NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3041 8.3349 115.2654 58.1276 63.4560 173.7840 3 F 4.4681 8.4649 126.0385 59.1684 39.5775 176.1562 4 I 4.0661 8.1031 121.6578 63.4222 38.1969 177.2082 5 K 3.3962 7.9082 120.7178 59.2394 31.7491 176.9638 6 P 4.4022 0.0000 0.0000 64.4591 31.3931 176.9978 7 I 4.4473 7.4460 109.8515 60.6463 38.1219 176.5291 8 Y 4.0159 8.0024 124.7049 61.7052 38.4629 178.4655 9 Q 3.8199 8.0735 118.1423 58.8125 28.7760 178.3560 10 D 4.3014 7.8312 119.4595 57.3670 41.0755 178.7482 11 I 2.5769 7.2405 120.1404 63.9456 37.0300 177.8012 12 N 3.9585 7.9033 118.1018 56.8811 38.3777 177.0444 13 S 4.0449 7.4418 115.0725 61.4959 63.0119 176.4844 14 I 3.7980 7.1903 114.3307 63.3189 37.5474 177.3816 15 L 4.2359 7.5790 121.5324 56.9231 42.1374 178.0674 16 I 3.8432 7.6712 117.5446 63.0459 37.1127 176.3972 17 G 4.1080 7.8195 108.6009 45.2091 0.0000 173.5280 18 Q 4.3221 8.7403 123.8441 56.4229 29.4549 181.2496 19 K 5.6882 8.4754 124.7784 53.4722 35.5768 177.6059 20 V 4.4900 8.3796 125.3694 59.1735 35.3280 173.0489 21 K 4.4073 8.4917 126.6265 55.9531 32.4808 180.3538 *22 R 4.1662 8.5581 126.8087 55.5125 27.1323 174.3356 *38 E 4.1353 8.2146 130.9398 56.3137 31.1631 179.0165 39 K 4.2008 8.1510 118.0552 57.6789 31.5836 180.0586 40 L 4.4151 8.0066 122.6708 58.3190 41.4183 179.5168 41 V 3.6318 7.9529 118.8714 66.0634 31.5168 177.2599 42 Y 4.1703 8.2837 121.2225 61.2743 38.7046 178.2891 43 K 3.7621 7.8217 123.2933 59.9725 31.7636 180.2139 44 F 4.1803 8.1637 121.6972 61.2013 39.2787 177.1852 45 L 3.8843 8.0681 118.4826 57.7253 41.2740 179.5536 46 K 3.5966 8.3098 119.6202 58.8352 31.7520 178.2435 47 E 4.0108 7.5738 117.5278 57.3710 29.8225 177.1693 48 N 4.6400 7.4626 114.0287 52.7176 40.8483 174.8949 49 L 4.6059 8.1087 124.0043 53.9147 42.9179 178.5000 50 S 4.1565 7.8191 115.4556 60.6023 62.7456 177.6689 51 D 4.4578 7.8461 118.4480 56.3244 41.0517 177.0555 52 L 4.5823 7.7154 117.9825 54.7799 42.7077 176.0652 53 T 5.0059 7.3221 114.9411 62.1271 69.7739 174.5221 54 F 5.2241 9.4654 124.3106 55.6801 43.9101 174.6207 55 K 4.5585 9.3397 121.4786 56.2465 32.7933 178.2615 56 Q 3.9484 8.8652 122.8076 59.7411 29.0215 178.2326 57 Y 4.2893 8.0394 118.2331 60.0528 37.8383 177.8172 58 E 3.8292 7.0340 120.5956 59.2210 29.7439 177.8867 59 Y 3.5116 8.2751 119.8134 60.5897 38.7482 178.2325 60 L 3.3653 7.8334 119.5872 57.3853 41.6245 179.1186 61 N 4.4512 8.3867 116.5851 56.3865 38.6137 176.6118 62 D 4.3406 8.1307 119.5149 57.4080 41.0328 177.9886 63 L 3.5757 6.9800 119.1319 58.3389 42.1456 178.7669 64 F 4.3432 7.5408 117.3481 60.4651 38.4009 177.7426 65 M 4.4684 8.7069 120.6653 59.0337 31.9336 179.0818 66 K 4.2990 8.0373 121.3050 57.7745 33.3359 178.4564 67 N 5.3367 7.7942 114.7927 52.2062 38.9815 174.0287 68 P 4.3351 0.0000 0.0000 65.5831 31.8709 177.8973 69 A 4.0979 7.9557 119.9719 53.3720 18.6754 176.7784 70 I 4.2714 7.6110 117.7452 59.4685 37.9280 175.1248 71 I 4.4181 7.8844 118.0637 59.5747 40.8001 175.4655 72 G 4.0758 8.4244 107.4157 43.7158 0.0000 174.5313 73 H 4.0238 8.3947 117.7819 58.8299 28.4593 178.2538 74 E 3.8650 7.4921 119.4171 60.8060 29.9670 180.7522 75 A 4.3268 7.7232 121.6202 55.0876 18.6526 179.8946 76 R 3.8011 7.7912 116.3232 59.4179 29.8547 178.9113 77 Y 4.7991 8.5137 117.0812 61.0173 37.8879 178.4288 78 K 4.2172 8.2300 119.1222 58.8338 31.9163 179.1720 79 L 4.0961 7.6761 118.3723 57.6136 41.4995 179.0821 80 F 4.0985 8.2464 117.3014 58.1408 39.0295 174.9029 81 N 4.1437 8.0140 114.2901 53.5576 36.8044 174.9998 82 S 4.5840 7.6484 106.0223 56.1681 65.5372 173.6271 83 P 4.1709 0.0000 0.0000 65.9381 31.1463 178.8617 84 T 3.8011 7.9342 114.1277 66.7089 68.4647 176.9838 85 L 3.5986 7.5958 120.7303 57.1482 41.4671 179.1420 86 L 2.8389 7.9476 120.9423 57.9950 41.6950 179.0138 87 F 3.9632 7.7148 118.8971 61.0858 39.3630 176.7318 88 L 3.6892 7.5229 117.7103 56.2725 41.5025 177.6903 89 L 4.6916 7.5778 116.4184 54.1352 43.9711 177.3645 90 S 4.2221 7.1542 112.3162 57.7713 63.4766 174.2341 91 R 4.1332 8.0965 121.5307 55.0237 31.1416 176.9015 92 G 3.9194 8.2599 105.4707 44.3396 0.0000 174.6675 93 K 3.7435 8.6998 119.8321 59.5038 32.0036 179.5527 94 A 3.9809 7.9876 120.0483 55.0754 18.1744 179.2897 95 A 4.1521 8.0678 117.8535 55.7342 18.6878 179.6089 96 T 4.5605 8.4310 114.3457 66.9694 68.3196 176.7271 97 E 3.9716 8.4869 121.4122 59.2509 29.5100 178.0280 98 N 4.5705 8.3348 114.1747 53.1993 39.2039 175.4316 99 W 4.1554 7.2743 131.3994 57.6183 31.5067 174.8237 100 S 3.9152 7.0285 117.6242 56.6044 65.4807 175.1703 101 I 3.3806 7.8290 123.8109 64.4061 36.7040 177.5588 102 E 4.3885 7.2263 112.2755 55.5771 30.9961 179.8953 103 N 4.8173 7.6107 116.7220 52.4360 38.6589 173.0276 104 L 4.2861 7.3120 120.0518 53.0059 43.4684 177.2420 105 F 4.7202 8.8544 120.4510 57.9538 39.3865 174.4857 106 E 4.2699 8.3476 121.8243 53.5905 32.7810 175.3153 107 E 3.8111 7.3124 120.4966 56.3199 30.0214 175.5789 108 K 4.4485 8.0381 125.0603 55.1509 35.3925 175.0181 *110 N 4.6759 8.5229 119.9256 53.2951 40.5703 174.6856 111 D 4.4552 7.7614 116.9119 54.4058 41.6204 176.2811 112 T 3.8390 8.5945 119.5704 66.2119 68.5862 174.3892 113 A 4.7867 7.5310 121.0618 50.4227 21.6928 175.7344 114 D 4.7182 8.6016 119.2631 56.4375 42.2014 177.5086 115 I 4.9579 8.1488 118.0684 59.4873 41.9871 174.1132 116 L 5.2164 9.6403 128.5580 53.2368 44.8745 174.7894 117 L 5.5242 9.0083 126.0775 52.9694 44.6198 175.8199 118 V 4.8045 8.8185 123.1930 59.7731 34.8896 174.8831 119 K 4.2448 9.0923 126.9124 56.8953 35.3278 176.0414 120 D 4.1622 9.6271 127.1503 55.2373 37.0361 171.5838 121 Q 3.8454 8.4114 113.5501 56.2634 25.9490 174.8026 122 F 5.2598 8.0198 120.6136 57.5056 42.7086 173.3999 123 Y 5.0997 8.1562 122.9160 56.1014 41.1351 174.1244 124 E 4.8615 9.7690 125.7827 54.5131 31.8051 174.6157 125 L 4.6366 8.9021 128.9605 53.9511 43.2462 175.6494 126 L 4.9558 9.1901 127.0203 53.1358 44.8130 174.2811 127 D 5.3274 8.5120 126.0832 52.4466 43.5858 174.7423 128 V 4.6532 9.0472 127.0549 62.1263 32.8175 175.1573 129 K 4.7257 9.2463 128.1137 54.9645 34.0005 175.5547 130 T 5.1069 8.6215 115.7748 61.1196 70.9321 174.5270 131 R 4.4448 8.7089 123.0618 55.0790 33.9902 173.4180 132 N 3.1400 8.4235 125.6203 52.6473 39.0041 174.8784 133 I 3.9297 7.9973 126.6099 61.7806 38.3466 176.6572 134 S 4.3024 7.5845 114.9026 60.2655 63.1300 174.3152 135 K 4.4606 7.0782 119.5280 54.1191 33.6808 176.3694 136 S 4.0084 8.4932 115.9906 58.7119 63.0588 174.7516 137 A 3.9300 8.6004 127.7142 52.7267 18.3568 176.7017 138 F 4.7554 8.7079 124.1539 55.8573 40.8929 173.7179 139 A 3.8476 8.9030 130.5459 51.6576 18.5064 175.2398 140 P 4.3834 0.0000 0.0000 62.0035 33.3972 175.5121 141 N 4.2965 8.5459 118.2092 54.8151 38.4499 174.1123 142 I 3.8659 8.4717 124.5078 62.0191 38.2206 175.6315 143 I 4.2928 6.9655 119.1853 59.7727 41.5625 172.9279 144 S 4.4004 8.5520 121.2024 58.2032 62.8683 175.0858 145 A 4.3488 9.1253 131.7719 54.7897 18.0070 179.1438 146 Y 3.9431 8.0071 117.8336 60.5470 39.0705 177.3097 147 K 3.8252 8.4631 121.0722 59.5994 32.2411 178.3406 148 L 3.9343 8.1462 120.3558 57.9683 41.8295 178.7737 149 A 4.0688 7.9018 120.6573 55.4733 18.2193 179.5845 150 Q 3.6696 7.8211 116.4686 59.2425 28.6056 179.5618 151 T 3.8184 7.8809 116.6694 66.7959 68.5506 176.5220 152 C 4.2376 8.3739 118.4783 62.7895 28.2308 175.8196 153 A 4.0298 8.1768 122.4295 55.4659 17.9885 179.9435 154 K 3.8738 8.1546 116.9984 59.6344 32.0155 179.5019 155 M 3.9206 8.5359 119.4632 58.3911 32.0098 178.9350 156 I 3.9140 7.9591 119.7333 64.6922 37.1698 178.1653 157 D 4.4282 7.9350 118.1779 56.7654 40.6924 177.8036 158 N 4.7845 7.8138 115.7517 52.0380 39.2994 175.3138 159 K 2.9968 7.2283 120.2306 55.3375 29.7152 180.7699 160 E 4.3303 7.2886 120.5610 55.5073 27.9878 176.1527 161 F 4.9046 8.1791 121.1063 57.8507 41.0020 176.2488 162 D 5.2261 7.9638 119.1278 53.1082 41.0808 181.2256 163 L 4.9075 8.0315 123.9007 56.6519 45.0888 176.1173 164 F 4.7719 7.3318 110.0698 55.3828 40.9320 173.2677 165 D 5.3093 9.0083 119.2342 52.6781 44.9267 175.2368 166 I 4.6665 7.7389 120.7927 59.7885 39.8309 174.3804 167 N 5.2030 9.1784 124.4047 51.3681 42.8900 173.2441 168 Y 5.1389 8.5291 118.1934 56.1153 42.2123 174.5508 169 L 5.3516 8.8849 124.6292 53.3855 45.0962 174.7132 170 E 4.8899 9.4439 129.0414 55.5477 31.5305 175.1776 171 V 4.7923 9.0689 126.8964 61.3759 34.2233 173.8976 172 D 5.3202 9.2389 129.3810 53.4331 42.5042 175.9034 173 W 6.3000 8.7572 118.3636 54.8631 32.2319 173.3568 174 E 5.0925 9.0102 120.0571 54.9482 33.0069 175.4045 175 L 4.5791 8.8927 123.9430 55.0611 41.7341 178.2888 176 N 4.9077 9.3253 120.8248 50.7146 40.8866 173.0571 177 G 4.0074 8.4389 119.6284 47.0398 0.0000 173.4533 178 E 4.5863 8.9592 123.1446 55.8175 29.9509 174.6917 179 D 5.4038 7.8099 119.6538 53.2614 44.9686 177.7042 180 L 5.0596 8.7761 119.3905 53.9838 43.9873 175.9239 181 V 4.8599 8.6923 122.9971 60.9639 34.4011 174.0616 182 C 4.9426 8.8356 129.3079 59.8943 31.3376 173.3633 183 V 4.5076 8.7832 119.4571 61.7527 33.4469 175.3685 184 S 4.7709 7.6901 113.5875 58.1078 65.8441 174.0034 185 T 5.3888 8.4426 109.5288 60.9503 72.1373 172.8228 186 S 4.9524 9.3300 116.6970 57.3975 67.9244 173.1572 187 F 5.4536 8.4520 122.6415 56.9038 42.3893 173.3793 188 A 4.4647 7.8309 125.0414 50.7951 23.3497 174.6377 189 E 4.4631 9.7984 120.7419 54.3386 31.3615 176.8481 190 L 3.8003 8.4517 127.5389 58.3846 42.0965 178.5817 191 F 3.4355 7.2528 112.6963 57.9013 38.9063 175.8459 192 K 4.6160 7.9198 120.6964 56.2483 32.8031 176.6003 193 S 5.4262 7.9101 113.7261 56.6560 64.1415 173.7251 194 E 4.1917 9.0991 123.6013 55.7447 29.7545 175.8475 195 P 4.0575 0.0000 0.0000 65.5492 31.4518 178.6366 196 S 3.8764 7.9499 111.0744 60.1218 63.1045 174.6588 197 E 4.2971 7.8241 119.4349 56.6820 29.5915 176.3684 198 L 4.2863 7.5300 120.8943 54.4917 42.2699 175.7110 199 Y 4.5525 8.8614 125.6113 57.2144 40.0177 173.8078 200 I 4.2676 7.9852 128.0620 59.7328 38.6938 175.1451 201 N 4.2985 8.5406 128.0639 51.6655 38.4873 174.7054 202 W 4.1388 8.7489 126.9206 59.5894 29.6354 178.8705 203 A 4.0185 8.4178 119.5189 55.1880 18.8243 178.1531 204 A 4.2466 8.1287 120.0430 52.0244 16.9914 177.1017 205 A 4.0322 8.3523 118.2136 53.0375 17.0466 177.2619 206 M 2.9384 7.8233 114.6385 57.8291 30.6355 176.6890 207 Q 4.8068 7.4827 116.0591 54.6112 31.0123 175.9438 208 I 4.3191 8.4879 124.4762 61.6720 38.4857 175.1473 209 Q 4.9729 9.0649 124.4040 53.0928 32.0495 174.4780 210 F 4.8782 7.7932 116.7490 56.5013 40.9931 172.9976 211 H 4.7681 8.7676 116.7180 54.8107 30.0578 176.7616 212 V 3.7979 8.9024 123.5455 66.3304 31.1510 178.5211 213 R 4.0574 8.2743 114.2082 58.6299 29.2722 177.5275 214 D 4.7605 7.8895 117.8386 53.3619 41.4927 176.2174 215 L 3.7117 7.1015 122.8561 54.3740 42.4441 176.3595 216 D 4.5927 8.4600 125.9136 53.6798 40.1094 176.1375 217 Q 4.6636 8.4296 119.2376 56.2066 29.8487 176.1593 218 G 4.0339 8.4384 103.8378 45.0000 0.0000 174.1603 219 F 4.1761 8.7825 125.7913 59.1117 39.6288 175.2722 220 N 4.6166 7.8267 123.9818 52.8230 39.1708 172.5634 221 G 3.6755 5.9335 104.4117 45.6388 0.0000 173.2670 222 T 4.3888 8.8469 111.0148 60.6706 71.3693 175.5234 223 R 3.7636 8.3074 120.3384 59.3300 29.9641 177.8416 224 E 3.2513 7.5556 118.5872 59.0028 29.5128 178.3202 225 E 3.9851 8.0280 118.5630 59.2585 29.6193 178.9195 226 W 3.5687 8.5839 128.2331 60.5302 30.6495 177.8345 227 A 4.4029 8.2792 120.3602 55.3014 17.8519 179.8179 228 K 4.0208 8.3271 117.1416 59.6161 32.1329 179.6360 229 S 4.0583 8.5075 113.9793 61.3241 62.1410 175.5291 230 Y 3.7264 8.1444 122.6403 60.5004 38.3917 178.0721 231 L 3.9858 8.0601 119.8744 57.6236 41.7030 179.3120 232 K 3.8716 7.9756 119.5502 59.7190 32.0239 178.0658 233 H 4.0330 8.0577 118.3286 59.2988 29.7488 176.7126 234 F 3.9750 8.2047 122.5203 61.3533 39.2615 177.2651 235 V 3.4660 8.1521 117.9525 66.2944 31.3534 177.9606 236 T 3.8145 7.9695 115.5414 66.9600 68.2166 176.6090 237 Q 4.0293 8.3524 119.7906 58.5038 28.7185 178.4169 238 A 2.8113 7.9091 122.0839 54.7458 18.4087 179.4963 239 E 3.7250 7.7582 116.5958 59.6151 29.5606 179.5365 240 Q 3.8983 7.8388 117.9924 58.9236 28.7619 179.0148 241 R 3.6081 7.8035 119.5346 59.1040 29.7401 178.0875 242 A 3.8066 7.3538 119.2501 55.4216 18.5042 179.1945 243 I 3.7467 7.4561 117.9544 64.6710 37.2636 178.8003 244 S 4.1477 8.1197 114.1794 60.9824 62.7533 176.3045 245 M 4.0301 7.8150 123.1318 58.2675 31.6307 178.5804 246 I 3.7277 7.5037 120.1481 64.6456 37.1167 178.3186 247 D 4.4107 7.9591 117.7894 56.5725 40.7440 177.7155 248 K 4.0805 7.6498 118.6692 57.1460 32.7928 177.3826 249 F 5.3706 8.1347 115.3668 57.1747 40.6454 176.1387 250 V 4.3614 7.6230 115.7489 64.3730 32.4958 176.7738 251 K 3.8159 8.3856 119.5300 59.3601 31.8793 176.6647 252 P 4.2902 0.0000 0.0000 63.8819 31.5878 177.1989 253 F 5.2290 8.0055 115.6475 57.3874 40.4615 177.3492 254 K 4.0503 7.8794 118.2591 59.2943 31.6551 178.9290 255 K 4.0052 7.9485 116.4967 59.1656 32.6034 177.0959 256 Y 4.4115 7.7900 116.0683 58.5841 38.4200 175.3280 257 I 4.6693 7.5454 120.4569 59.5135 39.6742 175.6374 258 L 4.3103 8.1907 121.9734 55.2177 42.6115 176.2664 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.33 4.30 0.00 4.02 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 3 F 8.46 4.47 0.00 3.28 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.10 4.07 1.73 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 1.63 1.11 0.74 0.00 0.00 5 K 7.91 3.40 0.00 1.69 1.76 0.00 1.49 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.50 7.81 6 P 0.00 4.40 0.00 2.09 2.13 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 7 I 7.45 4.45 2.00 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 0.94 0.96 0.00 0.00 8 Y 8.00 4.02 0.00 2.87 3.04 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 9 Q 8.07 3.82 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.02 0.00 10 D 7.83 4.30 0.00 3.02 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 11 I 7.24 2.58 1.64 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 0.78 1.12 0.62 0.00 0.00 12 N 7.90 3.96 0.00 1.76 2.37 0.00 0.00 7.29 7.58 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 13 S 7.44 4.04 0.00 3.95 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 14 I 7.19 3.80 1.84 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.15 0.95 0.00 0.00 15 L 7.58 4.24 0.00 1.90 1.61 0.89 0.91 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 16 I 7.67 3.84 2.00 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 1.24 0.67 0.90 0.00 0.00 17 G 7.82 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 18 Q 8.74 4.32 0.00 1.71 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 19 K 8.48 5.69 0.00 1.47 1.54 0.00 1.63 0.00 0.00 2.40 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.24 0.83 7.81 20 V 8.38 4.49 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 0.68 0.00 0.00 0.93 0.00 0.00 21 K 8.49 4.41 0.00 1.54 1.62 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.01 7.81 *22 R 8.56 4.17 0.00 1.57 1.79 0.00 3.27 0.00 0.00 3.22 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 *38 E 8.21 4.14 0.00 2.06 2.05 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 2.20 2.30 0.00 39 K 8.15 4.20 0.00 1.76 1.78 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.10 7.81 40 L 8.01 4.42 0.00 1.76 1.80 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.95 3.63 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 1.12 0.00 0.00 1.07 0.00 0.00 42 Y 8.28 4.17 0.00 3.07 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.82 3.76 0.00 1.84 1.83 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.34 7.81 44 F 8.16 4.18 0.00 3.16 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.07 3.88 0.00 1.82 1.69 1.05 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.31 3.60 0.00 0.95 1.46 0.00 1.14 0.00 0.00 1.12 0.00 0.00 3.10 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.09 1.23 7.81 47 E 7.57 4.01 0.00 1.86 1.80 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 2.18 2.38 0.00 48 N 7.46 4.64 0.00 1.97 2.47 0.00 0.00 6.76 7.34 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 49 L 8.11 4.61 0.00 1.63 1.43 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.82 4.16 0.00 3.63 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 51 D 7.85 4.46 0.00 2.56 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 52 L 7.72 4.58 0.00 1.63 1.48 0.57 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.32 5.01 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 1.06 0.00 0.00 54 F 9.47 5.22 0.00 2.92 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 9.34 4.56 0.00 0.97 1.40 0.00 1.56 0.00 0.00 0.73 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.51 1.00 7.81 56 Q 8.87 3.95 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 57 Y 8.04 4.29 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 58 E 7.03 3.83 0.00 1.52 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 2.65 2.43 0.00 59 Y 8.28 3.51 0.00 2.83 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 60 L 7.83 3.37 0.00 2.00 1.44 0.75 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.39 4.45 0.00 3.04 3.12 0.00 0.00 6.64 7.89 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 62 D 8.13 4.34 0.00 2.96 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 63 L 6.98 3.58 0.00 0.76 1.01 0.65 0.26 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 64 F 7.54 4.34 0.00 1.51 1.45 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 65 M 8.71 4.47 0.00 2.07 2.43 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.20 2.89 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.95 0.00 75 A 7.72 4.33 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 76 R 7.79 3.80 0.00 1.66 1.17 0.00 2.82 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.49 0.00 77 Y 8.51 4.80 0.00 3.27 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 78 K 8.23 4.22 0.00 2.11 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.67 7.81 79 L 7.68 4.10 0.00 1.84 1.66 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.25 4.10 0.00 3.01 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.01 4.14 0.00 2.92 2.91 0.00 0.00 6.80 7.47 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 82 S 7.65 4.58 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.17 0.00 2.12 2.02 0.00 3.77 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 2.25 2.15 0.00 84 T 7.93 3.80 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 1.20 0.00 0.00 85 L 7.60 3.60 0.00 1.48 1.39 0.09 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.95 2.84 0.00 1.67 1.57 0.66 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.71 3.96 0.00 2.86 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 88 L 7.52 3.69 0.00 1.28 1.38 0.28 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.58 4.69 0.00 1.67 1.68 0.62 0.49 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 90 S 7.15 4.22 0.00 3.61 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 91 R 8.10 4.13 0.00 1.60 1.79 0.00 3.16 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 92 G 8.26 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 93 K 8.70 3.74 0.00 1.71 1.46 0.00 1.65 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.60 7.81 94 A 7.99 3.98 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 95 A 8.07 4.15 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.43 4.56 4.42 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 1.33 0.00 0.00 97 E 8.49 3.97 0.00 2.07 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 2.32 2.35 0.00 98 N 8.33 4.57 0.00 2.90 2.88 0.00 0.00 7.00 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 99 W 7.27 4.16 0.00 3.11 3.19 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 108 K 8.04 4.45 0.00 1.66 1.56 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.39 7.81 *110 N 8.52 4.68 0.00 2.72 2.84 0.00 0.00 7.04 8.47 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 0.00 111 D 7.76 4.46 0.00 2.83 2.56 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 0.00 112 T 8.59 3.84 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 113 A 7.53 4.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 D 8.60 4.72 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 8.15 4.96 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.76 1.14 0.00 0.00 116 L 9.64 5.22 0.00 1.71 1.56 0.91 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 117 L 9.01 5.52 0.00 1.94 1.71 0.99 0.66 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 0.00 118 V 8.82 4.80 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 0.00 0.00 0.59 0.00 0.00 0.35 0.00 0.00 119 K 9.09 4.24 0.00 1.15 1.07 0.00 1.47 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.22 7.81 120 D 9.63 4.16 0.00 2.88 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 0.00 121 Q 8.41 3.85 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 122 F 8.02 5.26 0.00 3.27 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.16 5.10 0.00 2.82 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 0.00 124 E 9.77 4.86 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 125 L 8.90 4.64 0.00 1.76 1.47 0.86 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.19 4.96 0.00 1.76 1.73 1.16 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.51 5.33 0.00 2.59 2.41 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 0.00 128 V 9.05 4.65 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 0.91 0.00 0.00 1.04 0.00 0.00 129 K 9.25 4.73 0.00 1.76 1.74 0.00 1.90 0.00 0.00 1.87 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.46 7.81 130 T 8.62 5.11 4.64 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 1.32 0.00 0.00 131 R 8.71 4.44 0.00 1.91 1.88 0.00 3.23 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.57 0.00 132 N 8.42 3.14 0.00 2.05 2.34 0.00 0.00 6.84 7.82 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 0.00 133 I 8.00 3.93 1.70 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 1.21 1.15 0.84 0.00 0.00 134 S 7.58 4.30 0.00 3.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.08 4.46 0.00 1.64 1.73 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.32 7.81 136 S 8.49 4.01 0.00 3.79 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 0.00 137 A 8.60 3.93 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 0.00 138 F 8.71 4.76 0.00 2.92 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 0.00 139 A 8.90 3.85 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 0.00 140 P 0.00 4.38 0.00 2.01 2.10 0.00 3.68 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 1.95 1.92 0.00 141 N 8.55 4.30 0.00 2.53 2.95 0.00 0.00 6.88 7.45 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 0.00 142 I 8.47 3.87 1.44 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 -0.36 -0.01 0.00 0.00 143 I 6.97 4.29 1.93 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 1.22 1.34 0.90 0.00 0.00 144 S 8.55 4.40 0.00 3.92 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 0.00 145 A 9.13 4.35 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 Y 8.01 3.94 0.00 3.25 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 0.00 147 K 8.46 3.83 0.00 1.82 1.93 0.00 1.61 0.00 0.00 1.39 0.00 0.00 2.59 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.41 7.81 148 L 8.15 3.93 0.00 1.80 1.67 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 149 A 7.90 4.07 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 7.82 3.67 0.00 1.85 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.76 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 151 T 7.88 3.82 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 152 C 8.37 4.24 0.00 3.29 3.19 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 0.00 153 A 8.18 4.03 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 0.00 154 K 8.15 3.87 0.00 1.85 1.75 0.00 0.93 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.25 1.25 7.81 155 M 8.54 3.92 0.00 2.05 2.38 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.83 0.00 156 I 7.96 3.91 2.09 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.54 1.04 0.00 0.00 157 D 7.93 4.43 0.00 2.60 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 0.00 0.00 0.00 0.00 158 N 7.81 4.78 0.00 2.77 2.73 0.00 0.00 7.06 7.58 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 0.00 159 K 7.23 3.00 0.00 1.93 1.71 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.26 7.81 160 E 7.29 4.33 0.00 1.85 1.92 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 2.21 2.19 0.00 161 F 8.18 4.90 0.00 3.03 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 0.00 162 D 7.96 5.23 0.00 2.64 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 0.00 163 L 8.03 4.91 0.00 1.80 1.76 1.06 0.85 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 0.00 164 F 7.33 4.77 0.00 2.99 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 0.00 165 D 9.01 5.31 0.00 2.69 2.61 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 0.00 166 I 7.74 4.67 1.32 0.00 0.00 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 1.39 0.90 0.68 0.00 0.00 167 N 9.18 5.20 0.00 2.56 2.44 0.00 0.00 6.36 8.03 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 0.00 168 Y 8.53 5.14 0.00 2.87 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 0.00 169 L 8.88 5.35 0.00 2.10 1.69 1.32 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 170 E 9.44 4.89 0.00 2.18 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 2.47 2.35 0.00 171 V 9.07 4.79 2.24 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 1.06 0.00 0.00 1.04 0.00 0.00 172 D 9.24 5.32 0.00 2.66 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 0.00 173 W 8.76 6.30 0.00 3.52 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 0.00 174 E 9.01 5.09 0.00 2.04 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 2.33 2.37 0.00 175 L 8.89 4.58 0.00 1.69 1.50 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 176 N 9.33 4.91 0.00 2.52 2.68 0.00 0.00 6.69 7.63 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 0.00 177 G 8.44 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 0.00 178 E 8.96 4.59 0.00 1.90 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 2.24 1.85 0.00 179 D 7.81 5.40 0.00 2.24 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.78 5.06 0.00 1.26 1.34 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 181 V 8.69 4.86 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.98 0.00 0.00 182 C 8.84 4.94 0.00 3.13 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 0.00 183 V 8.78 4.51 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 0.87 0.00 0.00 0.96 0.00 0.00 184 S 7.69 4.77 0.00 3.89 3.96 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 0.00 185 T 8.44 5.39 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 1.25 0.00 0.00 186 S 9.33 4.95 0.00 3.83 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 0.00 187 F 8.45 5.45 0.00 2.96 2.44 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 0.00 188 A 7.83 4.46 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 9.80 4.46 0.00 1.77 1.77 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 2.37 2.13 0.00 190 L 8.45 3.80 0.00 1.78 0.97 1.09 0.68 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 0.00 191 F 7.25 3.44 0.00 2.74 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 7.92 4.62 0.00 1.97 1.90 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.39 7.81 193 S 7.91 5.43 0.00 4.01 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 E 9.10 4.19 0.00 2.23 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 195 P 0.00 4.06 0.00 1.81 1.30 0.00 3.50 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.44 0.00 196 S 7.95 3.88 0.00 3.98 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 0.00 197 E 7.82 4.30 0.00 2.17 2.05 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 2.33 2.34 0.00 198 L 7.53 4.29 0.00 1.99 1.84 1.05 1.19 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 0.00 199 Y 8.86 4.55 0.00 3.12 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 0.00 200 I 7.99 4.27 1.56 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 1.20 0.74 -0.35 0.00 0.00 201 N 8.54 4.30 0.00 2.69 2.68 0.00 0.00 7.30 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 0.00 202 W 8.75 4.14 0.00 3.48 3.27 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 0.00 203 A 8.42 4.02 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 0.00 204 A 8.13 4.25 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 0.00 205 A 8.35 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 M 7.82 2.94 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.76 0.00 207 Q 7.48 4.81 0.00 1.98 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.58 6.99 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 208 I 8.49 4.32 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.95 0.00 0.00 209 Q 9.06 4.97 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 210 F 7.79 4.88 0.00 2.90 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 0.00 211 H 8.77 4.77 0.00 3.44 3.45 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.90 3.80 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.12 0.00 0.00 213 R 8.27 4.06 0.00 2.05 2.11 0.00 3.09 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 214 D 7.89 4.76 0.00 2.84 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 0.00 215 L 7.10 3.71 0.00 1.37 1.29 0.53 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.46 4.59 0.00 2.86 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 0.00 217 Q 8.43 4.66 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.38 2.22 0.00 218 G 8.44 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 0.00 0.00 0.00 219 F 8.78 4.18 0.00 3.21 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 0.00 220 N 7.83 4.62 0.00 2.77 2.69 0.00 0.00 6.83 7.51 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 0.00 221 G 5.93 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 T 8.85 4.39 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 223 R 8.31 3.76 0.00 1.82 1.87 0.00 2.21 0.00 0.00 2.54 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 224 E 7.56 3.25 0.00 1.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 225 E 8.03 3.99 0.00 2.53 2.27 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 2.38 2.34 0.00 226 W 8.58 3.57 0.00 3.15 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 0.00 227 A 8.28 4.40 1.56 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 K 8.33 4.02 0.00 1.85 1.90 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.61 7.81 229 S 8.51 4.06 0.00 3.87 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 0.00 230 Y 8.14 3.73 0.00 2.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 L 8.06 3.99 0.00 2.11 1.76 1.09 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 232 K 7.98 3.87 0.00 1.93 1.92 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.33 7.81 233 H 8.06 4.03 0.00 3.24 3.24 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 F 8.20 3.98 0.00 2.40 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 0.00 235 V 8.15 3.47 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 0.96 0.00 0.00 1.08 0.00 0.00 236 T 7.97 3.81 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 1.18 0.00 0.00 237 Q 8.35 4.03 0.00 2.14 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 238 A 7.91 2.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 E 7.76 3.73 0.00 2.14 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 2.23 2.35 0.00 240 Q 7.84 3.90 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 241 R 7.80 3.61 0.00 0.82 0.97 0.00 3.07 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.35 0.00 242 A 7.35 3.81 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 0.00 243 I 7.46 3.75 1.96 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 0.86 0.00 0.00 244 S 8.12 4.15 0.00 3.96 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 0.00 245 M 7.82 4.03 0.00 2.28 2.38 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 2.86 2.91 0.00 246 I 7.50 3.73 1.94 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 1.50 0.82 0.91 0.00 0.00 247 D 7.96 4.41 0.00 2.53 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 0.00 248 K 7.65 4.08 0.00 1.34 0.74 0.00 1.60 0.00 0.00 1.48 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.04 1.28 7.81 249 F 8.13 5.37 0.00 3.21 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 0.00 250 V 7.62 4.36 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 1.13 0.00 0.00 1.03 0.00 0.00 251 K 8.39 3.82 0.00 1.79 1.92 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.47 7.81 252 P 0.00 4.29 0.00 1.12 1.73 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 253 F 8.01 5.23 0.00 3.27 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 0.00 254 K 7.88 4.05 0.00 1.82 1.90 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.64 7.81 255 K 7.95 4.01 0.00 1.64 1.78 0.00 1.12 0.00 0.00 1.45 0.00 0.00 2.52 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.99 0.45 7.81 256 Y 7.79 4.41 0.00 3.12 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 0.00 257 I 7.55 4.67 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.52 0.95 0.00 0.00 258 L 8.19 4.31 0.00 1.59 1.50 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.