NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 N 4.7097 8.2827 119.2105 53.3379 39.9918 175.9211 11 E 3.8778 5.9000 119.3248 58.8866 30.3185 174.9904 12 N 4.3725 9.0703 117.5670 56.4557 38.9861 176.6485 13 L 4.3390 7.8020 121.0829 57.0513 41.7230 179.2546 14 W 4.1065 8.1037 128.1620 60.3152 30.6965 177.9004 15 L 3.6768 8.4218 120.6475 57.8490 41.1348 178.8078 16 E 3.9042 8.5071 119.1111 59.4376 29.4441 178.9981 17 Q 3.9441 8.1183 119.6490 59.3773 28.9854 178.4774 18 Q 3.6974 7.6961 119.0228 58.6262 28.5882 178.7258 19 L 4.0640 7.8407 120.0123 57.7198 41.7413 179.3538 20 K 3.8813 8.1097 118.5482 59.9231 31.8111 179.3430 21 Q 3.9198 7.7264 116.5903 58.6390 28.7445 178.2359 22 K 3.8147 7.9498 119.7506 58.8209 32.2514 177.5107 23 F 4.6692 7.8540 114.2189 56.3267 39.2214 175.6597 24 G 3.9817 7.9171 107.8616 46.4709 0.0000 174.2460 25 L 4.4554 7.6505 118.0792 53.6962 42.8027 177.6307 26 K 4.2687 8.9299 124.1333 59.5529 32.8611 176.8972 27 D 4.8563 7.8014 117.3861 53.0458 45.5176 174.5851 28 V 4.8551 8.1758 119.9828 61.3758 35.1165 174.1126 29 V 4.6437 8.9974 126.7122 60.1000 34.3092 174.2333 30 V 4.8716 8.8434 126.8522 61.3794 33.8781 174.8546 31 V 4.0894 8.6208 121.1439 60.0141 34.1472 175.9331 32 S 4.3288 8.9582 118.2240 56.7668 64.2202 179.6039 33 G 3.9342 7.5810 113.1509 45.5959 0.0000 170.7663 *36 E 4.1881 8.2272 118.8968 56.4115 29.9925 174.1232 37 D 4.8819 8.3257 122.0042 54.7527 42.7370 177.4385 38 E 3.8966 9.7746 121.7129 59.0724 29.5458 177.7390 39 E 4.1238 8.1891 116.5453 58.4277 29.9965 178.3675 40 T 4.0475 7.7781 115.7229 67.0893 68.5019 176.3427 41 Q 4.0386 7.3541 118.2030 58.9723 28.7642 178.5848 42 L 4.1757 7.5986 120.2792 57.2976 43.6712 178.4963 43 A 4.3731 7.5853 122.0397 52.2748 14.3581 177.5035 *46 G 3.8887 7.7997 112.3176 44.9434 0.0000 172.8633 47 L 3.8702 8.1517 121.7546 58.4460 42.0543 178.9258 48 H 4.7954 7.5653 116.8750 57.9149 28.6651 177.9292 49 G 3.5770 8.1265 107.2530 47.5843 0.0000 175.5527 50 A 4.0390 8.3013 123.2605 54.9975 18.0952 179.6848 51 Q 3.9498 8.0622 116.5963 58.9207 28.7655 178.7422 52 L 3.9162 8.0692 121.3126 58.1868 42.2936 178.5596 53 L 3.8685 8.1378 120.4765 58.5040 41.7362 178.5869 54 D 4.3798 8.0068 116.5328 56.9033 41.1796 177.6246 55 R 4.1321 7.3912 118.3088 58.6699 30.2603 177.8761 56 L 4.1101 7.6184 117.9363 55.9386 42.0775 177.6766 57 L 4.3668 7.1907 118.2178 54.9452 42.4087 176.3225 58 E 4.7789 9.4820 121.1100 53.4663 32.8615 173.8781 59 P 4.5545 0.0000 0.0000 64.7141 31.7060 176.9787 60 G 4.2631 9.2322 110.8216 44.7804 0.0000 173.3933 61 D 4.6719 8.0070 120.5610 54.8950 42.1304 175.7838 62 I 4.5569 9.5901 124.7809 60.8345 38.5661 174.8853 63 V 4.6171 9.4509 128.4817 60.9464 33.9067 174.3978 64 G 4.9153 9.1258 115.3322 45.3317 0.0000 171.9079 65 F 5.2967 8.6632 121.3666 55.6471 42.5130 175.2853 66 S 4.7086 8.8104 119.2087 57.1261 64.5211 172.4530 67 W 4.8408 7.9290 118.3670 54.9077 30.5199 175.4253 68 G 4.0650 9.1558 106.0712 44.5302 0.0000 174.7948 69 R 3.2466 8.4371 117.9910 59.1561 29.6071 178.4552 70 A 3.9508 7.8224 119.7867 55.3183 18.5176 179.6522 71 V 3.6313 7.8526 116.3426 66.0367 31.6377 177.8947 72 S 4.1615 8.3898 112.8328 61.4076 61.9977 175.8444 73 A 4.0702 8.2359 123.5061 55.2082 18.0934 179.4675 74 L 4.1844 7.7538 118.6542 58.3241 42.2511 179.2426 75 V 3.6024 8.1011 118.4453 66.2381 31.2793 177.7897 76 E 4.0773 8.5981 117.0910 58.7307 29.3039 178.0899 77 N 4.8393 7.5481 113.8363 51.6844 39.3530 175.0026 78 L 4.1151 7.2718 122.1585 53.8844 42.2017 175.5524 79 P 4.2729 0.0000 0.0000 62.5360 31.8822 175.8985 80 Q 4.2269 8.4553 122.4432 55.1598 28.9742 175.7065 81 A 4.1818 8.8253 129.9555 52.2546 18.9435 177.3305 82 G 3.9446 8.5412 109.2981 46.0453 0.0000 173.9418 83 Q 4.5645 7.5718 116.1086 53.8685 31.7213 174.8127 84 S 4.3129 8.5591 114.1547 58.7411 63.2303 174.0000 85 R 4.6244 8.2750 124.0231 56.3199 31.1413 175.8044 86 Q 3.6151 8.2565 113.8351 56.8349 27.3325 173.9304 87 L 4.7070 7.7333 115.6933 54.6922 43.5988 176.4312 88 I 4.8601 8.5861 123.0132 59.8019 40.1580 174.1519 89 C 5.3832 9.4422 125.9107 58.2656 30.4357 173.5011 90 V 5.1180 8.9914 116.6923 58.8010 35.7687 173.3514 91 P 5.1589 0.0000 0.0000 62.5595 32.5036 175.7914 92 I 4.2561 8.4009 114.6254 60.3065 38.6742 174.3609 93 I 4.6169 7.5711 120.3958 60.1025 40.8368 174.3265 94 G 4.0185 8.8153 115.5217 45.5578 0.0000 173.3230 95 G 4.1120 8.6859 107.2451 45.4237 0.0000 172.9935 96 P 4.5101 0.0000 0.0000 62.2191 31.7660 176.3892 97 S 3.8618 9.1108 113.7370 59.9150 60.2688 173.3221 98 G 3.9617 8.3607 107.2368 45.5264 0.0000 174.8038 99 K 4.0668 7.6740 117.5952 57.1569 32.4704 176.8716 100 L 4.7206 7.1945 118.3086 52.0550 45.1205 176.1789 101 E 4.1438 8.5016 119.5785 56.1026 30.5565 177.9976 102 S 4.1127 8.6650 116.5508 61.7457 63.0491 177.1987 103 R 3.8159 7.7182 115.3220 58.4248 29.3147 176.6585 104 Y 4.8459 7.7249 114.8340 57.7128 38.9325 174.9490 105 H 4.4782 7.9592 121.1641 56.3566 31.5614 175.9532 106 V 3.8803 8.7946 127.6194 65.4187 31.0495 178.4282 107 N 4.4256 8.5961 116.4955 56.1761 38.4440 177.1528 108 T 3.8772 7.9787 116.7200 66.8119 68.5088 176.3905 109 L 3.9480 7.9935 120.5739 58.0343 41.6856 179.6417 110 T 3.2947 7.9274 115.6416 66.6176 68.5385 176.0227 111 Y 3.9964 8.2287 121.5258 60.8302 38.8250 178.2511 112 S 3.9737 8.2445 115.8682 61.4707 62.8433 176.5546 113 A 3.8257 7.9835 123.5124 55.0050 18.0381 179.4619 114 A 3.8326 7.8794 119.0353 55.1136 18.4072 179.8297 115 A 3.7124 7.5268 118.7682 55.2797 18.4641 179.9597 116 K 3.8861 8.0585 117.0563 59.1511 31.9133 178.5578 117 L 4.3597 7.9420 116.1800 53.3432 42.3579 176.4225 118 K 3.7673 7.6609 117.2325 57.8164 30.2963 174.0983 119 G 4.4261 8.2937 106.7753 44.7175 0.0000 172.9902 120 E 4.9348 8.6417 118.5910 54.6996 32.0241 175.7048 121 S 5.2227 8.4251 116.1178 56.8774 66.2657 173.0955 122 H 4.8592 8.8276 118.6235 54.1702 30.9435 173.4834 123 L 4.4434 8.7034 123.3505 53.7076 42.7945 176.1898 124 A 4.4287 8.5595 125.1426 51.2603 19.7569 177.9187 125 D 5.0470 8.7631 124.9021 53.8143 41.8916 176.0988 126 F 5.1768 6.9493 112.2683 54.2106 41.3806 172.2717 127 P 4.8766 0.0000 0.0000 62.3039 32.5326 176.2058 128 A 4.6049 9.3417 122.5157 54.4605 19.4999 177.5896 129 L 5.3194 8.1296 114.0997 52.9575 44.4938 176.4156 130 L 4.8332 8.7314 123.4341 53.0502 43.9314 176.9552 131 D 4.3847 9.0972 123.5410 56.3333 41.4819 176.4221 132 N 4.7788 7.9051 117.8889 51.4648 40.2719 173.4915 133 P 4.2414 0.0000 0.0000 65.3543 31.4663 178.0848 134 L 3.9053 7.9868 119.2406 58.4257 41.9812 179.1500 135 I 3.6429 7.8664 118.8192 64.3607 36.9172 177.9501 136 R 3.8366 7.7610 118.1238 59.8478 29.8745 177.9177 137 N 4.4646 8.2889 115.1364 56.1965 38.6037 177.3942 138 G 3.7233 8.0153 106.3138 47.3847 0.0000 175.5691 139 I 3.9575 7.6370 123.5135 60.8857 36.0916 177.2214 *141 Q 4.2387 7.9212 119.5286 55.3265 31.1589 175.4191 142 S 4.4447 7.6917 112.9403 58.5932 65.2093 174.8278 143 Q 3.9188 8.5495 123.8019 59.5326 28.9360 177.7214 144 H 4.1292 8.3670 118.8684 59.5047 29.7515 176.5963 145 F 3.7087 7.7579 121.6391 61.2229 39.1277 177.0995 146 K 3.7649 8.0721 117.9633 59.7291 31.5269 179.4945 147 T 3.6373 8.0211 116.2890 66.5885 68.3773 176.8549 148 I 3.5989 7.3669 121.6371 64.2963 37.0491 178.4333 149 S 2.8427 7.5543 114.0544 60.8762 61.8406 176.1161 150 A 4.1854 7.4736 123.9132 54.4337 18.1944 178.9962 151 Y 4.2440 7.2123 115.5118 61.1177 37.8213 178.3391 152 W 4.5070 7.9745 119.9175 60.1901 29.2204 178.2414 153 D 4.5764 8.4969 118.5959 56.3892 39.8713 177.5634 154 N 4.9970 7.9082 114.8801 52.4656 39.3797 174.1985 155 L 4.0462 7.7008 121.2035 56.2658 42.9434 177.0290 156 D 4.6304 9.2405 125.3552 55.8027 42.9153 176.6684 157 I 5.2050 7.5441 117.7353 59.4431 41.4945 174.1164 158 A 5.0351 9.1570 128.5772 50.0211 22.0895 175.0889 159 L 5.0571 8.5962 121.3064 52.9109 44.5616 176.0002 160 V 4.5494 8.6295 123.5791 61.3854 35.2505 174.7009 161 G 4.4259 8.7452 114.7915 46.3065 0.0000 172.6627 162 I 4.7589 8.1383 120.2439 59.0907 39.2834 176.4314 163 G 4.6429 9.2461 115.2827 46.3833 0.0000 171.8466 164 S 3.8888 8.5576 112.5039 56.3521 65.8690 173.0867 165 P 3.6749 0.0000 0.0000 62.3909 29.0386 175.5624 *172 N 4.5317 8.3312 120.7690 52.5371 41.1708 176.9012 173 W 4.6789 8.6492 127.5961 61.1346 30.7231 177.5230 174 H 4.2553 8.5486 115.3250 58.5535 28.0225 177.4222 175 A 3.8165 7.7533 121.1886 55.2791 18.3496 179.3009 176 F 4.1231 8.4613 115.5499 60.2027 38.7696 176.7775 177 Y 4.7641 7.4966 113.8354 55.8788 38.9507 176.3053 178 G 4.1904 8.1658 111.2977 44.4737 0.0000 175.0531 179 G 3.5913 8.5528 105.1186 47.8796 0.0000 175.6528 180 E 4.0950 8.1482 120.9917 59.2590 29.6943 179.2106 181 E 3.9899 7.7392 117.8234 58.8924 29.6369 179.0778 182 S 4.1333 8.3711 113.6064 61.2135 62.3464 175.6763 183 D 4.3663 8.1812 121.8816 57.4811 40.5967 178.0636 184 D 4.3836 7.6066 118.8823 57.6746 40.8887 179.3342 185 L 3.8408 7.6596 118.5248 58.0992 41.5114 179.5153 186 N 4.4423 8.7377 114.8413 55.9754 38.4983 176.8530 187 A 4.3019 8.4839 121.5387 53.9159 18.9126 178.6691 188 R 4.3110 7.7375 114.6879 55.4424 30.2994 176.3867 189 Q 3.5373 8.0555 115.8327 56.5941 26.2282 173.7005 190 V 3.7353 7.7344 117.9958 63.4411 31.7534 175.4478 191 A 4.1961 9.0657 130.2971 54.5325 19.8133 176.6413 192 G 3.9194 7.1407 100.2560 46.0694 0.0000 171.8730 193 D 4.8408 8.4566 117.6589 51.8770 43.3361 174.5025 194 I 4.5895 8.3750 120.4993 60.3044 40.8492 175.6619 195 C 3.5492 9.3757 124.3350 60.7855 25.7722 172.8091 196 S 3.2586 7.9140 109.0110 59.8392 60.4477 172.5845 197 R 4.2975 7.1776 118.5388 54.4010 33.0234 175.4755 198 F 5.0411 8.6672 122.8496 56.2351 41.1031 175.0945 199 F 5.2495 7.9917 115.3618 55.8424 42.0351 173.8517 200 D 5.1259 9.5310 120.8408 53.3770 42.0844 177.4143 201 I 3.8695 8.2287 118.7580 63.6833 37.9790 176.3514 202 H 4.7923 8.1402 115.1000 55.8746 29.1245 175.6554 203 G 4.0232 8.1039 108.0937 44.9713 0.0000 175.9209 204 A 4.4135 7.7027 128.3371 51.6787 18.0160 177.7723 *206 V 4.1481 8.2141 116.5628 62.3055 32.3247 175.9047 207 E 4.1721 8.6633 124.4642 56.7448 29.9349 175.8141 208 T 4.5849 8.4320 110.9498 60.3343 71.9429 175.0311 209 N 4.4425 8.2326 118.8169 53.1794 37.2824 176.4957 *211 S 4.4756 8.1084 112.5480 57.9040 64.7009 174.2989 212 E 4.6755 8.1998 117.1151 55.5770 31.3208 176.2283 213 K 4.7211 7.9429 119.3686 57.0060 33.5884 175.4142 214 T 5.0364 8.1389 115.8445 62.9611 71.6546 174.5656 215 L 4.9822 9.0731 126.0861 52.7787 42.6814 175.4116 216 S 4.5966 8.2454 116.1965 56.5027 66.0143 174.2672 217 I 2.9898 7.1009 121.6477 60.3900 38.0501 175.8797 218 E 4.3681 8.5449 135.0000 56.2043 28.3509 178.1178 *220 N 4.6938 8.8284 111.2885 53.3344 40.9638 176.5245 221 K 4.2684 7.9025 117.0631 59.1793 32.2839 178.9305 222 L 3.9166 7.9623 120.7305 58.1109 41.8232 179.1259 223 K 4.1278 7.4455 117.1229 58.6854 32.0212 178.5190 224 Q 4.1621 7.6565 116.5641 56.1047 29.3348 176.1813 225 A 4.3454 7.0583 122.0806 51.5533 19.1175 177.2490 226 R 3.8592 8.6393 122.4424 59.1520 30.6315 176.3732 227 Y 5.0981 7.9239 115.6665 56.0983 41.9302 174.4174 228 S 4.9635 9.5551 118.8182 56.7506 65.1936 172.8944 229 I 4.5757 8.9256 130.4105 59.6915 38.4840 175.4631 230 G 4.1620 8.6595 115.8024 45.4958 0.0000 171.5551 231 I 5.1350 8.4309 123.6089 59.4209 40.8414 174.1211 232 A 4.4067 8.4233 129.9230 51.6331 22.9184 175.0912 *234 S 4.2463 8.3005 112.0448 57.9859 63.6953 175.0081 235 E 4.0095 8.6205 120.7943 59.4932 29.0322 178.9756 236 E 3.9494 7.4939 117.1435 58.5067 29.9582 177.7044 237 K 4.5142 7.7425 118.4600 55.4856 32.3611 176.9651 238 Y 4.1562 7.5182 119.7420 61.8088 38.5628 178.2931 239 S 4.0056 8.3480 114.3563 61.3977 62.9938 176.3960 240 G 3.6423 7.9641 108.9679 47.5414 0.0000 175.5632 241 I 3.6985 7.8672 122.8200 64.0054 37.0488 178.4906 242 I 3.4641 7.8798 120.0570 63.6623 37.6025 178.1760 243 G 3.6763 8.3304 106.7393 47.0238 0.0000 175.5345 244 A 3.5283 7.9869 123.3072 54.5681 18.3055 179.6017 245 L 3.6735 7.7153 117.3845 58.1799 41.4781 180.1626 246 R 4.0133 7.9337 116.7377 58.9864 30.0795 178.8877 247 G 3.0005 7.8709 103.8292 44.4244 0.0000 173.6693 248 K 3.8949 7.4688 119.0428 57.5473 30.1558 176.5147 249 Y 4.3074 7.0519 118.3963 59.7317 38.0569 176.3302 250 I 4.8697 7.6713 111.1581 57.9674 40.4161 174.5683 251 N 5.0815 8.9949 117.6206 52.7374 38.9417 173.2565 252 C 5.3394 7.9141 116.2142 58.3097 33.3011 172.5495 253 L 5.0805 8.5978 122.7525 53.4031 45.5785 175.0023 254 V 4.7656 8.8685 126.7364 61.7905 33.7105 174.3405 255 T 5.1451 8.9347 122.8550 61.5513 71.1865 171.4184 256 N 5.5549 8.5821 118.3141 50.9823 40.3654 176.0917 257 S 4.1491 8.8192 114.6832 61.5372 63.0769 176.6139 258 S 4.1460 8.1489 118.3114 62.0085 62.5889 176.8489 259 T 3.9585 8.4202 117.8715 66.3149 67.9469 176.4308 260 A 4.0391 7.9598 121.9955 55.5478 18.6964 179.2582 261 E 4.1320 8.4027 116.6327 59.6347 29.0638 179.3287 262 L 4.0036 7.8575 118.6250 58.2761 41.5249 179.7676 263 L 4.4167 8.1436 117.3469 57.1460 41.6661 178.6656 264 L 4.3794 7.8005 117.4685 55.5655 42.0172 176.5516 265 K 4.1229 7.6375 123.5163 56.6893 32.1076 176.0611 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 10 N 8.28 4.71 0.00 2.75 2.61 0.00 0.00 6.71 6.77 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 11 E 5.90 3.88 0.00 2.13 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 2.39 2.62 0.00 12 N 9.07 4.37 0.00 2.80 3.04 0.00 0.00 7.17 6.74 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 13 L 7.80 4.34 0.00 1.95 1.77 0.95 1.10 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 14 W 8.10 4.11 0.00 3.42 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.42 3.68 0.00 2.20 1.73 1.08 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.51 3.90 0.00 2.21 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 2.39 0.00 17 Q 8.12 3.94 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 18 Q 7.70 3.70 0.00 1.65 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 19 L 7.84 4.06 0.00 1.88 1.80 0.93 0.85 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 20 K 8.11 3.88 0.00 1.96 1.86 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.61 1.49 7.81 21 Q 7.73 3.92 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 22 K 7.95 3.81 0.00 1.50 1.17 0.00 1.50 0.00 0.00 1.16 0.00 0.00 3.17 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.30 1.01 7.81 23 F 7.85 4.67 0.00 3.04 2.96 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 24 G 7.92 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 25 L 7.65 4.46 0.00 1.70 1.75 0.91 0.84 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 26 K 8.93 4.27 0.00 2.01 1.93 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.93 1.65 7.81 27 D 7.80 4.86 0.00 2.52 2.38 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 28 V 8.18 4.86 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 0.78 0.00 0.00 0.92 0.00 0.00 29 V 9.00 4.64 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 1.21 0.00 0.00 0.97 0.00 0.00 30 V 8.84 4.87 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.93 0.00 0.00 31 V 8.62 4.09 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 0.96 0.00 0.00 32 S 8.96 4.33 0.00 3.88 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 33 G 7.58 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *36 E 8.23 4.19 0.00 2.08 1.89 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 2.31 2.29 0.00 37 D 8.33 4.88 0.00 2.76 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 38 E 9.77 3.90 0.00 1.94 1.91 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 2.29 2.46 0.00 39 E 8.19 4.12 0.00 2.02 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 2.31 2.42 0.00 40 T 7.78 4.05 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 1.23 0.00 0.00 41 Q 7.35 4.04 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.97 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 42 L 7.60 4.18 0.00 1.58 1.85 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.59 4.37 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 *46 G 7.80 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 0.00 0.00 0.00 47 L 8.15 3.87 0.00 1.71 1.57 0.87 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 48 H 7.57 4.80 0.00 3.23 3.32 0.00 5.95 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.13 3.58 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 0.00 0.00 0.00 50 A 8.30 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.06 3.95 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 52 L 8.07 3.92 0.00 1.72 1.86 0.83 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.14 3.87 0.00 1.77 1.84 0.91 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.01 4.38 0.00 2.88 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.39 4.13 0.00 1.82 2.03 0.00 3.29 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 56 L 7.62 4.11 0.00 1.75 1.59 0.69 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.19 4.37 0.00 1.70 1.64 0.96 0.80 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 58 E 9.48 4.78 0.00 2.12 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 2.44 2.42 0.00 59 P 0.00 4.55 0.00 2.05 2.04 0.00 3.74 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 2.05 2.13 0.00 60 G 9.23 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 0.00 0.00 0.00 61 D 8.01 4.67 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 9.59 4.56 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.80 0.99 0.00 0.00 63 V 9.45 4.62 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.95 0.00 0.00 64 G 9.13 4.92 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 0.00 0.00 0.00 65 F 8.66 5.30 0.00 3.07 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.81 4.71 0.00 3.71 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 W 7.93 4.84 0.00 3.53 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 68 G 9.16 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 69 R 8.44 3.25 0.00 1.54 1.78 0.00 3.02 0.00 0.00 2.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 70 A 7.82 3.95 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 71 V 7.85 3.63 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 1.06 0.00 0.00 72 S 8.39 4.16 0.00 4.35 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 73 A 8.24 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.75 4.18 0.00 1.75 1.92 0.96 0.97 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 75 V 8.10 3.60 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 0.92 0.00 0.00 0.95 0.00 0.00 76 E 8.60 4.08 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 77 N 7.55 4.84 0.00 2.90 2.83 0.00 0.00 7.02 7.86 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 78 L 7.27 4.12 0.00 1.77 1.62 0.97 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.27 0.00 2.04 1.99 0.00 3.68 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 2.03 2.08 0.00 80 Q 8.46 4.23 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 81 A 8.83 4.18 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.54 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.57 4.56 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 84 S 8.56 4.31 0.00 3.85 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.28 4.62 0.00 1.88 1.87 0.00 3.34 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 86 Q 8.26 3.62 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 87 L 7.73 4.71 0.00 1.62 1.61 0.95 0.83 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 88 I 8.59 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3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.75 0.00 97 S 9.11 3.86 0.00 4.05 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.36 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 99 K 7.67 4.07 0.00 1.80 1.48 0.00 1.66 0.00 0.00 1.89 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.33 7.81 100 L 7.19 4.72 0.00 1.30 1.44 0.71 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.50 4.14 0.00 2.05 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 2.44 2.03 0.00 102 S 8.66 4.11 0.00 3.83 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 0.00 103 R 7.72 3.82 0.00 1.64 1.78 0.00 2.22 0.00 0.00 2.91 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.00 104 Y 7.72 4.85 0.00 3.04 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 H 7.96 4.48 0.00 3.30 3.28 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.79 3.88 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 1.11 0.00 0.00 1.09 0.00 0.00 107 N 8.60 4.43 0.00 2.65 2.87 0.00 0.00 7.13 7.05 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 0.00 108 T 7.98 3.88 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 1.20 0.00 0.00 109 L 7.99 3.95 0.00 1.86 1.67 1.26 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.93 3.29 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 1.27 0.00 0.00 111 Y 8.23 4.00 0.00 3.06 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 0.00 112 S 8.24 3.97 0.00 3.96 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 0.00 113 A 7.98 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.88 3.83 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 0.00 115 A 7.53 3.71 1.12 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 0.00 0.00 116 K 8.06 3.89 0.00 1.86 2.01 0.00 1.92 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.62 7.81 117 L 7.94 4.36 0.00 1.69 1.72 1.06 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.66 3.77 0.00 1.87 1.85 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.44 7.81 119 G 8.29 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.64 4.93 0.00 1.90 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 2.22 2.23 0.00 121 S 8.43 5.22 0.00 3.84 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 0.00 122 H 8.83 4.86 0.00 2.94 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.70 4.44 0.00 1.64 1.73 0.85 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.56 4.43 0.59 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 0.00 125 D 8.76 5.05 0.00 2.66 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 0.00 126 F 6.95 5.18 0.00 3.25 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.88 0.00 2.49 2.21 0.00 3.77 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 128 A 9.34 4.60 1.67 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 0.00 0.00 129 L 8.13 5.32 0.00 1.64 1.68 1.14 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.73 4.83 0.00 1.51 1.57 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 131 D 9.10 4.38 0.00 2.69 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 0.00 132 N 7.91 4.78 0.00 2.75 2.69 0.00 0.00 7.24 7.71 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 0.00 133 P 0.00 4.24 0.00 2.18 2.07 0.00 3.66 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.36 0.00 134 L 7.99 3.91 0.00 1.82 1.72 0.91 1.04 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 0.00 135 I 7.87 3.64 1.88 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 1.53 0.78 0.92 0.00 0.00 136 R 7.76 3.84 0.00 1.80 2.14 0.00 3.47 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 137 N 8.29 4.46 0.00 2.81 2.80 0.00 0.00 7.06 7.38 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 0.00 138 G 8.02 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 0.00 0.00 0.00 139 I 7.64 3.96 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 1.44 0.51 0.80 0.00 0.00 *141 Q 7.92 4.24 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.04 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 142 S 7.69 4.44 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 8.55 3.92 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 144 H 8.37 4.13 0.00 3.34 3.43 0.00 5.93 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 0.00 145 F 7.76 3.71 0.00 2.97 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 0.00 146 K 8.07 3.76 0.00 2.00 1.79 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.69 7.81 147 T 8.02 3.64 4.33 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 1.14 0.00 0.00 148 I 7.37 3.60 1.33 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 1.42 0.89 0.48 0.00 0.00 149 S 7.55 2.84 0.00 2.72 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.47 4.19 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.21 4.24 0.00 3.10 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 0.00 152 W 7.97 4.51 0.00 3.58 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 0.00 153 D 8.50 4.58 0.00 2.92 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 0.00 154 N 7.91 5.00 0.00 2.73 2.82 0.00 0.00 6.92 8.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 7.70 4.05 0.00 1.93 1.58 1.03 1.49 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 0.00 156 D 9.24 4.63 0.00 2.82 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 0.00 157 I 7.54 5.21 1.84 0.00 0.00 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 1.42 1.07 0.90 0.00 0.00 158 A 9.16 5.04 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.60 5.06 0.00 1.41 1.60 0.51 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 160 V 8.63 4.55 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 0.97 0.00 0.00 0.81 0.00 0.00 161 G 8.75 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.14 4.76 1.93 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 1.35 0.76 1.07 0.00 0.00 163 G 9.25 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.56 3.89 0.00 3.78 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 0.00 165 P 0.00 3.67 0.00 1.69 1.67 0.00 3.11 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.46 0.00 *172 N 8.33 4.53 0.00 2.99 2.94 0.00 0.00 6.64 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 W 8.65 4.68 0.00 3.72 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 H 8.55 4.26 0.00 3.29 3.38 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 A 7.75 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 F 8.46 4.12 0.00 1.52 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 0.00 0.00 0.00 177 Y 7.50 4.76 0.00 2.95 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.17 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 0.00 0.00 0.00 0.00 179 G 8.55 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 0.00 180 E 8.15 4.09 0.00 2.02 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 2.40 2.41 0.00 181 E 7.74 3.99 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 182 S 8.37 4.13 0.00 3.95 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 0.00 183 D 8.18 4.37 0.00 2.91 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 0.00 184 D 7.61 4.38 0.00 2.63 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 7.66 3.84 0.00 2.03 1.84 0.11 -0.71 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 0.00 186 N 8.74 4.44 0.00 2.81 2.93 0.00 0.00 7.11 7.50 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 0.00 187 A 8.48 4.30 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 0.00 188 R 7.74 4.31 0.00 1.94 1.95 0.00 3.28 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 189 Q 8.06 3.54 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 190 V 7.73 3.74 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.91 0.00 0.00 191 A 9.07 4.20 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 0.00 192 G 7.14 3.92 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 0.00 0.00 0.00 193 D 8.46 4.84 0.00 1.58 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.37 4.59 1.84 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 1.30 1.03 0.81 0.00 0.00 195 C 9.38 3.55 0.00 2.74 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 0.00 196 S 7.91 3.26 0.00 3.77 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 0.00 197 R 7.18 4.30 0.00 1.77 1.56 0.00 3.10 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.47 0.00 198 F 8.67 5.04 0.00 2.82 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 0.00 199 F 7.99 5.25 0.00 3.25 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 D 9.53 5.13 0.00 2.81 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 0.00 201 I 8.23 3.87 1.84 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 1.36 1.29 0.65 0.00 0.00 202 H 8.14 4.79 0.00 3.24 3.32 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.10 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 0.00 204 A 7.70 4.41 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 *206 V 8.21 4.15 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 0.89 0.00 0.00 0.94 0.00 0.00 207 E 8.66 4.17 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 208 T 8.43 4.58 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 0.91 0.00 0.00 209 N 8.23 4.44 0.00 2.72 2.95 0.00 0.00 6.87 7.57 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 *211 S 8.11 4.48 0.00 3.89 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 0.00 212 E 8.20 4.68 0.00 2.02 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 2.14 2.25 0.00 213 K 7.94 4.72 0.00 2.11 1.96 0.00 1.48 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.46 7.81 214 T 8.14 5.04 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 1.19 0.00 0.00 215 L 9.07 4.98 0.00 2.06 1.97 1.07 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.25 4.60 0.00 3.61 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 0.00 217 I 7.10 2.99 0.67 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.57 0.54 0.00 0.00 218 E 8.54 4.37 0.00 2.11 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 *220 N 8.83 4.69 0.00 2.89 2.85 0.00 0.00 6.94 6.75 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 0.00 221 K 7.90 4.27 0.00 1.95 1.87 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.53 7.81 222 L 7.96 3.92 0.00 1.66 1.62 0.83 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 223 K 7.45 4.13 0.00 2.11 1.84 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.64 1.59 7.81 224 Q 7.66 4.16 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 225 A 7.06 4.35 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 R 8.64 3.86 0.00 1.60 1.73 0.00 2.95 0.00 0.00 3.03 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 227 Y 7.92 5.10 0.00 2.92 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 0.00 228 S 9.56 4.96 0.00 3.83 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 I 8.93 4.58 1.91 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 1.12 0.49 0.88 0.00 0.00 230 G 8.66 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 I 8.43 5.14 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 1.19 1.49 0.98 0.00 0.00 232 A 8.42 4.41 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 *234 S 8.30 4.25 0.00 4.06 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 0.00 235 E 8.62 4.01 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 236 E 7.49 3.95 0.00 2.03 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 2.32 2.34 0.00 237 K 7.74 4.51 0.00 1.91 1.77 0.00 1.79 0.00 0.00 1.98 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.28 7.81 238 Y 7.52 4.16 0.00 3.05 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 0.00 239 S 8.35 4.01 0.00 4.07 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 0.00 240 G 7.96 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 I 7.87 3.70 1.75 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 1.39 0.77 0.77 0.00 0.00 242 I 7.88 3.46 1.27 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 1.38 1.45 0.60 0.00 0.00 243 G 8.33 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 A 7.99 3.53 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 0.00 245 L 7.72 3.67 0.00 1.46 1.24 -0.22 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 246 R 7.93 4.01 0.00 1.72 2.07 0.00 3.34 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 247 G 7.87 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 0.00 0.00 0.00 248 K 7.47 3.89 0.00 1.66 1.75 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.23 7.81 249 Y 7.05 4.31 0.00 2.80 2.83 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 0.00 250 I 7.67 4.87 2.10 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.53 0.91 0.00 0.00 251 N 8.99 5.08 0.00 2.84 3.01 0.00 0.00 6.89 7.20 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 0.00 252 C 7.91 5.34 0.00 2.82 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 0.00 253 L 8.60 5.08 0.00 1.66 1.39 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 254 V 8.87 4.77 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 0.89 0.00 0.00 0.92 0.00 0.00 255 T 8.93 5.15 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 256 N 8.58 5.55 0.00 2.88 2.92 0.00 0.00 5.73 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 S 8.82 4.15 0.00 4.14 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 S 8.15 4.15 0.00 3.91 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 0.00 259 T 8.42 3.96 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 1.27 0.00 0.00 260 A 7.96 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 E 8.40 4.13 0.00 2.08 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 2.42 2.59 0.00 262 L 7.86 4.00 0.00 2.05 1.82 0.92 0.27 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 0.00 263 L 8.14 4.42 0.00 1.92 1.92 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 264 L 7.80 4.38 0.00 1.84 1.75 0.92 0.65 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 0.00 265 K 7.64 4.12 0.00 1.88 1.78 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.17 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.46 7.81 * Residues marked with a * may have inaccurate shift predictions.