00 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 90 D 8.66 4.85 0.00 2.84 2.97 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 91 C 8.58 4.77 0.00 3.23 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.44 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 93 H 8.74 5.07 0.00 3.47 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.58 4.89 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 1.09 0.00 0.00 95 I 8.79 4.73 2.12 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 1.03 0.00 0.00 96 P 0.00 4.78 0.00 2.24 1.99 0.00 4.02 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.08 0.00 97 C 8.65 5.41 0.00 2.65 2.88 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 98 P 0.00 4.23 0.00 2.03 1.99 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 99 G 8.53 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 0.00 0.00 0.00 100 G 8.68 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 0.00 101 V 8.74 4.23 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 0.96 0.00 0.00 0.91 0.00 0.00 102 H 8.86 4.56 0.00 3.29 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 R 8.85 4.15 0.00 1.89 1.98 0.00 3.35 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 104 Q 8.34 4.27 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 105 N 7.93 4.77 0.00 2.25 2.69 0.00 0.00 6.83 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 0.00 106 S 7.94 4.17 0.00 4.25 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 0.00 107 N 9.08 4.97 0.00 2.87 2.73 0.00 0.00 6.59 7.70 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 0.00 108 H 8.18 5.33 0.00 2.38 2.54 0.00 5.52 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.69 4.57 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 8.60 4.27 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 1.29 0.00 0.00 111 R 8.67 4.72 0.00 1.81 1.83 0.00 3.30 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 112 H 8.24 4.40 0.00 3.38 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.13 3.93 0.00 2.07 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 2.44 2.42 0.00 114 I 7.65 3.68 1.86 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 1.62 1.19 0.96 0.00 0.00 115 L 7.74 3.80 0.00 1.72 1.15 1.03 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.17 4.10 0.00 4.00 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 0.00 117 K 8.15 3.95 0.00 1.92 1.94 0.00 1.52 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.51 7.81 118 L 7.96 3.95 0.00 1.75 1.62 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 119 V 7.66 3.53 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 1.20 0.00 0.00 0.70 0.00 0.00 120 E 8.18 3.97 0.00 2.23 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 0.00 2.36 2.54 0.00 121 E 8.39 4.11 0.00 2.16 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 2.31 2.45 0.00 122 G 8.46 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 0.00 123 V 8.20 3.71 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 1.06 0.00 0.00 1.09 0.00 0.00 124 Q 7.48 3.98 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.74 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 125 R 7.54 3.75 0.00 1.12 0.66 0.00 2.91 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.53 0.00 126 F 8.14 5.01 0.00 3.12 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 0.00 127 C 7.92 4.60 0.00 3.22 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.73 4.25 0.00 3.90 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 0.00 129 P 0.00 4.42 0.00 1.93 1.95 0.00 3.70 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 130 Y 7.95 3.87 0.00 3.19 2.97 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 0.00 131 Q 8.18 4.04 0.00 2.50 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 132 A 8.55 4.05 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 0.00 133 S 8.09 3.98 0.00 3.94 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 0.00 134 A 7.84 3.96 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 0.00 135 N 8.70 4.40 0.00 2.98 2.95 0.00 0.00 6.67 7.69 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 0.00 136 K 8.44 3.94 0.00 1.88 2.05 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.53 7.81 137 Y 8.22 4.07 0.00 3.03 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 0.00 138 C 8.30 4.31 0.00 3.35 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 0.00 139 N 8.50 4.43 0.00 2.87 2.83 0.00 0.00 7.26 9.09 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 0.00 140 D 7.97 4.24 0.00 2.71 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.32 3.87 0.00 1.13 1.10 0.00 1.39 0.00 0.00 1.45 0.00 0.00 2.72 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.86 7.81 142 F 8.35 4.56 0.00 3.01 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 0.00 143 P 0.00 4.90 0.00 2.05 2.03 0.00 3.70 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 144 G 9.91 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 0.00 145 T 7.49 4.85 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 1.49 0.00 0.00 146 I 8.77 4.88 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.07 0.74 0.00 0.00 147 A 9.09 5.44 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 R 9.26 4.83 0.00 1.77 1.68 0.00 3.22 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 149 R 7.74 4.32 0.00 0.67 0.93 0.00 2.52 0.00 0.00 3.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.92 0.00 150 S 8.45 4.49 0.00 3.76 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 0.00 151 K 8.15 4.98 0.00 1.77 1.89 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.30 7.81 152 G 8.16 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 F 9.01 4.57 0.00 3.20 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 0.00 154 G 8.33 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 N 7.82 4.50 0.00 2.64 2.65 0.00 0.00 6.96 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 0.00 156 N 8.67 4.80 0.00 2.86 2.88 0.00 0.00 6.07 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 0.00 157 V 8.09 4.07 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 0.76 0.00 0.00 0.91 0.00 0.00 158 E 8.28 4.16 0.00 2.09 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 2.38 2.35 0.00 159 V 8.47 5.20 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 0.75 0.00 0.00 0.88 0.00 0.00 160 A 7.96 4.59 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 0.00 161 W 9.38 4.84 0.00 3.48 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 0.00 162 R 9.31 5.07 0.00 0.67 1.47 0.00 2.59 0.00 0.00 2.97 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.75 0.00 163 C 9.28 5.14 0.00 3.00 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 0.00 164 Y 9.29 4.96 0.00 3.03 2.87 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 0.00 165 E 8.97 4.42 0.00 2.08 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 2.47 2.44 0.00 166 K 9.11 3.97 0.00 1.87 2.07 0.00 1.90 0.00 0.00 1.92 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.61 1.73 7.81 167 A 8.07 4.08 1.30 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 0.00 168 S 8.01 4.47 0.00 4.25 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 0.00 169 L 7.53 4.60 0.00 1.78 1.55 0.91 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 0.00 170 L 8.37 4.70 0.00 1.70 1.56 0.90 0.89 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 0.00 171 Y 9.03 4.12 0.00 3.14 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 0.00 172 S 8.16 4.09 0.00 4.06 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 0.00 173 V 7.04 4.28 2.13 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 0.91 0.00 0.00 0.91 0.00 0.00 174 Y 8.73 4.62 0.00 2.73 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 0.00 175 A 8.94 4.86 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 E 8.75 4.20 0.00 1.87 1.67 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 2.04 2.12 0.00 177 C 9.19 5.72 0.00 3.36 3.26 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 0.00 178 A 9.39 5.11 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 0.00 179 S 9.02 3.84 0.00 3.05 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 0.00 180 N 8.02 4.85 0.00 2.84 2.89 0.00 0.00 5.83 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 0.00 181 C 7.65 4.59 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 0.00 182 G 6.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 T 7.36 4.70 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 184 T 8.48 4.24 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 1.06 0.00 0.00 185 W 8.56 5.28 0.00 3.32 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 0.00 186 Y 8.18 5.28 0.00 2.95 2.97 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 0.00 187 C 9.30 5.18 0.00 2.74 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 0.00 188 P 0.00 3.42 0.00 0.51 0.95 0.00 3.37 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.45 0.00 189 G 8.96 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 0.00 190 G 8.89 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 0.00 191 R 7.81 4.81 0.00 1.64 1.77 0.00 3.32 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 1.07 1.80 0.00 192 R 8.49 4.16 0.00 1.75 1.93 0.00 3.24 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 193 G 8.44 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 0.00 0.00 0.00 194 T 7.49 4.42 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 1.16 0.00 0.00 195 S 8.07 4.05 0.00 3.70 3.45 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 0.00 196 T 8.23 4.42 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 197 E 8.77 3.97 0.00 2.12 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 2.37 2.46 0.00 198 L 7.53 4.06 0.00 1.96 1.75 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 199 D 7.93 4.69 0.00 3.15 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 K 7.97 4.29 0.00 1.74 1.62 0.00 1.63 0.00 0.00 1.35 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.71 1.14 7.81 201 R 7.77 4.27 0.00 1.81 1.99 0.00 3.22 0.00 0.00 3.18 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 202 H 6.64 4.63 0.00 2.41 2.99 0.00 5.47 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 8.35 4.37 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 T 8.58 4.25 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 1.32 0.00 0.00 205 E 8.97 4.89 0.00 2.22 2.13 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 2.71 2.88 0.00 206 E 8.54 4.17 0.00 2.05 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 2.52 2.41 0.00 207 E 8.19 4.05 0.00 1.97 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 2.31 1.94 0.00 208 G 7.81 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 I 7.61 3.23 1.83 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.56 0.28 0.00 0.00 210 R 7.63 3.59 0.00 1.85 1.88 0.00 3.17 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 211 Q 7.96 3.82 0.00 2.13 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 212 A 7.32 3.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 I 7.76 3.89 1.78 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.02 0.94 0.00 0.00 214 G 8.03 3.75 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 0.00 0.00 0.00 215 S 7.59 4.34 0.00 3.98 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 0.00 216 V 6.83 3.63 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 0.01 0.00 0.00 0.71 0.00 0.00 217 D 8.29 4.48 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 S 8.83 4.65 0.00 3.91 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 0.00 219 P 0.00 4.43 0.00 2.23 2.18 0.00 3.92 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 2.04 2.22 0.00 220 C 7.84 5.08 0.00 2.98 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 S 8.85 4.49 0.00 3.99 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 0.00 222 E 8.67 4.14 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.87 0.00 223 V 7.73 4.58 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 0.76 0.00 0.00 0.93 0.00 0.00 224 E 7.79 5.14 0.00 1.76 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 2.23 0.00 225 V 8.77 4.21 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 1.00 0.00 0.00 0.94 0.00 0.00 226 C 8.80 4.97 0.00 3.02 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 0.00 227 L 9.05 4.87 0.00 1.63 1.61 0.99 0.82 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 0.00 228 P 0.00 4.76 0.00 1.53 1.79 0.00 3.78 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 2.23 2.07 0.00 229 K 8.72 4.89 0.00 1.93 1.77 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.43 1.40 7.81 230 D 9.00 5.00 0.00 3.26 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 E 7.69 5.03 0.00 2.31 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 2.08 2.09 0.00 232 N 8.93 4.76 0.00 2.63 2.69 0.00 0.00 6.94 8.15 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 0.00 233 P 0.00 4.78 0.00 2.06 2.03 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 234 P 0.00 4.59 0.00 2.15 2.28 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 235 L 8.79 4.24 0.00 1.81 1.74 0.93 1.38 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 0.00 236 C 8.85 5.39 0.00 2.87 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 L 8.63 4.77 0.00 1.60 1.58 0.94 0.92 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 0.00 238 D 8.82 4.65 0.00 2.56 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 0.00 239 E 8.62 4.08 0.00 2.14 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 2.33 2.28 0.00 240 S 8.63 4.19 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 G 8.38 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 0.00 242 Q 8.33 4.30 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 7.04 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 243 I 7.38 3.99 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 1.27 0.62 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.