NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4192 8.3049 120.3486 55.0938 33.6314 175.7792 2 R 3.9986 8.2514 124.8342 55.2965 32.2161 176.1320 3 L 3.9690 9.3877 123.1819 58.0883 41.8115 179.5841 4 K 3.8437 8.0633 116.8026 60.0341 32.1294 178.5287 5 D 4.5020 7.9634 116.4787 56.6163 40.9369 178.3324 6 L 4.0519 7.5731 120.6818 57.2044 42.6819 178.3242 7 G 4.0532 7.8091 103.9601 45.6930 0.0000 173.9794 8 E 3.9897 8.8214 122.8796 59.5871 29.7352 179.9674 9 R 3.9264 8.0044 120.0232 61.5317 29.6273 180.3811 10 A 4.1956 7.9281 121.3867 54.7390 18.4305 179.3194 11 L 3.9023 7.7456 118.5128 58.3668 42.1884 179.2098 12 L 3.9947 8.2943 119.0516 57.8031 41.3147 179.4246 13 A 4.0682 8.0417 122.2908 55.7416 18.3409 180.2567 14 R 4.0730 7.7588 118.2658 61.2498 29.7284 181.2954 15 L 4.4475 8.0601 118.3545 56.4714 41.5842 178.8303 16 A 3.9744 7.8858 122.0618 54.7333 18.4322 177.0316 17 P 4.4170 0.0000 0.0000 64.1978 32.0425 175.7935 18 L 4.0184 7.5674 119.8768 56.1130 41.3380 177.3544 19 G 3.9388 8.9738 111.5648 45.7620 0.0000 172.4827 20 Y 4.0550 7.8445 121.1345 56.0968 39.3955 173.5749 21 P 4.3735 0.0000 0.0000 61.7553 32.0803 174.7710 22 P 4.3772 0.0000 0.0000 65.6967 31.9704 177.3893 23 E 4.7016 7.9934 113.6971 54.1304 29.2839 177.5490 24 A 4.7367 7.4825 126.3540 50.1589 21.1458 176.8470 25 P 4.3894 0.0000 0.0000 64.2370 31.7201 176.5593 26 L 4.7752 7.2618 118.3646 52.3508 45.6375 174.2046 27 P 4.6157 0.0000 0.0000 61.4689 32.2920 174.2827 28 P 3.1384 0.0000 0.0000 63.3757 31.5672 177.2241 29 G 3.7610 8.4017 108.6880 45.9111 0.0000 173.2489 30 D 4.6967 7.3941 119.8078 52.8411 42.6410 176.3153 31 D 4.4423 9.5710 119.7612 56.9249 40.7981 175.8412 32 A 4.5923 7.3841 119.2770 50.9391 23.0116 174.8128 33 G 4.3847 8.5407 105.2925 44.4677 0.0000 171.9289 34 G 4.5010 7.5215 105.7878 46.2931 0.0000 172.7296 35 V 4.6529 7.8736 111.8271 59.2728 36.5576 174.9779 36 W 5.0876 8.7807 122.0738 55.9271 30.2970 176.1536 37 A 4.5556 9.6524 127.5612 51.6580 21.4037 175.9009 38 E 3.9462 10.1878 124.8247 57.6795 27.0808 176.2118 39 G 4.0909 8.4882 104.5285 45.3819 0.0000 173.0786 40 R 4.9699 8.2837 118.2164 54.2269 34.2215 175.0824 41 A 4.2530 8.3322 124.2652 50.5498 19.8149 176.4963 42 W 4.3929 8.9920 123.4546 56.5432 30.5639 176.1213 43 L 5.1753 8.7634 125.7004 53.2312 44.0461 175.5286 44 L 5.3702 8.8787 123.1769 53.5145 45.9328 175.0076 45 K 4.9429 9.1242 125.9626 55.3033 36.1582 174.6152 46 T 5.1288 8.6649 122.7335 61.8903 71.3540 172.9447 47 D 5.0851 9.4011 125.9234 52.4911 44.4839 175.2438 48 G 4.1754 8.3935 108.5594 44.3565 0.0000 171.1651 49 F 4.8786 7.9818 112.8652 56.2797 41.6530 172.7736 50 L 4.7444 8.2056 120.1062 53.9903 42.9927 176.7043 51 Y 4.2081 9.3410 126.3829 60.9535 38.7210 178.7975 52 R 4.1961 8.3058 113.0430 58.1130 29.5597 176.6901 53 E 4.4090 8.2138 117.4368 56.7494 30.2159 176.8933 54 V 3.8767 7.3167 110.3249 61.3440 33.6147 175.7415 55 A 3.7785 7.3198 121.6213 51.3230 17.1393 176.9546 56 L 3.9794 7.8289 124.1579 54.6416 42.8905 177.7656 57 K 4.0512 8.6358 121.5637 56.7393 31.7605 177.4469 58 G 4.2481 9.1493 112.2685 44.5598 0.0000 173.3083 59 M 3.7525 7.5721 119.5327 53.9236 33.1510 175.7107 60 G 4.3563 9.0783 112.2056 42.5894 0.0000 171.6940 61 P 4.3471 0.0000 0.0000 65.8504 30.6219 178.1012 62 F 4.1308 8.1627 119.8038 61.3782 39.3267 176.8172 63 E 3.9533 8.2505 117.6586 59.2544 29.2495 179.3688 64 V 3.4567 7.7223 118.3836 65.8594 31.5687 178.3646 65 G 3.5646 8.3213 105.7819 47.7098 0.0000 175.3571 66 F 3.9257 8.0916 123.1988 61.1562 39.3482 177.5190 67 R 4.0430 8.5770 118.1933 58.8443 29.8326 179.2612 68 G 3.7949 8.0921 105.7965 47.8835 0.0000 175.9978 69 V 3.0444 7.3254 120.3698 65.2402 31.4417 177.8529 70 A 3.6521 7.5706 120.2625 54.8842 18.0118 179.3772 71 A 2.5800 7.7902 119.4203 55.2473 18.5200 180.0269 72 T 4.0942 7.7540 114.6947 66.2372 68.4731 176.8443 73 A 4.2501 8.3183 123.0977 55.2463 18.3995 179.8622 74 S 4.1308 8.1635 113.7480 61.8689 62.8765 176.6640 75 D 4.5718 8.0434 121.4408 57.4267 40.5995 178.8673 76 L 4.1241 7.9120 119.0714 57.8792 41.5835 179.6441 77 L 4.2577 8.7242 120.4713 57.1264 41.2983 179.3875 78 A 4.0817 8.0547 120.0446 54.5423 18.4668 178.7584 79 K 4.5017 7.4566 115.4508 55.3663 31.9894 177.1088 80 M 3.3422 8.0221 117.8884 56.3781 29.8805 176.4293 81 G 3.9691 7.9138 105.5380 44.5967 0.0000 173.8883 82 R 4.4551 8.4002 125.2647 54.1068 30.9432 173.8226 83 P 4.6006 0.0000 0.0000 63.1951 31.3536 176.3493 84 L 4.5863 8.6001 123.4864 55.6545 44.7735 176.3815 85 G 4.2549 7.4155 102.9704 45.7077 0.0000 172.4155 86 F 5.5727 9.0579 118.6974 55.7276 43.8324 174.1539 87 T 5.1238 9.0712 110.6827 59.9950 72.4662 172.5113 88 L 5.1388 8.7268 123.0154 52.9539 45.0306 175.6172 89 G 4.3085 8.7849 110.4625 43.6627 0.0000 171.9290 90 L 5.1728 8.6801 126.6525 52.6014 45.1824 175.7637 91 F 5.1535 9.0060 122.1970 55.8427 41.4682 174.4101 92 L 5.0851 9.1605 124.3835 51.9370 45.1482 175.1240 93 P 5.1480 0.0000 0.0000 62.4793 32.0381 178.0621 94 E 3.9995 8.7445 117.6201 58.9555 29.7424 177.3776 95 D 4.7242 7.8486 115.2152 54.1767 41.2147 176.3643 96 L 3.9678 7.4163 121.9527 54.7446 42.8729 176.3007 97 E 4.3293 8.4264 124.3150 55.5820 30.5781 177.8451 98 E 4.1790 8.9297 121.6105 59.4896 29.5014 179.7276 99 G 3.6640 8.1547 106.4491 47.4495 0.0000 175.2087 100 F 4.0321 8.2554 122.9273 61.2734 39.3923 177.4701 101 V 3.6614 7.9628 117.3298 65.8694 31.3381 177.4169 102 L 3.9647 8.0876 120.1247 58.2371 41.8375 178.8657 103 E 4.0819 8.3081 118.4109 59.3925 29.4275 179.2239 104 L 4.0668 7.6720 118.9701 57.9330 41.6340 179.9061 105 V 3.5572 7.9193 118.0896 66.0691 31.4023 178.3584 106 R 4.0793 8.4501 118.3261 58.8706 29.8447 179.2931 107 G 2.2230 7.8791 105.5480 47.2045 0.0000 175.6018 108 A 3.8295 7.6659 123.4291 54.6902 18.3265 179.5778 109 A 3.9093 8.2188 119.6563 55.1128 18.3914 179.5177 110 E 3.8923 8.4666 117.9994 59.3996 29.8789 178.9109 111 A 3.2137 7.6008 120.5604 54.6683 18.1228 179.3760 112 A 3.9277 7.7171 119.2428 55.2386 18.4069 179.7155 113 K 3.6794 8.2859 118.4530 59.7564 32.0114 179.1425 114 R 3.9130 7.8267 117.2391 58.5186 30.0148 177.9300 115 L 4.4830 7.1793 115.0517 53.8059 42.0020 177.1145 116 G 3.6291 7.9457 106.9869 45.8439 0.0000 173.0042 117 A 4.6436 7.6536 121.7046 49.7969 22.1021 175.7868 118 F 5.0370 8.3812 114.0104 56.3067 44.1643 173.9703 119 L 5.0298 8.7323 119.4624 53.2347 42.9668 176.9202 120 L 4.5110 9.1985 124.0360 54.5807 42.4312 176.6949 121 G 4.0296 8.2116 104.0734 44.4454 0.0000 171.8331 122 G 3.9338 7.5088 110.0179 45.7269 0.0000 170.5499 123 D 4.7909 8.5143 122.0154 53.3298 45.2011 175.2335 124 T 5.0466 8.2426 112.7001 60.1636 71.8638 172.6951 125 N 5.0878 9.0933 122.5962 52.1757 43.5803 174.9078 126 R 4.5779 8.6749 121.9860 57.5440 30.5962 176.4469 127 G 4.2651 8.6182 107.5109 45.1266 0.0000 174.2635 128 V 3.8745 8.4751 120.1592 64.6219 31.9602 175.7832 129 E 4.8109 7.6590 115.0635 53.9206 33.1464 175.7060 130 V 4.1017 8.4054 120.9412 63.2895 32.6573 174.5840 131 A 5.2879 9.1099 129.2109 50.3450 22.9757 174.2703 132 L 5.2043 8.8071 121.5753 53.5867 46.0599 174.9636 133 T 4.8624 8.6986 114.5576 59.7404 72.1367 172.7064 134 V 4.6342 9.1592 124.6397 61.3175 34.1939 174.3395 135 S 5.4077 9.0035 123.7352 57.0865 66.3413 173.4021 136 G 4.4376 9.1349 108.7471 45.0931 0.0000 171.2762 137 Y 5.6834 8.5808 118.7209 55.1503 41.5582 174.3340 138 A 4.7834 8.7997 120.9509 50.4270 23.5523 174.8062 139 L 3.5027 7.9344 122.1469 53.0775 43.7936 175.0183 140 A 4.8068 8.2513 131.5118 50.8911 20.6019 177.8284 141 E 4.0020 8.9160 119.1184 58.1131 30.3436 173.6864 142 A 4.7643 7.4367 121.0752 48.5201 19.1478 172.1025 143 P 4.3278 0.0000 0.0000 63.2700 32.1661 176.1990 144 L 4.6239 8.7556 126.4352 52.8301 43.5020 174.0555 145 P 4.8044 0.0000 0.0000 61.9196 33.9217 175.4225 146 R 4.3923 8.4845 119.1882 55.1830 29.4890 176.3624 147 K 4.7508 8.3310 124.0805 55.3625 35.9978 174.2634 148 A 4.6728 8.1352 123.7690 51.2288 22.1567 175.7794 149 L 4.7509 8.9523 120.2928 51.7989 45.2388 174.8126 150 P 4.4457 0.0000 0.0000 64.0993 31.6941 175.5063 151 G 4.1464 9.0466 112.7335 46.0975 0.0000 174.3811 152 D 4.6887 8.2786 119.1812 54.3962 42.1654 176.1851 153 L 4.9180 9.3251 121.8483 53.8780 44.2517 175.4541 154 L 5.2114 8.5216 121.4894 53.4117 44.0213 175.3412 155 Y 5.1355 9.3413 121.3582 56.0949 42.2325 174.4414 156 L 5.1285 9.4073 122.1305 53.1400 43.9965 175.5522 157 A 5.2160 9.3748 126.2429 51.6413 21.1582 177.4992 158 G 4.0746 9.4990 107.3479 46.3708 0.0000 172.9773 159 D 5.4199 8.1184 114.4398 52.1597 40.0291 176.3798 160 R 4.2210 7.7754 117.3061 56.6047 30.5335 176.5475 161 W 4.4605 7.7406 119.2713 58.3318 29.6321 175.4153 162 G 4.2923 9.2562 112.5032 46.3557 0.0000 175.7970 163 R 3.8743 8.0574 118.8685 59.3983 30.2174 179.1417 164 T 3.9858 7.8662 109.2371 64.5357 68.7361 176.7639 165 G 3.5665 8.0244 108.0990 47.3848 0.0000 175.4003 166 A 3.7866 7.8133 122.7070 54.8728 18.4250 179.4814 167 A 3.8427 7.7559 119.1718 55.3872 18.3213 180.0287 168 I 3.7018 7.6392 117.9080 64.4477 37.1570 178.5655 169 R 3.9250 8.2947 119.5805 59.3696 29.8142 178.4084 170 A 4.1855 8.6099 121.0415 55.5006 17.9149 179.0678 171 H 4.1470 8.3036 119.0899 60.2869 29.7010 177.8077 *172 Y 3.8390 7.8977 121.7043 61.7961 36.9089 179.1860 173 E 4.4678 8.5169 118.6269 56.5452 29.7840 177.4037 174 G 3.8169 7.4773 106.5893 46.2595 0.0000 173.2994 175 R 4.5083 7.9337 119.0977 54.3054 31.4697 176.0408 176 S 4.4760 8.4980 118.1324 58.3751 63.2819 173.5915 177 L 4.8193 8.3369 123.9620 54.3836 41.7955 175.7231 178 E 4.0939 8.1698 121.4661 57.9019 29.4951 176.9490 179 G 3.7493 9.1460 114.0339 45.3663 0.0000 173.1292 180 F 4.9772 8.3060 118.0595 54.7021 39.4595 173.8949 181 P 4.2131 0.0000 0.0000 65.9935 31.5292 178.8209 182 K 3.9486 7.9940 117.6206 59.0069 31.8874 179.3151 183 I 3.6773 7.6403 119.9623 64.1785 37.0325 178.1890 184 R 3.5805 7.9109 119.6547 59.2200 29.7727 178.2147 185 E 3.8823 8.3647 119.1941 59.1433 29.4025 178.5484 186 A 3.9651 7.8439 119.8416 54.7651 18.4052 178.8326 187 A 4.2689 7.3775 118.2097 54.5436 19.3947 179.3869 188 F 3.9246 8.3779 115.6435 59.4875 40.3639 176.0843 189 Y 4.4532 7.7982 113.3629 55.7973 37.9915 175.4984 190 P 4.3134 0.0000 0.0000 62.6847 30.7534 176.0192 191 L 4.2341 8.3621 127.1323 53.9179 42.2371 174.9519 192 P 4.2970 0.0000 0.0000 62.7062 32.1156 176.3685 193 R 4.3222 8.3961 120.5711 55.1303 29.9182 177.2986 194 L 4.0619 8.4646 124.6642 57.6046 41.6151 179.1454 195 E 3.9418 8.3036 118.1242 59.2163 29.3038 178.8547 196 L 4.0855 7.9293 119.2637 57.9545 41.8258 179.1515 197 L 4.1576 8.2145 117.8166 56.6048 41.2664 178.9280 198 A 4.1468 8.3874 120.8181 54.0404 18.5159 177.9208 199 L 4.4251 7.6754 116.5274 54.3170 41.9995 176.2432 200 S 4.2277 7.5106 114.5841 59.9129 62.4385 174.8301 201 G 4.0105 9.0017 115.4130 45.5675 0.0000 173.5302 202 L 4.4403 7.6760 117.9389 54.7375 42.9154 176.6024 203 L 4.6194 7.5324 117.5450 53.1772 43.5993 176.2603 204 R 4.1262 8.5711 121.4129 59.2232 30.9135 176.0218 205 G 4.1598 7.9629 103.5668 47.1340 0.0000 171.8988 206 S 5.2708 8.3358 112.7662 57.7637 66.8270 174.0967 207 L 5.0741 8.5397 119.7356 52.6525 46.0640 174.8761 208 D 4.8877 9.0458 123.5922 53.5766 42.4279 175.9207 209 S 4.8257 9.4946 122.0868 56.7690 62.4883 173.7766 210 S 3.7701 8.4692 121.2304 57.1496 65.2079 175.0262 211 D 4.8920 8.0351 119.5474 54.1476 41.7289 176.0787 212 G 4.0780 8.1715 106.9961 45.2100 0.0000 175.3530 213 L 4.0187 8.8036 123.7535 57.8268 42.2023 179.1991 214 A 3.9178 7.8587 120.7310 55.2481 18.4122 179.1200 215 E 4.0516 8.2706 117.2657 59.8882 29.5571 179.0942 216 T 3.9476 7.9620 115.7189 66.6663 68.4962 176.7609 217 L 3.9268 8.4449 121.2907 57.6038 41.5573 179.6729 218 W 3.9549 8.3470 118.9351 59.5489 28.7537 178.6727 219 Q 4.2020 7.9395 117.4394 58.5538 28.3055 178.3196 220 L 4.0525 7.9664 121.2970 58.1274 42.2476 178.5748 221 A 4.0294 8.1478 121.1191 55.5018 18.0687 179.1333 222 D 4.6436 8.5880 115.4843 56.6220 40.9505 178.3631 223 L 4.2705 7.9896 119.4117 55.1286 41.7837 176.9915 224 G 4.2851 8.2101 109.5205 45.5020 0.0000 173.5148 225 V 4.5733 7.8618 111.7298 59.8660 36.9473 174.0920 226 G 4.1425 9.3211 108.3766 44.7779 0.0000 172.9545 227 V 4.6363 8.4880 121.2464 60.7326 34.7952 174.1058 228 E 5.0603 8.9152 127.3401 54.6605 32.3371 175.0735 229 V 4.1826 9.1780 128.9622 62.6486 32.2613 176.8289 230 E 4.5011 9.1147 126.2528 57.8431 31.0329 172.8247 231 A 4.7513 7.6204 119.4519 50.9527 22.3058 174.7505 232 L 4.7149 8.1122 119.1558 51.8827 45.5840 174.8225 233 P 3.6711 0.0000 0.0000 62.1429 31.7207 176.2639 234 L 4.3153 7.6380 122.2919 51.9905 42.7980 176.0583 235 Y 4.4597 7.4259 121.0873 57.0762 40.0164 174.7444 236 P 4.3763 0.0000 0.0000 66.0748 31.4787 178.7493 237 D 4.6642 8.2302 117.3333 56.3297 39.4835 178.7148 238 V 3.6650 7.8351 119.3953 65.6510 31.5633 177.9115 239 L 3.9852 8.2549 118.6284 57.6819 41.3051 179.0803 240 A 4.0877 7.9124 119.3087 55.3133 18.4439 179.0775 241 F 3.8317 8.1835 117.2501 61.3757 39.4745 176.8833 242 A 4.0162 8.1112 119.3993 54.0734 18.2847 178.2220 243 G 3.9986 9.7966 105.1920 45.7826 0.0000 173.7645 244 S 4.5767 7.3800 112.3920 56.2368 66.7980 175.1072 245 E 4.0006 8.7557 125.0574 60.0438 29.2614 179.3074 246 E 4.0242 8.1466 117.7929 61.0606 29.3749 180.9811 247 A 4.2195 8.0782 121.5334 54.8413 18.4315 179.6676 248 A 4.0393 8.2504 119.5394 55.1761 18.3379 179.7564 249 L 3.9210 8.0213 117.6336 58.0381 41.6674 179.4128 250 E 4.1939 8.0837 119.2893 59.2688 29.3991 178.8949 251 L 4.0617 7.7596 118.3773 57.7447 41.4547 179.6468 252 V 3.6578 7.7369 117.3838 65.7311 31.7796 177.5950 253 L 4.0498 8.1638 118.6622 55.9847 41.7615 177.4122 254 Y 5.0588 8.3223 116.3132 57.3688 38.6132 176.9230 255 G 3.7709 7.2231 108.4520 42.5742 0.0000 174.5289 256 G 3.9966 8.6658 104.7278 44.5248 0.0000 173.5385 257 E 3.4956 8.5646 117.4425 57.1792 27.5908 176.4613 258 E 3.8388 7.4511 118.6266 58.0097 29.6995 177.6847 259 F 3.6812 7.5112 115.7595 58.9142 37.2159 174.7275 260 E 4.8066 7.4340 116.7606 54.4280 33.6116 175.8328 261 A 4.9729 8.6215 123.1429 50.8938 21.7623 176.1040 262 V 4.6660 8.9335 121.7525 61.5612 33.3992 174.5531 263 L 4.9799 9.4158 128.5791 53.0634 44.5264 175.8105 264 V 4.6033 8.6476 124.0005 61.7188 32.8576 174.6245 265 V 4.6930 9.0384 130.1948 60.0695 33.5168 173.4771 266 P 5.3695 0.0000 0.0000 62.3350 31.9003 177.0652 267 Q 4.0316 9.1361 123.0705 59.9817 28.7275 179.2103 268 E 3.8723 8.2469 112.2786 59.2780 29.7961 180.6889 269 G 4.0902 7.9056 102.4797 44.5924 0.0000 175.2839 270 A 3.9172 7.8281 125.6923 54.7710 18.3336 180.6138 271 A 3.9377 7.9361 118.7329 55.0815 18.4496 179.5581 272 A 3.8494 7.8444 118.7810 55.3574 18.5999 179.5518 273 V 3.4808 7.9390 117.1170 66.4639 31.3853 178.0826 274 E 3.9258 7.9790 117.2702 59.1863 29.2232 179.2733 275 A 3.9364 7.8131 120.6236 55.2098 18.4879 179.2502 276 R 3.8034 8.8393 118.1523 59.7397 30.0638 178.1918 277 A 3.9796 8.4072 120.5622 55.1732 18.2634 179.3934 278 K 3.8280 8.2807 117.7530 59.8285 32.0820 178.8901 279 A 4.0567 8.5591 119.8114 54.3091 18.2713 178.7232 280 K 4.4685 7.8690 114.6147 55.4644 32.4865 176.6686 281 G 3.7976 7.6830 106.8995 46.4996 0.0000 173.5968 282 L 4.5600 8.1292 122.9506 52.3167 43.1414 174.4610 283 P 4.5278 0.0000 0.0000 62.9547 32.4278 175.2412 284 L 5.4513 8.6166 125.1713 53.4021 45.6288 175.0803 285 F 4.7863 9.3592 127.2989 56.3219 42.6732 173.3966 286 R 3.2424 8.0479 126.9417 56.0012 29.7677 175.2342 287 A 4.6161 7.9486 129.2355 52.0020 20.7423 175.7291 288 G 4.6194 7.4480 107.7217 47.2266 0.0000 174.7018 289 R 5.0525 7.9640 125.0410 56.0962 34.0571 171.4546 290 V 4.6671 8.7827 118.3021 63.0340 33.4845 175.2110 291 V 4.8755 8.6178 118.9042 59.2244 36.4583 174.7119 292 A 4.2585 8.4611 123.4474 52.3377 18.8139 177.8620 293 G 4.0121 9.9293 103.8830 43.9183 0.0000 172.7072 294 E 4.7472 7.9000 121.7122 55.7095 32.6556 175.5501 295 G 3.8088 8.8518 103.0020 45.3566 0.0000 172.1192 296 V 4.3370 6.7027 117.3266 60.8020 34.6250 173.7814 297 Y 5.0672 9.1703 124.4811 56.0868 42.4382 174.4523 298 L 4.8177 9.4901 125.8676 53.0837 43.6622 176.5497 299 R 3.8205 9.7960 129.6944 57.1868 28.1235 176.8470 300 G 4.0877 8.4180 105.7798 45.4214 0.0000 173.8788 301 A 4.4643 7.6757 121.7271 50.5843 19.5092 174.7467 302 P 4.5737 0.0000 0.0000 62.7013 32.1678 175.8858 303 L 4.5919 8.4087 127.3587 52.8216 42.4920 174.3049 304 P 4.4361 0.0000 0.0000 62.6849 32.2074 176.8585 305 R 4.1693 8.0984 122.2540 56.4407 29.9144 175.8780 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 1 M 8.30 4.42 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 R 8.25 4.00 0.00 1.94 1.82 0.00 3.36 0.00 0.00 3.34 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 3 L 9.39 3.97 0.00 1.68 1.74 0.92 1.01 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 4 K 8.06 3.84 0.00 1.71 1.89 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.55 7.81 5 D 7.96 4.50 0.00 2.64 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 6 L 7.57 4.05 0.00 1.85 1.77 0.92 1.23 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 7 G 7.81 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 8 E 8.82 3.99 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 9 R 8.00 3.93 0.00 1.85 1.93 0.00 3.31 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.28 0.00 10 A 7.93 4.20 1.38 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 11 L 7.75 3.90 0.00 1.75 1.83 0.93 1.12 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 12 L 8.29 3.99 0.00 1.91 1.71 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.04 4.07 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 14 R 7.76 4.07 0.00 1.97 1.86 0.00 3.26 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 15 L 8.06 4.45 0.00 1.72 1.76 0.94 0.85 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 16 A 7.89 3.97 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 17 P 0.00 4.42 0.00 2.26 2.31 0.00 3.75 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 2.08 1.99 0.00 18 L 7.57 4.02 0.00 1.73 1.72 0.94 1.39 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 19 G 8.97 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 20 Y 7.84 4.06 0.00 3.13 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 21 P 0.00 4.37 0.00 2.09 1.87 0.00 2.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.58 0.00 22 P 0.00 4.38 0.00 2.25 2.28 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 23 E 7.99 4.70 0.00 1.98 1.78 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 2.12 1.83 0.00 24 A 7.48 4.74 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.39 0.00 1.56 0.49 0.00 3.68 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.32 0.00 26 L 7.26 4.78 0.00 1.51 1.59 0.97 1.02 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 27 P 0.00 4.62 0.00 2.14 2.09 0.00 3.92 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 1.97 1.99 0.00 28 P 0.00 3.14 0.00 1.82 1.66 0.00 3.61 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.58 0.00 29 G 8.40 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 0.00 0.00 0.00 30 D 7.39 4.70 0.00 2.84 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 31 D 9.57 4.44 0.00 2.69 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.38 4.59 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 33 G 8.54 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 34 G 7.52 4.50 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 0.00 0.00 0.00 0.00 35 V 7.87 4.65 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.97 0.00 0.00 36 W 8.78 5.09 0.00 3.22 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 9.65 4.56 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 38 E 10.19 3.95 0.00 2.15 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 2.26 2.31 0.00 39 G 8.49 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 40 R 8.28 4.97 0.00 1.97 1.64 0.00 3.29 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 41 A 8.33 4.25 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.99 4.39 0.00 3.31 3.22 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 0.00 43 L 8.76 5.18 0.00 1.51 1.54 0.83 0.04 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 44 L 8.88 5.37 0.00 1.80 1.50 1.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 45 K 9.12 4.94 0.00 1.95 1.64 0.00 1.58 0.00 0.00 1.90 0.00 0.00 3.29 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.54 7.81 46 T 8.66 5.13 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 47 D 9.40 5.09 0.00 2.60 2.66 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 48 G 8.39 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 0.00 0.00 0.00 0.00 49 F 7.98 4.88 0.00 3.11 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 50 L 8.21 4.74 0.00 1.85 1.74 1.06 0.72 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 51 Y 9.34 4.21 0.00 3.33 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 52 R 8.31 4.20 0.00 2.04 2.20 0.00 3.13 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 53 E 8.21 4.41 0.00 2.11 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 2.31 2.32 0.00 54 V 7.32 3.88 1.59 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 0.18 0.00 0.00 0.49 0.00 0.00 55 A 7.32 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.83 3.98 0.00 1.62 1.55 0.90 0.88 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 57 K 8.64 4.05 0.00 1.77 1.63 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.03 7.81 58 G 9.15 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 M 7.57 3.75 0.00 1.53 1.83 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.97 0.00 60 G 9.08 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.35 0.00 1.91 0.84 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.45 0.00 62 F 8.16 4.13 0.00 3.39 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.25 3.95 0.00 1.94 1.54 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 1.71 1.90 0.00 64 V 7.72 3.46 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 1.06 0.00 0.00 0.45 0.00 0.00 65 G 8.32 3.56 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 0.00 66 F 8.09 3.93 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 67 R 8.58 4.04 0.00 1.85 1.74 0.00 3.43 0.00 0.00 2.93 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 68 G 8.09 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 69 V 7.33 3.04 1.50 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 -0.11 0.00 0.00 0.51 0.00 0.00 70 A 7.57 3.65 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 71 A 7.79 2.58 0.74 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 0.00 0.00 72 T 7.75 4.09 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 73 A 8.32 4.25 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.16 4.13 0.00 4.15 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.04 4.57 0.00 2.89 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 76 L 7.91 4.12 0.00 1.95 1.71 0.98 0.42 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 77 L 8.72 4.26 0.00 1.87 1.74 0.97 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.05 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.46 4.50 0.00 1.95 1.80 0.00 1.95 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.67 1.49 7.81 80 M 8.02 3.34 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 81 G 7.91 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 82 R 8.40 4.46 0.00 1.80 1.78 0.00 3.03 0.00 0.00 3.12 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 83 P 0.00 4.60 0.00 2.03 1.96 0.00 3.67 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 84 L 8.60 4.59 0.00 1.47 1.74 0.81 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.42 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 9.06 5.57 0.00 2.88 2.90 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 87 T 9.07 5.12 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 1.08 0.00 0.00 88 L 8.73 5.14 0.00 1.61 1.52 0.90 0.58 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 89 G 8.78 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 90 L 8.68 5.17 0.00 1.42 1.49 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 91 F 9.01 5.15 0.00 2.98 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 92 L 9.16 5.09 0.00 1.50 1.51 0.93 1.02 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 93 P 0.00 5.15 0.00 2.08 1.91 0.00 3.76 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 2.01 2.01 0.00 94 E 8.74 4.00 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 95 D 7.85 4.72 0.00 2.61 2.68 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 96 L 7.42 3.97 0.00 1.59 1.52 -0.02 0.83 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 97 E 8.43 4.33 0.00 2.09 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 98 E 8.93 4.18 0.00 2.22 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 0.00 2.38 2.41 0.00 99 G 8.15 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 0.00 0.00 0.00 100 F 8.26 4.03 0.00 3.17 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 0.00 101 V 7.96 3.66 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.05 0.00 0.00 102 L 8.09 3.96 0.00 1.84 1.86 0.96 0.82 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 0.00 103 E 8.31 4.08 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 104 L 7.67 4.07 0.00 1.86 1.69 1.08 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.92 3.56 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 1.11 0.00 0.00 0.98 0.00 0.00 106 R 8.45 4.08 0.00 2.15 2.24 0.00 3.29 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 107 G 7.88 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.67 3.83 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 0.00 109 A 8.22 3.91 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 0.00 110 E 8.47 3.89 0.00 2.38 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 0.00 2.72 2.73 0.00 111 A 7.60 3.21 0.16 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 0.00 112 A 7.72 3.93 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 0.00 113 K 8.29 3.68 0.00 1.87 1.94 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.45 7.81 114 R 7.83 3.91 0.00 1.95 2.00 0.00 3.37 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.98 0.00 115 L 7.18 4.48 0.00 1.83 1.71 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 116 G 7.95 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.65 4.64 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 0.00 118 F 8.38 5.04 0.00 3.05 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 0.00 119 L 8.73 5.03 0.00 1.59 1.64 0.99 0.95 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 0.00 120 L 9.20 4.51 0.00 1.38 1.60 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.21 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 0.00 122 G 7.51 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 0.00 123 D 8.51 4.79 0.00 2.64 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 0.00 0.00 0.00 0.00 124 T 8.24 5.05 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 1.16 0.00 0.00 125 N 9.09 5.09 0.00 2.29 2.75 0.00 0.00 7.06 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 0.00 126 R 8.67 4.58 0.00 1.59 1.72 0.00 3.28 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.21 0.00 127 G 8.62 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 8.48 3.87 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 0.84 0.00 0.00 0.92 0.00 0.00 129 E 7.66 4.81 0.00 1.98 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 130 V 8.41 4.10 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 1.21 0.00 0.00 0.65 0.00 0.00 131 A 9.11 5.29 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.81 5.20 0.00 1.67 1.19 0.85 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.70 4.86 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 1.25 0.00 0.00 134 V 9.16 4.63 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 1.04 0.00 0.00 0.86 0.00 0.00 135 S 9.00 5.41 0.00 3.78 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 0.00 136 G 9.13 4.44 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 0.00 0.00 0.00 137 Y 8.58 5.68 0.00 3.22 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 0.00 138 A 8.80 4.78 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.93 3.50 0.00 0.62 1.03 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.25 4.81 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 0.00 141 E 8.92 4.00 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.87 0.00 142 A 7.44 4.76 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 0.00 143 P 0.00 4.33 0.00 2.12 1.84 0.00 3.90 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.51 0.00 144 L 8.76 4.62 0.00 1.77 1.60 0.98 1.15 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 0.00 145 P 0.00 4.80 0.00 2.18 2.22 0.00 3.77 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 146 R 8.48 4.39 0.00 1.76 1.97 0.00 3.13 0.00 0.00 3.02 6.97 0.00 0.00 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0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *172 Y 7.90 3.84 0.00 2.45 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.52 4.47 0.00 1.96 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 2.35 2.59 0.00 174 G 7.48 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 0.00 175 R 7.93 4.51 0.00 1.81 1.96 0.00 3.15 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 176 S 8.50 4.48 0.00 3.94 3.83 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 0.00 177 L 8.34 4.82 0.00 1.74 1.67 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.17 4.09 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 179 G 9.15 3.75 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 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 205 G 7.96 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 0.00 0.00 0.00 206 S 8.34 5.27 0.00 3.95 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 0.00 207 L 8.54 5.07 0.00 1.68 1.58 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 208 D 9.05 4.89 0.00 2.79 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 0.00 209 S 9.49 4.83 0.00 4.18 4.06 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 0.00 210 S 8.47 3.77 0.00 2.97 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 0.00 211 D 8.04 4.89 0.00 2.63 2.66 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 0.00 212 G 8.17 4.08 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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4.67 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 0.94 0.00 0.00 1.01 0.00 0.00 263 L 9.42 4.98 0.00 1.68 1.58 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 264 V 8.65 4.60 2.30 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 0.94 0.00 0.00 0.95 0.00 0.00 265 V 9.04 4.69 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 0.81 0.00 0.00 0.71 0.00 0.00 266 P 0.00 5.37 0.00 2.26 2.18 0.00 3.93 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 267 Q 9.14 4.03 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.83 0.00 0.00 0.00 0.00 0.00 2.48 2.62 0.00 268 E 8.25 3.87 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.91 0.00 269 G 7.91 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 0.00 270 A 7.83 3.92 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 A 7.94 3.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 A 7.84 3.85 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 0.00 273 V 7.94 3.48 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.86 0.00 0.00 274 E 7.98 3.93 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.67 0.00 275 A 7.81 3.94 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 0.00 276 R 8.84 3.80 0.00 1.87 2.09 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 277 A 8.41 3.98 1.39 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 0.00 0.00 278 K 8.28 3.83 0.00 1.93 2.03 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.52 7.81 279 A 8.56 4.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 280 K 7.87 4.47 0.00 1.74 1.83 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.57 7.81 281 G 7.68 3.80 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 0.00 0.00 0.00 282 L 8.13 4.56 0.00 1.64 1.75 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 283 P 0.00 4.53 0.00 2.31 2.07 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 284 L 8.62 5.45 0.00 1.83 1.61 1.01 0.53 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 0.00 285 F 9.36 4.79 0.00 3.23 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 0.00 286 R 8.05 3.24 0.00 1.27 1.28 0.00 3.06 0.00 0.00 2.98 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.00 287 A 7.95 4.62 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 0.00 288 G 7.45 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 289 R 7.96 5.05 0.00 1.46 1.75 0.00 3.24 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.15 0.00 290 V 8.78 4.67 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 0.85 0.00 0.00 0.92 0.00 0.00 291 V 8.62 4.88 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 0.66 0.00 0.00 1.00 0.00 0.00 292 A 8.46 4.26 1.22 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 0.00 0.00 0.00 293 G 9.93 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 0.00 294 E 7.90 4.75 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 295 G 8.85 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 0.00 296 V 6.70 4.34 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 0.64 0.00 0.00 -0.82 0.00 0.00 297 Y 9.17 5.07 0.00 2.80 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 L 9.49 4.82 0.00 1.70 1.58 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 299 R 9.80 3.82 0.00 1.94 1.95 0.00 3.23 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.55 0.00 300 G 8.42 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 0.00 301 A 7.68 4.46 1.39 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 0.00 0.00 302 P 0.00 4.57 0.00 2.02 2.05 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 303 L 8.41 4.59 0.00 1.64 1.71 0.85 0.99 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 0.00 304 P 0.00 4.44 0.00 2.05 1.97 0.00 3.93 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 305 R 8.10 4.17 0.00 0.67 1.07 0.00 2.64 0.00 0.00 2.86 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.45 0.00 * Residues marked with a * may have inaccurate shift predictions.