NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2177 7.8827 121.4467 61.2147 38.7340 173.7882 17 V 4.1623 8.8436 126.1434 61.7208 32.6117 174.3075 18 G 3.8483 8.9012 115.0864 46.7138 0.0000 173.3197 19 G 4.2902 7.8842 110.7920 44.0934 0.0000 172.8492 20 Y 4.9641 7.9474 117.4689 55.1646 42.1620 175.1271 21 T 4.2294 8.6122 117.5076 64.0297 68.4524 175.0961 22 C 4.3456 8.6162 125.4946 60.6059 35.5008 175.0659 23 G 4.0525 8.8652 106.5634 44.2156 0.0000 172.5016 24 A 4.1119 8.7293 125.2170 53.7412 18.3252 176.7539 25 N 4.2375 8.8416 120.0232 54.6770 36.2776 175.4443 26 T 4.2018 7.6691 107.1523 62.6658 70.0172 174.9982 27 V 4.0895 7.0329 121.8160 59.7937 31.3174 173.6832 28 P 4.5022 0.0000 0.0000 64.1249 31.7882 178.0388 29 Y 5.0778 6.7611 115.1514 56.3026 38.8600 174.6977 30 Q 4.6683 7.4031 123.6065 56.3516 29.2148 175.4339 31 V 4.8949 8.9275 118.6328 59.6324 36.3637 174.1553 32 S 4.9644 8.6314 116.5926 56.5635 65.1407 172.6068 33 L 4.5753 8.6035 127.6683 53.3864 43.1032 174.9577 34 N 5.6929 9.0645 123.0899 50.0384 41.7921 175.0337 *37 S 4.1911 8.3918 120.9433 58.4182 64.1255 174.4321 38 G 4.0031 9.2800 109.0376 46.2658 0.0000 172.9186 39 Y 4.4790 6.5106 115.1571 56.2446 39.8761 172.5479 40 H 4.5034 8.9517 121.6496 56.4020 30.3011 174.7971 41 F 5.0670 7.7661 119.5246 56.6724 39.5296 173.7172 42 C 4.7251 6.8398 114.9163 56.4231 44.6803 173.3667 43 G 4.0925 8.6844 109.2402 45.9993 0.0000 172.2614 44 G 4.5164 7.4225 103.4432 46.6633 0.0000 172.6528 45 S 5.5118 8.5972 115.3116 56.4803 67.0273 173.6166 46 L 4.8460 8.9946 127.0920 54.5981 42.3041 177.0647 47 I 4.3524 8.3976 120.1710 61.5279 38.7711 174.5722 48 N 4.7193 7.6429 117.3920 51.9904 39.5778 174.9998 49 S 4.3164 8.6473 112.0869 60.9167 63.0341 174.8932 50 Q 4.5816 9.6708 120.6589 55.1004 31.2788 174.0980 51 W 5.5143 8.4506 116.0037 55.3075 33.5121 174.3804 52 V 5.0990 9.3718 123.2729 61.0637 34.6722 174.3330 53 V 4.9700 8.8406 126.7001 60.4318 33.9381 174.8440 54 S 5.1272 8.8797 117.6376 57.5033 66.2338 172.0012 55 A 4.6752 8.5189 120.6524 50.8240 20.2205 178.5686 56 A 3.8241 8.3249 124.3496 55.2603 18.4731 179.0906 57 H 4.5873 8.3378 109.0885 57.1257 28.6771 175.2623 58 C 4.7095 7.8209 117.1481 56.9641 40.6240 173.3231 59 Y 4.2565 7.5345 121.5609 58.1485 38.7805 175.2393 60 K 3.5488 6.7508 123.9394 55.5779 34.8314 174.3123 61 S 4.3007 8.1140 117.7724 57.9613 64.9289 173.5565 62 G 3.6903 8.2573 107.1639 46.6447 0.0000 173.8225 63 I 4.3702 7.2019 118.8064 59.7373 39.8635 176.1584 64 Q 4.6910 8.9130 128.1506 54.2079 31.7141 174.1365 65 V 4.4269 8.8064 127.1525 61.8623 33.5355 174.5772 66 R 5.2318 8.7905 127.0579 54.7395 32.3438 175.3095 67 L 4.6930 9.1041 124.7129 52.7606 44.8203 177.6335 *69 G 4.2760 8.2510 106.8750 45.4087 0.0000 172.8990 70 E 4.4259 8.1579 118.3824 55.6975 29.9608 174.4297 71 D 4.7352 7.8962 117.8758 54.9264 44.0812 174.1599 72 N 5.1374 8.8860 123.3380 52.5564 38.9129 176.1748 73 I 3.7962 8.4554 120.0284 62.3433 37.6733 176.3666 74 N 4.7999 8.6777 118.1175 52.9846 39.0806 174.6605 75 V 4.2426 7.5796 118.2871 60.7509 34.1278 174.7733 76 V 3.9512 8.5645 127.3523 63.5053 31.0936 175.1051 77 E 4.3459 9.9330 128.5946 55.6961 30.1784 177.0110 78 G 4.0066 8.3445 105.7983 45.3649 0.0000 174.1763 79 N 4.9887 8.1920 115.7903 52.9368 40.3805 174.2292 80 E 5.2553 7.9666 118.1490 55.8319 31.0042 176.4416 81 Q 4.2650 8.4394 119.7628 54.5761 32.8910 173.8676 82 F 5.5636 8.7201 123.6059 56.1158 40.6391 175.5350 83 I 4.6773 8.9457 124.9768 59.3438 40.7511 175.6992 84 S 4.6127 8.7520 122.1607 58.4673 64.2021 173.0622 85 A 4.7934 8.1344 124.3615 51.3986 19.2532 177.4191 86 S 4.5900 8.8857 115.3194 59.0331 65.2472 174.5452 87 K 4.6913 7.6410 120.0391 55.0006 35.5996 174.7390 88 S 5.2895 8.8112 121.8286 56.8730 66.3214 173.7187 89 I 4.5903 9.3008 124.3688 59.5319 40.0057 174.8796 90 V 4.2251 8.4392 127.2957 62.1245 32.6610 175.1917 91 H 3.6008 8.5473 126.5281 55.7642 30.0596 174.3799 92 P 4.2547 0.0000 0.0000 65.4375 31.0855 177.1315 93 S 4.6922 7.9610 112.4090 57.9919 62.8947 173.1853 94 Y 4.2998 7.8663 122.8774 57.7916 39.0549 174.5662 95 N 4.5114 8.0793 125.6391 51.3062 39.8179 175.0961 96 S 4.0548 7.6679 120.5444 60.0106 63.5237 175.5341 97 N 4.3464 8.0863 118.5244 55.6568 38.4884 175.8802 98 T 4.0041 8.2920 105.8511 60.5577 69.8691 174.8364 99 L 3.7133 8.0459 121.1086 55.6060 39.8877 173.8794 100 N 4.5312 7.6584 117.5295 54.4856 39.5229 174.5719 101 N 4.8729 8.7184 119.9637 54.3064 35.8446 175.4352 102 D 4.7587 8.0410 117.7108 53.1131 39.7662 174.5226 103 I 4.8118 7.2103 121.0202 59.3783 42.3053 172.7522 104 M 5.4243 9.3104 126.6853 54.2330 36.4186 173.2113 105 L 5.4135 9.4078 123.9502 53.0860 45.2620 175.4766 106 I 5.0199 9.3083 123.6496 59.4572 40.7229 174.1543 107 K 3.9663 8.6351 128.8591 54.3390 33.6734 175.5272 108 L 4.4863 8.0825 127.8191 54.2742 41.9308 177.2908 109 K 4.1497 8.7432 122.8157 59.1259 32.4650 177.5953 110 S 4.5860 7.7043 110.9788 55.8118 66.1188 173.3175 111 A 4.3649 8.4012 123.3185 52.2277 18.7390 177.2339 112 A 4.3412 9.0094 123.3473 51.5027 20.1615 177.7110 113 S 4.4947 8.8493 116.7610 57.3336 63.2625 174.6315 114 L 4.4674 8.5069 125.9187 54.6423 42.7057 176.7456 115 N 4.7726 8.9564 118.6429 52.7546 39.7976 174.7869 116 S 4.2394 8.8683 112.9363 62.0298 62.6747 175.5325 117 R 4.2044 7.9255 117.3998 56.5697 30.7928 175.7343 118 V 4.3983 7.6053 115.7996 60.8601 33.0233 173.6120 119 A 5.1554 8.5532 128.4334 50.1123 22.9584 175.1345 120 S 5.1315 8.7105 114.0256 57.7261 64.9925 173.0610 121 I 4.4518 8.1428 120.8610 59.1354 39.8034 175.4915 122 S 4.4496 8.5081 124.4501 58.2902 63.6257 174.0887 123 L 4.3387 8.3055 122.4429 53.4644 42.5101 175.2263 124 P 4.5577 0.0000 0.0000 62.8160 32.4133 176.2240 125 T 4.2242 8.2199 108.7721 62.1653 70.1660 174.4325 *127 S 4.7508 7.5712 114.9520 58.2136 64.0499 173.6986 128 C 4.4422 8.4275 118.4848 55.9106 40.8758 173.9875 129 A 4.1603 7.7149 126.7321 52.4421 18.8571 176.8521 130 S 4.5320 8.0932 114.5663 56.5299 65.8422 173.4959 *132 A 4.2372 8.2352 123.9071 53.5403 19.1590 177.5636 133 G 3.9419 9.0509 110.7733 45.3191 0.0000 173.8649 134 T 4.1772 7.5317 117.5061 63.3046 69.7179 173.9226 135 Q 4.5946 8.5897 125.2137 55.7605 29.9139 175.8035 136 C 5.2580 9.1816 120.1897 55.0422 44.8800 172.2901 137 L 5.2381 9.0517 122.1789 53.5437 44.0224 175.0212 138 I 5.1818 8.9046 126.8715 58.7828 40.3020 174.7822 139 S 4.8807 8.2611 119.0652 56.7301 66.2818 173.0566 140 G 3.7837 7.4665 108.0452 46.2723 0.0000 173.0087 141 W 4.9215 8.6745 116.9062 56.2795 29.1572 177.0891 142 G 4.0415 8.6483 109.4139 44.5187 0.0000 173.4079 143 N 3.6547 8.6055 118.6002 54.1725 38.9724 174.4775 144 T 5.1870 8.1141 113.0281 60.3983 69.2958 174.1123 145 K 4.6153 7.7233 121.2126 54.7755 34.7428 176.5003 146 S 4.3081 8.6770 117.5862 60.0931 63.6147 174.4241 147 S 4.4780 7.8493 116.4996 57.8046 65.6564 174.5453 148 G 3.8786 9.4582 114.0427 44.3878 0.0000 171.7685 149 T 4.8306 7.8084 107.1288 60.3337 72.2796 174.0782 150 S 4.3690 9.0769 116.7377 58.3046 65.7006 172.9776 151 Y 4.9365 8.7806 126.1778 55.6226 39.0891 174.4451 152 P 4.6419 0.0000 0.0000 62.6500 32.7070 175.7991 153 D 4.7148 8.6851 118.3214 55.3223 41.7825 176.8072 154 V 5.4252 7.4598 110.7209 58.3635 34.5470 175.5277 155 L 3.1930 8.2283 124.4347 55.0395 43.0169 175.9802 156 K 4.7889 8.0701 125.2251 55.0251 34.7956 174.7837 157 C 5.2274 8.8310 120.7461 55.2013 45.4259 172.8430 158 L 4.9374 8.3286 121.7090 53.9386 45.6164 174.3133 159 K 5.0966 8.9442 125.3615 55.3300 33.6298 175.8710 160 A 4.7974 8.8012 125.7622 50.0156 23.1583 173.4572 161 P 5.0403 0.0000 0.0000 61.7020 33.8999 175.3479 162 I 4.3066 8.3823 122.8283 61.6069 38.0928 175.3217 163 L 5.0161 8.7152 126.6115 52.8060 44.1975 176.7554 164 S 4.3821 8.0252 115.7426 58.0383 64.1707 175.1771 165 D 4.4275 8.8858 122.9987 57.7292 40.5467 179.3637 166 S 4.1609 8.0511 114.4471 61.5330 63.1214 176.5359 167 S 4.0913 7.7324 117.1465 60.9696 62.5567 175.8249 168 C 4.1892 8.0510 121.9270 59.4624 40.4787 175.5856 169 K 3.9261 8.1331 120.0558 59.5872 31.4437 179.2710 170 S 4.0731 7.9823 113.9028 61.7913 62.8852 176.5222 171 A 4.1038 7.5944 121.4269 54.6837 18.3698 179.1157 172 S 3.9713 7.8855 112.6488 57.5852 63.6604 175.7509 173 S 4.2169 8.1987 116.1510 58.1468 61.1063 169.8669 174 F 4.7372 7.5622 119.2193 57.9642 39.0788 175.5051 175 I 4.3336 8.4545 118.0467 59.6360 36.9427 174.8720 176 I 4.4769 8.1645 127.2934 60.4968 38.7169 175.7831 177 T 4.6174 8.1276 113.4386 59.6918 70.9187 175.3266 178 S 4.3725 8.5644 115.0112 60.0576 63.1335 174.3431 179 N 4.8986 8.0839 118.8043 53.4435 38.5905 173.7303 180 M 5.6603 7.9575 117.6401 53.8641 36.1791 174.5507 181 F 5.0961 8.6263 113.7218 56.2246 41.8466 172.4656 182 C 5.6433 9.3331 116.8752 55.0074 41.3699 172.6107 183 A 5.0783 8.7982 122.3864 50.4167 22.2148 175.9447 184 G 3.8214 6.8492 108.9697 45.0675 0.0000 171.9434 184A Y 4.6474 8.2857 119.3785 55.9293 41.0754 176.5717 185 L 4.0943 8.6315 124.7207 57.5494 42.0387 179.1527 186 E 3.9518 8.2136 117.1628 57.4477 29.7168 177.4383 187 G 3.7694 7.7848 106.0436 44.7246 0.0000 171.9082 188 G 4.1610 8.9749 106.3960 44.7371 0.0000 174.1850 188A K 4.8556 7.3762 116.9523 54.3814 35.6756 175.3885 189 D 4.6036 8.3429 123.2771 54.1218 45.7530 175.3878 190 S 4.8574 8.7627 117.0430 58.1874 65.2116 172.9249 191 C 4.6956 9.4059 118.3975 55.4856 44.5815 171.8595 192 Q 4.2414 8.7157 120.0985 58.3334 28.6471 177.8676 193 G 4.3080 9.3120 113.5859 45.6339 0.0000 173.7640 194 D 4.6851 8.4036 118.6954 55.3854 41.7360 176.7477 195 S 4.5732 8.0669 115.5145 60.5561 63.5513 175.2231 196 G 4.4036 8.7520 112.2642 46.4988 0.0000 173.7821 197 G 4.3779 7.9405 107.1265 45.4807 0.0000 171.0682 198 P 5.2087 0.0000 0.0000 62.1009 33.6293 175.5579 199 V 4.5860 8.4389 120.6464 61.4372 34.3241 174.0051 200 V 4.7744 8.8079 129.2688 61.4139 33.6897 173.8929 201 C 5.0869 8.5030 124.4708 55.8076 44.4711 174.5125 202 S 3.4370 9.7307 118.0092 59.7309 60.0089 173.3456 203 G 3.9174 8.5357 105.5370 45.6538 0.0000 173.9548 204 K 4.4022 7.5971 118.1845 54.0390 35.7228 175.3164 *209 L 4.0680 8.2251 121.0854 55.5077 42.3747 175.9388 210 Q 4.5678 8.9727 125.8126 56.5396 31.3178 175.6764 211 G 5.3638 7.9446 104.5433 45.9587 0.0000 171.5162 212 I 5.2496 8.2285 119.3753 58.9011 41.1660 175.1474 213 V 3.7952 8.8941 127.3241 64.3508 31.8593 174.6369 214 S 4.7760 8.5303 120.8822 58.7997 64.1201 173.6640 215 W 4.9215 7.4372 114.2229 55.9940 32.0265 172.0400 216 G 3.7474 8.1001 105.6918 46.3739 0.0000 172.7186 217 E 4.5290 8.5063 120.4841 54.2196 30.3642 174.6384 *219 G 4.3104 7.9725 115.7486 45.5649 0.0000 170.4590 220 C 4.9227 8.1069 115.2012 56.5102 44.3436 173.8573 221 A 4.2236 9.0845 125.0411 53.1209 16.7443 176.9759 221A Q 4.4537 7.4340 117.1794 56.3027 29.5589 175.9869 222 K 4.1998 8.4909 122.5374 58.0251 32.5599 176.2363 223 N 4.2226 9.5722 121.1012 53.9299 37.1174 174.1882 224 K 4.5338 7.6526 117.8441 53.6867 32.1405 173.6997 225 P 4.6409 0.0000 0.0000 61.8955 33.1588 177.0109 226 G 3.6115 8.3250 106.5064 45.9275 0.0000 172.7926 227 V 4.3119 7.6237 121.2812 60.6898 34.1662 174.1319 228 Y 5.0161 8.0745 124.1179 56.0207 42.3373 174.8883 229 T 4.5075 8.4324 119.2679 63.5547 69.9564 174.3638 230 K 5.0186 9.4182 128.2874 55.5410 31.8166 177.3403 231 V 4.0251 8.7547 126.9788 65.8806 31.3889 174.9635 232 C 4.5966 8.3650 112.7520 58.2952 41.3857 174.8796 233 N 4.2118 7.8442 117.0290 54.5135 38.5936 175.5871 234 Y 4.8105 8.1891 117.5100 57.4335 38.7298 177.2611 235 V 3.6385 7.9168 120.8066 66.2327 31.5541 177.4560 236 S 4.0786 8.1585 112.0350 61.2425 62.2755 175.6766 237 W 4.2621 8.3588 130.3483 60.5948 30.4465 177.6584 238 I 2.9643 8.0641 119.6571 64.1643 36.5575 178.5576 239 K 3.7617 8.0425 119.2498 59.5531 31.6463 179.4946 240 Q 3.9138 7.7242 117.0423 59.2022 28.7550 178.6769 241 T 3.7740 7.4879 116.7080 66.5789 68.1418 176.9653 242 I 2.8124 7.0598 120.4963 63.6067 37.0951 177.7248 243 A 4.2538 7.6285 119.5345 53.2843 18.3010 177.6437 244 S 4.6804 7.4543 110.2232 57.4332 63.5339 173.5058 245 N 4.7046 8.1014 121.4516 53.4802 39.4834 174.1356 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.22 1.79 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 1.36 0.59 0.85 0.00 0.00 17 V 8.84 4.16 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 0.92 0.00 0.00 0.88 0.00 0.00 18 G 8.90 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 0.00 0.00 0.00 19 G 7.88 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 0.00 0.00 0.00 0.00 20 Y 7.95 4.96 0.00 3.00 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 21 T 8.61 4.23 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 22 C 8.62 4.35 0.00 2.76 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 23 G 8.87 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.73 4.11 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 25 N 8.84 4.24 0.00 2.86 2.89 0.00 0.00 7.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.67 4.20 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 27 V 7.03 4.09 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.50 0.00 2.37 2.44 0.00 3.81 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 2.17 1.97 0.00 29 Y 6.76 5.08 0.00 3.26 3.43 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 30 Q 7.40 4.67 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 1.91 2.48 0.00 31 V 8.93 4.89 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 1.04 0.00 0.00 32 S 8.63 4.96 0.00 3.15 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 33 L 8.60 4.58 0.00 0.62 0.93 0.80 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.06 5.69 0.00 2.46 2.50 0.00 0.00 6.77 8.46 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 *37 S 8.39 4.19 0.00 3.70 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 38 G 9.28 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.51 4.48 0.00 3.08 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.95 4.50 0.00 2.90 3.23 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.77 5.07 0.00 3.07 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 42 C 6.84 4.73 0.00 2.12 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 43 G 8.68 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 0.00 0.00 0.00 0.00 44 G 7.42 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 0.00 0.00 0.00 0.00 45 S 8.60 5.51 0.00 3.82 3.82 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 46 L 8.99 4.85 0.00 1.89 1.68 1.08 0.82 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 47 I 8.40 4.35 1.88 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 1.60 0.85 0.94 0.00 0.00 48 N 7.64 4.72 0.00 2.99 3.00 0.00 0.00 6.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.65 4.32 0.00 4.05 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 0.00 50 Q 9.67 4.58 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 1.89 2.14 0.00 51 W 8.45 5.51 0.00 3.40 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 52 V 9.37 5.10 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 0.98 0.00 0.00 0.99 0.00 0.00 53 V 8.84 4.97 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 0.69 0.00 0.00 1.05 0.00 0.00 54 S 8.88 5.13 0.00 3.90 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 55 A 8.52 4.68 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.32 3.82 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.34 4.59 0.00 3.42 3.61 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.82 4.71 0.00 3.21 3.29 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 59 Y 7.53 4.26 0.00 2.98 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 K 6.75 3.55 0.00 1.24 1.18 0.00 0.83 0.00 0.00 1.23 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 0.96 7.81 61 S 8.11 4.30 0.00 3.94 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 62 G 8.26 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 63 I 7.20 4.37 1.86 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.48 0.94 0.00 0.00 64 Q 8.91 4.69 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.87 0.00 0.00 0.00 0.00 0.00 2.07 2.20 0.00 65 V 8.81 4.43 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 0.91 0.00 0.00 0.91 0.00 0.00 66 R 8.79 5.23 0.00 1.61 1.94 0.00 2.66 0.00 0.00 2.57 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.21 0.00 67 L 9.10 4.69 0.00 1.62 1.64 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.25 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 0.00 0.00 0.00 0.00 70 E 8.16 4.43 0.00 2.18 1.93 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 2.58 2.16 0.00 71 D 7.90 4.74 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 N 8.89 5.14 0.00 2.85 2.84 0.00 0.00 7.18 7.31 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 73 I 8.46 3.80 1.43 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.52 -0.53 0.00 0.00 74 N 8.68 4.80 0.00 2.82 2.86 0.00 0.00 6.61 7.23 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 75 V 7.58 4.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.56 3.95 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 0.90 0.00 0.00 0.98 0.00 0.00 77 E 9.93 4.35 0.00 1.90 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 2.30 2.55 0.00 78 G 8.34 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 79 N 8.19 4.99 0.00 2.63 2.79 0.00 0.00 7.16 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.97 5.26 0.00 1.45 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 2.57 2.29 0.00 81 Q 8.44 4.27 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 82 F 8.72 5.56 0.00 2.84 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 83 I 8.95 4.68 1.88 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 1.25 0.79 0.92 0.00 0.00 84 S 8.75 4.61 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.13 4.79 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.89 4.59 0.00 3.75 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 87 K 7.64 4.69 0.00 1.79 1.55 0.00 1.79 0.00 0.00 1.93 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.53 7.81 88 S 8.81 5.29 0.00 3.96 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 89 I 9.30 4.59 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.91 1.17 0.00 0.00 90 V 8.44 4.23 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 0.61 0.00 0.00 0.78 0.00 0.00 91 H 8.55 3.60 0.00 2.91 2.94 0.00 5.65 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 92 P 0.00 4.25 0.00 2.15 2.15 0.00 2.41 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.78 0.00 93 S 7.96 4.69 0.00 3.99 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.87 4.30 0.00 2.94 2.84 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 95 N 8.08 4.51 0.00 2.59 2.44 0.00 0.00 6.62 7.41 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 96 S 7.67 4.05 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.09 4.35 0.00 2.80 2.77 0.00 0.00 6.83 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 98 T 8.29 4.00 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 99 L 8.05 3.71 0.00 1.44 1.85 0.64 1.13 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 0.00 100 N 7.66 4.53 0.00 2.67 2.64 0.00 0.00 7.26 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.72 4.87 0.00 2.95 2.65 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.04 4.76 0.00 3.10 2.71 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 0.00 103 I 7.21 4.81 1.48 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 1.39 1.18 0.22 0.00 0.00 104 M 9.31 5.42 0.00 2.11 1.82 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.65 0.00 105 L 9.41 5.41 0.00 1.68 1.76 -0.07 0.58 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 0.00 106 I 9.31 5.02 1.94 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 1.20 0.82 0.90 0.00 0.00 107 K 8.64 3.97 0.00 0.79 1.04 0.00 1.14 0.00 0.00 1.29 0.00 0.00 2.60 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.70 0.21 7.81 108 L 8.08 4.49 0.00 1.50 1.54 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.74 4.15 0.00 1.58 1.84 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.52 7.81 110 S 7.70 4.59 0.00 3.88 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.40 4.36 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.01 4.34 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 0.00 113 S 8.85 4.49 0.00 3.76 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 0.00 114 L 8.51 4.47 0.00 1.66 1.62 0.96 1.11 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 0.00 115 N 8.96 4.77 0.00 2.81 2.93 0.00 0.00 6.82 7.67 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 0.00 116 S 8.87 4.24 0.00 3.89 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 0.00 117 R 7.93 4.20 0.00 1.88 1.97 0.00 3.19 0.00 0.00 3.27 7.35 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.75 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 0.00 128 C 8.43 4.44 0.00 2.93 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.71 4.16 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.09 4.53 0.00 3.81 3.71 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 *132 A 8.24 4.24 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.53 4.18 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.59 4.59 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 C 9.18 5.26 0.00 2.78 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 0.00 137 L 9.05 5.24 0.00 1.74 1.56 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.90 5.18 1.87 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.54 0.95 0.00 0.00 139 S 8.26 4.88 0.00 3.57 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.47 3.78 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 0.00 0.00 0.00 141 W 8.67 4.92 0.00 3.21 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 0.00 142 G 8.65 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 0.00 143 N 8.61 3.65 0.00 2.09 2.57 0.00 0.00 7.09 7.28 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 0.00 144 T 8.11 5.19 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 145 K 7.72 4.62 0.00 1.78 1.87 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.27 1.29 7.81 146 S 8.68 4.31 0.00 4.12 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 0.00 147 S 7.85 4.48 0.00 3.82 3.78 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 0.00 148 G 9.46 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 0.00 149 T 7.81 4.83 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 1.31 0.00 0.00 150 S 9.08 4.37 0.00 3.84 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.78 4.94 0.00 2.94 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.64 0.00 2.40 2.08 0.00 4.07 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 153 D 8.69 4.71 0.00 2.80 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 0.00 154 V 7.46 5.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.97 0.00 0.00 155 L 8.23 3.19 0.00 1.32 1.23 -0.69 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.07 4.79 0.00 1.52 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 157 C 8.83 5.23 0.00 1.61 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 0.00 0.00 0.00 0.00 158 L 8.33 4.94 0.00 1.69 1.44 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.94 5.10 0.00 1.83 1.83 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.57 1.63 7.81 160 A 8.80 4.80 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 0.00 161 P 0.00 5.04 0.00 2.01 2.44 0.00 3.09 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 162 I 8.38 4.31 1.90 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.35 0.79 0.00 0.00 163 L 8.72 5.02 0.00 1.53 1.58 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.03 4.38 0.00 3.89 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 0.00 165 D 8.89 4.43 0.00 2.74 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.05 4.16 0.00 4.05 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 0.00 167 S 7.73 4.09 0.00 4.19 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 0.00 168 C 8.05 4.19 0.00 3.18 3.31 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 0.00 169 K 8.13 3.93 0.00 1.87 1.88 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.79 7.81 170 S 7.98 4.07 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 0.00 171 A 7.59 4.10 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 0.00 172 S 7.89 3.97 0.00 2.72 3.31 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 0.00 173 S 8.20 4.22 0.00 4.04 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 0.00 174 F 7.56 4.74 0.00 3.12 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 0.00 175 I 8.45 4.33 1.93 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 1.45 0.62 0.98 0.00 0.00 176 I 8.16 4.48 1.99 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 1.67 0.98 1.03 0.00 0.00 177 T 8.13 4.62 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 1.29 0.00 0.00 178 S 8.56 4.37 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.08 4.90 0.00 2.87 3.09 0.00 0.00 6.67 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 0.00 180 M 7.96 5.66 0.00 1.92 2.05 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.63 5.10 0.00 3.10 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 0.00 182 C 9.33 5.64 0.00 2.97 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 0.00 183 A 8.80 5.08 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 0.00 184 G 6.85 3.82 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 0.00 0.00 0.00 184A Y 8.29 4.65 0.00 3.06 3.30 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 0.00 185 L 8.63 4.09 0.00 1.73 1.72 0.91 0.94 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 0.00 186 E 8.21 3.95 0.00 1.99 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 2.36 2.41 0.00 187 G 7.78 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 0.00 0.00 0.00 188 G 8.97 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 188A K 7.38 4.86 0.00 1.50 1.69 0.00 0.73 0.00 0.00 1.34 0.00 0.00 2.51 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.16 7.81 189 D 8.34 4.60 0.00 2.84 2.57 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 0.00 0.00 0.00 0.00 190 S 8.76 4.86 0.00 4.00 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 0.00 191 C 9.41 4.70 0.00 2.90 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 0.00 192 Q 8.72 4.24 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.11 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 193 G 9.31 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.40 4.69 0.00 2.97 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 0.00 195 S 8.07 4.57 0.00 3.99 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 0.00 196 G 8.75 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 0.00 197 G 7.94 4.38 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 0.00 198 P 0.00 5.21 0.00 2.33 2.36 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 199 V 8.44 4.59 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.49 0.00 0.00 200 V 8.81 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 0.75 0.00 0.00 0.78 0.00 0.00 201 C 8.50 5.09 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.73 3.44 0.00 3.96 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.54 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 0.00 204 K 7.60 4.40 0.00 1.73 1.73 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.44 7.81 *209 L 8.23 4.07 0.00 1.50 1.62 0.95 0.73 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 0.00 210 Q 8.97 4.57 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.35 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 211 G 7.94 5.36 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 0.00 212 I 8.23 5.25 1.95 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 1.31 1.17 1.01 0.00 0.00 213 V 8.89 3.80 2.32 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 1.02 0.00 0.00 1.23 0.00 0.00 214 S 8.53 4.78 0.00 3.95 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 0.00 215 W 7.44 4.92 0.00 3.34 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 0.00 216 G 8.10 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 0.00 217 E 8.51 4.53 0.00 2.28 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 0.00 2.39 2.41 0.00 *219 G 7.97 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.11 4.92 0.00 2.94 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 0.00 221 A 9.08 4.22 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.43 4.45 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 222 K 8.49 4.20 0.00 1.72 1.72 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.62 7.81 223 N 9.57 4.22 0.00 2.85 3.00 0.00 0.00 6.62 7.84 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 0.00 224 K 7.65 4.53 0.00 1.91 1.90 0.00 1.94 0.00 0.00 1.32 0.00 0.00 3.47 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.54 7.81 225 P 0.00 4.64 0.00 2.11 2.09 0.00 3.57 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 2.03 1.95 0.00 226 G 8.33 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.62 4.31 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 -0.66 0.00 0.00 228 Y 8.07 5.02 0.00 1.43 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 0.00 229 T 8.43 4.51 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 1.31 0.00 0.00 230 K 9.42 5.02 0.00 2.18 1.91 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.63 7.81 231 V 8.75 4.03 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.14 0.00 0.00 232 C 8.37 4.60 0.00 3.16 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 0.00 233 N 7.84 4.21 0.00 2.21 2.43 0.00 0.00 6.85 8.80 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 0.00 234 Y 8.19 4.81 0.00 3.21 3.30 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 0.00 235 V 7.92 3.64 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.03 0.00 0.00 236 S 8.16 4.08 0.00 3.96 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 0.00 237 W 8.36 4.26 0.00 3.52 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.06 2.96 1.96 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 1.40 0.81 0.67 0.00 0.00 239 K 8.04 3.76 0.00 1.85 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.55 7.81 240 Q 7.72 3.91 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 241 T 7.49 3.77 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 242 I 7.06 2.81 1.43 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.41 0.00 0.00 243 A 7.63 4.25 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 0.00 244 S 7.45 4.68 0.00 3.73 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 0.00 245 N 8.10 4.70 0.00 3.10 3.00 0.00 0.00 6.91 7.56 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 * Residues marked with a * may have inaccurate shift predictions.