NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.6698 8.3493 119.5500 53.1481 41.8540 175.5098 5 D 4.7645 8.0284 119.0712 52.5511 41.6722 169.3831 6 V 4.6123 7.9678 120.2732 61.5214 33.4686 176.0702 7 V 4.4548 8.6292 128.0185 60.9754 34.4004 174.3480 8 I 4.2586 9.0326 129.7303 61.0748 38.1612 175.0068 9 V 4.6157 8.3830 127.9554 61.7965 33.1128 174.4453 10 T 4.7231 8.7846 125.2449 62.1047 71.1561 173.2244 11 C 5.2226 8.6229 124.6861 57.6128 34.6372 172.2547 12 A 5.0148 9.1749 129.4053 50.8054 19.0560 177.5229 13 I 3.9271 8.6253 124.3013 65.4962 36.9966 177.0465 14 T 4.5891 8.0660 113.0738 62.4023 73.8081 173.9891 15 G 3.9606 8.0878 108.1522 45.0445 0.0000 172.5022 16 A 4.5996 8.1779 119.5687 51.6335 20.8655 177.6174 17 I 4.1598 7.8818 116.3502 64.2631 37.7194 176.4762 18 H 4.6433 7.9440 116.0189 55.7737 29.2819 174.7658 19 T 4.8773 7.9941 111.2132 58.9706 71.4365 172.3719 20 P 4.3566 0.0000 0.0000 65.9936 31.9888 177.8383 21 S 4.2700 8.3359 115.4030 57.6219 61.7710 174.4731 *23 S 4.1132 7.6284 114.9609 57.2759 63.4150 172.2222 24 P 4.2673 0.0000 0.0000 64.6667 31.0828 176.2890 25 Y 4.4975 7.3331 115.7719 58.0649 38.6495 175.5710 26 L 4.0462 7.5672 123.0725 54.0520 42.3302 174.6550 27 P 4.6066 0.0000 0.0000 62.9459 31.9949 176.0622 28 V 4.2240 9.2352 115.4184 62.3948 34.3400 177.2855 29 T 4.1513 7.8465 109.1759 60.4638 70.8749 173.4190 30 P 4.2482 0.0000 0.0000 66.2759 31.4449 178.7829 31 D 4.5026 8.1507 116.8551 57.3611 40.6906 178.6346 32 Q 4.0366 8.1961 118.6976 59.0963 28.7214 179.0485 33 I 3.6992 7.9387 120.7692 64.1999 37.1244 178.6588 34 V 3.6168 8.0310 121.4985 66.6972 31.4164 178.4997 35 E 4.0124 8.2558 117.9722 61.3572 29.5029 180.8520 36 E 4.1970 8.5225 119.7466 58.9065 29.4251 179.2876 37 A 3.9911 8.1563 121.0055 55.2058 18.4118 179.8927 38 V 3.5329 7.9157 116.6991 66.0688 31.7167 178.3965 39 K 3.9388 8.2566 118.0722 59.2836 31.8759 179.0732 40 A 3.9775 8.4300 121.2345 55.1545 18.3340 179.3828 41 A 4.5455 8.0385 120.5531 55.0511 18.2726 179.8299 42 E 3.9979 8.2683 115.2547 58.9592 29.5762 178.6441 43 A 4.3355 7.5080 118.5420 51.9662 18.7935 177.5814 44 G 3.9128 7.4562 105.7721 44.9105 0.0000 173.9251 45 A 4.5409 7.8287 123.2612 49.9747 19.2891 178.8420 46 G 3.7471 8.5532 107.6232 47.9463 0.0000 172.3580 *48 V 4.4387 7.7065 113.1153 61.2116 33.6753 173.6875 49 H 5.4470 9.2165 124.4844 54.5886 32.1691 173.0596 50 I 4.8125 8.6745 126.6157 59.9202 39.7526 174.4589 51 H 5.2796 8.9565 123.3801 54.0735 31.4423 173.8514 52 A 4.3057 7.5008 121.6688 50.7621 20.9772 176.3513 53 R 4.7242 7.8821 117.3815 53.8310 34.6632 174.7912 54 D 4.2295 8.8600 122.3657 53.9203 41.5217 175.8472 55 P 4.1582 0.0000 0.0000 65.3085 31.7292 177.9145 56 K 4.3649 8.2778 118.8958 55.0239 32.7123 181.4544 57 D 4.2677 7.9547 114.5024 52.0192 40.2701 176.8627 58 G 3.8604 8.1919 108.0564 45.5154 0.0000 173.9825 59 R 2.5100 7.0665 120.6898 54.7529 30.9876 174.1805 60 P 4.3919 0.0000 0.0000 63.4803 31.9194 175.5467 61 T 4.6535 8.0265 116.8927 60.9496 70.3582 173.7231 62 T 4.4099 8.5858 116.2125 61.4529 69.9766 173.3731 63 D 4.3509 7.7005 123.3892 54.8522 41.1253 177.5478 64 V 3.9067 8.5349 121.1552 64.4716 31.5103 178.1631 65 E 4.0885 8.6925 118.2303 58.6472 29.2963 179.4337 66 V 3.5463 7.8863 118.7103 66.0121 31.6459 177.8959 67 F 4.1128 8.2349 117.0882 60.5916 38.7008 177.4979 68 R 3.8450 8.2637 118.3496 59.4818 29.8562 177.9526 69 Y 3.9681 7.8788 118.8196 60.7239 38.7925 177.7921 70 I 3.6378 7.8442 120.6532 64.8914 37.3031 178.2973 71 C 3.8832 7.9289 117.2137 62.3960 27.7287 176.0630 72 R 4.0845 7.8554 120.3501 59.7730 29.4885 178.5474 73 E 3.8767 7.9849 117.1181 59.1410 29.6143 179.2290 74 I 3.8373 7.8884 120.1896 64.3200 37.3889 178.4079 75 K 4.3056 8.1735 121.7000 58.8962 31.7565 178.9423 76 K 4.0931 8.0143 118.2083 58.7382 31.9929 178.2624 77 Q 4.4589 7.8815 116.1415 55.4594 29.9381 175.6226 78 S 4.6145 7.2640 112.9792 56.9895 65.6216 173.6922 79 D 4.7747 8.6512 125.3798 53.0037 39.6646 176.7703 80 V 3.6172 7.5096 119.6600 62.4936 31.5679 175.9384 81 V 3.8226 8.1433 122.7310 63.0503 32.1069 175.3348 82 I 4.4698 8.4832 128.9374 59.9184 38.3601 174.5743 83 N 4.9783 9.3373 128.2838 52.5256 40.3225 173.7443 84 V 4.5717 8.1932 126.5628 61.3068 33.5264 175.0041 85 T 4.4869 8.5719 123.4817 62.3525 67.8365 173.8438 86 T 4.4975 8.9949 117.2404 61.6561 69.3438 174.9025 87 G 4.0761 8.6805 113.3308 47.2551 0.0000 175.0035 88 G 3.8719 8.0294 108.9774 47.1561 0.0000 173.0448 89 G 4.0819 9.1861 112.9521 45.6313 0.0000 175.8141 90 G 3.8269 8.4139 109.4045 48.5204 0.0000 175.2134 91 T 4.0962 7.6195 107.1158 62.4884 69.1560 174.7669 92 L 4.4865 8.0914 121.8363 54.5942 41.8502 177.3611 93 G 3.9600 8.2327 107.0090 45.3633 0.0000 174.0452 94 I 3.8611 7.4644 121.8206 60.3104 37.8347 174.2484 95 P 4.5516 0.0000 0.0000 61.6963 33.8289 177.3043 96 V 3.5101 8.1209 117.1943 66.2506 31.1015 177.2744 97 E 3.8699 8.1671 117.2647 59.3550 29.4377 178.1164 98 E 4.0902 8.0131 118.5606 59.3289 29.7654 178.7553 99 R 3.9763 7.9261 116.3628 58.8711 30.3689 178.3522 100 A 4.1866 8.3736 120.1170 53.7574 18.3549 179.3820 101 K 3.9831 7.8415 117.5131 58.8098 31.9704 179.5332 102 V 3.5168 7.5826 119.4019 64.3007 31.0674 178.5643 103 V 3.3284 7.7268 119.1094 65.5380 31.2140 176.2783 104 P 4.6192 0.0000 0.0000 64.8562 31.1949 178.2297 105 A 4.1358 7.6511 118.8491 54.4718 18.6749 178.7671 106 L 4.5412 8.1509 115.5515 53.5396 43.9637 176.5213 107 K 3.8026 8.2513 119.2706 56.6564 29.9274 171.9549 108 P 4.8461 0.0000 0.0000 62.4676 32.8394 176.9252 109 E 4.2055 8.7239 118.0482 59.3068 30.6610 176.9870 110 I 5.2136 7.6165 117.3677 59.8743 41.7568 173.4911 111 A 5.3030 9.0862 128.6256 50.5104 22.9752 175.7548 112 T 4.6425 8.5048 110.3134 61.5802 70.1453 174.7010 113 F 4.4617 9.1920 125.9135 57.3119 41.7535 173.7325 114 N 5.1393 8.4447 124.8582 52.0231 40.6698 174.7703 *116 G 3.5850 8.1851 106.7754 45.8000 0.0000 172.8055 117 S 5.0639 7.8134 114.5719 57.4783 63.8793 173.9563 *119 N 4.5973 8.2955 118.9052 53.6108 39.3864 174.1464 120 F 4.8659 8.4956 122.7760 56.5346 40.0676 171.6613 121 A 4.8694 8.9514 127.9665 49.9045 21.1739 176.4789 122 I 4.6197 8.5661 114.7948 60.1009 38.6530 176.9832 123 H 4.1725 8.4260 119.3961 58.8461 27.8514 175.0978 124 P 4.4176 0.0000 0.0000 64.4946 31.2028 178.1023 125 L 4.2373 8.1636 118.4036 57.5721 41.2690 179.1043 126 L 4.3708 7.8744 118.0939 57.3450 41.5319 179.0942 127 K 4.1711 8.0349 118.0335 58.4753 32.0949 178.3598 128 K 4.1395 7.8586 118.2768 56.1672 32.7043 175.8095 129 Y 4.5646 7.5885 116.6618 56.0388 39.8615 175.2812 130 K 4.4736 8.5891 123.5057 56.2487 34.3187 176.2311 131 E 4.6407 7.7110 117.5790 54.2226 31.6117 175.1593 132 F 4.8509 8.4324 121.4869 55.2378 42.4274 175.2881 133 K 3.9136 9.1986 126.2754 58.7180 32.3165 176.8294 134 Y 4.7609 7.9723 116.0559 55.9286 40.1818 176.3114 135 D 4.4333 8.9508 123.6734 57.4960 40.8241 179.4319 136 W 4.4079 8.1741 116.5789 59.4458 28.1009 177.9846 137 E 2.9363 7.0000 119.6206 58.4427 28.8273 177.5494 138 P 3.8003 0.0000 0.0000 65.4758 31.0739 178.2979 139 E 3.9246 7.4110 116.5749 59.3922 29.4959 178.1313 140 Y 4.4070 8.2775 118.5452 60.7858 38.9826 177.9571 141 L 3.7764 7.5811 118.2529 57.4622 42.1402 180.5797 142 E 3.9911 8.0496 120.5381 56.1764 28.5158 178.3984 *144 T 4.2769 7.9767 108.0191 60.7351 70.6985 175.4367 145 R 4.0544 7.8669 122.1377 58.8552 30.0313 176.0502 146 D 4.8812 7.5515 116.3308 53.6972 41.9869 174.4595 147 I 4.4648 7.7652 117.6529 58.5852 39.3555 175.6434 148 V 3.7033 8.3177 125.7077 62.5771 32.1877 175.3926 149 F 4.7183 8.7969 129.7209 57.8429 39.6417 173.3616 150 R 4.4656 8.3418 126.8862 55.3459 30.7549 176.2873 151 N 4.9961 8.6444 124.6614 52.1486 40.3375 174.5964 152 T 4.0474 8.8938 113.7826 60.4562 70.4815 176.6734 153 F 4.0957 8.6361 121.2335 60.8039 38.8245 177.8492 154 K 3.9220 8.1317 118.4972 59.5559 32.0455 178.2207 155 D 4.2823 7.8897 119.0713 57.6184 40.7124 179.0405 156 L 3.9049 8.2278 119.6357 57.4389 41.0913 179.3763 157 E 3.4891 8.4153 118.7938 59.2415 29.5477 179.0658 158 A 4.0405 7.8391 120.6334 55.3206 18.3921 179.4329 159 L 3.9877 8.4969 119.2533 58.2386 42.0517 179.2939 160 S 4.4273 8.5938 114.5786 61.6425 62.8940 176.8499 161 R 4.0576 7.9894 121.0708 58.9858 29.3851 178.9100 162 I 4.0001 7.7493 120.6513 63.8804 37.0981 178.3751 163 F 4.0325 8.8784 118.5551 60.5835 38.6986 177.9041 164 K 4.0471 8.2633 117.8761 59.7176 32.0033 179.2506 165 E 4.1068 8.8681 118.9707 58.5514 29.1619 178.1865 166 N 4.8711 7.6265 113.5240 52.0106 39.6544 173.8546 167 D 4.5868 7.7324 116.3461 55.9607 40.0088 173.4373 168 T 4.8641 7.9021 114.0769 61.3797 71.1048 175.4438 169 K 4.3168 8.8832 128.4297 55.6282 33.4908 174.1927 170 P 4.7885 0.0000 0.0000 62.6054 32.2278 175.3582 171 E 4.5037 9.3652 126.7901 54.7740 31.0653 175.1234 172 L 4.9188 8.9339 129.8209 53.7912 42.7175 176.1516 173 E 4.7229 9.2036 125.6211 55.9447 30.7753 175.7009 174 C 5.0767 9.1438 123.2965 58.2478 30.9498 174.0786 175 Y 4.8785 9.2701 120.2287 56.6741 39.2320 174.6017 176 D 4.6629 7.5804 117.8154 52.4093 44.3563 176.5504 177 I 3.8688 8.2793 123.0051 64.4087 37.0943 178.9360 178 G 3.8357 8.2342 106.0763 47.9726 0.0000 175.5447 179 Q 4.3855 8.0041 120.1586 58.6049 28.6091 178.7592 180 I 3.6998 7.6816 120.7743 64.4739 37.2101 177.5869 181 Y 4.0297 8.1011 117.5854 61.3391 37.5094 178.6132 182 N 4.7152 8.7414 116.3568 56.8089 38.7365 177.2908 183 T 4.0864 8.0621 116.0375 66.5884 68.7953 176.0660 184 A 4.2475 8.4062 123.1110 55.1886 18.2663 179.8342 185 F 4.4966 8.4061 115.3601 59.1330 39.1445 176.5412 *187 F 4.8762 7.9431 119.7760 58.2425 40.7746 176.7998 188 H 3.8939 8.0106 116.1072 58.7323 28.4773 176.7817 189 E 3.7485 8.0586 117.6699 57.5183 29.2816 177.8116 190 G 3.8059 7.8161 107.3041 45.2405 0.0000 174.1845 191 Y 4.2707 7.5496 117.3392 59.5240 38.3391 175.7553 192 L 4.6627 7.8914 118.8792 52.6206 43.8980 175.0707 193 E 4.5026 8.5998 124.4277 54.0400 30.6346 174.0213 194 P 4.5946 0.0000 0.0000 61.2705 32.5563 173.9094 195 P 4.5550 0.0000 0.0000 62.8741 32.0196 176.0857 196 L 4.2951 8.9064 122.2981 54.3409 43.7016 175.8473 197 R 4.9038 8.4398 121.6680 54.9000 32.3010 174.3606 198 L 5.1645 8.9242 126.8166 53.0344 45.0666 175.4751 199 Q 4.7552 8.6916 122.2044 54.4140 32.4859 173.8410 200 F 5.3413 9.0102 126.0672 56.7142 40.3044 174.7202 201 I 4.8835 8.7456 125.6640 59.8867 39.4453 174.3194 202 H 5.0514 9.3287 124.9746 54.9892 31.1969 175.2795 203 G 4.0767 9.1335 111.0041 45.2141 0.0000 173.8494 204 I 3.7426 7.5786 121.3008 60.4130 37.9687 175.0034 205 L 4.2583 8.1619 126.6907 57.8013 41.5853 176.5349 206 G 4.2887 8.0425 114.0486 45.7692 0.0000 172.0412 207 G 4.4160 7.7530 107.0769 44.1156 0.0000 172.5962 208 I 3.9293 8.7296 120.2045 61.1223 39.0309 177.6329 209 G 4.0916 8.3531 116.6800 45.7996 0.0000 174.3634 210 T 4.4632 8.0277 115.8241 60.9960 69.4365 174.0335 211 A 4.0846 7.7980 124.9176 52.2365 19.2320 179.4953 212 V 3.6114 8.5372 120.2494 66.3439 31.4696 178.3165 213 E 3.9781 8.2547 117.6144 59.6982 29.0385 179.1116 214 D 4.3525 7.8005 117.7372 57.2340 41.0027 178.6212 215 V 3.6212 7.5971 116.9188 65.9193 31.8524 177.1914 216 L 4.0875 7.8101 119.9524 57.9868 41.9445 179.9675 217 F 4.3329 8.0395 119.5881 58.1968 39.3203 176.6769 *219 K 3.8007 8.0719 119.5284 55.8349 33.8499 177.6378 220 Q 3.9118 8.0318 118.0878 59.0648 28.3531 178.8858 221 T 3.4443 7.3468 116.6377 66.1929 68.2860 176.6353 222 A 3.5757 7.4146 122.1353 55.0109 18.2687 179.0331 223 D 4.4839 7.9467 117.3800 57.8312 40.7456 179.3115 224 R 3.8702 7.8443 117.6227 58.9696 30.1271 177.7784 225 L 4.2794 7.8567 117.6159 56.2197 42.2512 177.6606 226 I 4.1746 7.5760 118.4063 62.7310 38.3906 176.6078 227 G 4.2348 7.9235 108.8154 44.6938 0.0000 174.9068 228 R 3.9845 8.8417 122.8483 59.1473 30.1962 177.7015 229 E 4.1830 8.1523 112.7766 57.5960 30.3119 176.4250 230 N 5.0170 8.3686 117.3296 53.4088 39.8432 173.6090 231 Y 5.4727 7.5850 116.0988 56.1241 41.3350 173.5121 232 T 4.7542 9.0485 109.9491 59.7866 72.8802 172.5053 233 W 6.2215 8.0225 117.0069 54.9014 31.8955 173.3409 234 S 5.1069 8.4735 114.4508 55.4152 66.2766 171.9497 235 L 5.4102 8.2316 122.7615 53.3412 45.9773 174.7478 236 V 4.6880 9.3573 125.3549 61.1287 34.1977 174.2453 237 G 4.4504 8.7559 115.4489 44.7514 0.0000 172.4960 238 A 4.3850 9.0330 128.3740 51.7569 19.8725 177.6043 239 G 3.8423 9.3138 110.0831 46.6102 0.0000 177.2103 240 R 3.9776 8.7268 120.8442 57.7671 29.4265 177.0868 241 F 4.5219 8.1457 117.5021 57.7109 39.4229 176.8690 242 Q 4.5538 8.4126 121.9349 56.7860 29.1979 176.0204 *244 P 4.4185 0.0000 0.0000 63.5026 33.4110 178.7652 245 L 4.1705 8.1862 119.2543 57.3359 41.4383 179.6346 246 G 3.6825 8.2449 105.8044 48.1403 0.0000 175.8928 247 T 3.8940 7.9034 117.6485 66.2244 68.3248 176.1418 248 L 3.9711 8.1020 121.2871 58.2645 42.2799 178.5916 249 A 4.4220 8.3060 120.5884 55.2486 18.1056 179.7615 250 V 3.6172 7.5254 115.5424 66.0210 31.6841 179.6638 251 I 3.9416 7.6974 117.6321 61.3578 37.1913 177.0552 *253 G 3.7820 8.0139 106.6856 44.9134 0.0000 173.5777 254 G 2.2683 8.1286 107.8944 44.4804 0.0000 173.1939 255 D 4.8898 7.9281 120.8631 52.8628 43.4786 176.1510 256 V 4.5738 8.3534 118.0469 60.1569 34.9445 174.2758 257 R 5.0402 8.7029 123.5816 54.9626 32.2543 175.1794 258 V 4.7094 9.1909 119.2039 59.1467 36.0147 173.6295 259 G 4.4507 8.5922 105.6027 43.6075 0.0000 175.3140 260 L 4.9565 8.6463 121.2037 56.3799 41.8862 178.5088 261 E 4.3506 8.1084 118.9916 58.0622 29.8869 177.1798 262 D 4.8507 8.4804 117.6249 55.1490 42.5799 176.4588 263 S 5.0182 7.7112 112.6946 56.9467 65.5036 173.9220 264 L 4.2374 8.7335 125.9111 55.4685 41.8937 175.7551 265 Y 5.0432 7.6346 116.2277 56.1846 40.6030 175.2874 266 I 4.1843 8.6480 124.8443 62.7978 39.3416 176.0042 267 E 4.6977 7.8122 113.8978 53.6999 33.5275 177.2558 268 R 3.8148 8.5252 117.8861 59.0903 29.9253 176.7806 269 G 3.8539 8.6719 112.5199 45.4285 0.0000 172.4800 270 K 4.5552 8.4645 121.7500 53.9080 33.8518 175.3932 271 L 4.0225 8.6012 126.7091 54.3318 42.1707 176.9751 272 A 4.0981 8.4654 127.2740 52.1923 18.5399 177.9762 273 K 2.8643 8.8655 123.3336 57.3576 32.3567 177.0708 274 S 4.7062 7.4481 111.7109 55.9764 65.5747 175.4180 275 N 4.3848 9.7743 119.9959 56.7969 38.2848 177.5220 276 A 4.0223 8.0585 121.3417 55.1574 18.4373 179.0597 277 E 3.8827 8.0113 117.3573 59.6388 29.4642 179.1997 278 Q 4.0118 7.3941 117.3672 58.7401 28.8580 178.3906 279 V 3.7418 7.6518 118.3570 66.0483 31.8156 177.5092 280 E 4.1632 8.6517 118.6160 59.2651 29.2938 179.9743 281 K 4.1533 7.7145 115.5909 57.3986 32.0159 178.2658 *283 V 4.0079 7.7322 119.2814 62.5187 33.5086 177.5772 284 R 3.9567 8.2287 118.8837 59.3608 29.7765 179.1748 285 I 3.7119 7.7543 119.4948 64.2070 37.1210 178.3707 286 V 3.5560 7.8213 118.6393 66.3023 31.2729 178.1578 287 K 4.7679 8.0825 119.1892 59.0386 31.6085 179.2980 288 E 4.0848 7.9786 118.0860 58.9324 29.3452 178.2466 289 L 4.5067 7.6630 117.1462 54.3588 41.6894 177.1239 290 G 3.8436 7.9096 106.2968 46.2432 0.0000 173.3888 291 K 4.9901 7.9105 119.1250 54.3189 36.6092 174.9070 292 R 5.0203 8.8550 116.3302 54.2460 33.1598 172.7987 293 P 4.9790 0.0000 0.0000 62.3175 32.3841 175.9399 294 A 4.4636 8.7669 125.5016 52.1119 18.8858 177.9300 295 T 4.0821 9.1798 112.8405 60.6401 70.0172 173.7984 296 P 4.3586 0.0000 0.0000 66.2158 31.2925 178.7873 297 D 4.4190 8.0616 116.9400 57.1577 40.7216 178.5297 298 E 3.9367 8.2721 119.4423 59.1971 29.3736 179.1160 299 V 3.5497 8.0089 118.6479 66.3689 31.4008 178.2975 300 R 3.8962 7.9934 117.3808 59.1977 29.7921 178.7801 301 E 3.8954 8.1964 119.0441 59.3817 29.4821 178.8330 302 I 3.7894 8.1886 118.8990 63.7524 37.2878 177.4787 303 L 4.5282 8.0182 116.6385 53.3112 42.4949 176.2839 304 G 3.8090 7.6967 105.3896 46.5436 0.0000 174.2933 305 L 4.3877 7.9573 118.7268 53.3467 42.6644 178.2772 306 K 3.9859 8.4499 120.5991 58.2445 33.2000 177.9159 307 G 4.0620 8.2267 107.5180 44.6431 0.0000 174.8875 308 K 3.9567 8.5440 119.4165 59.3748 32.8561 178.5211 309 E 4.0022 8.0304 116.7698 57.4865 29.6633 177.0460 310 R 4.3807 7.5300 116.7868 55.8109 30.6444 176.7619 311 V 4.1620 6.7785 111.0463 60.3674 32.7047 175.8279 312 N 4.8207 8.3915 120.5629 51.7458 38.0864 174.8755 313 F 4.4876 7.0477 117.6517 57.5846 37.4106 174.2666 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 4 D 8.35 4.67 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.03 4.76 0.00 2.72 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.97 4.61 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 7 V 8.63 4.45 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.86 0.00 0.00 8 I 9.03 4.26 1.80 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 1.07 0.45 0.88 0.00 0.00 9 V 8.38 4.62 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 1.00 0.00 0.00 0.91 0.00 0.00 10 T 8.78 4.72 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 1.26 0.00 0.00 11 C 8.62 5.22 0.00 2.99 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 12 A 9.17 5.01 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 13 I 8.63 3.93 1.89 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 1.29 0.87 0.93 0.00 0.00 14 T 8.07 4.59 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 1.18 0.00 0.00 15 G 8.09 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 16 A 8.18 4.60 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.88 4.16 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.73 0.98 0.00 0.00 18 H 7.94 4.64 0.00 3.19 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.99 4.88 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 1.34 0.00 0.00 20 P 0.00 4.36 0.00 2.24 2.29 0.00 3.85 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 21 S 8.34 4.27 0.00 3.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *23 S 7.63 4.11 0.00 3.80 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 24 P 0.00 4.27 0.00 1.65 1.88 0.00 3.56 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.63 0.00 25 Y 7.33 4.50 0.00 3.05 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 26 L 7.57 4.05 0.00 1.56 1.60 0.98 1.49 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 27 P 0.00 4.61 0.00 2.23 2.07 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 28 V 9.24 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 0.86 0.00 0.00 1.03 0.00 0.00 29 T 7.85 4.15 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 30 P 0.00 4.25 0.00 2.15 2.26 0.00 3.52 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 1.94 2.09 0.00 31 D 8.15 4.50 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.20 4.04 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 33 I 7.94 3.70 2.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.89 0.00 0.00 34 V 8.03 3.62 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 0.95 0.00 0.00 0.92 0.00 0.00 35 E 8.26 4.01 0.00 2.02 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 0.00 2.25 2.23 0.00 36 E 8.52 4.20 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 37 A 8.16 3.99 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 38 V 7.92 3.53 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.97 0.00 0.00 39 K 8.26 3.94 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.63 7.81 40 A 8.43 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.04 4.55 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 42 E 8.27 4.00 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 43 A 7.51 4.34 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 44 G 7.46 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 45 A 7.83 4.54 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 46 G 8.55 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *48 V 7.71 4.44 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 0.73 0.00 0.00 1.02 0.00 0.00 49 H 9.22 5.45 0.00 3.29 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.67 4.81 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 0.93 0.00 0.00 51 H 8.96 5.28 0.00 2.93 3.14 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.50 4.31 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 7.88 4.72 0.00 1.68 1.72 0.00 3.17 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.48 0.00 54 D 8.86 4.23 0.00 2.48 2.36 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 55 P 0.00 4.16 0.00 1.98 1.98 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 56 K 8.28 4.36 0.00 1.76 1.70 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.22 7.81 57 D 7.95 4.27 0.00 2.01 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.19 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 59 R 7.07 2.51 0.00 0.67 1.08 0.00 2.70 0.00 0.00 2.75 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.56 0.00 60 P 0.00 4.39 0.00 1.66 1.80 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.81 0.00 61 T 8.03 4.65 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 1.01 0.00 0.00 62 T 8.59 4.41 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 63 D 7.70 4.35 0.00 2.59 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 64 V 8.53 3.91 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 0.74 0.00 0.00 0.95 0.00 0.00 65 E 8.69 4.09 0.00 2.11 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 2.34 2.46 0.00 66 V 7.89 3.55 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.86 0.00 0.00 67 F 8.23 4.11 0.00 3.21 2.87 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 0.00 0.00 0.00 68 R 8.26 3.85 0.00 2.06 2.12 0.00 3.16 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 69 Y 7.88 3.97 0.00 3.03 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 70 I 7.84 3.64 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.63 0.87 0.00 0.00 71 C 7.93 3.88 0.00 2.09 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 72 R 7.86 4.08 0.00 2.02 1.97 0.00 3.12 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 73 E 7.98 3.88 0.00 1.79 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 74 I 7.89 3.84 1.86 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 1.39 0.95 0.94 0.00 0.00 75 K 8.17 4.31 0.00 2.09 2.21 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.36 7.81 76 K 8.01 4.09 0.00 1.95 1.85 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.64 7.81 77 Q 7.88 4.46 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 78 S 7.26 4.61 0.00 3.91 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.65 4.77 0.00 2.82 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 80 V 7.51 3.62 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 0.70 0.00 0.00 1.07 0.00 0.00 81 V 8.14 3.82 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 0.80 0.00 0.00 0.95 0.00 0.00 82 I 8.48 4.47 2.08 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 1.29 0.98 0.90 0.00 0.00 83 N 9.34 4.98 0.00 2.81 2.98 0.00 0.00 6.39 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 84 V 8.19 4.57 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 0.41 0.00 0.00 0.88 0.00 0.00 85 T 8.57 4.49 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 1.30 0.00 0.00 86 T 8.99 4.50 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 87 G 8.68 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 88 G 8.03 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 89 G 9.19 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 90 G 8.41 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 7.62 4.10 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 0.45 0.00 0.00 92 L 8.09 4.49 0.00 1.81 1.75 0.79 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.23 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 94 I 7.46 3.86 2.00 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 1.47 1.12 0.92 0.00 0.00 95 P 0.00 4.55 0.00 2.23 2.16 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 96 V 8.12 3.51 1.98 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 0.98 0.00 0.00 0.82 0.00 0.00 97 E 8.17 3.87 0.00 1.97 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 2.29 2.38 0.00 98 E 8.01 4.09 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 99 R 7.93 3.98 0.00 1.85 2.08 0.00 3.49 0.00 0.00 3.62 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.85 0.00 100 A 8.37 4.19 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 0.00 101 K 7.84 3.98 0.00 1.73 1.85 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.60 7.81 102 V 7.58 3.52 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 0.46 0.00 0.00 0.30 0.00 0.00 103 V 7.73 3.33 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 0.71 0.00 0.00 0.50 0.00 0.00 104 P 0.00 4.62 0.00 2.03 2.08 0.00 3.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 105 A 7.65 4.14 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 0.00 106 L 8.15 4.54 0.00 1.89 1.85 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.25 3.80 0.00 1.84 1.92 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.35 7.81 108 P 0.00 4.85 0.00 2.39 2.17 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 109 E 8.72 4.21 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 110 I 7.62 5.21 1.93 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 1.39 1.60 0.98 0.00 0.00 111 A 9.09 5.30 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 0.00 112 T 8.50 4.64 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 1.44 0.00 0.00 113 F 9.19 4.46 0.00 2.75 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 0.00 114 N 8.44 5.14 0.00 2.86 2.88 0.00 0.00 7.09 7.65 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 *116 G 8.19 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 0.00 117 S 7.81 5.06 0.00 3.78 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *119 N 8.30 4.60 0.00 2.79 2.81 0.00 0.00 6.28 8.13 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 0.00 120 F 8.50 4.87 0.00 2.93 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 0.00 121 A 8.95 4.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 I 8.57 4.62 1.95 0.00 0.00 0.86 0.00 0.00 0.00 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2.85 0.00 0.00 0.00 0.00 1.33 1.50 7.81 131 E 7.71 4.64 0.00 1.78 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 132 F 8.43 4.85 0.00 2.84 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 9.20 3.91 0.00 1.48 1.52 0.00 1.56 0.00 0.00 1.22 0.00 0.00 2.41 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.57 1.07 7.81 134 Y 7.97 4.76 0.00 2.53 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 0.00 135 D 8.95 4.43 0.00 2.86 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 0.00 136 W 8.17 4.41 0.00 3.53 3.33 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 0.00 137 E 7.00 2.94 0.00 1.16 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 1.47 1.47 0.00 138 P 0.00 3.80 0.00 2.09 1.83 0.00 3.46 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.95 0.00 0.00 149 F 8.80 4.72 0.00 3.08 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 0.00 150 R 8.34 4.47 0.00 1.82 1.76 0.00 3.24 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 151 N 8.64 5.00 0.00 2.26 2.40 0.00 0.00 7.11 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 0.00 152 T 8.89 4.05 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 153 F 8.64 4.10 0.00 3.11 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.13 3.92 0.00 1.85 1.81 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.55 7.81 155 D 7.89 4.28 0.00 2.88 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.23 3.90 0.00 1.79 1.86 0.82 0.71 0.00 0.00 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3.20 0.00 0.00 0.00 0.00 1.54 1.61 7.81 165 E 8.87 4.11 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 166 N 7.63 4.87 0.00 2.64 2.72 0.00 0.00 6.50 7.96 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 0.00 167 D 7.73 4.59 0.00 2.73 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 0.00 168 T 7.90 4.86 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 1.06 0.00 0.00 169 K 8.88 4.32 0.00 1.91 1.76 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.47 7.81 170 P 0.00 4.79 0.00 1.62 1.17 0.00 3.75 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.88 0.00 171 E 9.37 4.50 0.00 2.12 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 0.00 2.33 2.29 0.00 172 L 8.93 4.92 0.00 1.62 1.57 0.75 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 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3.24 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 0.00 182 N 8.74 4.72 0.00 2.95 3.06 0.00 0.00 7.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 T 8.06 4.09 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 184 A 8.41 4.25 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 0.00 185 F 8.41 4.50 0.00 3.26 3.40 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 *187 F 7.94 4.88 0.00 3.00 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 0.00 188 H 8.01 3.89 0.00 3.04 3.18 0.00 5.73 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.06 3.75 0.00 1.84 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 190 G 7.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 8.69 4.76 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 200 F 9.01 5.34 0.00 3.16 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 0.00 201 I 8.75 4.88 1.18 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.95 0.90 0.00 0.00 202 H 9.33 5.05 0.00 3.23 3.28 0.00 5.58 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 0.00 203 G 9.13 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 0.00 204 I 7.58 3.74 1.67 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 -0.23 0.00 0.00 205 L 8.16 4.26 0.00 1.69 1.74 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 206 G 8.04 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 233 W 8.02 6.22 0.00 2.95 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 0.00 234 S 8.47 5.11 0.00 3.79 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 8.23 5.41 0.00 2.15 1.58 1.23 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 236 V 9.36 4.69 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 1.12 0.00 0.00 0.97 0.00 0.00 237 G 8.76 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 0.00 238 A 9.03 4.39 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 0.00 239 G 9.31 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 0.00 240 R 8.73 3.98 0.00 1.65 1.86 0.00 2.71 0.00 0.00 3.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 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0.00 0.00 0.00 0.00 0.00 2.21 1.86 0.00 268 R 8.53 3.81 0.00 1.67 1.87 0.00 3.21 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 269 G 8.67 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 270 K 8.46 4.56 0.00 1.77 1.71 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.39 7.81 271 L 8.60 4.02 0.00 1.74 1.61 1.02 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 272 A 8.47 4.10 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 K 8.87 2.86 0.00 1.41 1.27 0.00 1.53 0.00 0.00 1.43 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.68 1.05 7.81 274 S 7.45 4.71 0.00 4.08 3.87 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 0.00 0.00 0.00 275 N 9.77 4.38 0.00 2.81 2.94 0.00 0.00 7.19 7.12 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 0.00 276 A 8.06 4.02 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 0.00 277 E 8.01 3.88 0.00 2.00 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 2.28 2.32 0.00 278 Q 7.39 4.01 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.72 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 279 V 7.65 3.74 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 0.94 0.00 0.00 1.00 0.00 0.00 280 E 8.65 4.16 0.00 2.18 1.98 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 2.33 2.43 0.00 281 K 7.71 4.15 0.00 1.86 1.92 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.46 7.81 *283 V 7.73 4.01 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 284 R 8.23 3.96 0.00 2.07 1.97 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 1.65 1.91 0.00 285 I 7.75 3.71 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 1.41 0.65 0.92 0.00 0.00 286 V 7.82 3.56 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 1.09 0.00 0.00 0.91 0.00 0.00 287 K 8.08 4.77 0.00 1.98 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.49 7.81 288 E 7.98 4.08 0.00 2.14 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 2.52 2.49 0.00 289 L 7.66 4.51 0.00 1.77 1.68 0.93 1.01 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 0.00 290 G 7.91 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 0.00 0.00 0.00 291 K 7.91 4.99 0.00 1.81 1.82 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.53 7.81 292 R 8.85 5.02 0.00 1.79 1.95 0.00 2.75 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 293 P 0.00 4.98 0.00 2.19 2.07 0.00 3.76 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 1.97 1.96 0.00 294 A 8.77 4.46 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 0.00 295 T 9.18 4.08 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 296 P 0.00 4.36 0.00 2.18 2.23 0.00 3.60 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 2.30 2.19 0.00 297 D 8.06 4.42 0.00 2.68 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 0.00 298 E 8.27 3.94 0.00 2.27 1.98 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 2.31 2.30 0.00 299 V 8.01 3.55 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 1.10 0.00 0.00 0.96 0.00 0.00 300 R 7.99 3.90 0.00 2.08 1.96 0.00 3.34 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 301 E 8.20 3.90 0.00 2.08 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 0.00 2.29 2.37 0.00 302 I 8.19 3.79 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.70 0.86 0.00 0.00 303 L 8.02 4.53 0.00 1.70 1.69 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 304 G 7.70 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 305 L 7.96 4.39 0.00 1.64 1.70 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 306 K 8.45 3.99 0.00 1.84 1.94 0.00 1.51 0.00 0.00 1.98 0.00 0.00 3.09 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.40 7.81 307 G 8.23 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 0.00 0.00 0.00 308 K 8.54 3.96 0.00 1.90 2.06 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.41 7.81 309 E 8.03 4.00 0.00 1.93 1.98 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 2.27 2.23 0.00 310 R 7.53 4.38 0.00 1.76 1.89 0.00 3.13 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 311 V 6.78 4.16 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 0.79 0.00 0.00 -0.24 0.00 0.00 312 N 8.39 4.82 0.00 2.59 2.79 0.00 0.00 6.97 6.65 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 0.00 313 F 7.05 4.49 0.00 3.07 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.