NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.4505 7.8676 121.0529 61.2764 39.8264 174.2008 17 S 4.7844 9.0422 121.8770 55.6420 66.2758 172.1892 18 G 3.4518 7.8354 109.7151 46.5977 0.0000 175.4092 19 G 3.7675 8.9056 112.8359 45.1942 0.0000 172.7271 *29 D 4.5666 7.9563 117.9544 53.6921 42.6422 174.9075 30 A 4.5625 8.5687 122.8362 52.2316 19.2366 176.9854 31 I 4.9828 8.4388 113.6713 59.3752 41.6262 173.8492 32 Y 5.3277 9.6170 121.5320 56.6520 41.5407 175.5389 33 S 4.5854 8.8695 119.6250 55.6761 65.5562 174.1987 34 S 4.2276 8.4938 113.0331 61.1196 62.8939 175.6804 *39 T 4.5839 7.2453 109.3995 60.7706 70.3871 173.2094 40 G 3.9260 6.8480 109.9822 45.7200 0.0000 171.0144 41 R 4.8156 8.5375 119.1092 54.9778 32.1205 175.1989 42 C 5.1274 8.7648 123.1936 57.4747 32.4985 172.5346 43 S 5.0906 8.3288 115.1382 57.0572 66.0011 174.2649 44 L 3.2540 8.6005 126.4783 55.7745 42.2737 176.1891 45 G 3.8478 9.4176 114.8833 47.9676 0.0000 172.7820 46 F 5.0794 8.0000 115.5559 54.6796 44.2707 174.0345 47 N 5.2772 8.8986 119.8832 53.6853 39.2508 174.7112 48 V 5.1598 9.4137 115.9193 60.2647 37.0096 174.1346 48A R 5.0629 8.9467 116.7760 55.3565 33.2736 174.1220 48B S 4.6056 8.8512 114.7773 56.0886 65.3234 174.4351 48C G 3.7885 8.9212 118.3688 47.2082 0.0000 173.7373 48D S 4.6376 8.9178 118.5534 57.8963 63.3179 173.2407 49 T 4.4921 8.0001 119.5915 62.4970 69.8076 172.9931 50 Y 5.0344 8.2927 123.4857 56.7753 40.9582 174.2631 51 Y 5.3316 9.4368 119.6232 56.7428 43.4639 173.6302 52 F 5.5718 8.5342 114.4673 55.3146 41.5796 174.1674 53 L 4.9655 9.0457 120.7297 54.8496 43.6817 176.1146 54 T 4.6951 8.4578 114.9444 61.2991 71.2430 172.4365 55 A 4.5324 8.5833 123.3787 51.8727 19.3220 179.2289 56 G 3.9743 8.7361 110.4317 46.5509 0.0000 175.3694 57 H 3.9004 8.1276 114.4294 57.1942 28.7876 176.3665 58 C 4.3975 7.6255 117.8894 62.5476 28.7606 175.0613 59 T 4.4474 7.9531 109.3906 63.9389 69.1331 174.3040 60 D 4.5220 8.3069 123.9935 54.6682 40.8848 177.2019 58 G 3.8075 7.6355 108.0894 49.4476 0.0000 175.3613 59 A 4.4174 8.0431 119.5906 54.6389 18.4331 177.4040 60 T 4.2320 8.1169 117.1935 62.2682 69.5849 175.6019 65 T 4.2837 7.4572 116.6948 62.0399 70.7290 173.5257 66 W 4.8932 8.6737 124.6288 54.6679 32.6268 174.7197 67 W 5.5183 9.7387 122.6623 55.0415 32.6712 176.0649 68 A 4.4949 9.3864 123.0441 53.5353 19.4423 177.2795 *78 N 5.1296 8.2459 112.1553 52.2782 38.4217 175.7646 79 S 2.8776 7.8095 113.5406 60.6866 63.1969 175.3475 80 A 3.8308 7.5905 122.1636 52.5816 18.6315 176.7928 81 R 3.2178 7.4651 113.9454 57.7225 27.3931 176.8157 82 T 4.4236 8.2540 105.8310 61.4316 70.7978 174.1304 83 T 4.5675 8.0445 119.4460 61.7268 69.8904 173.5741 84 V 3.8825 8.5072 127.0364 63.2346 32.0390 175.2711 85 L 4.5287 9.4172 128.7317 55.2481 42.9720 176.9696 86 G 4.2560 6.7710 104.4184 45.7644 0.0000 170.7234 87 T 5.6445 7.4204 109.0126 59.7698 72.1495 173.8895 88 T 4.3295 8.8667 120.6614 64.7214 68.4154 173.8258 89 S 4.6774 8.9909 119.9623 58.5133 65.3313 174.2771 90 G 4.2341 7.6757 105.5447 45.6063 0.0000 172.2345 91 S 4.8682 8.4119 115.2872 57.0022 66.4182 173.0194 *93 S 4.4145 8.6590 120.5966 58.8063 63.1465 171.8537 94 F 5.6347 8.5567 126.1264 57.3471 42.6132 172.2444 *99A P 3.3848 0.0000 0.0000 64.0799 31.7364 174.4975 100 N 4.8497 8.6075 116.2237 53.7425 37.9052 174.4761 101 N 5.3214 7.4599 112.8672 51.6688 42.1988 173.3554 102 D 5.3769 9.1701 117.3691 53.1027 40.6307 173.7761 103 Y 5.2495 8.4909 118.5750 55.5805 42.2215 175.2052 104 G 4.4566 9.1445 106.6020 46.5462 0.0000 171.5085 105 I 5.0032 8.6758 119.3298 58.9940 41.8621 173.7581 106 V 4.4111 7.9241 128.3792 60.7463 34.1631 174.1844 107 R 4.2356 8.6525 129.1724 55.6451 31.1115 175.1400 108 Y 4.8272 8.4423 125.4294 58.6400 38.2401 176.3549 109 T 4.2963 9.2438 112.9552 61.4355 69.4284 173.5061 110 N 4.7369 8.0915 121.9971 52.5082 38.1174 175.1149 111 T 4.0254 8.4179 116.8885 63.3906 69.3573 175.4408 112 T 4.3522 7.1508 110.6124 61.1971 70.2447 174.5372 113 I 3.8005 7.6389 123.6943 59.7991 38.5283 173.6736 114 P 4.3156 0.0000 0.0000 63.0445 31.8079 176.7229 115 K 4.6421 7.9682 119.9003 54.2787 32.2337 174.8201 116 D 4.5089 8.5979 120.8038 54.2522 42.5346 178.1316 117 G 3.6382 8.6255 114.6288 44.1138 0.0000 171.6306 118 T 4.8837 7.0858 109.0006 60.4787 72.5626 173.7338 119 V 4.4789 8.4241 121.8216 61.3458 32.6354 176.2578 120 G 3.7115 8.0892 120.5437 46.8411 0.0000 173.6096 121 G 3.7004 8.7583 112.9715 45.8151 0.0000 172.3257 122 Q 4.2291 8.0409 123.2266 54.1525 29.8562 174.4785 123 D 4.6431 8.5257 125.2923 54.3213 42.0229 174.3141 124 I 4.9559 7.9958 126.2303 59.9338 38.6551 175.3820 125 T 4.6243 8.9103 117.2672 62.6908 71.0265 174.0603 126 S 4.6034 7.6910 114.1140 57.4022 66.2652 173.5778 127 A 4.9528 8.3844 121.6383 51.0201 20.2457 176.2727 128 A 4.6974 8.4536 120.3940 50.1716 22.8342 176.1376 129 N 4.3960 8.6807 116.7142 52.6574 39.3476 175.6777 130 A 4.1947 8.4652 125.3802 52.4856 19.4318 176.8494 131 T 4.6940 7.9763 109.3167 59.1463 71.8853 173.7287 132 V 3.8113 8.2279 123.2544 64.4520 31.9189 176.5104 133 G 3.9308 8.8877 115.2531 45.3103 0.0000 173.2193 134 M 4.1810 7.9226 120.4708 55.4680 33.4691 175.0640 135 A 4.6203 8.4853 127.6911 51.9238 19.3086 177.0317 136 V 4.5827 8.8356 115.4540 59.9106 36.7106 174.8485 137 T 4.7580 8.2727 118.2404 61.7359 72.4797 173.0466 138 R 5.6483 8.9132 125.7676 53.8296 32.8618 174.4494 139 R 5.1641 8.5917 124.3707 54.7510 33.5000 174.1961 140 G 4.3273 8.9635 111.7515 45.0496 0.0000 173.4893 141 S 4.4221 8.9292 114.3408 60.0254 63.8604 176.1307 142 T 4.1204 8.4290 119.1435 66.2197 68.3928 176.3022 143 T 4.5159 7.5646 105.9799 61.7162 70.7537 173.8280 *156 G 4.3810 7.4103 108.7920 47.0531 0.0000 172.5435 157 T 5.3076 8.5436 121.4707 62.3269 70.2910 173.8935 158 H 4.9286 9.2292 122.3224 54.3358 33.6301 172.5528 159 S 5.0054 8.5589 116.1182 56.6059 66.5885 174.5193 160 G 4.0462 7.8049 107.6240 46.4390 0.0000 172.2607 161 S 5.1251 8.5918 117.2098 56.4554 68.0151 173.8537 162 V 4.2039 8.6562 123.2345 63.3886 31.5735 176.4426 163 T 4.4656 8.7742 118.2800 62.4079 70.3576 174.3026 164 A 4.5891 7.5144 121.4384 51.2157 22.4532 174.8585 165 L 5.0009 8.3149 118.4267 52.5482 45.9508 175.3251 166 N 4.1420 8.7002 114.5359 54.6616 37.4845 173.4115 167 A 4.5044 8.2552 118.0274 51.8256 20.1663 177.5217 168 T 4.6660 8.3212 117.8704 62.0274 70.3869 174.4526 169 V 3.7480 8.1857 125.9562 60.7804 34.5779 173.5768 170 N 4.7110 8.3051 126.9592 52.2303 39.0069 173.8824 171 Y 4.4227 8.6738 124.4707 58.1641 38.7126 177.1545 172 G 3.9097 8.4703 106.0616 46.5177 0.0000 174.0242 173 G 3.7767 9.4446 105.7270 46.3412 0.0000 175.0158 174 G 3.9760 8.5209 107.3558 44.8099 0.0000 174.8111 175 D 4.5090 7.9030 121.4456 52.8101 39.7317 174.3163 176 V 4.3613 7.4530 121.0799 61.0409 34.0247 174.6285 177 V 4.6884 8.1164 120.1683 59.7159 35.3850 174.0814 178 Y 4.7954 8.3040 119.4940 56.7072 41.9999 175.4503 179 G 4.1554 8.8892 106.7341 45.7320 0.0000 173.6879 180 M 4.7163 8.1325 118.9468 54.2894 34.2216 175.4926 181 I 4.5177 8.9026 122.9268 60.6779 38.7556 174.9333 182 R 4.6349 9.1335 128.9106 55.3031 31.9131 175.1689 183 T 5.3670 8.5163 114.5407 58.9760 73.3293 173.1716 184 N 4.9378 8.4433 116.7521 53.0877 38.6680 174.2862 *190 V 4.5414 7.9804 117.8542 63.6253 32.4451 174.0329 191 C 4.5956 8.7686 120.7490 55.1165 42.9865 172.2525 192 A 4.6920 7.7766 121.4376 51.7700 21.5670 175.1678 192A E 4.7559 9.1304 118.3734 53.6149 33.8764 173.6911 192B P 4.3245 0.0000 0.0000 64.6424 31.9893 176.6951 193 G 4.2064 8.8896 109.8344 46.8631 0.0000 175.0104 194 D 4.5349 8.2647 118.8818 56.1004 41.3759 176.7761 195 S 4.4290 7.8605 115.9234 60.2088 63.2736 175.3688 196 G 4.1493 8.7686 112.5242 46.4644 0.0000 173.9066 197 G 3.9479 8.0100 107.0568 44.5134 0.0000 171.5438 198 P 4.8242 0.0000 0.0000 62.3553 33.0309 174.6837 199 L 5.1296 9.0727 124.7210 53.5572 44.1418 174.7472 200 Y 5.4704 8.7595 123.7612 55.4771 42.5631 174.4621 201 S 4.4711 9.0067 114.4034 56.3355 65.3374 173.9100 202 G 3.6434 8.9866 118.8433 47.4657 0.0000 173.6663 *207 T 4.8484 8.2723 115.1595 61.0626 71.2314 171.8899 208 R 5.0973 8.1095 121.9640 54.7898 32.3611 175.4618 209 A 4.2219 8.7893 126.8469 52.2081 19.0347 177.0382 210 I 4.2726 9.1835 122.5358 62.5682 40.3233 175.7437 211 G 4.7308 7.9684 106.2072 45.4068 0.0000 171.2330 212 L 5.5552 9.0329 119.2433 52.7919 45.3122 176.7927 213 T 3.7801 9.1770 121.4139 64.3803 68.8726 173.9639 214 S 4.4308 8.6517 121.3519 58.1541 63.9220 174.2579 215 G 4.0897 6.8856 104.6480 45.8047 0.0000 171.3442 216 G 3.9346 7.6776 104.8473 45.7417 0.0000 171.3377 217 S 4.6973 8.0163 115.1593 57.3533 66.5601 174.8836 218 G 4.0181 10.0226 108.1765 45.6611 0.0000 171.2862 219 N 4.7238 7.9150 115.3569 52.3852 40.1846 174.3645 220 C 4.4427 9.2285 115.5992 59.1252 40.5644 175.8780 221 S 4.2796 8.3398 115.6920 60.7454 62.6821 175.0943 222 S 4.5142 9.0094 111.4614 57.5481 63.7422 174.7520 223 G 3.9651 9.6396 107.9196 45.8678 0.0000 172.5862 224 G 4.3654 7.5833 104.5406 45.9676 0.0000 172.1652 225 T 4.8355 8.4236 115.8504 61.9226 71.8915 173.8045 226 T 4.8362 8.3088 122.2238 61.6608 72.2534 172.9744 227 F 5.3478 9.2046 124.5048 55.9894 41.6576 174.8492 228 F 5.3311 9.2844 120.7699 55.5527 42.9836 174.1140 229 Q 4.5971 9.2673 124.8205 55.0325 30.1172 173.7075 230 P 4.7879 0.0000 0.0000 62.9536 32.1851 177.7830 231 V 3.7947 8.8404 124.0876 64.8401 31.2936 178.5497 232 T 3.7674 7.9709 110.1464 64.9605 68.1498 175.6443 233 E 3.7698 7.8150 120.2668 58.7369 29.6338 178.6745 234 A 2.7537 7.4541 120.2644 54.6212 18.4892 179.3363 235 L 3.8692 7.7954 117.4736 58.2015 41.4960 180.0898 235A S 4.0542 7.8493 113.5038 61.3941 62.8022 176.2729 236 A 3.9588 7.7091 122.8029 54.6295 18.1841 178.3759 237 Y 4.6878 7.7800 113.1877 56.7645 38.7213 176.0113 238 G 3.6401 8.0741 107.7980 47.0846 0.0000 173.4915 239 V 4.7496 7.6616 109.8919 59.2405 35.9624 175.8457 240 S 4.8119 8.8197 116.8685 56.7312 66.6891 174.8165 241 V 4.4514 8.3824 116.4596 61.6436 32.6343 175.9495 242 Y 4.4025 7.6455 119.0422 57.6104 37.6868 174.7473 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 7.87 4.45 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.40 1.08 0.00 0.00 17 S 9.04 4.78 0.00 4.07 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 18 G 7.84 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 0.00 0.00 0.00 19 G 8.91 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 *29 D 7.96 4.57 0.00 2.66 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 30 A 8.57 4.56 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.44 4.98 2.03 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.80 0.49 0.00 0.00 32 Y 9.62 5.33 0.00 3.22 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 33 S 8.87 4.59 0.00 3.13 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.49 4.23 0.00 4.06 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *39 T 7.25 4.58 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 40 G 6.85 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 0.00 0.00 0.00 41 R 8.54 4.82 0.00 1.67 1.74 0.00 3.03 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.10 0.00 42 C 8.76 5.13 0.00 2.91 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 43 S 8.33 5.09 0.00 3.81 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.60 3.25 0.00 1.26 1.27 0.29 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.42 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 46 F 8.00 5.08 0.00 2.96 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 47 N 8.90 5.28 0.00 2.51 2.99 0.00 0.00 6.74 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 48 V 9.41 5.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.12 0.00 0.00 48A R 8.95 5.06 0.00 1.21 1.07 0.00 2.21 0.00 0.00 2.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.39 0.00 48B S 8.85 4.61 0.00 4.02 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 48C G 8.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48D S 8.92 4.64 0.00 4.05 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.00 4.49 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 0.89 0.00 0.00 50 Y 8.29 5.03 0.00 2.95 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 51 Y 9.44 5.33 0.00 2.83 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 52 F 8.53 5.57 0.00 3.12 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 53 L 9.05 4.97 0.00 1.81 1.77 1.04 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.46 4.70 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 0.95 0.00 0.00 55 A 8.58 4.53 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.74 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.13 3.90 0.00 2.16 1.31 0.00 5.55 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 58 C 7.63 4.40 0.00 3.14 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 59 T 7.95 4.45 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 60 D 8.31 4.52 0.00 2.97 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 58 G 7.64 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 0.00 0.00 0.00 59 A 8.04 4.42 1.46 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 0.00 0.00 60 T 8.12 4.23 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 1.21 0.00 0.00 65 T 7.46 4.28 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 0.03 0.00 0.00 66 W 8.67 4.89 0.00 3.26 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 94 F 8.56 5.63 0.00 2.92 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 *99A P 0.00 3.38 0.00 2.02 0.89 0.00 3.72 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 100 N 8.61 4.85 0.00 2.98 3.12 0.00 0.00 7.31 7.26 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 0.00 101 N 7.46 5.32 0.00 2.48 2.93 0.00 0.00 6.32 8.08 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 0.00 102 D 9.17 5.38 0.00 2.95 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 8.49 5.25 0.00 3.02 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 0.00 104 G 9.14 4.46 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 0.00 0.00 0.00 105 I 8.68 5.00 1.24 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.90 0.00 0.00 114 P 0.00 4.32 0.00 2.34 2.00 0.00 3.74 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 1.97 1.97 0.00 115 K 7.97 4.64 0.00 1.58 1.74 0.00 1.11 0.00 0.00 0.61 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.50 1.23 7.81 116 D 8.60 4.51 0.00 2.71 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 0.00 117 G 8.63 3.64 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 0.00 0.00 0.00 118 T 7.09 4.88 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 1.19 0.00 0.00 119 V 8.42 4.48 1.52 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 1.02 0.00 0.00 0.78 0.00 0.00 120 G 8.09 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 0.00 0.00 0.00 121 G 8.76 3.70 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 0.00 0.00 0.00 122 Q 8.04 4.23 0.00 1.94 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.93 0.00 0.00 0.00 0.00 0.00 1.49 1.99 0.00 123 D 8.53 4.64 0.00 2.77 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 8.00 4.96 1.96 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 1.23 1.20 0.82 0.00 0.00 125 T 8.91 4.62 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 1.21 0.00 0.00 126 S 7.69 4.60 0.00 3.84 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 0.00 127 A 8.38 4.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.45 4.70 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 0.00 129 N 8.68 4.40 0.00 2.70 2.76 0.00 0.00 6.91 7.35 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 0.00 130 A 8.47 4.19 1.25 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 0.00 0.00 131 T 7.98 4.69 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 1.21 0.00 0.00 132 V 8.23 3.81 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 0.80 0.00 0.00 0.95 0.00 0.00 133 G 8.89 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 0.00 0.00 0.00 134 M 7.92 4.18 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 135 A 8.49 4.62 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 0.00 136 V 8.84 4.58 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 0.64 0.00 0.00 0.82 0.00 0.00 137 T 8.27 4.76 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 1.04 0.00 0.00 138 R 8.91 5.65 0.00 1.88 1.82 0.00 3.23 0.00 0.00 3.57 7.04 0.00 0.00 0.00 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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 0.00 168 T 8.32 4.67 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 1.05 0.00 0.00 169 V 8.19 3.75 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 0.01 0.00 0.00 -0.39 0.00 0.00 170 N 8.31 4.71 0.00 2.55 2.56 0.00 0.00 7.23 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 0.00 171 Y 8.67 4.42 0.00 3.25 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 0.00 172 G 8.47 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 0.00 0.00 0.00 173 G 9.44 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 0.00 174 G 8.52 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 D 7.90 4.51 0.00 2.89 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 7.45 4.36 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 0.51 0.00 0.00 0.84 0.00 0.00 177 V 8.12 4.69 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 0.87 0.00 0.00 0.83 0.00 0.00 178 Y 8.30 4.80 0.00 2.79 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 0.00 179 G 8.89 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 0.00 180 M 8.13 4.72 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.81 0.00 181 I 8.90 4.52 2.20 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 1.20 0.85 0.99 0.00 0.00 182 R 9.13 4.63 0.00 2.07 1.94 0.00 3.19 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.97 0.00 183 T 8.52 5.37 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 1.28 0.00 0.00 184 N 8.44 4.94 0.00 2.84 3.02 0.00 0.00 5.52 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 *190 V 7.98 4.54 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.92 0.00 0.00 191 C 8.77 4.60 0.00 3.07 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 0.00 192 A 7.78 4.69 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192A E 9.13 4.76 0.00 1.95 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 2.20 2.23 0.00 192B P 0.00 4.32 0.00 2.02 1.99 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 193 G 8.89 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 0.00 0.00 0.00 194 D 8.26 4.53 0.00 2.84 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 0.00 195 S 7.86 4.43 0.00 3.84 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 0.00 196 G 8.77 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 0.00 0.00 0.00 197 G 8.01 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 0.00 198 P 0.00 4.82 0.00 1.89 1.04 0.00 3.79 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 2.01 1.57 0.00 199 L 9.07 5.13 0.00 1.06 1.43 0.13 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.76 5.47 0.00 3.17 3.18 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 0.00 201 S 9.01 4.47 0.00 3.84 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 0.00 202 G 8.99 3.64 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 0.00 0.00 0.00 *207 T 8.27 4.85 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 208 R 8.11 5.10 0.00 1.90 1.86 0.00 3.27 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 209 A 8.79 4.22 0.07 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 0.00 210 I 9.18 4.27 1.93 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 1.34 0.94 0.88 0.00 0.00 211 G 7.97 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 L 9.03 5.56 0.00 1.76 1.68 1.11 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 213 T 9.18 3.78 4.46 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 1.07 0.00 0.00 214 S 8.65 4.43 0.00 4.00 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 0.00 215 G 6.89 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 0.00 216 G 7.68 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 0.00 0.00 0.00 217 S 8.02 4.70 0.00 3.98 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 0.00 218 G 10.02 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 0.00 219 N 7.92 4.72 0.00 3.13 2.91 0.00 0.00 7.45 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 0.00 220 C 9.23 4.44 0.00 2.99 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 0.00 221 S 8.34 4.28 0.00 3.99 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 0.00 222 S 9.01 4.51 0.00 3.90 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 0.00 223 G 9.64 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 7.58 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 T 8.42 4.84 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 226 T 8.31 4.84 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 0.68 0.00 0.00 227 F 9.20 5.35 0.00 2.92 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 0.00 228 F 9.28 5.33 0.00 3.05 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 0.00 229 Q 9.27 4.60 0.00 2.40 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.95 0.00 0.00 0.00 0.00 0.00 2.82 2.59 0.00 230 P 0.00 4.79 0.00 2.26 2.02 0.00 3.78 0.00 0.00 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 231 V 8.84 3.79 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 0.74 0.00 0.00 0.95 0.00 0.00 232 T 7.97 3.77 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 1.17 0.00 0.00 233 E 7.82 3.77 0.00 2.09 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 2.09 2.26 0.00 234 A 7.45 2.75 1.02 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 0.00 235 L 7.80 3.87 0.00 1.77 1.80 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 235A S 7.85 4.05 0.00 3.73 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 0.00 236 A 7.71 3.96 0.78 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 0.00 237 Y 7.78 4.69 0.00 2.94 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 G 8.07 3.64 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 0.00 0.00 0.00 239 V 7.66 4.75 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 0.55 0.00 0.00 0.92 0.00 0.00 240 S 8.82 4.81 0.00 3.75 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 V 8.38 4.45 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 0.42 0.00 0.00 0.80 0.00 0.00 242 Y 7.65 4.40 0.00 3.08 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.