NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 I 5.0713 7.7832 120.2242 60.5543 38.6723 175.6971 7 W 4.5822 8.6090 124.8593 58.2160 29.6109 173.6424 8 V 3.9132 8.2413 115.8987 63.2004 32.4385 175.5493 9 E 4.4304 8.6957 121.5074 57.7342 30.8313 177.4823 10 K 3.9495 8.2729 117.6156 58.8729 32.1744 176.1174 11 Y 4.4900 7.5827 113.4403 57.4880 39.2270 175.0095 12 R 3.7705 8.3163 121.2659 56.0499 30.2109 174.6698 13 P 4.2769 0.0000 0.0000 63.3219 31.8881 176.2113 14 R 4.2106 8.3803 119.1705 56.7117 31.9088 176.6905 15 T 4.7613 7.0984 109.8008 58.3236 70.8838 173.9454 16 L 3.9224 8.4322 126.4877 58.2371 41.8609 179.6138 17 D 4.3827 8.1203 116.6059 57.1384 40.7338 177.2428 18 E 4.2009 8.2760 116.4106 56.4590 29.9906 176.2299 19 V 3.8634 7.5317 120.1904 61.7793 31.2508 175.7785 20 V 4.1705 8.2563 126.9864 61.3172 33.2297 177.2433 21 G 4.1013 8.8230 107.8801 45.9179 0.0000 174.0931 22 Q 4.5934 7.3604 118.4237 55.2438 29.8997 177.6942 23 D 4.3574 8.6223 118.8624 58.2799 40.6354 178.4800 24 E 3.7560 7.7468 117.6334 59.1447 30.3412 178.9343 25 V 3.7524 7.4676 117.5629 65.9428 31.8273 177.9193 26 I 3.5719 7.6975 119.6161 64.3962 36.7127 178.1330 27 Q 3.9996 8.1862 118.3994 58.9922 28.8606 179.1797 28 R 4.3764 7.8839 114.8708 57.4227 29.8655 177.8789 29 L 4.3272 7.9300 121.1170 57.3976 41.9880 178.7709 30 K 4.2381 8.6651 119.5676 59.2489 31.7310 178.9956 31 G 3.7319 7.4749 102.2990 46.7236 0.0000 173.2993 32 Y 4.5902 7.8746 115.4596 57.6622 39.1961 177.5492 33 V 4.1467 8.0483 113.0770 62.4335 32.9092 177.3662 34 E 4.1432 8.2536 118.6557 58.9515 29.4829 177.9917 35 R 4.1662 7.9519 115.5097 55.8034 31.2410 176.0866 36 K 4.1852 7.9631 115.8042 58.0089 29.2859 174.8422 37 N 4.6225 7.9439 114.1669 51.4444 41.4092 175.6108 38 I 4.4840 7.6505 122.4848 59.1833 39.7066 173.0461 39 P 4.5108 0.0000 0.0000 62.0715 32.5774 175.4789 40 H 4.2518 8.3463 116.3388 55.2932 29.4178 173.8781 41 L 5.0921 9.1591 124.6225 54.0991 43.5425 175.7212 42 L 5.1260 9.3685 125.4381 53.5199 44.6826 174.9096 43 F 5.9502 9.9883 127.2382 56.3845 40.5835 174.8301 44 S 5.8979 10.4746 119.4710 54.7876 65.0809 173.6416 45 G 4.3338 7.7725 116.1358 43.9743 0.0000 169.9674 46 P 4.3594 0.0000 0.0000 61.9332 31.5758 174.1527 47 P 4.4486 0.0000 0.0000 63.4657 32.3167 175.7763 48 G 3.9087 8.8199 106.8248 47.5060 0.0000 174.8942 49 T 4.0477 8.3884 108.6265 60.2374 70.7629 173.3093 50 G 3.6596 8.5356 111.4673 45.5051 0.0000 175.6275 51 K 3.0544 7.9337 121.4198 59.6073 32.0179 179.2056 52 T 3.2367 7.8909 114.9613 66.1724 68.4020 176.4583 53 A 3.8582 7.8271 122.4507 55.5122 18.5519 179.7398 54 T 4.0108 8.3226 108.3042 64.6642 68.6343 176.4889 55 A 4.3511 8.1608 123.0126 54.1818 18.2524 179.5661 56 I 2.8175 7.3370 118.7183 63.9426 36.9253 178.1055 57 A 3.7395 8.0892 121.0650 53.8791 16.5995 179.1165 58 L 3.8498 7.9993 119.5915 57.6496 42.2892 178.5445 59 A 3.6883 7.0328 120.0589 54.3916 17.9651 179.4185 60 R 3.4588 7.6174 117.8889 58.7457 29.8260 177.4959 61 D 4.4946 7.4808 116.0740 55.1300 40.8563 177.3948 62 L 4.3957 6.8489 117.8137 54.5336 43.1772 177.3697 63 F 5.1349 7.5765 114.8310 56.4859 40.2097 176.5414 64 G 4.0005 8.4107 109.6563 44.5922 0.0000 173.2186 65 E 4.7050 8.6441 123.6805 55.4734 32.4345 175.8957 66 N 4.9741 7.6582 115.2226 52.7549 39.4724 177.0737 67 W 4.6724 8.2340 117.5958 60.0948 28.6432 177.0142 68 R 3.7704 6.9154 117.6050 59.1708 29.4023 178.1167 69 D 4.4400 7.8910 116.8717 57.3770 40.8912 177.2097 70 N 4.8265 8.1692 115.9525 53.9023 39.5280 174.8960 71 F 4.7724 7.9009 122.7885 58.5889 40.6191 174.2184 72 I 4.3799 7.2464 124.7160 59.4904 41.4623 173.3201 73 E 5.0613 8.5427 127.5752 55.0011 30.7219 174.8363 74 M 4.8802 8.4427 122.9839 53.6641 35.1943 173.4371 75 N 4.7884 8.8016 120.6603 53.7516 39.4499 174.3972 76 A 4.4841 8.9011 127.8141 52.6269 18.8632 177.9378 77 S 4.3165 8.7756 110.1781 59.0722 64.1933 174.9775 78 D 4.5766 7.9290 121.6390 53.2570 38.9681 175.7149 79 E 4.0235 8.5599 123.4333 58.0818 29.6526 178.6494 80 R 4.4408 7.9989 114.0131 55.8382 30.0903 176.5703 81 G 4.0158 7.7760 106.6817 45.5790 0.0000 175.5512 82 I 3.6650 7.8540 119.5056 64.0917 38.0768 176.7073 83 D 4.6079 7.9749 117.8117 55.9758 41.1479 178.3720 84 V 3.8963 7.6870 118.3060 62.6594 33.1633 176.7805 85 V 4.2471 7.5487 120.6494 62.0064 30.4058 175.0105 86 R 4.5558 7.4468 120.7288 56.9279 32.4047 176.5595 87 H 4.3627 8.1502 116.7345 58.1591 30.1820 176.4388 88 K 4.1002 7.9813 119.5743 58.3945 32.1164 178.3248 89 I 3.8215 7.6779 119.7359 63.6327 36.5606 177.7636 90 K 4.0935 7.8352 118.5495 58.3943 31.9984 178.4941 91 E 3.9395 7.7772 119.1555 58.9071 29.3154 178.3798 92 F 4.2769 7.6734 119.2537 60.2093 39.5507 176.4896 93 A 3.9408 7.2705 118.0039 53.3877 18.9352 178.6790 94 R 4.1762 7.3646 115.8730 57.2949 30.3111 176.3922 95 T 4.0740 6.9405 108.7789 60.3334 69.2378 174.3040 96 A 4.0006 8.3089 130.0571 50.5279 19.1899 174.4419 97 P 3.8503 0.0000 0.0000 62.6720 31.3453 176.4597 98 I 3.6768 8.1503 125.0522 63.3335 36.0301 174.7422 99 G 4.0986 7.6934 121.6801 43.5513 0.0000 171.4912 100 G 4.2855 6.8426 108.9579 44.5071 0.0000 172.4811 101 A 4.9714 8.1686 121.4847 49.4336 21.7681 175.7744 102 P 4.5470 0.0000 0.0000 64.2812 31.9269 176.2600 103 F 5.3730 8.3927 110.6568 54.9838 41.2375 174.6386 104 K 4.9025 9.0627 116.9378 54.9307 36.8628 175.6110 105 I 5.2633 9.0699 122.0946 59.8005 41.0906 174.5600 106 I 4.5034 8.8518 126.0694 59.4323 40.6797 174.0577 107 F 5.1484 8.3725 129.3083 56.8172 41.6949 174.3887 108 L 4.8284 7.8934 127.4321 52.7811 43.4236 174.8256 109 D 4.2873 8.2574 124.3793 54.0338 42.8389 175.3867 110 E 3.9263 8.7837 120.1617 57.1205 27.2628 175.8871 111 A 4.1016 7.8634 124.4491 55.4604 18.5229 180.4140 112 D 4.8810 7.8954 114.3292 53.9175 39.1012 176.5775 113 A 4.6449 8.1995 122.2101 52.7747 20.8703 177.1773 114 L 4.4788 7.6597 115.7282 53.4892 43.1930 176.7740 115 T 4.2055 8.4136 111.8513 61.1582 69.7180 175.9053 116 A 3.8554 8.3617 125.3466 55.5327 18.7734 179.3064 117 D 4.2730 7.7868 115.5263 57.4479 40.4002 178.6767 118 A 4.0266 7.9520 120.7787 55.4691 18.2557 179.4803 119 Q 3.8666 7.6437 116.1504 58.9826 28.6749 178.7518 120 A 3.9383 8.0306 121.5515 55.1966 18.2619 179.3780 121 A 3.9802 7.4250 117.0881 54.7062 18.4894 179.1873 122 L 3.7399 7.4763 119.3697 58.1017 42.1050 179.0128 123 R 3.8492 8.4858 119.4450 59.2778 30.1925 177.4714 124 R 4.2430 7.8785 115.0180 56.4052 29.9020 176.7668 125 T 4.5471 7.8636 105.3279 61.5334 70.7994 175.4980 126 M 4.3678 8.0337 122.2766 58.3842 32.4334 177.7975 127 E 4.1385 8.0477 116.1328 58.7222 30.0093 177.7253 128 M 4.0958 7.8004 117.1299 56.6932 32.2150 175.4029 129 Y 4.9882 7.4323 116.8059 55.6381 38.1144 175.4098 130 S 4.6941 8.3426 113.0699 57.7324 64.7514 175.6362 131 K 4.6215 8.1223 119.5088 56.3241 32.6175 175.6160 132 S 4.8601 8.0499 113.7942 59.7160 69.8750 173.9798 133 C 5.1855 7.5803 117.6439 58.0697 30.3594 173.3630 134 R 4.8475 8.6046 118.2640 55.2803 34.8584 174.0922 135 F 5.3991 9.3504 121.0680 55.8492 42.3265 174.3863 136 I 4.7919 8.9619 123.6798 59.5742 39.9099 174.4527 137 L 4.7526 8.9950 128.1762 53.0394 43.6157 175.5931 138 S 5.2351 8.0879 120.0920 57.5750 64.0718 172.6542 139 C 5.0195 8.9939 120.3352 57.0850 32.6757 174.4488 140 N 4.3516 9.2257 119.9385 55.9016 39.7821 174.6572 141 Y 5.0621 7.5419 114.8990 55.8690 42.1175 176.3589 142 V 3.6607 8.7454 123.6231 66.0407 31.9228 177.8100 143 S 4.0423 8.2842 113.0757 61.1234 62.0264 174.4946 144 R 4.3360 7.8434 117.3861 55.9558 29.8306 175.3770 145 I 4.3823 7.6906 118.4088 59.3949 38.7022 175.4905 146 I 3.7134 7.7626 119.2821 61.2334 37.9941 176.4232 147 E 3.8983 9.0466 123.2400 59.2787 29.2703 177.3860 148 P 4.2256 0.0000 0.0000 64.6163 31.7119 177.1436 149 I 4.1848 7.5094 117.9288 63.3406 38.3056 177.5075 150 Q 3.9438 8.1158 118.2512 59.0273 28.1843 179.0763 151 S 4.0515 8.0712 113.9690 61.3491 62.3326 175.4616 152 R 4.6437 7.9627 116.1466 56.0070 30.0045 175.4889 153 C 5.8477 8.0319 114.8507 56.8335 31.5101 173.6375 154 A 4.2127 8.6542 124.9972 51.5301 19.3568 176.3195 155 V 4.5619 7.9345 122.7816 61.5520 33.6878 175.3080 156 F 4.7513 9.4764 124.9755 56.0442 42.8279 174.1086 157 R 4.9701 8.7373 124.0307 54.6930 30.5662 176.2954 158 F 4.2257 10.3398 125.3420 57.2469 39.3359 175.9782 159 K 4.4647 8.5797 123.3415 53.9017 33.5034 174.7537 160 P 4.2752 0.0000 0.0000 63.4117 31.0867 176.1889 161 V 3.3487 8.0206 121.8395 60.4869 32.3298 174.5686 162 P 4.5783 0.0000 0.0000 61.2422 33.0024 175.9504 163 K 4.0151 8.1194 118.7852 60.1682 31.9043 178.7427 164 E 3.9808 8.0196 118.0140 59.2137 29.4835 179.2512 165 A 4.0053 7.9046 120.5658 55.1714 18.4391 179.2718 166 M 4.0362 7.6368 115.4539 58.7277 32.3864 177.9996 167 K 3.7495 8.2475 120.2572 59.6999 32.2045 178.1565 168 K 3.8602 8.3156 119.5916 59.7075 32.1984 178.5582 169 R 4.1090 7.9662 118.6898 59.5466 29.8107 178.4743 170 L 4.0833 8.8574 119.2011 57.7959 41.6661 179.3796 171 L 4.0154 7.9217 118.8519 57.9506 41.5203 179.4475 172 E 3.9705 8.2032 118.3840 59.5608 29.1838 179.5154 173 I 2.5932 7.4793 118.5964 63.8270 37.1584 177.9143 174 C 4.3770 7.5811 117.7987 62.3159 28.1287 175.3114 175 E 3.6959 8.4055 120.8060 59.4050 29.2479 177.9607 176 K 4.3766 7.6254 114.8656 56.7916 31.9426 177.2660 177 E 4.4399 8.5644 116.2299 55.4698 32.2576 175.4370 178 G 3.9996 8.1311 105.9814 47.0528 0.0000 174.0674 179 V 4.4498 7.7553 115.9290 60.7935 34.3596 175.1662 180 K 4.5136 8.3467 126.1999 55.0016 32.3688 174.9663 181 I 4.6608 8.0372 124.8818 60.6161 38.7286 175.7236 182 T 4.3178 8.2175 115.9389 60.8234 70.9114 175.6001 183 E 3.9588 8.7694 120.0274 59.4998 29.2930 178.9108 184 D 4.4650 8.2299 118.7003 57.6830 41.0616 179.2591 185 G 3.5042 7.9209 104.6454 46.7320 0.0000 175.5449 186 L 3.9269 7.2376 122.2338 58.2074 42.6424 177.9493 187 E 4.0810 8.2874 118.2852 59.7597 29.4689 179.5738 188 A 4.0235 8.1557 120.5834 54.7551 18.0862 178.8757 189 L 4.0854 7.7317 116.5490 56.7136 41.6503 178.1228 190 I 4.5164 7.7231 117.6872 62.3614 39.7318 176.8202 191 Y 4.1101 7.9841 119.7647 61.1011 38.5192 177.9812 192 I 3.9536 8.1631 118.6008 64.9304 37.7094 178.0043 193 S 4.2688 7.7111 114.4358 59.4011 62.3440 175.7693 194 G 3.7692 8.2244 106.9600 45.7640 0.0000 173.3334 195 G 3.5846 8.1622 105.3874 46.9131 0.0000 174.2804 196 D 4.8198 7.8778 118.5629 51.2532 43.8356 174.6117 197 F 4.1644 9.7373 127.9255 60.7272 39.0806 177.2938 198 R 4.1483 8.3288 117.8887 59.6212 29.7185 177.7936 199 K 3.8803 8.5429 118.6326 59.6024 32.1487 178.2699 200 A 3.9590 8.0907 120.7696 55.3441 18.3484 179.2929 201 I 3.7239 8.8230 118.8744 64.8570 37.3215 178.0867 202 N 4.2227 8.4115 116.7473 56.8377 38.4650 176.9499 203 A 3.9008 8.0898 121.7149 54.7557 18.4142 178.9678 204 L 3.6937 8.1247 118.1032 58.4496 42.2928 178.9717 205 Q 3.0734 8.2001 119.6005 59.2892 28.6446 179.5199 206 G 3.5240 7.6436 104.4229 47.4056 0.0000 175.0176 207 A 4.1557 7.8965 122.3325 54.2229 18.3914 179.4804 208 A 3.8071 7.7577 119.2205 55.0037 18.4423 179.2722 209 A 4.0191 7.5133 118.2451 56.6659 18.8027 178.3167 210 I 3.9724 7.2223 117.1533 60.8359 38.8357 176.3883 211 G 3.8386 8.4668 110.6596 46.1142 0.0000 175.1510 212 E 3.5785 8.1015 130.3722 56.3479 27.8361 177.1832 213 V 3.6383 8.4795 126.2856 63.7302 31.6404 175.6921 214 V 4.0978 9.1498 125.4121 61.3614 32.0322 174.6589 215 D 4.8598 8.2354 127.7755 53.1763 42.4432 176.8537 216 A 3.8419 8.6249 122.9342 55.3251 18.4530 179.2648 217 D 4.6071 8.0428 116.9094 57.9113 41.1347 178.7716 218 T 3.9114 8.0216 109.6110 65.2629 68.1485 176.0698 219 I 3.6943 7.2893 120.9506 64.4770 37.1417 177.9686 220 Y 4.3372 7.9957 117.9489 60.8917 37.7019 178.4947 221 Q 4.3984 8.2033 120.3032 59.4181 29.1870 177.9619 222 I 3.8318 7.6259 119.3969 63.8514 37.2092 177.5520 223 T 4.2513 7.6671 107.9391 60.4083 70.2679 174.0550 224 A 3.9516 7.8542 123.6150 53.6326 16.2661 178.0931 225 T 4.8305 8.6664 109.5009 58.0894 71.5754 174.4403 226 A 3.0814 8.3562 129.0522 51.6392 19.0919 177.0272 227 R 2.7821 7.6092 118.4808 56.0637 30.5444 176.4850 228 P 4.1972 0.0000 0.0000 65.2877 30.9454 178.6149 229 E 3.9585 7.9214 117.4159 59.2142 29.3493 178.8981 230 E 4.0657 8.1052 118.8195 59.3884 29.4870 179.0321 231 M 4.0607 7.9130 118.4981 58.6834 31.7600 178.3640 232 T 4.1546 7.6083 107.7996 62.9863 68.8763 175.7358 233 E 3.8648 7.6631 122.1199 59.0574 30.0804 177.4802 234 L 3.9908 8.2000 120.6738 58.5817 42.1325 179.1405 235 I 3.7737 8.4546 119.7863 64.2942 36.9701 178.3552 236 Q 3.9365 7.6013 120.2796 59.4720 28.6292 178.2950 237 T 3.9240 8.7615 110.9083 64.1167 68.6233 176.2648 238 A 4.0240 7.8046 123.9532 55.3488 18.3962 179.5920 239 L 4.1658 7.8390 115.9251 57.8612 41.6739 179.6941 240 K 4.1794 8.0305 118.1565 59.1116 32.0773 176.9105 241 G 3.6108 7.3910 105.9299 45.6883 0.0000 175.0965 242 N 4.7257 7.8744 120.2079 51.6385 35.6166 174.9096 243 F 4.1778 8.1851 126.4996 61.7317 40.1107 175.8458 244 M 3.6980 8.2247 117.5391 58.3848 31.7287 178.6223 245 E 3.8637 8.0630 117.8179 59.3403 29.6857 178.9481 246 A 3.9377 7.7728 120.7203 55.1313 18.4081 179.5965 247 R 3.6157 7.7693 117.3607 59.4246 30.0906 178.2687 248 E 3.8946 7.9340 118.3113 59.5836 29.4603 179.2850 249 L 3.9372 7.8759 118.4597 57.9576 41.5554 179.2631 250 L 3.9128 7.8955 118.9338 59.1051 42.1914 178.0924 251 D 4.3778 8.5479 118.9253 56.3003 40.5229 178.7741 252 R 3.8373 8.4158 118.1718 59.5764 30.4086 178.7605 253 L 4.0130 8.6625 120.3188 58.4750 42.0610 178.6269 254 M 4.3674 8.5293 118.0573 57.0771 31.7731 178.3365 255 V 3.8418 7.4399 117.3218 64.7581 32.3411 176.5706 256 E 3.8450 8.0625 118.5868 59.2824 29.4060 177.7090 257 Y 4.6228 7.5401 112.4359 56.7890 40.2326 175.7139 258 G 3.9185 8.4087 105.9431 45.2141 0.0000 173.2685 259 M 4.3510 7.7329 116.9169 54.3687 33.5462 177.7147 260 S 4.6239 8.3769 117.4156 57.7073 65.7411 175.5820 261 G 3.5819 8.5507 107.2822 47.8136 0.0000 175.5593 262 E 3.9528 8.1369 120.5469 59.3854 29.6400 178.9162 263 D 4.3949 8.4521 119.0929 57.6233 40.9051 179.1581 264 I 3.7619 7.9103 120.3482 64.3582 37.1290 178.9687 265 V 3.7145 8.1698 119.9871 64.4170 31.1462 178.2147 266 A 4.0189 8.3397 122.0725 55.3846 18.4438 179.5826 267 Q 3.9986 8.1129 115.9820 58.8568 28.5625 178.8709 268 L 4.0296 8.3134 119.5823 58.2559 41.9825 178.8600 269 F 4.3999 8.4080 120.0123 61.4425 39.2542 176.6956 270 R 3.5918 8.2828 117.8342 59.7907 29.8323 178.0426 271 E 4.2308 8.3890 116.3836 58.0034 29.4067 178.8812 272 I 3.8201 7.6276 120.1107 63.8453 37.3235 178.0425 273 I 3.7774 7.2859 119.5539 64.3911 37.2309 177.7882 274 S 4.3921 7.6529 112.0189 58.2499 63.1065 174.6096 275 M 4.1953 6.9362 122.1363 55.1686 32.4603 174.6548 276 P 4.7019 0.0000 0.0000 62.7358 31.7987 174.9109 277 I 4.3993 7.2301 117.0556 59.6154 40.7848 175.0256 278 K 3.9399 8.4017 122.2705 57.0703 33.1596 178.0357 279 D 4.4124 8.7127 122.0542 57.1645 40.5250 179.1992 280 S 3.9220 7.9323 113.0299 61.0555 62.9154 175.1453 281 L 4.1857 7.7529 122.2437 57.4789 42.1158 177.9739 282 K 3.8211 8.1318 119.6643 59.8069 31.9175 178.5531 283 V 3.5704 7.4163 117.8712 66.0667 31.5908 177.6627 284 Q 3.9378 8.1523 117.1577 59.2514 28.4961 179.6133 285 L 3.9914 7.8244 119.0806 58.0099 41.6942 179.6159 286 I 3.8281 8.1023 119.8761 64.4731 36.9982 177.5442 287 D 4.4241 8.6198 119.0936 57.7768 40.8660 178.6893 288 K 3.8493 7.9146 117.8760 59.5094 32.0184 179.0604 289 L 3.4623 8.5864 120.9990 57.8723 41.9989 179.2901 290 G 3.5151 8.6382 106.2672 47.6863 0.0000 175.0055 291 E 4.0095 8.2679 122.2423 59.0775 29.7114 178.8601 292 V 3.6364 8.6619 118.8061 66.3320 31.6971 177.4772 293 D 4.3172 8.3185 117.7370 57.2100 40.9312 178.0007 294 F 4.4031 8.0608 122.0386 60.8215 39.4060 177.0236 295 R 3.6187 8.0842 117.7467 59.3671 29.8584 178.6581 296 L 3.9203 7.9255 118.4363 58.2186 41.2480 179.8827 297 T 3.8329 7.7113 108.8769 64.8108 68.3221 176.0536 298 E 3.9670 7.6671 120.4112 57.1939 29.4523 177.5422 299 G 3.9512 7.9436 105.7446 44.9133 0.0000 173.5925 300 A 4.0113 7.3491 122.6396 51.6974 19.0109 177.5902 301 N 4.5087 8.6655 117.3489 53.9245 39.5326 174.7504 302 E 3.6989 8.7111 128.0442 59.8418 30.0282 178.6108 303 R 3.9256 7.9470 117.7424 59.6774 30.2472 178.8035 304 I 3.8606 7.6532 118.9780 64.3805 37.0648 178.2741 305 Q 4.0392 8.1988 118.3115 58.6798 28.7655 178.4866 306 L 4.2392 8.0633 120.0501 58.1053 41.7609 179.2323 307 D 4.5068 8.3548 118.5291 57.4515 40.7166 178.7506 308 A 4.1573 8.5158 121.1550 54.7402 18.1421 178.5683 309 Y 4.4960 8.2667 118.0093 59.9874 38.8466 177.4404 310 L 4.1010 8.1059 118.7683 57.1795 42.1418 178.6255 311 A 3.9867 8.5996 122.8081 54.8025 17.9670 178.9140 312 Y 4.3229 7.5836 114.8242 61.7329 37.8658 179.5316 313 L 4.0085 7.6721 119.7654 57.2688 41.2432 178.6813 314 S 4.7461 8.0257 112.5175 59.1551 63.2323 175.7539 315 T 4.2314 7.6365 114.5575 63.9461 68.7549 175.8634 316 L 4.1240 7.4374 119.7126 55.0062 41.5590 178.2764 317 A 4.1691 8.0746 123.9393 54.9745 18.2902 180.8675 318 K 4.4536 7.8200 115.7189 56.6949 33.1516 177.1264 *319 K 4.1215 8.1934 125.6345 54.9038 32.3269 178.0735 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 6 I 7.78 5.07 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.98 1.00 0.00 0.00 7 W 8.61 4.58 0.00 3.51 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.24 3.91 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 9 E 8.70 4.43 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 10 K 8.27 3.95 0.00 1.76 1.95 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.60 1.16 7.81 11 Y 7.58 4.49 0.00 2.96 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 12 R 8.32 3.77 0.00 1.92 1.81 0.00 3.29 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 13 P 0.00 4.28 0.00 1.96 1.92 0.00 3.59 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 1.92 2.01 0.00 14 R 8.38 4.21 0.00 1.72 1.85 0.00 3.17 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 15 T 7.10 4.76 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 16 L 8.43 3.92 0.00 1.68 1.67 0.83 1.03 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 17 D 8.12 4.38 0.00 2.60 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 18 E 8.28 4.20 0.00 2.00 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 2.26 2.18 0.00 19 V 7.53 3.86 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 0.81 0.00 0.00 0.87 0.00 0.00 20 V 8.26 4.17 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 1.00 0.00 0.00 0.98 0.00 0.00 21 G 8.82 4.10 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 0.00 22 Q 7.36 4.59 0.00 1.96 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.60 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 23 D 8.62 4.36 0.00 2.65 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 24 E 7.75 3.76 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 25 V 7.47 3.75 1.63 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 0.34 0.00 0.00 0.46 0.00 0.00 26 I 7.70 3.57 1.78 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 1.40 0.15 0.91 0.00 0.00 27 Q 8.19 4.00 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 28 R 7.88 4.38 0.00 2.14 2.25 0.00 3.23 0.00 0.00 3.41 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.98 0.00 29 L 7.93 4.33 0.00 1.78 1.70 0.15 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.67 4.24 0.00 2.06 1.84 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 31 G 7.47 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 32 Y 7.87 4.59 0.00 3.26 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.05 4.15 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 0.70 0.00 0.00 1.04 0.00 0.00 34 E 8.25 4.14 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 35 R 7.95 4.17 0.00 1.76 1.95 0.00 3.20 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 36 K 7.96 4.19 0.00 2.03 2.27 0.00 1.79 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.73 7.81 37 N 7.94 4.62 0.00 2.70 2.83 0.00 0.00 6.59 7.18 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 38 I 7.65 4.48 2.29 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.10 1.02 0.00 0.00 39 P 0.00 4.51 0.00 2.24 2.12 0.00 3.45 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 40 H 8.35 4.25 0.00 3.38 3.46 0.00 5.61 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 9.16 5.09 0.00 1.60 1.51 1.03 0.44 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 42 L 9.37 5.13 0.00 1.75 1.62 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 43 F 9.99 5.95 0.00 3.10 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 44 S 10.47 5.90 0.00 3.96 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 45 G 7.77 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 0.00 0.00 0.00 0.00 46 P 0.00 4.36 0.00 2.20 2.11 0.00 4.06 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 47 P 0.00 4.45 0.00 2.21 2.07 0.00 3.81 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 2.15 1.94 0.00 48 G 8.82 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 49 T 8.39 4.05 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 1.31 0.00 0.00 50 G 8.54 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 51 K 7.93 3.05 0.00 1.71 2.01 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.16 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.31 0.45 7.81 52 T 7.89 3.24 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 53 A 7.83 3.86 1.29 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 0.00 54 T 8.32 4.01 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 1.41 0.00 0.00 55 A 8.16 4.35 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 56 I 7.34 2.82 1.68 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 0.97 0.44 0.20 0.00 0.00 57 A 8.09 3.74 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.00 3.85 0.00 1.84 1.58 0.88 1.00 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 59 A 7.03 3.69 1.14 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 0.00 0.00 60 R 7.62 3.46 0.00 0.97 1.49 0.00 2.21 0.00 0.00 2.83 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.00 61 D 7.48 4.49 0.00 2.78 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 62 L 6.85 4.40 0.00 0.92 1.12 0.89 0.81 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 63 F 7.58 5.13 0.00 3.26 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 64 G 8.41 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 0.00 0.00 0.00 65 E 8.64 4.71 0.00 1.94 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 2.18 2.35 0.00 66 N 7.66 4.97 0.00 2.77 2.72 0.00 0.00 7.01 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 67 W 8.23 4.67 0.00 3.79 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 6.92 3.77 0.00 1.28 1.77 0.00 2.62 0.00 0.00 2.73 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 69 D 7.89 4.44 0.00 2.57 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 70 N 8.17 4.83 0.00 2.66 3.02 0.00 0.00 6.97 8.28 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 71 F 7.90 4.77 0.00 3.35 3.37 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 72 I 7.25 4.38 1.51 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 1.11 1.17 0.70 0.00 0.00 73 E 8.54 5.06 0.00 2.08 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 2.37 2.75 0.00 74 M 8.44 4.88 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 75 N 8.80 4.79 0.00 2.77 2.77 0.00 0.00 7.00 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 76 A 8.90 4.48 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 77 S 8.78 4.32 0.00 3.94 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 78 D 7.93 4.58 0.00 2.73 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 79 E 8.56 4.02 0.00 2.09 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 2.28 2.53 0.00 80 R 8.00 4.44 0.00 1.93 2.05 0.00 2.99 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 81 G 7.78 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 82 I 7.85 3.66 1.86 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 1.64 1.10 0.90 0.00 0.00 83 D 7.97 4.61 0.00 2.69 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 84 V 7.69 3.90 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 0.80 0.00 0.00 0.93 0.00 0.00 85 V 7.55 4.25 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 0.73 0.00 0.00 0.98 0.00 0.00 86 R 7.45 4.56 0.00 1.89 1.90 0.00 3.28 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 87 H 8.15 4.36 0.00 3.26 3.30 0.00 5.91 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.98 4.10 0.00 1.83 1.73 0.00 1.54 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.34 1.31 7.81 89 I 7.68 3.82 2.08 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 1.64 1.34 1.03 0.00 0.00 90 K 7.84 4.09 0.00 1.73 1.83 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.70 7.81 91 E 7.78 3.94 0.00 2.02 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 2.29 2.37 0.00 92 F 7.67 4.28 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 93 A 7.27 3.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.36 4.18 0.00 1.96 1.91 0.00 3.26 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 95 T 6.94 4.07 4.14 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 1.19 0.00 0.00 96 A 8.31 4.00 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 97 P 0.00 3.85 0.00 2.12 1.85 0.00 3.71 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 98 I 8.15 3.68 1.81 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 1.29 0.40 0.88 0.00 0.00 99 G 7.69 4.10 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 0.00 100 G 6.84 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 0.00 0.00 101 A 8.17 4.97 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 0.00 102 P 0.00 4.55 0.00 2.26 2.22 0.00 4.25 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.20 0.00 103 F 8.39 5.37 0.00 3.10 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 0.00 104 K 9.06 4.90 0.00 1.23 0.81 0.00 1.10 0.00 0.00 0.61 0.00 0.00 2.63 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.92 1.05 7.81 105 I 9.07 5.26 2.30 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 1.52 1.30 1.21 0.00 0.00 106 I 8.85 4.50 1.31 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 0.55 0.42 0.78 0.00 0.00 107 F 8.37 5.15 0.00 3.24 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 0.00 108 L 7.89 4.83 0.00 1.67 1.29 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.26 4.29 0.00 2.87 2.52 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 0.00 110 E 8.78 3.93 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 111 A 7.86 4.10 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 D 7.90 4.88 0.00 2.81 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 0.00 113 A 8.20 4.64 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 0.00 114 L 7.66 4.48 0.00 1.62 1.58 0.97 0.86 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 0.00 115 T 8.41 4.21 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 1.21 0.00 0.00 116 A 8.36 3.86 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 0.00 117 D 7.79 4.27 0.00 2.76 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 0.00 118 A 7.95 4.03 1.29 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 0.00 119 Q 7.64 3.87 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 120 A 8.03 3.94 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 0.00 121 A 7.43 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 0.00 122 L 7.48 3.74 0.00 1.66 1.43 0.33 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.49 3.85 0.00 1.88 1.87 0.00 3.10 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 124 R 7.88 4.24 0.00 1.84 1.90 0.00 3.20 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 125 T 7.86 4.55 4.81 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 1.58 0.00 0.00 126 M 8.03 4.37 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.39 0.00 127 E 8.05 4.14 0.00 1.94 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 2.30 0.00 128 M 7.80 4.10 0.00 1.20 1.80 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.01 0.00 129 Y 7.43 4.99 0.00 3.31 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 0.00 130 S 8.34 4.69 0.00 3.99 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.12 4.62 0.00 1.81 1.89 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.43 7.81 132 S 8.05 4.86 0.00 3.84 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 0.00 133 C 7.58 5.19 0.00 3.26 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 0.00 134 R 8.60 4.85 0.00 2.18 1.91 0.00 3.33 0.00 0.00 3.53 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 135 F 9.35 5.40 0.00 3.11 2.94 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 0.00 136 I 8.96 4.79 2.09 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 1.15 0.94 0.15 0.00 0.00 137 L 9.00 4.75 0.00 1.52 1.52 0.85 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.09 5.24 0.00 3.98 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 0.00 139 C 8.99 5.02 0.00 3.08 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 0.00 140 N 9.23 4.35 0.00 2.61 2.30 0.00 0.00 6.85 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 0.00 141 Y 7.54 5.06 0.00 3.10 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 0.00 142 V 8.75 3.66 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.00 0.00 0.00 143 S 8.28 4.04 0.00 3.86 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 0.00 144 R 7.84 4.34 0.00 1.95 1.97 0.00 3.36 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 145 I 7.69 4.38 1.89 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 1.35 0.79 0.90 0.00 0.00 146 I 7.76 3.71 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 0.57 0.90 0.00 0.00 147 E 9.05 3.90 0.00 2.02 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 2.38 2.36 0.00 148 P 0.00 4.23 0.00 2.03 2.10 0.00 3.61 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 2.02 2.19 0.00 149 I 7.51 4.18 1.84 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 1.45 0.72 0.85 0.00 0.00 150 Q 8.12 3.94 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 151 S 8.07 4.05 0.00 3.94 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 0.00 152 R 7.96 4.64 0.00 1.82 1.97 0.00 3.16 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 153 C 8.03 5.85 0.00 2.98 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 0.00 154 A 8.65 4.21 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 0.00 155 V 7.93 4.56 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 0.81 0.00 0.00 0.93 0.00 0.00 156 F 9.48 4.75 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 8.74 4.97 0.00 1.74 1.99 0.00 3.24 0.00 0.00 3.28 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 158 F 10.34 4.23 0.00 2.80 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 0.00 159 K 8.58 4.46 0.00 1.76 1.75 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.37 7.81 160 P 0.00 4.28 0.00 2.17 2.11 0.00 3.84 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 2.00 1.98 0.00 161 V 8.02 3.35 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 0.48 0.00 0.00 0.82 0.00 0.00 162 P 0.00 4.58 0.00 2.18 2.03 0.00 3.59 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 163 K 8.12 4.02 0.00 1.80 1.73 0.00 1.72 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.51 7.81 164 E 8.02 3.98 0.00 2.10 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 2.40 2.44 0.00 165 A 7.90 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 0.00 166 M 7.64 4.04 0.00 2.17 1.48 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 167 K 8.25 3.75 0.00 1.96 1.83 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 168 K 8.32 3.86 0.00 1.94 2.02 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.47 7.81 169 R 7.97 4.11 0.00 2.03 2.37 0.00 3.10 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.76 0.00 170 L 8.86 4.08 0.00 1.91 1.77 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 171 L 7.92 4.02 0.00 1.94 1.72 0.93 0.99 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 0.00 172 E 8.20 3.97 0.00 2.12 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 2.33 2.56 0.00 173 I 7.48 2.59 1.92 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.63 0.42 0.00 0.00 174 C 7.58 4.38 0.00 3.14 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.41 3.70 0.00 1.86 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 2.31 0.00 176 K 7.63 4.38 0.00 1.91 1.85 0.00 1.90 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.40 7.81 177 E 8.56 4.44 0.00 1.16 1.80 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 1.64 1.47 0.00 178 G 8.13 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 0.00 0.00 0.00 179 V 7.76 4.45 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 0.94 0.00 0.00 1.35 0.00 0.00 180 K 8.35 4.51 0.00 1.75 1.74 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.47 7.81 181 I 8.04 4.66 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 1.43 0.41 0.92 0.00 0.00 182 T 8.22 4.32 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 1.20 0.00 0.00 183 E 8.77 3.96 0.00 1.99 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 2.40 2.34 0.00 184 D 8.23 4.47 0.00 2.72 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 0.00 185 G 7.92 3.50 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 0.00 186 L 7.24 3.93 0.00 1.82 1.76 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 187 E 8.29 4.08 0.00 2.14 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 2.34 2.50 0.00 188 A 8.16 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 L 7.73 4.09 0.00 2.08 1.69 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 190 I 7.72 4.52 2.12 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 1.09 2.23 0.92 0.00 0.00 191 Y 7.98 4.11 0.00 3.03 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 I 8.16 3.95 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.00 0.95 0.00 0.00 193 S 7.71 4.27 0.00 4.01 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 0.00 194 G 8.22 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 0.00 0.00 0.00 195 G 8.16 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 0.00 196 D 7.88 4.82 0.00 2.69 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 0.00 197 F 9.74 4.16 0.00 3.33 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 R 8.33 4.15 0.00 1.95 2.16 0.00 3.23 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 199 K 8.54 3.88 0.00 2.00 1.97 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 200 A 8.09 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 0.00 201 I 8.82 3.72 1.98 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.89 1.09 0.00 0.00 202 N 8.41 4.22 0.00 2.98 2.91 0.00 0.00 7.02 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 A 8.09 3.90 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 0.00 204 L 8.12 3.69 0.00 1.74 1.87 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 205 Q 8.20 3.07 0.00 1.73 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 206 G 7.64 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 0.00 207 A 7.90 4.16 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 A 7.76 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 7.51 4.02 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 0.00 210 I 7.22 3.97 1.85 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 1.40 0.82 0.90 0.00 0.00 211 G 8.47 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 0.00 212 E 8.10 3.58 0.00 2.14 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 2.21 2.23 0.00 213 V 8.48 3.64 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 0.65 0.00 0.00 0.93 0.00 0.00 214 V 9.15 4.10 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 0.86 0.00 0.00 0.90 0.00 0.00 215 D 8.24 4.86 0.00 2.61 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 8.62 3.84 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 D 8.04 4.61 0.00 2.74 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 0.00 218 T 8.02 3.91 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 1.20 0.00 0.00 219 I 7.29 3.69 1.74 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 1.42 0.96 0.77 0.00 0.00 220 Y 8.00 4.34 0.00 3.21 2.86 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 0.00 221 Q 8.20 4.40 0.00 2.40 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 222 I 7.63 3.83 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 1.85 0.90 0.90 0.00 0.00 223 T 7.67 4.25 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 1.26 0.00 0.00 224 A 7.85 3.95 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 T 8.67 4.83 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 226 A 8.36 3.08 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 0.00 227 R 7.61 2.78 0.00 1.99 1.72 0.00 3.49 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 228 P 0.00 4.20 0.00 1.96 2.22 0.00 3.11 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.99 0.00 229 E 7.92 3.96 0.00 2.00 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 0.00 230 E 8.11 4.07 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 231 M 7.91 4.06 0.00 2.04 2.11 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 2.68 2.62 0.00 232 T 7.61 4.15 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 233 E 7.66 3.86 0.00 2.23 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 0.00 2.28 2.30 0.00 234 L 8.20 3.99 0.00 1.77 1.96 0.97 0.95 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 0.00 235 I 8.45 3.77 1.91 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 1.52 0.65 0.96 0.00 0.00 236 Q 7.60 3.94 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 237 T 8.76 3.92 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 1.28 0.00 0.00 238 A 7.80 4.02 1.48 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 0.00 0.00 239 L 7.84 4.17 0.00 1.79 1.76 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 240 K 8.03 4.18 0.00 1.74 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.58 7.81 241 G 7.39 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 0.00 242 N 7.87 4.73 0.00 2.94 2.79 0.00 0.00 6.51 8.01 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 0.00 243 F 8.19 4.18 0.00 3.11 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 0.00 244 M 8.22 3.70 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.76 0.00 245 E 8.06 3.86 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 246 A 7.77 3.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 R 7.77 3.62 0.00 1.05 1.70 0.00 3.20 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.72 0.00 248 E 7.93 3.89 0.00 2.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 249 L 7.88 3.94 0.00 1.87 1.72 0.97 0.37 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 0.00 250 L 7.90 3.91 0.00 1.62 1.70 0.96 1.67 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 0.00 251 D 8.55 4.38 0.00 2.99 2.59 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 0.00 252 R 8.42 3.84 0.00 2.11 1.98 0.00 3.10 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 253 L 8.66 4.01 0.00 2.01 1.83 0.96 1.49 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 0.00 254 M 8.53 4.37 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.58 0.00 255 V 7.44 3.84 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 0.83 0.00 0.00 0.99 0.00 0.00 256 E 8.06 3.85 0.00 1.95 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 2.06 0.00 257 Y 7.54 4.62 0.00 3.02 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 0.00 258 G 8.41 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 0.00 259 M 7.73 4.35 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.70 0.00 260 S 8.38 4.62 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 G 8.55 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 0.00 262 E 8.14 3.95 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 0.00 263 D 8.45 4.39 0.00 2.91 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 0.00 264 I 7.91 3.76 1.99 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 1.61 1.01 0.94 0.00 0.00 265 V 8.17 3.71 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 0.84 0.00 0.00 0.78 0.00 0.00 266 A 8.34 4.02 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 0.00 267 Q 8.11 4.00 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 268 L 8.31 4.03 0.00 1.82 1.82 0.96 1.01 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 0.00 269 F 8.41 4.40 0.00 3.08 3.34 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 0.00 270 R 8.28 3.59 0.00 1.88 1.90 0.00 2.75 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.52 0.00 271 E 8.39 4.23 0.00 2.05 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 2.40 2.52 0.00 272 I 7.63 3.82 2.02 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.83 0.98 0.00 0.00 273 I 7.29 3.78 1.70 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 -0.08 0.75 0.00 0.00 274 S 7.65 4.39 0.00 3.84 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 0.00 275 M 6.94 4.20 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.95 0.00 276 P 0.00 4.70 0.00 2.17 2.11 0.00 3.73 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 1.93 1.93 0.00 277 I 7.23 4.40 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.79 0.91 0.00 0.00 278 K 8.40 3.94 0.00 1.83 1.74 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.55 7.81 279 D 8.71 4.41 0.00 2.76 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 0.00 280 S 7.93 3.92 0.00 3.86 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 0.00 281 L 7.75 4.19 0.00 1.75 1.63 0.92 0.29 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 0.00 282 K 8.13 3.82 0.00 2.05 1.83 0.00 1.68 0.00 0.00 1.54 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.58 7.81 283 V 7.42 3.57 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 0.84 0.00 0.00 1.00 0.00 0.00 284 Q 8.15 3.94 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 285 L 7.82 3.99 0.00 1.99 1.84 0.94 0.71 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 0.00 286 I 8.10 3.83 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.12 1.04 0.00 0.00 287 D 8.62 4.42 0.00 2.88 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 0.00 288 K 7.91 3.85 0.00 2.12 1.80 0.00 1.43 0.00 0.00 0.61 0.00 0.00 2.28 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 1.18 7.81 289 L 8.59 3.46 0.00 1.89 1.78 0.12 1.07 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 0.00 290 G 8.64 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 0.00 291 E 8.27 4.01 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 292 V 8.66 3.64 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 0.85 0.00 0.00 1.20 0.00 0.00 293 D 8.32 4.32 0.00 2.76 2.80 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 0.00 294 F 8.06 4.40 0.00 3.10 3.28 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 0.00 295 R 8.08 3.62 0.00 1.95 1.96 0.00 3.35 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 296 L 7.93 3.92 0.00 1.86 1.69 0.99 0.45 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 0.00 297 T 7.71 3.83 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 1.23 0.00 0.00 298 E 7.67 3.97 0.00 1.77 1.82 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 1.47 1.73 0.00 299 G 7.94 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 0.00 0.00 0.00 300 A 7.35 4.01 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 0.00 301 N 8.67 4.51 0.00 2.80 2.73 0.00 0.00 6.47 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 0.00 302 E 8.71 3.70 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 2.40 2.43 0.00 303 R 7.95 3.93 0.00 1.93 1.93 0.00 3.24 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 304 I 7.65 3.86 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 1.66 0.59 0.92 0.00 0.00 305 Q 8.20 4.04 0.00 2.12 2.20 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 2.40 2.54 0.00 306 L 8.06 4.24 0.00 2.04 1.78 0.93 0.92 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 0.00 307 D 8.35 4.51 0.00 2.90 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 0.00 308 A 8.52 4.16 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 0.00 309 Y 8.27 4.50 0.00 3.30 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 L 8.11 4.10 0.00 2.08 1.87 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 311 A 8.60 3.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 Y 7.58 4.32 0.00 2.85 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 0.00 313 L 7.67 4.01 0.00 1.59 1.66 0.85 0.54 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 0.00 314 S 8.03 4.75 0.00 4.11 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 0.00 315 T 7.64 4.23 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 0.00 316 L 7.44 4.12 0.00 1.60 1.72 0.88 1.07 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 0.00 317 A 8.07 4.17 1.29 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 0.00 318 K 7.82 4.45 0.00 1.71 1.78 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.33 7.81 *319 K 8.19 4.12 0.00 1.52 1.62 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.