NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.2497 8.3349 115.4144 58.1211 64.2111 173.4415 3 F 4.6456 8.1271 118.2179 58.3713 39.7503 175.7838 4 I 4.0634 7.5663 120.6866 63.4803 38.7554 177.5674 5 K 3.3865 8.0438 121.4202 58.9496 32.1621 176.5836 6 P 4.2345 0.0000 0.0000 65.5299 31.5580 177.5987 7 I 4.4427 7.6084 109.8766 61.1186 37.9979 176.9235 8 Y 4.2102 8.2836 126.3946 61.4661 38.3134 178.6678 9 Q 3.7656 7.9398 121.4852 60.8348 28.3944 182.3559 10 D 4.4908 8.2720 119.9947 57.4528 40.9320 179.0392 11 I 2.4870 7.4699 118.9131 64.5127 37.1907 177.3041 12 N 3.9478 7.4520 117.2001 56.7902 38.3787 176.4408 13 S 4.1012 7.9083 115.2510 61.8633 62.9348 176.4753 14 I 3.8399 7.2883 115.7440 63.1706 37.7123 177.8126 15 L 4.1902 7.6609 120.4093 56.4566 41.4346 177.7108 16 I 4.0059 6.8375 119.8821 62.5636 37.2839 176.3627 17 G 4.0388 8.7212 116.9153 45.9111 0.0000 174.3839 18 Q 4.3095 8.1978 121.2369 54.8327 28.9495 181.1166 19 K 5.8083 8.4466 124.9267 52.0819 34.9852 175.9765 *35 E 3.7286 8.6501 123.7384 54.9437 30.7738 174.2355 36 P 4.6501 0.0000 0.0000 61.9196 29.6463 177.8800 37 F 4.6627 8.4162 125.5092 58.1910 40.8216 177.3987 38 E 4.2570 8.6377 120.1949 61.7386 29.1449 184.4725 39 K 4.2948 8.0733 122.0076 60.0849 31.9223 183.3303 40 L 4.2175 7.9967 119.3544 57.9335 41.7633 179.4908 41 V 3.6536 7.8167 117.3185 66.5855 31.3279 177.1086 42 Y 4.2920 8.1594 120.7249 62.2645 38.5395 178.3053 43 K 3.7050 8.6929 123.4077 59.8171 31.6898 180.1808 44 F 4.1048 8.5129 119.4184 61.4333 39.2765 178.3233 45 L 3.9676 7.9762 117.9178 57.6059 41.2530 179.7030 46 K 3.8573 8.0085 121.0647 60.0570 31.7963 179.9420 47 E 3.9724 8.1822 116.9934 60.0279 29.5994 179.4759 48 N 4.9705 7.4382 111.8569 53.1345 40.9639 174.6394 49 L 4.6706 8.4516 123.8497 59.0059 42.9688 181.5464 50 S 4.0236 7.2568 114.8945 62.9869 63.3009 178.3467 51 D 4.9438 7.6074 118.7670 53.0642 40.0260 176.9636 52 L 4.7427 8.4928 119.9669 55.5199 45.1480 176.5220 53 T 4.8921 7.4835 115.3404 62.1697 69.6459 174.4507 54 F 5.1314 9.4641 124.5527 55.4944 43.9245 174.8009 55 K 4.4458 8.7823 121.8496 56.0249 32.3380 177.9141 56 Q 4.0010 8.9928 123.0900 59.9040 28.6308 179.1197 57 Y 4.2667 7.9269 117.9138 59.9860 38.2736 177.3071 58 E 3.8912 6.9378 120.0580 59.4994 29.5243 178.3374 59 Y 3.3891 8.0862 119.1744 60.8892 38.5948 178.5213 60 L 3.4747 7.5720 118.3828 57.4074 41.7101 178.8363 61 N 4.4472 8.5500 116.8017 56.5599 38.5074 176.6837 62 D 4.3039 8.1056 119.9952 57.7074 40.8244 179.1785 63 L 3.4594 7.0210 118.7619 57.5379 41.8754 178.2307 64 F 4.5201 6.7983 115.8130 59.2368 38.8992 177.6917 65 M 4.6597 8.4930 119.0545 57.9254 31.4977 177.6645 66 K 4.5648 7.9015 116.8141 55.9253 33.9285 177.7621 67 N 5.0734 7.8457 114.6898 51.4003 39.8540 174.0615 68 P 4.3533 0.0000 0.0000 65.6269 32.1357 178.3481 69 A 4.0748 8.0624 120.3034 55.0756 18.4103 177.2172 70 I 4.0513 7.2147 107.5869 60.1907 38.4930 175.2658 71 I 4.4461 7.6965 116.5039 59.8345 41.0821 175.2455 72 G 4.2431 8.4480 105.9735 43.9068 0.0000 174.5742 73 H 3.8298 9.8279 116.0162 58.6287 28.5235 177.1778 74 E 3.9870 7.6999 119.5464 59.2031 29.4786 178.8281 75 A 4.1617 7.8830 119.4028 55.6459 18.5066 179.7200 76 R 3.8021 7.6618 115.6985 59.6633 29.6219 178.9258 77 Y 4.9033 8.7423 116.7847 60.9966 37.6037 178.4200 78 K 3.9540 8.2834 119.6946 58.6406 32.3173 178.4768 79 L 4.1825 7.9789 119.1281 55.9507 41.8429 178.9437 80 F 4.2041 8.1549 115.4582 58.1638 37.7305 178.1833 *82 S 4.2009 9.0255 128.0055 57.9171 62.4406 170.7272 83 P 4.4020 0.0000 0.0000 65.1498 31.0983 178.0750 84 T 3.8671 7.4224 114.5211 66.3440 68.4975 177.0268 85 L 3.5448 7.3893 121.0247 57.3598 41.5536 178.5784 86 L 2.7063 8.0947 120.4355 58.0773 41.5820 178.5562 87 F 3.9435 7.7614 120.0209 61.6396 39.4238 177.2233 88 L 3.7181 7.2636 115.9004 56.2287 41.4901 177.7672 89 L 4.4315 7.1317 116.8765 55.0651 44.1350 177.3640 90 S 4.3691 7.7543 112.2890 58.5136 63.3102 174.2238 91 R 4.2273 8.7668 118.7145 55.6438 30.7688 177.3765 92 G 4.3967 8.4654 105.3764 45.8452 0.0000 173.9091 93 K 3.5653 8.5620 119.7230 59.8871 31.8652 178.8752 94 A 4.0210 8.0094 119.3180 55.5709 18.2780 179.1205 95 A 4.1238 8.1583 116.9708 55.9206 18.7055 179.6459 96 T 4.3362 8.2566 113.8662 67.0118 68.7117 176.6086 97 E 3.9286 8.8796 121.5823 59.1866 29.4090 177.8467 98 N 4.6648 8.3383 113.9969 53.4719 39.1362 175.3130 99 W 4.0854 7.8490 129.4039 57.5048 31.5245 174.7795 100 S 3.7007 6.7561 119.5956 57.8034 65.5141 176.7498 101 I 3.2059 7.9247 120.3579 63.3911 35.0267 174.8624 102 E 4.3678 7.2838 112.7210 55.9066 30.2291 178.4102 103 N 4.8195 7.2956 117.0221 52.6510 39.0343 172.8494 104 L 4.4344 7.4915 120.6281 52.4681 43.6246 176.9368 105 F 4.6950 8.4181 123.0118 59.0153 39.4746 175.2361 106 E 4.3606 8.3025 117.5328 53.4929 33.6380 175.5040 107 E 3.6258 8.0707 118.3931 58.7404 30.0424 177.1317 108 K 4.5464 8.4415 128.5619 53.0745 35.1614 174.9819 109 Q 4.0836 8.9416 122.9461 57.1697 28.0198 174.1263 110 N 4.5780 7.9273 113.2195 54.7088 39.4338 174.7618 111 D 4.4263 7.7146 118.3322 54.9064 41.5446 176.1471 112 T 3.8384 8.6293 120.8878 66.2927 68.5474 174.1089 113 A 4.7369 8.4397 121.8383 50.6058 21.5282 176.0873 114 D 4.7213 8.6414 119.2196 56.2337 42.0171 177.2239 115 I 4.9159 7.9970 118.5002 59.4307 41.1078 174.3578 116 L 5.2473 9.5714 126.8765 53.1408 44.6270 175.8107 117 L 6.0483 9.0465 121.4756 52.2911 45.3872 175.7174 118 V 5.5394 8.7976 125.7868 59.3302 34.0240 176.0468 119 K 4.3490 8.4091 127.7417 54.2986 35.2418 173.3520 120 D 4.3734 9.5282 124.9192 54.4072 36.9918 171.0502 121 Q 3.6380 8.2068 112.0926 56.6795 25.9895 175.1763 122 F 5.3409 8.0918 120.2999 57.3499 42.8635 172.9869 123 Y 4.7973 8.6272 123.6558 56.0781 41.0915 174.4025 124 E 4.6729 9.1331 125.4433 54.3743 31.5164 174.7758 125 L 4.4457 8.8720 129.0951 54.1181 42.8009 175.7791 126 L 4.9840 9.0068 127.3628 53.0967 44.9204 174.5778 127 D 5.0723 8.4795 125.0078 52.3615 43.9845 174.5118 128 V 4.5339 8.4727 127.4724 62.4217 32.5059 175.1939 129 K 4.7436 8.9417 128.4169 55.1423 33.7479 175.7701 130 T 5.0843 8.6310 115.6433 60.8008 71.0261 174.5310 131 R 4.4439 8.7575 123.3651 54.9325 33.6538 173.4522 132 N 3.1400 8.4961 125.8992 52.9333 38.2818 174.3797 133 I 3.6572 8.2144 128.0997 62.2135 38.5457 176.2820 134 S 4.6379 7.1996 119.7248 56.4981 62.1357 172.5426 135 K 4.5894 6.9058 124.9710 53.4281 40.3500 176.8094 136 S 4.5116 7.2999 111.7886 57.8227 65.4275 175.7137 137 A 4.3772 8.3057 124.1884 51.5790 18.0503 179.4196 138 F 4.4564 7.9673 123.9732 57.3582 38.9912 174.1051 139 A 3.7921 8.7605 129.4782 52.2294 18.7964 175.2321 140 P 4.5254 0.0000 0.0000 61.1382 34.2532 174.7345 141 N 4.5503 8.4129 117.6499 54.1360 38.3767 174.9057 142 I 3.8099 8.9490 126.1667 62.1295 37.9960 175.8755 143 I 4.2349 7.1353 118.8315 59.6758 41.5396 172.9620 144 S 4.3217 8.7526 122.6565 59.0038 62.8251 175.1421 145 A 4.2830 9.1555 131.2024 54.3518 18.0507 178.9951 146 Y 4.1005 8.0309 118.1892 60.4147 39.0884 177.0855 147 K 3.8302 8.4434 121.0475 59.4491 32.2806 178.2768 148 L 3.8926 7.9507 120.2292 58.1076 41.8777 178.7308 149 A 4.0479 7.6730 120.0481 55.3142 18.1283 179.3158 150 Q 3.6187 7.5968 116.3265 59.5476 28.7034 179.0722 151 T 3.8188 7.9063 116.2645 67.3215 68.7243 175.9000 152 C 4.0868 8.7485 118.0878 63.0678 28.1902 176.2453 153 A 4.0090 8.1615 122.0776 55.2349 17.9027 179.8903 154 K 3.7940 8.1646 117.1650 59.7294 32.0735 179.3505 155 M 3.7886 8.3123 119.3891 58.5799 31.8393 178.8093 156 I 3.7635 7.5847 119.3324 64.3721 37.1925 177.8499 157 D 4.5158 8.0336 119.2907 57.2893 40.7683 178.3438 158 N 4.7364 7.8180 113.6921 51.9439 39.2853 175.1908 159 K 3.8702 7.8964 118.8670 57.4935 30.2763 175.3907 160 E 4.4080 7.4918 119.2202 54.8897 29.1888 175.3778 161 F 4.5292 8.7165 124.7005 58.2901 40.5310 176.9362 162 D 5.0284 7.8101 118.3110 51.2263 40.3189 179.4554 163 L 5.1810 7.7330 123.7700 55.8729 46.1542 176.0706 164 F 5.2501 7.3663 109.9951 56.3536 40.5261 173.4003 165 D 5.0886 8.4105 118.8310 52.7253 45.4270 175.0803 166 I 4.6349 8.3805 121.7438 59.9827 39.0293 174.2897 167 N 5.1903 8.7174 124.6351 51.4828 41.8721 173.6586 168 Y 5.1582 8.5375 117.9185 56.1281 42.2950 174.7919 169 L 5.2575 8.9624 124.1782 53.3244 44.9868 175.1485 170 E 4.7221 8.9694 128.2547 56.1520 31.5327 175.9207 171 V 4.4360 9.2371 125.3172 61.2440 33.9305 173.8598 172 D 5.1221 8.8745 128.2193 53.8210 42.3788 175.5710 173 W 5.6574 8.5860 118.1676 55.6127 32.3489 172.9139 174 E 4.9120 10.0332 122.9309 55.0212 33.1658 175.3442 175 L 5.1311 8.4079 123.1453 54.6011 41.6853 178.5157 176 N 4.6333 8.0019 120.2915 52.2627 36.9826 174.0596 177 G 4.0509 8.0498 112.3230 43.7692 0.0000 171.9698 178 E 4.4141 8.5449 118.3486 56.6629 29.3458 172.0703 179 D 4.7307 7.7764 120.3157 53.8095 44.2158 178.2789 180 L 5.1087 8.5004 120.1585 55.8992 42.9381 172.9033 181 V 5.0318 9.3306 124.3294 58.9060 34.3195 171.3969 182 C 4.6547 9.0668 125.8456 58.9739 31.8944 174.0084 183 V 4.2152 8.2388 126.1419 64.3839 32.9900 175.1004 184 S 4.7544 7.5656 112.9762 58.1230 65.9459 173.9650 185 T 5.2092 8.3057 109.5672 61.1053 72.3341 172.3540 186 S 4.8495 8.9008 116.1985 58.7850 68.2147 173.5841 187 F 5.3561 8.2419 122.0220 57.2660 42.0389 172.9292 188 A 4.5324 8.1915 126.1618 50.3858 23.4510 174.3331 189 E 4.6040 9.7405 119.7486 54.2805 31.7021 177.0709 190 L 3.7586 8.5785 127.4838 58.2347 42.1193 178.3203 191 F 3.5871 7.5924 115.7880 57.9364 38.9852 176.5377 192 K 4.7688 8.2933 122.3603 54.1723 32.2925 180.3941 193 S 5.5346 7.7540 112.6834 56.7525 64.7777 173.7758 194 E 4.0171 8.7707 123.3780 55.6386 29.5556 175.1367 195 P 3.8150 0.0000 0.0000 65.5531 31.5042 178.5676 196 S 3.6211 7.7186 111.8908 60.1481 62.8480 174.6654 197 E 4.4106 7.4732 119.0623 57.0188 30.3667 176.4412 198 L 4.3306 8.2517 119.8499 54.8671 42.5620 176.1088 199 Y 4.4198 8.8310 124.5567 56.9545 40.3386 173.9194 200 I 4.1739 7.5280 127.8944 59.6109 38.2810 175.5426 201 N 4.4976 8.5726 127.9844 51.5787 37.8298 174.5344 202 W 4.3319 8.6563 124.8140 59.4842 29.5809 178.8169 203 A 4.0283 8.3465 119.2265 55.0732 18.9229 178.1244 204 A 4.2247 8.3027 120.3133 51.6811 16.9258 177.3394 205 A 3.7880 8.0961 117.4194 53.0100 16.7537 177.9047 206 M 3.0776 8.1276 115.4469 57.8692 30.5139 176.6959 207 Q 4.5948 7.6270 117.1258 55.4574 30.2982 175.7209 208 I 4.3225 8.5776 124.8563 61.4928 38.3445 174.9950 209 Q 5.3041 8.7489 125.6625 53.1525 31.2942 174.8127 210 F 4.7557 7.7984 116.3837 56.7355 40.7271 172.8868 211 H 4.8116 8.5904 117.0352 54.7898 29.8274 176.7060 212 V 3.6287 8.9258 123.6465 66.4007 30.9652 178.4182 213 R 4.0224 8.3609 114.5541 58.4689 29.4606 177.5231 214 D 4.7615 7.7076 117.3347 52.8960 41.4617 176.1828 215 L 3.6327 6.8010 122.8206 54.3346 42.5337 176.1076 216 D 4.4373 8.5777 125.9013 54.9669 41.6129 176.2220 217 Q 5.1624 7.8648 124.0349 54.5556 31.2426 177.0296 218 G 3.2414 9.4574 109.1927 46.1374 0.0000 176.8643 219 F 3.5001 9.1173 121.2752 59.5090 38.0406 174.0447 220 N 4.8494 7.9794 129.7641 52.4794 37.6894 174.0938 221 G 3.7803 5.9006 109.2286 44.9744 0.0000 173.0348 222 T 4.5632 8.7034 109.1135 59.8944 70.5492 175.6386 223 R 3.8718 8.7828 123.5702 59.9899 30.0028 178.2300 224 E 4.1442 7.9535 118.2513 59.3623 29.6565 178.4220 225 E 4.0720 8.5335 119.0207 59.2904 29.6021 178.9368 226 W 3.8545 8.7675 127.6592 60.5038 30.4990 177.7283 227 A 4.5419 8.3283 122.9926 56.0161 17.4749 180.3590 228 K 4.1492 8.2633 121.3497 59.0520 31.7824 181.0193 229 S 4.3683 8.0990 112.1846 61.8359 62.0159 175.3405 230 Y 3.8314 8.2975 122.5504 60.6346 38.4176 178.0746 231 L 3.9707 8.2371 119.9891 57.7432 41.7685 179.4510 232 K 3.9206 7.7518 118.5382 59.5419 32.0250 178.4118 233 H 4.1255 8.0209 118.5942 59.2869 29.8301 176.4967 234 F 3.9154 8.0220 122.6771 61.6223 39.0982 177.0506 235 V 3.5038 8.2362 117.4693 66.5118 31.3442 178.2567 236 T 3.8336 7.9335 115.1200 66.8181 68.2711 176.7594 237 Q 4.0357 8.5069 120.1674 58.8495 28.6218 178.4400 238 A 2.9631 8.5672 122.1415 54.8706 18.1237 179.6542 239 E 3.7606 7.8482 116.9614 59.4006 29.5903 179.2405 240 Q 3.8962 7.8701 118.1128 59.0998 28.7640 179.0747 241 R 3.6686 7.7220 119.2168 59.2314 29.6828 178.2675 242 A 3.8131 7.1144 119.2437 55.1622 18.6533 179.4165 243 I 3.7440 7.4134 117.8989 64.7070 37.1824 178.7784 244 S 4.0647 8.4147 116.3147 61.9245 62.5659 176.7110 245 M 4.1535 8.2393 121.4952 58.3557 31.5894 178.9086 246 I 3.7077 7.5696 119.8400 64.5825 37.1104 178.3084 247 D 4.2519 7.8117 117.8284 57.0223 40.8250 178.1615 248 K 3.9021 7.9947 119.4003 58.2004 32.3783 177.8767 249 F 5.3121 8.1354 114.4956 57.2682 40.1249 175.8209 250 V 4.3787 7.5285 115.6904 64.4068 33.1299 176.7767 251 K 3.8376 8.2016 119.6264 59.1907 32.0522 176.6505 252 P 4.2237 0.0000 0.0000 63.7895 31.4929 176.4948 253 F 5.1419 8.3041 118.2360 57.4029 41.1327 177.7830 254 K 4.1474 7.9209 122.7898 57.2828 31.5310 184.2063 255 K 4.2311 8.1813 114.7242 58.5908 32.7434 176.8236 256 Y 4.4005 8.0990 119.4643 59.8702 39.7043 176.4167 257 I 3.9754 7.4049 120.5729 60.4571 35.4723 177.7736 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.33 4.25 0.00 4.26 4.08 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 3 F 8.13 4.65 0.00 3.24 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 4 I 7.57 4.06 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.43 0.27 0.00 0.00 5 K 8.04 3.39 0.00 1.79 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.49 7.81 6 P 0.00 4.23 0.00 2.12 2.17 0.00 3.64 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 2.12 2.16 0.00 7 I 7.61 4.44 2.17 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.79 0.96 0.00 0.00 8 Y 8.28 4.21 0.00 2.82 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.94 3.77 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.02 0.00 10 D 8.27 4.49 0.00 2.96 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 11 I 7.47 2.49 1.64 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.23 0.78 0.00 0.00 12 N 7.45 3.95 0.00 2.13 2.60 0.00 0.00 7.04 7.59 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 13 S 7.91 4.10 0.00 3.98 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 14 I 7.29 3.84 1.90 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.32 0.99 0.00 0.00 15 L 7.66 4.19 0.00 1.92 1.75 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 I 6.84 4.01 1.86 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 1.21 0.61 0.98 0.00 0.00 17 G 8.72 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 18 Q 8.20 4.31 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 19 K 8.45 5.81 0.00 1.72 1.58 0.00 1.70 0.00 0.00 2.40 0.00 0.00 2.95 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.23 0.91 7.81 *35 E 8.65 3.73 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 36 P 0.00 4.65 0.00 2.08 1.91 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.61 0.00 37 F 8.42 4.66 0.00 3.04 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.64 4.26 0.00 1.97 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 2.32 1.97 0.00 39 K 8.07 4.29 0.00 1.75 1.82 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.10 7.81 40 L 8.00 4.22 0.00 2.00 1.89 0.70 0.83 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 41 V 7.82 3.65 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.15 0.00 0.00 42 Y 8.16 4.29 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 43 K 8.69 3.71 0.00 1.79 1.73 0.00 1.90 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.35 7.81 44 F 8.51 4.10 0.00 3.16 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.98 3.97 0.00 1.85 1.66 1.05 1.17 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 46 K 8.01 3.86 0.00 1.58 1.59 0.00 1.25 0.00 0.00 1.28 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.41 0.70 7.81 47 E 8.18 3.97 0.00 2.04 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 2.26 2.22 0.00 48 N 7.44 4.97 0.00 2.17 2.51 0.00 0.00 6.75 7.14 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 49 L 8.45 4.67 0.00 1.69 1.51 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.26 4.02 0.00 3.66 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 51 D 7.61 4.94 0.00 2.74 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 52 L 8.49 4.74 0.00 1.63 1.65 0.79 0.49 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 53 T 7.48 4.89 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 0.96 0.00 0.00 54 F 9.46 5.13 0.00 2.99 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 55 K 8.78 4.45 0.00 0.86 1.48 0.00 1.05 0.00 0.00 1.44 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.73 1.05 7.81 56 Q 8.99 4.00 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.93 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 57 Y 7.93 4.27 0.00 3.38 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 58 E 6.94 3.89 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.47 0.00 59 Y 8.09 3.39 0.00 2.89 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 60 L 7.57 3.47 0.00 2.14 1.74 0.81 0.69 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 61 N 8.55 4.45 0.00 3.03 3.14 0.00 0.00 6.97 8.63 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 62 D 8.11 4.30 0.00 2.41 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.02 3.46 0.00 0.57 0.71 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 64 F 6.80 4.52 0.00 1.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 M 8.49 4.66 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.08 3.13 0.00 66 K 7.90 4.56 0.00 1.95 1.78 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.45 1.34 7.81 67 N 7.85 5.07 0.00 2.72 2.68 0.00 0.00 7.02 7.91 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 68 P 0.00 4.35 0.00 2.06 2.17 0.00 3.72 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 2.06 2.30 0.00 69 A 8.06 4.07 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 70 I 7.21 4.05 1.84 0.00 0.00 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 1.34 0.66 0.90 0.00 0.00 71 I 7.70 4.45 1.84 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 1.30 0.97 0.96 0.00 0.00 72 G 8.45 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 0.00 0.00 0.00 0.00 73 H 9.83 3.83 0.00 2.59 3.45 0.00 5.51 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 7.70 3.99 0.00 2.13 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 0.00 2.33 1.99 0.00 75 A 7.88 4.16 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 76 R 7.66 3.80 0.00 1.73 1.54 0.00 2.80 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.51 0.00 77 Y 8.74 4.90 0.00 3.29 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 78 K 8.28 3.95 0.00 1.91 1.95 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.55 7.81 79 L 7.98 4.18 0.00 1.62 1.57 1.03 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.15 4.20 0.00 2.76 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *82 S 9.03 4.20 0.00 3.90 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 83 P 0.00 4.40 0.00 2.09 2.01 0.00 3.81 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 2.22 2.14 0.00 84 T 7.42 3.87 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 1.14 0.00 0.00 85 L 7.39 3.54 0.00 1.41 1.36 0.51 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.09 2.71 0.00 1.51 1.55 0.25 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.76 3.94 0.00 2.86 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.26 3.72 0.00 1.32 1.35 0.31 1.06 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 89 L 7.13 4.43 0.00 1.52 1.63 0.54 0.73 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 90 S 7.75 4.37 0.00 4.02 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 91 R 8.77 4.23 0.00 1.62 1.82 0.00 3.12 0.00 0.00 3.02 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 92 G 8.47 4.40 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 0.00 101 I 7.92 3.21 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.69 0.91 0.00 0.00 102 E 7.28 4.37 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.11 0.00 103 N 7.30 4.82 0.00 2.60 2.38 0.00 0.00 7.12 6.22 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 0.00 104 L 7.49 4.43 0.00 1.71 1.87 1.00 1.08 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 0.00 105 F 8.42 4.69 0.00 3.46 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 0.00 106 E 8.30 4.36 0.00 1.92 1.70 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 2.11 1.82 0.00 107 E 8.07 3.63 0.00 1.88 1.73 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 2.29 1.89 0.00 108 K 8.44 4.55 0.00 1.66 1.60 0.00 1.86 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 0.96 7.81 109 Q 8.94 4.08 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.03 0.00 0.00 0.00 0.00 0.00 2.29 1.94 0.00 110 N 7.93 4.58 0.00 2.62 2.80 0.00 0.00 7.00 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 7.71 4.43 0.00 2.81 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 0.00 112 T 8.63 3.84 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 113 A 8.44 4.74 1.17 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 0.00 0.00 114 D 8.64 4.72 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 0.00 115 I 8.00 4.92 1.99 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.88 1.14 0.00 0.00 116 L 9.57 5.25 0.00 1.79 1.68 0.86 -1.07 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 0.00 117 L 9.05 6.05 0.00 1.97 1.84 1.11 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.80 5.54 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.18 0.00 0.00 119 K 8.41 4.35 0.00 1.64 1.65 0.00 1.94 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 0.97 7.81 120 D 9.53 4.37 0.00 2.83 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 0.00 121 Q 8.21 3.64 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.18 1.89 0.00 122 F 8.09 5.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.63 4.80 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 E 9.13 4.67 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 125 L 8.87 4.45 0.00 1.74 1.49 0.84 0.43 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 0.00 126 L 9.01 4.98 0.00 1.76 1.71 1.13 0.94 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 0.00 127 D 8.48 5.07 0.00 2.42 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 0.00 0.00 0.00 0.00 128 V 8.47 4.53 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 0.93 0.00 0.00 1.06 0.00 0.00 129 K 8.94 4.74 0.00 1.84 1.78 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.30 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.46 7.81 130 T 8.63 5.08 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 131 R 8.76 4.44 0.00 1.92 1.88 0.00 3.14 0.00 0.00 3.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 132 N 8.50 3.14 0.00 2.10 2.39 0.00 0.00 7.19 7.94 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 0.00 133 I 8.21 3.66 1.69 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.71 0.86 0.00 0.00 134 S 7.20 4.64 0.00 3.72 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 0.00 135 K 6.91 4.59 0.00 1.72 1.57 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.25 0.96 7.81 136 S 7.30 4.51 0.00 3.88 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 0.00 137 A 8.31 4.38 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 0.00 138 F 7.97 4.46 0.00 2.98 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 0.00 139 A 8.76 3.79 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.53 0.00 2.04 2.14 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.95 0.00 141 N 8.41 4.55 0.00 2.54 2.94 0.00 0.00 6.84 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 8.95 3.81 1.36 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 -0.36 -0.01 0.00 0.00 143 I 7.14 4.23 1.93 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 1.20 1.34 0.87 0.00 0.00 144 S 8.75 4.32 0.00 3.92 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 0.00 145 A 9.16 4.28 1.44 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 0.00 146 Y 8.03 4.10 0.00 3.30 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 0.00 147 K 8.44 3.83 0.00 1.81 1.89 0.00 1.57 0.00 0.00 1.27 0.00 0.00 2.58 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.36 7.81 148 L 7.95 3.89 0.00 1.82 1.75 0.87 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 149 A 7.67 4.05 0.70 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 0.00 150 Q 7.60 3.62 0.00 2.01 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.64 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 151 T 7.91 3.82 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 1.39 0.00 0.00 152 C 8.75 4.09 0.00 3.26 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 0.00 153 A 8.16 4.01 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 0.00 154 K 8.16 3.79 0.00 1.78 1.71 0.00 1.17 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.20 1.38 7.81 155 M 8.31 3.79 0.00 1.59 2.13 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.64 0.00 156 I 7.58 3.76 2.06 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.75 1.00 0.00 0.00 157 D 8.03 4.52 0.00 2.63 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 0.00 158 N 7.82 4.74 0.00 2.78 2.80 0.00 0.00 7.32 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 0.00 159 K 7.90 3.87 0.00 1.82 2.07 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.70 1.48 7.81 160 E 7.49 4.41 0.00 2.03 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 2.16 2.14 0.00 161 F 8.72 4.53 0.00 3.00 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 0.00 162 D 7.81 5.03 0.00 2.63 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 7.73 5.18 0.00 1.84 1.89 1.16 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.37 5.25 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.41 5.09 0.00 2.59 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 I 8.38 4.63 1.51 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.31 0.68 0.00 0.00 167 N 8.72 5.19 0.00 2.65 2.43 0.00 0.00 6.55 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 0.00 168 Y 8.54 5.16 0.00 2.86 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 0.00 169 L 8.96 5.26 0.00 2.02 1.68 1.26 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 170 E 8.97 4.72 0.00 2.24 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 2.46 2.34 0.00 171 V 9.24 4.44 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 0.54 0.00 0.00 1.00 0.00 0.00 172 D 8.87 5.12 0.00 2.63 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 W 8.59 5.66 0.00 3.56 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 0.00 174 E 10.03 4.91 0.00 1.99 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 2.34 2.27 0.00 175 L 8.41 5.13 0.00 1.70 1.52 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 176 N 8.00 4.63 0.00 2.73 2.85 0.00 0.00 7.24 7.98 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 0.00 177 G 8.05 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 0.00 178 E 8.54 4.41 0.00 2.00 1.83 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 2.22 1.87 0.00 179 D 7.78 4.73 0.00 2.60 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.50 5.11 0.00 1.32 1.57 0.92 0.80 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 0.00 181 V 9.33 5.03 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 0.65 0.00 0.00 0.93 0.00 0.00 182 C 9.07 4.65 0.00 2.93 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 0.00 183 V 8.24 4.22 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 0.83 0.00 0.00 1.00 0.00 0.00 184 S 7.57 4.75 0.00 3.90 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 0.00 185 T 8.31 5.21 4.39 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 1.22 0.00 0.00 186 S 8.90 4.85 0.00 3.85 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 F 8.24 5.36 0.00 2.81 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 0.00 0.00 0.00 0.00 188 A 8.19 4.53 0.99 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 0.00 0.00 189 E 9.74 4.60 0.00 1.76 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.24 0.00 190 L 8.58 3.76 0.00 1.80 0.93 1.02 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 191 F 7.59 3.59 0.00 2.77 2.43 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 0.00 192 K 8.29 4.77 0.00 1.65 1.75 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 1.21 7.81 193 S 7.75 5.53 0.00 3.99 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 0.00 194 E 8.77 4.02 0.00 2.14 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 2.38 2.34 0.00 195 P 0.00 3.82 0.00 1.80 1.20 0.00 3.39 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.44 0.00 196 S 7.72 3.62 0.00 3.85 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 E 7.47 4.41 0.00 2.15 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 2.24 2.40 0.00 198 L 8.25 4.33 0.00 1.74 1.79 1.13 1.23 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 0.00 199 Y 8.83 4.42 0.00 3.15 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 0.00 200 I 7.53 4.17 1.23 0.00 0.00 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 1.07 0.57 -0.51 0.00 0.00 201 N 8.57 4.50 0.00 3.03 2.88 0.00 0.00 7.23 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 0.00 202 W 8.66 4.33 0.00 3.48 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 A 8.35 4.03 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 0.00 204 A 8.30 4.22 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 0.00 205 A 8.10 3.79 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 0.00 206 M 8.13 3.08 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.84 0.00 207 Q 7.63 4.59 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.95 7.00 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 208 I 8.58 4.32 1.82 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.90 0.91 0.00 0.00 209 Q 8.75 5.30 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 210 F 7.80 4.76 0.00 2.81 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 0.00 211 H 8.59 4.81 0.00 3.27 3.42 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.93 3.63 2.31 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 1.11 0.00 0.00 1.13 0.00 0.00 213 R 8.36 4.02 0.00 2.02 2.07 0.00 3.33 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 214 D 7.71 4.76 0.00 2.69 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 0.00 215 L 6.80 3.63 0.00 0.62 1.34 0.38 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.58 4.44 0.00 2.77 2.50 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 0.00 217 Q 7.86 5.16 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.15 0.00 218 G 9.46 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 0.00 0.00 0.00 219 F 9.12 3.50 0.00 3.20 3.46 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 0.00 220 N 7.98 4.85 0.00 2.69 2.75 0.00 0.00 6.10 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 G 5.90 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 0.00 222 T 8.70 4.56 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 0.00 223 R 8.78 3.87 0.00 1.90 2.08 0.00 2.21 0.00 0.00 2.78 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 224 E 7.95 4.14 0.00 1.16 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 0.00 2.28 2.39 0.00 225 E 8.53 4.07 0.00 2.53 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 226 W 8.77 3.85 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 0.00 227 A 8.33 4.54 1.64 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 0.00 228 K 8.26 4.15 0.00 1.82 1.83 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.31 7.81 229 S 8.10 4.37 0.00 3.98 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 0.00 230 Y 8.30 3.83 0.00 2.34 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 0.00 231 L 8.24 3.97 0.00 2.00 1.76 1.02 1.15 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 0.00 232 K 7.75 3.92 0.00 1.96 1.94 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 233 H 8.02 4.13 0.00 3.25 3.25 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 F 8.02 3.92 0.00 2.46 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 0.00 235 V 8.24 3.50 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 0.97 0.00 0.00 1.08 0.00 0.00 236 T 7.93 3.83 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 1.21 0.00 0.00 237 Q 8.51 4.04 0.00 2.24 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 238 A 8.57 2.96 0.94 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 0.00 239 E 7.85 3.76 0.00 2.15 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 240 Q 7.87 3.90 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 241 R 7.72 3.67 0.00 0.84 0.80 0.00 3.07 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.29 0.00 242 A 7.11 3.81 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 I 7.41 3.74 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.92 0.00 0.00 244 S 8.41 4.06 0.00 3.83 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 0.00 245 M 8.24 4.15 0.00 2.24 2.32 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.87 0.00 246 I 7.57 3.71 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.86 0.90 0.00 0.00 247 D 7.81 4.25 0.00 2.54 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 K 7.99 3.90 0.00 1.36 0.74 0.00 1.53 0.00 0.00 1.45 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.93 1.22 7.81 249 F 8.14 5.31 0.00 3.15 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 0.00 250 V 7.53 4.38 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 1.13 0.00 0.00 1.02 0.00 0.00 251 K 8.20 3.84 0.00 1.89 1.92 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.30 7.81 252 P 0.00 4.22 0.00 1.15 1.71 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 253 F 8.30 5.14 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 0.00 254 K 7.92 4.15 0.00 1.79 1.83 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.26 7.81 255 K 8.18 4.23 0.00 1.68 1.89 0.00 0.98 0.00 0.00 1.51 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 0.73 7.81 256 Y 8.10 4.40 0.00 3.18 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 0.00 257 I 7.40 3.98 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.62 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.