NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3283 8.2649 123.5837 51.6980 19.9418 176.7080 3 R 4.0014 8.3047 119.8894 55.2120 30.9840 174.9127 4 N 4.6379 8.8291 117.6529 54.1061 41.0533 173.3260 5 K 4.9267 9.5491 122.7084 54.7086 35.4863 174.6843 6 I 4.9870 8.9026 128.0592 59.4668 40.1593 174.1613 7 A 5.0768 9.1977 129.3278 50.1652 21.6605 175.3635 8 L 4.8455 9.1558 122.9757 53.2049 44.0982 176.2710 9 I 4.4594 8.7273 127.6332 63.1569 37.2610 174.6324 10 G 4.4481 8.6381 116.2910 45.5344 0.0000 173.1350 11 S 4.5625 9.5520 123.9709 57.9704 64.6250 175.9561 12 G 3.9787 7.7536 113.3136 44.8545 0.0000 174.8278 13 M 3.6429 8.3642 119.5600 58.4401 31.9719 178.5644 14 I 3.8809 7.6213 119.4026 64.2861 37.4753 178.2115 15 G 4.0341 7.6940 107.6482 47.2811 0.0000 175.6605 16 G 3.6297 8.2647 108.2573 47.7134 0.0000 176.0070 17 T 4.0439 7.7054 117.4956 66.2989 68.3701 176.7768 18 L 4.0091 8.3984 121.1511 57.7661 41.5877 179.4329 19 A 4.1434 8.0637 120.6124 55.4150 18.3181 179.1141 20 H 4.1743 8.4436 116.6771 59.5732 29.9273 177.3558 21 L 3.9041 8.2743 120.7461 57.8819 41.5051 179.5021 22 A 4.0795 8.5533 121.1423 54.8680 18.2930 179.8873 23 G 3.3763 8.4751 104.5175 48.0039 0.0000 175.7867 24 L 3.5343 7.2518 120.9645 56.7584 41.7473 179.0555 25 K 4.2233 7.9616 115.1920 55.2130 32.7734 176.3087 26 E 3.8287 7.8194 117.9347 57.4277 27.4519 175.7935 27 L 4.1289 7.7900 118.4202 56.0381 42.4751 178.5025 28 G 3.7756 7.4937 103.9048 44.6763 0.0000 172.0563 29 D 4.5411 8.1754 120.3027 54.1207 42.6263 175.9750 30 V 4.7361 8.2505 120.7863 61.0652 35.0784 174.2108 31 V 4.8373 8.8243 127.7929 61.1522 34.0282 174.0107 32 L 4.9076 9.1441 128.7478 53.5382 43.1934 175.3313 33 F 5.2545 9.1558 126.9628 56.7695 42.4559 173.5096 34 D 4.6323 7.1040 122.0414 53.3406 44.5644 176.0751 35 I 3.5658 8.1046 114.8055 62.5385 38.2792 176.3466 36 A 4.0716 8.1681 125.2987 51.5456 18.6756 177.0890 37 E 4.2587 7.8718 122.2952 56.7763 30.7608 175.9430 38 G 4.3250 9.0430 114.4218 46.7078 0.0000 175.8438 39 T 3.7828 7.8678 116.8044 65.9627 68.4031 174.7407 40 P 4.3082 0.0000 0.0000 65.7191 31.4737 178.4022 41 Q 4.0682 8.0189 117.6789 58.6659 28.6108 178.7925 42 G 3.5178 8.5128 107.0794 47.8159 0.0000 175.9608 43 K 4.0415 8.1134 121.7436 58.8939 31.9815 179.7034 44 G 3.6887 8.2839 106.0628 47.8211 0.0000 175.5804 45 L 3.9595 8.1116 123.2057 57.5423 41.8733 178.1838 46 D 4.2652 8.0724 117.4807 57.6491 41.4025 178.2951 47 I 3.6636 7.7389 119.7443 64.0962 37.0353 178.0649 48 A 3.8713 7.7213 121.6811 55.5027 18.0036 179.6597 49 E 3.9681 8.4364 115.7328 59.0473 29.8089 179.1599 50 S 4.3212 7.8934 114.1006 60.2518 63.3266 176.4877 51 S 2.8422 7.6724 118.6227 60.5255 62.3382 174.6423 52 P 4.1322 0.0000 0.0000 64.7673 31.0614 178.3819 53 V 3.6788 7.3131 116.7827 66.0692 31.6521 177.2795 54 D 4.6986 7.9736 115.4574 54.2862 41.2165 177.4946 55 G 3.9001 7.8427 107.7984 45.2981 0.0000 173.5826 56 F 4.4380 7.7559 114.3415 56.3621 38.6474 174.5537 57 D 4.8429 8.7855 123.8282 52.8788 41.4757 175.5112 58 A 4.9122 8.3487 124.9131 50.3562 22.5664 175.2910 59 K 4.3887 9.2992 121.2799 55.9090 33.6988 175.9809 60 F 5.1121 8.9795 123.0100 55.9749 41.6455 174.9335 61 T 4.6707 8.7740 119.3523 61.7331 72.1724 173.1149 62 G 4.5012 8.8489 112.8341 44.8111 0.0000 172.5979 63 A 4.8143 8.9612 123.8022 50.2341 22.7723 176.3745 64 N 4.7943 8.6548 114.7451 51.7431 39.8375 173.5628 65 D 5.2414 7.7016 118.5492 51.9600 43.7401 176.1052 66 Y 3.7777 8.8478 123.7857 60.9454 37.9206 178.5478 67 A 2.5800 8.2026 121.4918 54.2909 18.0650 179.3346 68 A 4.0139 7.6108 118.6984 54.4297 18.7173 178.7476 69 I 4.0712 7.5627 110.6117 59.9841 37.9992 175.3174 70 E 4.3754 7.3149 122.0515 58.3215 29.7042 176.9808 71 G 3.8826 9.0199 113.2250 45.6233 0.0000 173.3741 72 A 4.0419 7.8357 122.3612 52.8477 18.9256 178.2930 73 D 4.6999 9.0800 122.8247 56.6455 42.4230 176.8554 74 V 4.8797 7.7283 117.1518 60.9785 35.5197 174.2807 75 V 4.9145 8.9413 127.1684 61.1140 34.5207 173.9822 76 I 4.8729 8.7653 128.4296 59.4808 40.2435 174.4966 77 V 4.8191 9.0835 128.1353 61.6316 32.9232 175.6086 78 T 4.6102 9.0923 117.6518 60.9162 70.7525 173.8690 79 A 4.0148 8.2729 124.4298 52.0098 18.7705 177.6911 80 G 3.9058 7.6203 109.7055 45.9302 0.0000 171.4668 81 V 4.5012 8.4107 112.6274 58.4872 34.4217 174.4227 82 P 4.3620 0.0000 0.0000 62.9562 32.0367 177.3333 83 R 4.1468 8.4838 120.9243 56.5443 28.5328 178.1976 84 K 4.3020 8.5354 127.3837 55.0161 32.5933 174.9358 *90 D 4.7468 8.0104 118.7926 54.8098 42.5029 183.6910 91 D 4.3998 8.1048 120.0510 58.5509 39.8145 181.9441 92 L 4.1685 7.9293 121.7692 57.8134 42.1505 178.2673 93 L 4.0117 8.1176 120.0366 58.5267 41.4887 179.1576 94 G 3.6572 7.6886 104.7251 47.8445 0.0000 175.7343 95 I 3.8075 7.3745 121.4743 64.3449 37.1302 178.4098 96 N 4.4619 8.4342 117.2791 55.7842 38.3103 177.2980 97 L 4.1170 8.2570 124.6813 58.8297 42.2612 179.8918 98 K 3.9736 7.8029 122.3943 59.4743 31.5150 181.1774 99 V 3.7910 7.7373 118.6559 66.4708 31.4546 178.1668 100 M 4.0853 8.2862 118.5281 58.0568 31.7162 178.4199 101 E 2.8592 7.8583 119.6496 59.0121 29.8290 178.9147 102 Q 3.8550 7.7429 117.8223 58.8472 28.7584 178.9659 103 V 3.6825 7.5653 121.0003 65.3356 31.5387 177.9746 104 G 3.7275 8.5067 105.6277 48.1283 0.0000 175.4318 105 A 3.9665 7.9028 123.3810 54.5061 18.2713 180.0289 106 G 2.8081 7.2820 104.1664 47.4764 0.0000 176.2167 107 I 3.6461 7.6273 122.1963 63.9300 36.9393 178.0437 108 K 3.7240 7.7419 119.2512 59.5799 31.9869 178.2526 109 K 3.7968 7.6067 117.8636 59.3153 32.4254 177.5265 110 Y 4.6932 8.0938 115.3490 57.7679 40.2632 175.6596 111 A 5.1409 8.2013 122.5393 50.5059 19.0936 175.4957 112 P 4.3092 0.0000 0.0000 65.1742 32.1576 177.5845 113 E 4.4024 8.0707 116.4175 56.1137 29.6367 175.8574 114 A 4.4184 7.6368 121.5921 51.7127 19.5331 177.4964 115 F 4.5144 8.7154 123.7429 57.6799 40.7070 174.3813 116 V 4.5715 8.5445 126.6931 61.0618 33.8873 174.1755 117 I 4.6777 8.7384 128.7939 59.6433 39.8489 174.0265 118 C 4.7153 8.9464 128.6332 58.4126 32.6320 174.0045 119 I 4.3417 8.5907 124.9180 62.2738 39.9513 176.6641 120 T 3.7910 8.0238 117.5135 64.3131 68.7535 172.8515 121 N 4.9148 8.5048 123.1282 51.5825 40.0661 173.6837 122 P 4.3930 0.0000 0.0000 62.4653 32.3270 176.7650 123 L 4.3399 8.5732 126.4656 57.7630 41.7849 178.6141 124 D 4.3367 8.0193 116.6647 57.0511 41.0380 177.9692 125 A 4.2573 7.8498 120.6236 54.9268 18.9538 179.3165 126 M 4.1207 8.2323 117.5430 58.4339 31.9400 179.2994 127 V 3.4082 7.8860 119.3997 64.4442 31.4155 178.3105 128 W 3.5910 7.9181 128.2902 59.8630 30.6317 177.5635 129 A 3.2550 8.6167 121.1748 54.9399 17.7687 179.3460 130 L 3.9332 8.3550 119.1584 58.2730 42.1719 178.9100 131 Q 3.8408 8.0310 119.7626 58.9785 28.7184 178.5528 132 K 3.6627 7.0570 117.8268 59.3777 32.1509 178.8374 133 F 4.5455 7.2770 116.8817 60.9476 38.9902 177.8456 134 S 4.4172 8.1879 112.3983 59.3029 62.9611 175.6161 135 G 3.8849 7.7796 108.3069 45.2960 0.0000 173.7822 136 L 4.1766 7.3671 118.9193 53.4540 42.3739 175.3060 137 P 4.2753 0.0000 0.0000 62.7232 32.0369 177.5555 138 A 4.1201 8.8553 125.6342 55.5636 18.6079 179.0907 139 H 4.4286 8.3586 110.3017 57.6938 28.9476 176.2842 140 K 4.9471 8.2874 119.6198 56.1742 33.3796 175.6888 141 V 4.6702 8.0795 120.6186 61.2703 33.7205 175.0371 142 V 4.9560 8.8942 120.8569 59.6585 36.4385 174.6245 143 G 4.3739 8.8643 109.2583 44.7042 0.0000 172.4204 144 M 4.6461 8.7490 124.4499 55.1382 32.5772 174.3232 145 A 4.8418 8.9100 128.4101 52.5262 26.3000 177.8015 146 G 3.8800 8.4182 101.9464 48.3526 0.0000 175.6244 147 V 3.7489 7.7740 119.8470 65.3672 31.4899 177.8188 148 L 3.9513 7.8727 119.7156 58.2547 42.0534 178.4337 149 D 4.3823 8.0661 118.7350 57.5486 40.7401 178.6995 150 S 4.2032 8.6800 113.7466 61.3372 62.3399 176.1693 151 A 3.9636 8.1104 123.3363 55.1753 18.1305 179.5909 152 R 3.4956 8.1013 116.8442 59.3219 30.1834 178.8451 153 F 4.5111 8.2409 121.5987 61.0226 39.2899 177.3683 154 R 3.9061 8.2748 117.6366 59.2609 29.8059 178.4628 155 Y 4.0885 8.0124 119.2435 60.7875 38.7688 178.0469 156 F 4.2596 7.9328 118.7506 60.7169 39.0181 177.6905 157 L 3.8518 8.2566 118.7837 57.7514 41.4413 179.7659 158 S 4.2770 8.2804 114.4541 61.3214 62.6756 176.5458 159 E 3.8101 7.6716 121.4685 59.1018 29.2964 177.7996 160 E 3.8776 7.8514 118.4717 59.0509 29.5724 177.7624 161 F 4.6812 7.9302 114.2236 57.0553 40.0301 174.9576 162 N 4.1681 7.5737 118.2571 55.1001 37.4219 172.7935 163 V 4.5627 7.3281 108.7509 58.8979 35.8566 176.0602 164 S 4.2950 8.3740 115.3327 58.3569 63.0152 175.4243 165 V 3.7445 8.5857 119.7250 64.7133 31.4461 177.9940 166 E 4.2047 8.5254 117.7820 58.1886 29.5025 176.8864 167 D 4.8331 8.2014 118.3630 54.0174 42.2020 175.7525 168 V 4.8264 7.6971 119.4613 61.5271 33.4286 175.1750 169 T 4.8015 8.8315 123.1844 61.9280 72.3874 173.3555 170 V 4.6697 8.3855 117.1796 59.4604 36.1425 174.8641 171 F 4.6725 9.0638 125.5845 56.6661 41.3564 174.1291 172 V 4.8339 8.1915 126.0306 61.1390 33.7883 174.6574 173 L 4.6729 9.0265 127.3976 54.3134 44.6266 177.8616 174 G 3.6623 8.7945 108.4038 45.2500 0.0000 171.1780 175 G 4.5106 7.5514 109.8226 44.8215 0.0000 172.7312 176 H 4.7315 8.4755 117.2154 56.2867 30.9014 176.4654 177 G 4.0785 8.3974 109.0202 46.4856 0.0000 176.8371 178 D 4.4845 8.7984 123.2546 56.2757 40.8327 177.0297 179 S 4.3464 7.7161 112.3549 59.1697 63.6637 174.1963 180 M 4.4649 7.6886 122.1948 55.3845 32.8585 176.3757 181 V 4.5174 8.9247 125.9351 60.3169 32.4673 171.9237 182 P 5.0879 0.0000 0.0000 62.0664 33.0902 176.3116 183 L 4.6361 9.4559 122.7916 52.9621 42.9357 177.0338 184 A 4.1680 8.8096 128.7990 55.0485 18.6132 179.5310 185 R 4.1488 7.9377 110.4323 58.3105 29.7691 176.7278 186 Y 5.0026 7.8447 115.7441 57.7094 38.7192 175.0177 187 S 5.2028 7.9911 116.2935 57.1532 66.1611 173.3711 188 T 5.0784 9.1461 112.7256 60.4138 72.9216 172.6002 189 V 4.5890 8.3991 122.5331 61.3209 33.5967 175.4299 190 A 3.8712 9.9875 132.1143 53.0272 16.6113 177.8311 191 G 3.9032 8.5036 108.6064 46.6601 0.0000 174.4713 192 I 3.9854 7.5300 121.7573 59.6541 37.7802 174.0026 193 P 4.9282 0.0000 0.0000 61.9495 33.2201 177.1632 194 L 4.0116 8.4541 121.0977 58.0039 41.6434 178.5388 195 P 4.2779 0.0000 0.0000 65.5411 31.2439 178.4384 196 D 4.3284 7.9685 117.5362 57.2396 40.8312 178.5570 197 L 3.6616 7.7741 119.5575 57.2621 41.4839 179.7452 198 V 3.8425 8.0654 118.8332 66.0114 31.3000 178.0170 199 K 3.9332 7.7503 116.9218 59.9265 32.0616 178.6071 200 M 4.3740 8.0127 116.0285 55.7595 32.1360 177.3346 201 G 4.0672 8.1605 108.1209 45.7280 0.0000 175.7539 202 W 4.2025 8.5166 121.2249 59.4134 29.2354 175.5450 203 T 4.4807 7.3430 108.0376 60.5493 70.1246 172.1049 204 S 4.9215 8.1559 116.0252 56.2054 67.0056 174.5257 205 Q 3.9998 8.4567 122.3330 59.4319 28.8260 177.8242 206 D 4.3189 8.0736 119.4924 57.3632 40.9398 178.7933 207 K 3.9859 8.0665 118.9518 59.1804 32.0408 179.1984 208 L 4.0247 8.1504 120.7163 58.2796 42.0541 178.5714 209 D 4.4670 8.9660 121.7733 58.2268 40.7851 179.8620 210 K 4.0404 8.1065 123.9534 59.6191 31.6713 181.1210 211 I 3.8576 7.8688 120.4550 64.4590 37.0280 178.6070 212 I 3.2351 7.7720 120.6410 64.1952 36.8786 178.3346 213 Q 3.8969 8.0281 120.4798 59.1069 28.6741 178.0914 214 R 3.8310 8.1100 119.1683 59.7121 30.0637 178.3127 215 T 4.2461 8.1273 115.5402 66.7435 68.3284 176.7098 216 R 4.0521 8.1148 119.9688 58.9874 30.0911 177.8565 217 D 5.0130 7.8943 116.4553 54.1178 40.7704 178.5489 218 G 3.8433 7.9379 109.1839 47.9108 0.0000 176.4720 219 G 3.6125 8.0650 107.5748 47.5605 0.0000 175.5524 220 A 4.1075 7.9535 122.7376 54.4735 18.3019 179.1972 221 E 3.9053 8.1090 118.3630 59.4562 29.6211 179.0930 222 I 3.7999 7.6009 119.8731 64.1687 37.0999 178.4592 223 V 3.9977 7.3487 120.7022 65.5165 31.1399 178.3921 224 G 3.6010 8.1388 104.3298 47.4352 0.0000 175.3987 225 L 4.2385 7.3752 120.5968 57.6780 41.9748 179.0401 226 L 4.0914 8.1747 118.0189 55.5851 41.6229 178.5992 227 K 4.3081 8.2122 122.8897 57.7179 31.4267 177.1848 228 T 4.2531 7.7622 112.1670 64.8972 68.9610 174.2057 229 G 4.0486 7.5068 108.3743 45.0516 0.0000 171.3754 230 S 4.6763 8.3506 113.4767 55.4491 65.8043 173.1559 231 A 4.1123 8.5286 122.9223 52.9437 18.5015 177.4175 232 F 4.8437 7.9695 113.1610 56.9628 40.5162 177.0267 233 Y 3.9898 7.2263 118.5011 60.9906 37.7630 177.8828 234 A 4.0023 7.9265 121.1992 54.5851 18.5499 177.7460 235 P 4.2132 0.0000 0.0000 65.5300 31.4145 178.6699 236 A 3.9903 8.0809 119.3583 55.2481 18.3910 179.4439 237 A 3.9676 8.2213 119.3808 55.4359 18.3145 180.0980 238 S 4.0578 8.2435 113.2951 61.8060 62.9818 176.8008 239 A 4.0600 8.1008 123.4071 55.2606 18.0205 179.7727 240 I 3.7307 8.1128 118.5806 64.3914 37.1173 178.3505 241 Q 3.9866 8.2040 120.5416 59.4982 28.9711 178.3883 242 M 4.1472 8.0193 119.0696 58.3657 31.9579 178.4695 243 A 4.2439 8.2462 120.9363 55.4071 18.5809 179.3730 244 E 3.9225 8.5669 117.9724 59.4061 29.6358 178.8582 245 S 4.1118 8.2170 113.3571 61.4098 62.5011 175.5480 246 Y 3.8411 7.9352 121.7155 60.7850 38.4150 178.0251 247 L 4.0468 8.2835 118.8185 56.8397 41.7904 178.7003 248 K 4.3187 7.8999 115.6185 54.6757 33.0802 175.4844 249 D 4.2707 7.5526 117.7198 55.0217 40.1000 174.4037 250 K 4.0101 8.2721 119.9965 57.1309 32.6997 176.6333 251 K 3.9848 7.8984 116.1614 56.9874 30.0879 175.9314 252 R 4.0117 7.5956 116.8779 56.8767 31.3687 176.4201 253 V 4.5972 8.3256 122.8756 62.0651 32.2635 175.0129 254 L 4.9517 9.0025 128.8107 52.0820 45.5315 174.2440 255 P 4.9087 0.0000 0.0000 62.7329 32.0227 175.8534 256 V 4.6894 8.6256 117.0008 58.9374 36.8143 174.7286 257 A 4.8116 9.0573 124.8400 52.0068 19.1599 176.6975 258 A 4.9324 8.9964 123.8614 50.0039 23.3262 174.7545 259 Q 3.7840 7.8075 121.3016 55.6805 29.5705 175.5983 260 L 4.6014 8.8861 127.8151 53.4994 43.2770 177.1142 261 S 4.8010 9.1149 115.8307 56.1248 62.9241 173.1549 262 G 4.0774 9.0670 113.1221 46.9174 0.0000 173.5019 263 Q 4.2599 8.1088 118.7869 56.8323 29.4595 176.2810 264 Y 3.2164 9.6150 118.9886 58.6276 35.9810 171.1018 265 G 3.9598 8.3662 106.6897 45.5526 0.0000 173.7445 266 V 4.4873 8.0142 121.7667 61.2706 33.6917 175.4648 267 K 5.0387 7.9621 126.3956 53.8567 35.7083 173.1012 268 D 4.6061 8.3370 117.4592 55.1088 38.9382 173.7194 269 M 4.9351 7.5648 115.1205 54.8532 36.0032 172.7048 270 Y 4.8407 8.8946 123.0959 57.4380 39.2546 175.0843 271 V 4.4454 8.8683 123.6248 60.6612 35.9128 174.5614 272 G 4.0881 8.5390 113.7601 46.1222 0.0000 172.7215 273 V 5.0291 8.8074 118.8217 58.6895 36.8146 172.9980 274 P 4.9251 0.0000 0.0000 63.3094 32.4959 175.2331 275 T 5.1289 9.0722 112.2978 60.2205 73.0564 172.5584 276 V 4.6211 8.9823 123.4926 61.9182 33.4025 174.5054 277 I 4.7779 8.6341 129.3742 59.8891 39.1997 174.7115 278 G 4.0186 8.4637 117.5549 44.5767 0.0000 172.6701 279 A 3.4482 8.8180 123.1476 53.8949 18.4141 178.2778 280 N 4.9523 8.5488 113.0113 52.5994 40.1437 176.6234 281 G 3.5876 8.0056 108.5023 46.2959 0.0000 176.4395 282 V 3.7658 9.1059 128.7106 63.2448 30.6434 175.0791 283 E 4.4937 9.0322 128.5527 57.4678 31.1343 177.0572 284 R 4.5474 7.7272 119.0440 55.2976 33.6862 173.4646 285 I 4.6888 8.4135 127.3718 60.0184 38.8185 175.1341 286 I 4.2168 8.6778 128.9344 60.4223 37.6055 174.9581 287 E 4.6934 9.0785 127.8392 53.3218 31.0829 174.7401 288 I 4.4796 8.1518 118.6387 58.7480 40.5121 174.6376 289 D 4.5688 8.3983 120.6915 53.9034 41.4642 176.0536 290 L 4.7851 8.0607 122.4543 52.5765 44.2978 176.8257 291 D 4.6762 9.1257 125.8564 53.2651 41.5491 178.3762 292 K 3.9261 8.5240 124.0081 60.2404 31.5615 177.9426 293 D 4.5750 8.0577 119.7395 57.2276 40.7758 178.6124 294 E 4.0102 9.2137 119.4441 59.2646 29.4059 179.3230 295 K 3.9853 8.5743 119.9186 59.4704 32.2790 178.6860 296 A 4.0722 8.1984 121.0665 55.1936 18.3700 179.6837 297 Q 3.9225 8.2748 116.5359 59.0881 28.7889 178.6209 298 F 4.0675 8.6228 122.0246 61.5834 39.3727 176.9212 299 D 4.3699 8.7679 118.8892 57.1327 40.5827 178.6789 300 K 3.8898 8.0489 120.2495 59.3956 32.2027 178.9071 301 S 3.9376 7.8523 113.1555 61.3353 62.3508 176.1547 302 V 3.3186 7.5332 120.8121 65.9328 31.1695 177.7716 303 A 3.9835 8.0682 120.7307 55.1495 18.3013 179.7994 304 S 4.0204 8.0598 112.8605 61.3870 63.1148 176.9057 305 V 3.4161 7.8237 121.6508 65.6794 31.1840 177.7614 306 A 3.8484 8.3423 121.0519 55.0489 18.1486 179.7896 307 G 3.4749 8.1044 104.1745 47.8645 0.0000 175.6800 308 L 3.9284 7.6878 122.5152 58.0095 42.0981 178.9373 309 C 3.6590 7.7398 116.6851 62.4912 27.8434 175.8042 310 E 3.9270 8.2158 120.2507 59.4836 29.2126 179.3732 311 A 4.0694 8.0782 120.5421 55.2570 18.2997 179.5136 312 C 4.3154 8.0148 115.4046 62.8729 28.1207 176.2837 313 I 3.9259 8.0439 121.7583 64.4244 36.5296 178.5804 314 G 3.8580 7.9975 105.2767 47.5905 0.0000 174.9132 315 I 4.3531 7.2213 119.3055 61.6182 39.1067 175.8680 316 A 4.7195 8.3212 123.0010 48.8527 19.0118 174.1390 317 P 4.4725 0.0000 0.0000 64.3363 31.9382 179.0454 318 S 4.2398 8.1721 111.6251 60.9085 62.7707 175.4347 319 L 3.7768 8.0601 122.5563 56.9522 41.6528 177.7363 320 K 4.2514 7.8766 124.9325 54.8213 31.5180 181.9933 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 A 8.26 4.33 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 3 R 8.30 4.00 0.00 2.03 1.88 0.00 3.51 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 4 N 8.83 4.64 0.00 2.87 2.81 0.00 0.00 6.32 8.18 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 5 K 9.55 4.93 0.00 1.76 1.62 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.36 7.81 6 I 8.90 4.99 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.68 0.93 0.00 0.00 7 A 9.20 5.08 1.21 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 8 L 9.16 4.85 0.00 1.59 1.64 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.73 4.46 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.05 1.05 0.00 0.00 10 G 8.64 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 9.55 4.56 0.00 3.72 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 12 G 7.75 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 13 M 8.36 3.64 0.00 0.69 1.73 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 14 I 7.62 3.88 1.88 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 1.65 0.77 0.94 0.00 0.00 15 G 7.69 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 16 G 8.26 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 17 T 7.71 4.04 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 18 L 8.40 4.01 0.00 1.90 1.77 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.06 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.44 4.17 0.00 3.36 3.49 0.00 5.62 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 21 L 8.27 3.90 0.00 1.90 1.72 0.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.55 4.08 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 23 G 8.48 3.38 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 24 L 7.25 3.53 0.00 1.58 1.62 0.62 0.88 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 25 K 7.96 4.22 0.00 1.76 1.82 0.00 1.95 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.42 7.81 26 E 7.82 3.83 0.00 2.12 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 2.37 2.29 0.00 27 L 7.79 4.13 0.00 1.67 1.75 0.95 0.86 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 28 G 7.49 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 29 D 8.18 4.54 0.00 2.54 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 30 V 8.25 4.74 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 1.00 0.00 0.00 0.78 0.00 0.00 31 V 8.82 4.84 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 0.95 0.00 0.00 32 L 9.14 4.91 0.00 1.64 1.61 1.07 0.82 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 33 F 9.16 5.25 0.00 2.98 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 34 D 7.10 4.63 0.00 2.65 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.10 3.57 1.78 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 1.32 0.49 0.88 0.00 0.00 36 A 8.17 4.07 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.87 4.26 0.00 1.92 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 2.36 2.20 0.00 38 G 9.04 4.32 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 0.00 39 T 7.87 3.78 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 1.15 0.00 0.00 40 P 0.00 4.31 0.00 2.34 2.23 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.86 0.00 41 Q 8.02 4.07 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 42 G 8.51 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.11 4.04 0.00 1.82 1.86 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.61 7.81 44 G 8.28 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.11 3.96 0.00 1.87 1.79 0.92 1.00 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 46 D 8.07 4.27 0.00 2.80 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 47 I 7.74 3.66 1.28 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 1.30 0.38 0.29 0.00 0.00 48 A 7.72 3.87 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 0.00 0.00 49 E 8.44 3.97 0.00 2.08 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 2.38 0.00 50 S 7.89 4.32 0.00 4.09 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 51 S 7.67 2.84 0.00 3.17 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 52 P 0.00 4.13 0.00 1.97 2.09 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 53 V 7.31 3.68 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 0.84 0.00 0.00 0.93 0.00 0.00 54 D 7.97 4.70 0.00 2.98 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 55 G 7.84 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 0.00 0.00 0.00 56 F 7.76 4.44 0.00 3.16 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 57 D 8.79 4.84 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 58 A 8.35 4.91 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 59 K 9.30 4.39 0.00 1.66 1.74 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.42 7.81 60 F 8.98 5.11 0.00 2.98 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.77 4.67 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 1.22 0.00 0.00 62 G 8.85 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 63 A 8.96 4.81 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 64 N 8.65 4.79 0.00 2.63 2.58 0.00 0.00 7.01 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 65 D 7.70 5.24 0.00 2.63 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 66 Y 8.85 3.78 0.00 3.13 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 67 A 8.20 2.58 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.61 4.01 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 69 I 7.56 4.07 1.86 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 1.71 0.84 0.81 0.00 0.00 70 E 7.31 4.38 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 71 G 9.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.84 4.04 1.37 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 73 D 9.08 4.70 0.00 2.81 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 74 V 7.73 4.88 2.13 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 0.91 0.00 0.00 1.03 0.00 0.00 75 V 8.94 4.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.91 0.00 0.00 76 I 8.77 4.87 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.68 0.91 0.00 0.00 77 V 9.08 4.82 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 1.11 0.00 0.00 0.90 0.00 0.00 78 T 9.09 4.61 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 1.23 0.00 0.00 79 A 8.27 4.01 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 80 G 7.62 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 81 V 8.41 4.50 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 0.77 0.00 0.00 1.00 0.00 0.00 82 P 0.00 4.36 0.00 2.17 2.04 0.00 3.75 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 1.97 1.94 0.00 83 R 8.48 4.15 0.00 1.86 1.81 0.00 3.25 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.19 0.00 84 K 8.54 4.30 0.00 1.76 1.73 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 0.99 7.81 *90 D 8.01 4.75 0.00 2.62 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 91 D 8.10 4.40 0.00 2.68 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.93 4.17 0.00 1.75 1.70 1.02 0.51 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 93 L 8.12 4.01 0.00 1.80 1.90 0.95 1.03 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 94 G 7.69 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 95 I 7.37 3.81 1.88 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 1.53 1.11 0.92 0.00 0.00 96 N 8.43 4.46 0.00 2.76 2.89 0.00 0.00 6.71 6.35 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 97 L 8.26 4.12 0.00 2.08 1.88 1.15 0.55 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 98 K 7.80 3.97 0.00 1.85 1.80 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.31 7.81 99 V 7.74 3.79 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 1.12 0.00 0.00 1.01 0.00 0.00 100 M 8.29 4.09 0.00 2.22 2.41 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 2.70 2.95 0.00 101 E 7.86 2.86 0.00 1.38 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 1.81 1.47 0.00 102 Q 7.74 3.86 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 103 V 7.57 3.68 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 1.28 0.00 0.00 1.13 0.00 0.00 104 G 8.51 3.73 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 0.00 105 A 7.90 3.97 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 0.00 106 G 7.28 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 0.00 0.00 0.00 107 I 7.63 3.65 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.75 0.91 0.00 0.00 108 K 7.74 3.72 0.00 1.87 1.92 0.00 1.75 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.41 7.81 109 K 7.61 3.80 0.00 1.53 1.23 0.00 1.51 0.00 0.00 1.20 0.00 0.00 2.72 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.94 7.81 110 Y 8.09 4.69 0.00 3.14 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 0.00 111 A 8.20 5.14 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 0.00 112 P 0.00 4.31 0.00 2.18 2.32 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 113 E 8.07 4.40 0.00 2.02 2.07 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 2.29 2.27 0.00 114 A 7.64 4.42 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 0.00 115 F 8.72 4.51 0.00 1.76 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 0.00 0.00 0.00 116 V 8.54 4.57 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 0.85 0.00 0.00 0.87 0.00 0.00 117 I 8.74 4.68 1.74 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 0.85 -0.08 0.86 0.00 0.00 118 C 8.95 4.72 0.00 2.88 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 8.59 4.34 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.79 0.94 0.00 0.00 120 T 8.02 3.79 4.26 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 1.30 0.00 0.00 121 N 8.50 4.91 0.00 2.73 2.76 0.00 0.00 7.10 8.02 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 0.00 122 P 0.00 4.39 0.00 2.26 2.21 0.00 3.74 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 2.08 2.02 0.00 123 L 8.57 4.34 0.00 1.71 1.70 0.90 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.02 4.34 0.00 2.64 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 0.00 125 A 7.85 4.26 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 0.00 126 M 8.23 4.12 0.00 2.07 2.29 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.91 0.00 127 V 7.89 3.41 1.95 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 0.66 0.00 0.00 0.53 0.00 0.00 128 W 7.92 3.59 0.00 3.32 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 0.00 129 A 8.62 3.26 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 0.00 130 L 8.35 3.93 0.00 1.81 1.77 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.03 3.84 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.74 0.00 132 K 7.06 3.66 0.00 1.04 1.30 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.07 0.90 7.81 133 F 7.28 4.55 0.00 2.96 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 0.00 134 S 8.19 4.42 0.00 3.96 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 0.00 135 G 7.78 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.37 4.18 0.00 1.62 1.59 0.93 1.02 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 0.00 137 P 0.00 4.28 0.00 2.06 2.02 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 138 A 8.86 4.12 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 0.00 139 H 8.36 4.43 0.00 3.57 3.62 0.00 5.44 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.29 4.95 0.00 1.80 2.08 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.05 1.46 7.81 141 V 8.08 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 0.66 0.00 0.00 0.94 0.00 0.00 142 V 8.89 4.96 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 0.89 0.00 0.00 0.87 0.00 0.00 143 G 8.86 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 0.00 144 M 8.75 4.65 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.67 0.00 145 A 8.91 4.84 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 G 8.42 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 V 7.77 3.75 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.04 0.00 0.00 148 L 7.87 3.95 0.00 1.84 1.91 0.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 149 D 8.07 4.38 0.00 2.97 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 S 8.68 4.20 0.00 3.90 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.11 3.96 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 0.00 152 R 8.10 3.50 0.00 1.92 1.61 0.00 3.19 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 153 F 8.24 4.51 0.00 3.14 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 0.00 154 R 8.27 3.91 0.00 2.08 1.99 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 155 Y 8.01 4.09 0.00 2.98 2.89 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 0.00 156 F 7.93 4.26 0.00 3.30 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 0.00 157 L 8.26 3.85 0.00 1.94 1.91 0.68 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.28 4.28 0.00 4.32 4.26 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 0.00 159 E 7.67 3.81 0.00 1.95 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 2.20 1.64 0.00 160 E 7.85 3.88 0.00 1.71 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 1.84 1.58 0.00 161 F 7.93 4.68 0.00 3.31 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 0.00 162 N 7.57 4.17 0.00 2.76 2.77 0.00 0.00 6.94 8.22 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 0.00 163 V 7.33 4.56 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 0.92 0.00 0.00 1.11 0.00 0.00 164 S 8.37 4.29 0.00 3.89 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 0.00 165 V 8.59 3.74 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.98 0.00 0.00 166 E 8.53 4.20 0.00 1.95 2.02 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 2.37 2.30 0.00 167 D 8.20 4.83 0.00 2.78 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 V 7.70 4.83 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.08 0.00 0.00 169 T 8.83 4.80 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 1.25 0.00 0.00 170 V 8.39 4.67 1.75 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 0.02 0.00 0.00 1.00 0.00 0.00 171 F 9.06 4.67 0.00 3.55 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 0.00 172 V 8.19 4.83 2.13 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 0.95 0.00 0.00 1.17 0.00 0.00 173 L 9.03 4.67 0.00 1.91 1.69 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 174 G 8.79 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 0.00 175 G 7.55 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 H 8.48 4.73 0.00 3.21 3.20 0.00 5.74 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 8.40 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 0.00 0.00 0.00 178 D 8.80 4.48 0.00 2.67 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 0.00 179 S 7.72 4.35 0.00 3.95 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 0.00 180 M 7.69 4.46 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.37 0.00 181 V 8.92 4.52 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 1.05 0.00 0.00 1.01 0.00 0.00 182 P 0.00 5.09 0.00 2.38 2.15 0.00 3.82 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 2.05 1.97 0.00 183 L 9.46 4.64 0.00 1.82 1.56 1.06 0.56 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 0.00 184 A 8.81 4.17 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 0.00 185 R 7.94 4.15 0.00 1.86 2.00 0.00 2.73 0.00 0.00 3.05 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.05 0.00 186 Y 7.84 5.00 0.00 2.60 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 0.00 187 S 7.99 5.20 0.00 3.95 3.67 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 0.00 188 T 9.15 5.08 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 1.20 0.00 0.00 189 V 8.40 4.59 1.75 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 0.96 0.00 0.00 0.82 0.00 0.00 190 A 9.99 3.87 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 0.00 191 G 8.50 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 0.00 0.00 0.00 192 I 7.53 3.99 1.63 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.64 0.62 0.00 0.00 193 P 0.00 4.93 0.00 2.14 2.15 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 194 L 8.45 4.01 0.00 1.78 1.87 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 195 P 0.00 4.28 0.00 2.15 2.11 0.00 3.54 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 196 D 7.97 4.33 0.00 2.77 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 L 7.77 3.66 0.00 1.81 1.53 0.29 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 198 V 8.07 3.84 2.29 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 1.09 0.00 0.00 1.10 0.00 0.00 199 K 7.75 3.93 0.00 1.97 1.86 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.50 7.81 200 M 8.01 4.37 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.46 0.00 201 G 8.16 4.07 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 0.00 202 W 8.52 4.20 0.00 3.49 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 T 7.34 4.48 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 1.48 0.00 0.00 204 S 8.16 4.92 0.00 4.08 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 0.00 205 Q 8.46 4.00 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 206 D 8.07 4.32 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 K 8.07 3.99 0.00 1.97 1.82 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 208 L 8.15 4.02 0.00 1.86 1.89 1.16 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 209 D 8.97 4.47 0.00 2.86 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 0.00 210 K 8.11 4.04 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 211 I 7.87 3.86 2.11 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 1.51 0.64 1.23 0.00 0.00 212 I 7.77 3.24 1.93 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 1.08 0.75 0.80 0.00 0.00 213 Q 8.03 3.90 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 214 R 8.11 3.83 0.00 1.69 1.76 0.00 2.71 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 215 T 8.13 4.25 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 1.25 0.00 0.00 216 R 8.11 4.05 0.00 2.05 1.98 0.00 3.08 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 217 D 7.89 5.01 0.00 2.69 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 0.00 218 G 7.94 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 0.00 0.00 0.00 219 G 8.06 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 A 7.95 4.11 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 0.00 221 E 8.11 3.91 0.00 2.10 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 2.34 2.36 0.00 222 I 7.60 3.80 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.83 0.93 0.00 0.00 223 V 7.35 4.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.98 0.00 0.00 224 G 8.14 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.38 4.24 0.00 1.74 1.75 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 226 L 8.17 4.09 0.00 1.80 1.79 1.06 0.93 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 0.00 227 K 8.21 4.31 0.00 1.92 1.98 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.55 7.81 228 T 7.76 4.25 4.26 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 1.20 0.00 0.00 229 G 7.51 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 0.00 230 S 8.35 4.68 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 0.00 231 A 8.53 4.11 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 F 7.97 4.84 0.00 3.04 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 0.00 233 Y 7.23 3.99 0.00 2.82 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 0.00 234 A 7.93 4.00 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 0.00 235 P 0.00 4.21 0.00 2.21 2.14 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 236 A 8.08 3.99 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 0.00 237 A 8.22 3.97 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 0.00 238 S 8.24 4.06 0.00 4.09 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 0.00 239 A 8.10 4.06 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 0.00 240 I 8.11 3.73 2.03 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 1.59 0.92 0.94 0.00 0.00 241 Q 8.20 3.99 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 242 M 8.02 4.15 0.00 2.27 2.35 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 243 A 8.25 4.24 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 0.00 244 E 8.57 3.92 0.00 2.14 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 2.33 2.34 0.00 245 S 8.22 4.11 0.00 4.09 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 0.00 246 Y 7.94 3.84 0.00 2.66 3.10 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 0.00 247 L 8.28 4.05 0.00 1.71 1.76 1.06 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 248 K 7.90 4.32 0.00 1.84 1.80 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.42 7.81 249 D 7.55 4.27 0.00 2.62 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 K 8.27 4.01 0.00 1.73 1.81 0.00 1.98 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.40 7.81 251 K 7.90 3.98 0.00 1.98 1.89 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.50 1.51 7.81 252 R 7.60 4.01 0.00 1.80 1.88 0.00 3.28 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 253 V 8.33 4.60 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 0.79 0.00 0.00 0.94 0.00 0.00 254 L 9.00 4.95 0.00 1.60 1.53 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 255 P 0.00 4.91 0.00 2.04 1.95 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 256 V 8.63 4.69 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 0.83 0.00 0.00 1.03 0.00 0.00 257 A 9.06 4.81 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 0.00 258 A 9.00 4.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 Q 7.81 3.78 0.00 1.31 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 260 L 8.89 4.60 0.00 1.68 1.76 1.25 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 261 S 9.11 4.80 0.00 3.91 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 0.00 262 G 9.07 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 0.00 0.00 0.00 263 Q 8.11 4.26 0.00 2.32 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.06 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 264 Y 9.62 3.22 0.00 3.21 2.62 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 0.00 265 G 8.37 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 0.00 0.00 0.00 266 V 8.01 4.49 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 0.87 0.00 0.00 1.24 0.00 0.00 267 K 7.96 5.04 0.00 1.75 1.48 0.00 2.01 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.24 1.00 7.81 268 D 8.34 4.61 0.00 2.87 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 0.00 269 M 7.56 4.94 0.00 2.08 1.86 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 270 Y 8.89 4.84 0.00 3.01 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 0.00 271 V 8.87 4.45 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.86 0.00 0.00 272 G 8.54 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 0.00 273 V 8.81 5.03 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.05 0.00 0.00 274 P 0.00 4.93 0.00 2.05 1.85 0.00 3.67 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.43 0.00 275 T 9.07 5.13 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 1.36 0.00 0.00 276 V 8.98 4.62 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 1.07 0.00 0.00 0.95 0.00 0.00 277 I 8.63 4.78 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.44 0.96 0.00 0.00 278 G 8.46 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 0.00 279 A 8.82 3.45 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 0.00 280 N 8.55 4.95 0.00 2.80 2.82 0.00 0.00 6.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 G 8.01 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 V 9.11 3.77 2.21 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 0.83 0.00 0.00 1.14 0.00 0.00 283 E 9.03 4.49 0.00 1.98 1.97 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 2.27 2.50 0.00 284 R 7.73 4.55 0.00 1.86 1.74 0.00 3.17 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 285 I 8.41 4.69 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.76 1.05 0.00 0.00 286 I 8.68 4.22 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.55 1.07 0.00 0.00 287 E 9.08 4.69 0.00 1.67 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 0.00 1.80 1.47 0.00 288 I 8.15 4.48 2.04 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 1.78 1.02 1.12 0.00 0.00 289 D 8.40 4.57 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 290 L 8.06 4.79 0.00 1.58 1.53 0.68 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 291 D 9.13 4.68 0.00 2.90 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 0.00 292 K 8.52 3.93 0.00 1.78 1.87 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.12 7.81 293 D 8.06 4.57 0.00 2.68 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 0.00 294 E 9.21 4.01 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 295 K 8.57 3.99 0.00 1.90 2.04 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 296 A 8.20 4.07 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 0.00 297 Q 8.27 3.92 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 298 F 8.62 4.07 0.00 3.15 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 0.00 299 D 8.77 4.37 0.00 2.76 2.74 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 0.00 300 K 8.05 3.89 0.00 1.84 2.04 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.41 7.81 301 S 7.85 3.94 0.00 3.87 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 0.00 302 V 7.53 3.32 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 0.83 0.00 0.00 0.15 0.00 0.00 303 A 8.07 3.98 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 0.00 304 S 8.06 4.02 0.00 4.03 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 0.00 305 V 7.82 3.42 2.07 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 0.88 0.00 0.00 0.85 0.00 0.00 306 A 8.34 3.85 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 0.00 307 G 8.10 3.47 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 0.00 308 L 7.69 3.93 0.00 1.96 1.54 0.88 0.80 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 0.00 309 C 7.74 3.66 0.00 2.38 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 0.00 310 E 8.22 3.93 0.00 2.05 1.97 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 2.38 2.43 0.00 311 A 8.08 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 C 8.01 4.32 0.00 3.46 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 0.00 313 I 8.04 3.93 2.14 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.98 0.00 0.00 314 G 8.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 I 7.22 4.35 2.07 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 1.49 0.77 0.96 0.00 0.00 316 A 8.32 4.72 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 0.00 317 P 0.00 4.47 0.00 2.22 2.16 0.00 3.94 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 318 S 8.17 4.24 0.00 4.04 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 0.00 319 L 8.06 3.78 0.00 1.73 1.50 0.96 -0.55 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 0.00 320 K 7.88 4.25 0.00 1.79 1.59 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.26 7.81 * Residues marked with a * may have inaccurate shift predictions.