NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4547 8.3149 120.0500 56.3800 33.6122 174.7264 3 V 4.2016 8.2962 117.3765 59.2488 36.2091 173.7369 4 T 4.4529 8.3759 119.4202 62.9711 70.3928 175.3550 5 F 4.0287 9.1197 125.0726 61.8808 39.2828 177.3459 6 E 3.8404 8.2942 117.3527 59.5047 29.2370 178.9734 7 Q 4.0215 8.0155 119.0225 58.8859 29.1286 178.1183 8 L 3.6878 7.7348 121.4702 57.9452 42.1591 178.6875 9 K 3.7874 7.7671 119.5558 59.3049 31.9994 178.3434 10 A 3.9180 8.2686 121.1974 55.0840 18.2881 179.3045 11 A 3.7753 7.4669 119.1051 55.4036 18.4114 179.6490 12 F 3.6268 7.1949 115.7864 60.6389 38.9642 177.5533 13 N 4.3616 8.5483 116.7098 56.9783 38.7724 177.0027 14 R 3.9659 8.4992 119.7697 59.3471 29.8533 179.2316 15 V 3.8274 7.7126 117.1843 65.6622 31.8524 177.7791 16 L 4.2445 8.3622 119.1221 57.9985 41.5858 179.5025 17 I 4.5397 7.8879 114.1829 63.7546 37.1642 177.9075 18 S 4.2849 7.7299 111.8843 59.9567 62.1739 175.1609 19 R 4.5679 7.9818 119.5195 55.8037 30.2111 176.4315 20 G 3.8371 7.9992 106.2968 45.6405 0.0000 173.5294 21 V 4.2555 7.5645 119.5543 60.4183 32.9730 175.0080 22 D 4.8005 8.6406 127.5178 53.6261 40.9584 177.3540 23 S 4.1598 8.8457 117.0721 62.7277 62.5169 175.4241 24 E 3.8414 8.5991 120.8078 60.6343 29.0310 178.6371 25 T 3.9403 8.6886 109.3360 64.6328 69.2490 176.6489 26 A 4.1464 8.4954 124.3292 55.0848 18.3411 179.1273 27 D 4.2828 8.5195 116.5454 57.3070 41.1235 178.2428 28 A 4.0092 7.5545 120.2170 55.4027 18.5339 178.7561 29 C 4.2378 8.4120 115.8449 62.7824 31.9994 175.3764 30 A 4.3155 8.3677 122.3419 54.9617 17.7969 179.1681 31 E 3.8812 8.1682 113.7586 57.7841 29.2469 178.2387 *33 F 4.1935 8.0037 117.8869 57.1754 41.0768 177.2356 34 A 4.2798 8.3442 122.2534 55.1472 18.2033 179.9238 35 R 4.0726 8.5052 116.9523 59.7117 30.0149 179.2619 36 T 3.6342 7.8258 114.9852 66.9044 68.4027 176.5141 37 T 3.6883 7.7105 117.0331 66.6750 68.4673 176.4171 38 E 4.1140 8.5256 120.8755 58.7234 29.3938 177.9614 39 S 4.4104 7.3850 112.6240 58.6479 63.2616 174.8642 40 G 3.6378 8.0252 111.1627 44.9631 0.0000 174.9657 41 V 3.9983 6.5094 120.3785 61.7151 30.1057 174.8835 42 Y 4.3602 7.9023 122.7462 60.4081 38.6162 178.1315 43 S 4.2097 8.5194 113.2289 61.5337 62.6876 175.1307 44 H 5.0282 8.3348 114.9226 55.0023 30.3495 174.5342 45 G 4.1984 7.9123 112.2832 45.2524 0.0000 176.6724 46 V 4.1596 8.5585 125.9333 64.7838 31.0949 178.1089 47 N 4.5932 8.4891 116.4109 55.3554 38.7028 175.5594 48 R 4.4477 8.2968 117.4306 56.8695 31.3246 177.6117 49 F 3.8790 8.2672 119.2375 61.3387 39.1461 174.9765 50 P 4.1413 0.0000 0.0000 65.7454 31.1551 178.5197 51 R 3.8750 7.9872 116.7690 59.2019 30.1048 177.9425 52 F 4.2285 8.5275 120.7920 61.5929 39.3489 177.0359 53 I 3.0344 7.6337 119.5024 64.2128 36.7708 178.2969 54 Q 3.8704 7.8070 118.6782 59.3053 28.7088 179.2808 55 Q 3.9399 7.9297 118.7298 58.5964 28.1200 178.5535 56 L 3.7731 7.4814 121.6588 57.9741 41.8014 178.8744 57 E 3.9402 7.9119 118.0544 59.2487 29.5187 178.6308 58 N 4.4725 8.0203 115.1386 54.4559 38.7018 176.1514 59 G 3.9243 7.5050 107.4039 44.8861 0.0000 174.2160 60 D 3.7057 7.5193 119.4254 56.2273 40.9907 176.9244 61 I 4.6029 7.2947 117.3452 59.4018 39.7591 175.4547 62 I 4.3372 8.4116 124.5768 58.7348 37.9185 174.6729 63 P 4.2745 0.0000 0.0000 65.8304 31.3107 178.1590 64 D 4.4215 8.1267 115.4314 56.8210 41.0285 177.1426 65 A 4.1343 7.4451 121.0947 52.8404 18.8496 176.4450 66 Q 4.6112 8.2182 119.8511 53.5138 32.3446 172.7369 67 P 4.8093 0.0000 0.0000 63.5348 32.5590 175.7325 68 K 4.4652 9.2596 123.1396 54.8815 35.6068 175.4953 69 R 2.5431 7.3746 127.8704 56.3389 30.2198 174.8488 70 I 4.2680 8.4283 124.1319 62.6507 39.2813 176.0772 71 T 4.6128 7.5393 117.1022 61.6076 72.8218 172.5246 72 S 4.8091 8.7475 119.8912 56.1756 64.4132 173.2725 73 L 4.7102 8.8912 131.0132 54.5078 43.9544 177.1133 74 G 3.9372 9.0686 108.8251 44.0943 0.0000 175.3160 75 A 3.9669 9.1626 129.3040 53.5675 20.5914 179.4041 76 I 5.0257 7.6730 115.9070 59.8478 40.5555 174.9011 77 E 5.1789 8.9711 124.2181 55.1052 34.1472 173.9536 78 Q 5.0512 9.2876 126.8904 54.9028 30.9669 174.4880 79 W 5.2216 9.6632 125.5507 54.8570 34.0644 173.5596 80 D 5.2558 9.3237 121.0071 52.6343 42.7692 176.8372 81 A 4.0871 9.4050 129.8859 53.2192 18.8100 177.4464 82 Q 3.8392 8.9087 113.4414 57.3499 26.8727 173.8176 83 R 4.1729 8.6876 112.2968 56.4579 28.2642 177.1995 84 S 4.9066 7.7388 111.7982 57.0390 64.4309 173.6699 85 I 3.8151 8.4763 120.6925 62.1287 37.0734 176.6954 86 G 4.3092 9.1951 114.0316 47.4832 0.0000 175.2170 87 N 5.0005 7.8858 119.9714 54.8247 37.5064 176.8135 88 L 3.9596 7.9819 121.5151 57.7460 41.5462 179.6703 89 T 3.7660 7.5398 113.0873 66.5123 68.4387 176.3039 90 A 3.5995 7.6182 121.6591 54.7304 18.3441 179.2561 91 K 4.2945 7.8569 117.5225 58.8663 33.8258 178.9874 92 K 4.0386 7.5114 120.1665 56.4036 28.5211 176.7628 *95 D 4.4300 7.9652 122.1316 54.0010 43.5426 178.2601 96 R 3.7665 7.6337 118.5762 59.0713 29.9050 178.3771 97 A 4.0002 7.6355 120.0959 54.6544 18.3192 179.6089 98 I 3.1697 7.2707 118.2912 64.3470 37.2094 178.1430 99 E 3.9055 7.8302 119.0399 59.4822 29.2245 179.4753 100 L 4.1501 7.8787 118.7009 57.7621 41.6340 179.4998 101 A 4.0445 8.0846 120.6167 54.9618 18.1182 179.4150 102 A 4.4050 8.3457 118.4757 54.4651 18.4634 178.4534 103 D 4.7385 7.5828 114.6499 55.0862 42.4705 177.3477 104 H 4.8254 8.8295 113.8738 55.2075 30.0589 174.3026 105 G 4.2210 10.3581 110.5852 45.1876 0.0000 173.3165 106 I 4.9980 7.2303 117.4399 59.5938 41.1453 174.3454 107 G 4.3067 9.3664 115.6434 44.3760 0.0000 171.1795 108 L 5.2583 8.7946 124.2504 53.0872 45.8211 174.9811 109 V 5.0001 9.3150 126.0119 61.0195 34.5635 173.7428 110 A 5.0246 8.9681 129.7881 50.2126 21.1857 174.7201 111 L 5.3360 9.1504 125.8902 53.5286 44.6555 175.7384 112 R 4.8404 8.5639 121.5856 53.8874 33.3968 174.9169 113 N 4.2836 8.5237 112.4495 54.2879 36.3993 174.4640 114 A 4.8318 8.0186 119.6780 51.0770 20.7964 176.6255 115 N 5.2922 8.1917 115.9076 51.0639 41.6262 174.0705 116 H 4.1172 8.8949 118.5727 56.7113 30.9695 173.4958 117 W 3.9432 8.8546 125.2435 58.2853 27.2908 177.2469 *119 R 3.8132 8.7198 125.4764 55.0249 30.4474 175.0020 120 G 2.8341 8.5521 113.6503 47.5655 0.0000 173.9832 121 G 3.4758 7.8750 106.9191 47.3373 0.0000 175.6916 122 S 3.6715 7.2027 117.5084 61.6775 62.1493 176.2794 123 Y 4.4863 5.6891 120.8138 60.1339 37.6185 178.3893 124 G 3.6469 7.8597 106.4376 47.3841 0.0000 175.5325 125 W 3.9926 8.4694 131.3131 60.1910 30.6740 178.1726 126 Q 4.0705 8.5507 117.5839 58.9485 27.8935 178.6273 127 A 4.0572 7.7800 122.0281 55.0737 18.5914 179.3531 128 A 4.6523 7.7920 120.6442 54.9347 18.1448 179.7256 129 E 3.8289 8.0154 116.1364 58.8048 29.5526 178.6722 130 K 4.3838 7.8380 116.4272 56.3240 32.5114 177.7641 131 G 3.7846 8.1885 108.6081 45.0990 0.0000 173.2482 132 Y 4.6215 7.5756 116.9894 56.8004 40.6873 174.3063 133 I 4.5139 8.9433 122.4782 60.4325 39.1028 175.3336 134 G 4.5125 8.8819 113.5639 44.5172 0.0000 172.0258 135 I 5.5108 8.6556 124.2437 59.8040 41.6356 174.0797 136 C 5.1664 9.3494 119.7777 57.6419 33.3186 172.5587 137 W 6.0087 8.2987 116.0693 57.2601 31.6996 172.6803 138 T 4.6762 8.2479 114.1701 60.9112 70.8635 171.6427 139 N 6.1805 8.1720 122.2239 51.6272 40.1239 172.6727 140 S 4.4740 7.8819 111.1450 58.0249 65.1476 173.8573 141 I 3.8017 7.6107 113.1403 60.1747 38.0441 175.4287 142 A 4.3426 8.5896 125.1478 52.6986 17.9583 178.1312 143 V 4.4974 8.1748 118.5774 60.7961 33.1151 174.1505 *145 P 4.9086 0.0000 0.0000 61.8970 32.4094 174.4102 146 P 4.5394 0.0000 0.0000 61.8736 32.0595 175.3574 147 W 4.6230 9.0235 130.5177 59.4048 30.7060 176.0891 148 G 3.5697 8.3045 113.8378 44.9278 0.0000 172.8537 149 A 4.5911 7.5258 121.8925 50.4871 21.0313 176.5088 150 K 4.4726 8.3659 115.7154 56.2199 33.6342 175.4824 151 E 4.6695 7.6640 120.4219 54.3285 31.9561 174.5936 152 C 4.7091 8.6165 123.3167 60.2287 28.4100 173.8610 153 R 4.6902 8.5517 120.5072 55.5750 33.1165 174.4618 154 I 4.6716 7.6056 111.2099 58.9356 40.7469 174.6418 155 G 4.3904 8.2793 110.3084 43.9523 0.0000 174.1252 156 T 3.8406 8.4608 109.5448 63.8200 69.2428 176.1012 157 N 4.7800 7.6207 112.9936 53.1913 35.0885 170.0690 158 P 4.7459 0.0000 0.0000 62.2077 33.1230 174.5569 159 L 5.2621 8.5950 126.0010 53.5201 43.9610 175.2310 160 I 4.9242 9.1631 127.2029 59.5909 40.2699 174.8954 161 V 4.8714 9.0734 126.4184 61.4616 34.1361 174.0655 162 A 5.0957 9.5554 130.2846 50.1437 22.0460 174.6855 163 I 4.8283 8.6349 122.1966 57.7927 39.9328 175.7395 164 P 4.3825 0.0000 0.0000 62.3686 29.8995 175.0436 165 S 4.5432 7.4134 114.0137 57.8787 65.7260 173.0024 166 T 4.4317 7.9390 115.8801 61.1600 70.1206 172.4892 167 P 4.4618 0.0000 0.0000 61.4861 32.2544 176.3803 168 I 3.8930 7.7687 120.3631 61.6658 37.2949 176.1286 169 T 4.7218 8.1744 123.2940 61.9576 71.4236 173.8913 *171 V 4.2164 8.0497 122.9089 62.9924 33.0339 173.7829 172 D 5.1567 8.5867 126.0858 52.5456 44.9677 174.4937 *174 S 4.4318 8.2801 119.1524 58.1189 63.3771 172.2296 *176 S 4.2306 8.3421 111.4951 57.7776 63.1788 173.0970 *178 F 4.3483 8.3835 118.0547 57.4569 39.9056 174.3696 179 S 4.7353 8.3680 116.8428 57.0535 64.7650 174.0843 180 Y 4.1524 8.6651 119.5016 61.3015 38.0188 179.6017 181 G 3.6125 7.8334 106.4421 46.1033 0.0000 175.2555 *183 L 4.1508 8.0566 121.6717 54.4185 43.8929 178.9645 184 E 4.1193 8.2677 120.0916 58.6571 29.5036 178.7556 185 V 3.5735 7.8408 118.2247 66.4441 31.5044 177.7997 186 N 4.3327 8.0863 115.4211 56.1767 38.3934 177.3212 187 R 3.8374 8.1186 120.2404 59.4566 30.0047 178.5972 188 L 4.0157 8.3220 117.7514 57.5305 41.7269 178.6842 189 A 4.3166 7.9505 118.3425 51.8664 18.7066 177.7302 190 G 3.8053 7.7223 105.0486 46.4038 0.0000 174.0851 191 R 4.5435 8.3233 118.0754 54.3781 32.1256 175.9565 192 Q 4.5488 8.0382 118.0661 54.0103 30.4359 176.0170 193 L 3.8966 8.1320 121.1415 53.8241 42.0898 176.9693 194 P 4.0218 0.0000 0.0000 65.6308 31.2515 176.2647 195 V 4.5408 7.2525 109.6446 59.3645 35.8953 173.8812 196 D 4.5529 8.7955 120.9086 55.5462 41.0583 177.1777 197 G 4.1618 8.8666 109.9418 44.1674 0.0000 171.8046 198 G 4.0496 6.8536 106.0207 46.2704 0.0000 171.9341 199 F 5.6099 8.9617 118.4761 55.7623 41.7402 176.2642 200 D 4.7917 8.8977 122.1509 51.9368 42.3569 177.0901 201 D 4.9686 8.5354 116.9752 55.1798 40.1478 176.9530 202 E 4.5619 8.4104 115.0790 55.6763 32.0034 176.1061 203 G 3.8145 8.4602 105.9941 46.1626 0.0000 172.8907 204 N 5.2827 8.6287 117.0252 50.6575 41.2168 174.4910 205 L 4.1189 8.8293 122.6651 55.9611 42.5079 176.3219 206 T 4.7479 9.3248 116.4152 60.7926 71.5335 174.1089 207 K 4.3494 8.5872 121.8579 55.9047 33.5721 175.6500 208 E 4.4020 8.3825 122.0988 54.8653 30.2566 174.9223 209 P 4.3380 0.0000 0.0000 65.7757 31.6971 178.7115 210 G 3.7847 8.1229 104.0591 47.0224 0.0000 175.7428 211 V 3.6589 7.7202 119.7700 65.9651 31.5852 178.1267 212 I 4.0319 7.4931 118.2242 64.4560 36.8952 178.3022 213 E 4.1991 8.7379 119.7900 58.8511 28.9504 179.3839 214 K 4.0716 7.7712 119.1085 59.2516 32.6339 178.0808 215 N 4.6227 7.9871 113.7024 52.6094 37.7583 175.2035 216 R 4.1675 7.9811 118.9421 57.7014 29.1289 177.3472 217 R 4.5979 8.5666 117.4231 55.3843 28.2973 176.5409 218 I 4.2064 7.5565 119.4545 60.7782 39.3303 175.9934 219 L 4.3567 8.7044 132.6129 53.7012 42.8740 173.5951 220 P 4.7129 0.0000 0.0000 62.5021 30.4277 178.0770 *222 G 3.3120 8.9806 117.1530 45.2272 0.0000 173.3442 223 Y 2.9017 6.5427 122.1610 57.7260 37.6575 173.8447 224 W 3.9914 7.0553 128.2589 60.3746 27.2524 177.4616 225 K 4.0712 7.1905 118.7804 59.2947 31.5488 179.2331 226 G 3.5996 7.6424 104.3996 47.4967 0.0000 175.2856 227 S 4.4744 8.0919 115.5634 61.1357 62.4636 177.5673 228 G 3.6460 8.0365 105.3100 45.5270 0.0000 174.9285 *230 S 4.2872 7.9947 116.5866 58.0614 64.1604 175.8749 231 I 3.7072 7.6296 119.1601 64.6889 36.8929 178.7047 232 V 3.7580 7.5001 111.6410 64.2065 31.5956 178.3831 233 L 3.8418 7.6445 118.5360 57.1962 41.3244 178.7683 234 D 4.5650 7.8498 115.7902 54.8408 41.0079 177.8904 *236 I 4.1421 7.7560 119.7600 60.8993 39.4580 177.9547 237 A 4.0457 8.3943 121.8559 55.3972 17.9380 179.9346 238 T 3.9460 8.3499 114.6795 67.0593 68.5172 176.6801 239 L 4.0928 7.9473 120.6064 57.6015 41.5225 179.0833 240 L 4.0153 8.0228 120.0320 57.4339 41.8766 178.6387 241 S 4.5402 7.6144 109.3206 57.1990 63.8617 173.1686 242 D 4.4363 8.0181 120.4891 55.6041 40.3510 172.6732 243 G 4.3018 7.6975 108.4835 44.1620 0.0000 172.6762 244 A 4.5356 8.3906 123.4674 51.3558 20.1124 178.5667 245 S 4.8512 8.1201 118.7834 56.4334 66.6715 175.1615 246 V 3.7586 8.5427 120.8671 65.7567 31.1562 178.0589 247 A 3.9662 7.9221 119.9703 55.0891 18.2312 178.9961 248 E 3.8141 7.9617 117.2597 59.5246 29.6898 179.2174 249 V 3.4437 7.8149 118.2200 66.2742 31.3213 178.1367 250 T 3.8407 7.8476 114.5372 66.3475 68.3637 176.0103 251 Q 4.3052 7.9641 118.1421 57.0852 29.5004 176.5033 252 D 4.6024 8.3106 118.4693 54.7396 41.7724 176.1666 253 N 4.9451 7.3550 115.3396 51.3362 40.6528 175.2281 254 S 4.4093 8.6899 116.3103 61.3239 63.5184 173.8764 255 D 4.4159 7.6594 117.1245 53.6800 42.8583 174.2921 256 E 4.2595 9.0600 120.1088 55.5805 28.1882 175.8383 257 Y 4.6913 7.7029 121.4962 57.0229 40.5377 175.1122 258 G 3.8748 9.0511 107.8633 45.8778 0.0000 173.7530 259 I 4.0808 7.3930 113.9601 60.5460 39.7404 174.3433 260 S 5.2110 9.4886 117.8025 56.9199 65.8158 173.8577 261 Q 4.5495 9.0340 121.6631 54.0407 33.4293 174.0766 262 I 4.6046 7.7993 122.2441 59.2796 40.7196 174.4607 263 F 5.0967 9.0502 125.2960 55.6477 42.2861 174.3445 264 I 5.2007 9.0427 123.4846 59.4662 41.2377 174.2640 265 A 5.2880 9.1276 127.2974 50.2117 22.5916 174.8218 266 I 4.9636 8.8059 122.5333 59.1736 40.4949 175.1228 267 E 4.3327 9.3007 128.7100 56.6568 30.0747 175.9600 268 V 4.1913 8.0912 121.9527 64.6751 33.6043 177.4396 269 D 4.5315 8.0408 117.3372 57.0754 40.6234 177.5130 270 K 4.3117 7.8812 115.5174 56.6946 32.4492 176.8275 271 L 4.6432 7.8181 118.0963 54.5268 43.5447 176.4706 272 I 4.2972 7.2098 116.7020 58.4148 40.9288 174.1316 273 D 4.6341 8.6071 127.8602 52.8278 41.4397 177.2566 274 G 3.8477 8.6682 108.5416 47.8952 0.0000 173.8783 275 P 4.2481 0.0000 0.0000 65.6216 31.3414 178.8965 276 T 3.8694 8.8865 114.6382 66.5132 68.4575 176.8183 277 R 3.8605 8.2645 120.9919 59.5991 30.1215 178.3948 278 D 4.3458 8.2982 118.5067 57.0282 40.7890 178.7048 279 A 3.9642 8.1220 121.3682 55.2007 18.5066 179.9193 280 K 3.9448 8.3601 117.4542 59.4594 31.8385 179.7073 281 L 3.9887 7.5939 118.1825 57.8312 41.6311 178.9814 282 Q 4.0917 7.9408 118.4670 59.0974 29.3342 177.9229 283 R 4.0932 8.0251 119.8972 59.2942 29.9006 178.4763 284 I 3.9879 7.4035 115.6702 62.4489 36.6613 177.3951 *286 D 4.9375 7.9999 121.8455 54.6368 42.7397 177.3269 287 Y 4.2290 7.8248 119.0799 60.5078 38.8353 177.3801 288 V 3.6919 7.9544 119.9976 66.0044 32.1569 178.2013 289 T 3.9416 7.9015 109.9590 64.5329 68.8630 175.7105 290 S 4.3901 8.3138 114.0803 58.3451 63.2445 174.1477 291 A 4.0897 7.1643 123.2635 51.7170 18.7115 177.4347 292 E 4.0434 8.3710 119.8083 56.3116 29.9390 177.9281 293 R 4.1259 8.3666 122.5340 56.0177 30.8832 176.4815 294 A 4.1937 8.3253 122.0191 53.4977 19.5286 177.3375 295 D 4.4546 7.6534 114.9861 52.4806 42.5731 174.9194 296 E 3.9844 8.9356 128.7057 59.0896 29.7774 177.9302 297 N 4.4385 8.5401 115.7045 55.1893 38.9267 175.0985 298 Q 4.2742 8.0221 119.4830 54.4159 29.6396 175.1131 299 A 4.3475 8.2803 128.2477 51.3901 19.6127 176.5640 300 I 4.0220 8.0534 121.1394 60.8429 37.9478 176.0768 301 R 4.6394 8.2026 120.3800 54.1234 32.2211 175.2554 302 L 4.2801 8.0024 120.3301 52.8178 42.8047 174.5480 303 P 4.3399 0.0000 0.0000 64.5511 31.4392 176.9851 304 G 4.1804 9.0096 110.0928 46.4341 0.0000 174.7614 305 H 4.4210 8.1421 117.4619 58.4214 28.5535 177.2811 306 E 4.0497 7.8852 120.5740 58.7389 29.1207 179.0678 307 F 4.3792 7.6146 118.4090 60.4741 38.8345 177.8291 308 T 4.0655 8.0587 115.9793 66.8483 67.9414 177.0512 309 T 3.9089 7.8525 111.2626 64.7757 68.9009 176.3400 310 L 4.0320 8.5879 122.3396 57.2642 41.5582 179.1844 311 L 4.2821 7.9679 121.2305 57.6276 42.2255 178.6564 312 A 3.9817 7.8764 120.5449 55.4603 18.2872 179.4907 313 E 4.0150 8.3942 116.9308 59.6869 29.3183 179.4176 314 N 4.6605 8.0350 116.8182 55.7878 38.7527 177.1711 315 R 4.1173 8.1518 117.1219 57.3287 30.2100 177.8957 316 R 4.3425 7.2494 117.6824 57.3488 31.4196 177.3662 317 N 4.8641 7.8934 114.1790 52.0689 37.3070 174.8340 318 G 3.9265 7.9534 109.0326 46.0011 0.0000 172.3693 319 I 4.5188 7.8249 118.4689 59.7173 38.9551 175.3451 320 T 4.6941 8.3956 119.8512 61.6352 70.5870 173.9162 321 V 4.3131 7.8086 125.1751 60.1887 34.4998 175.3123 322 D 4.4228 8.4589 125.6291 54.4511 42.1648 177.1487 323 D 4.5171 8.8934 124.6079 57.8245 40.9646 179.3741 324 S 4.1833 8.1406 113.9231 61.4776 62.8502 176.5971 325 V 3.5957 7.6912 121.2173 65.5786 31.4317 177.4507 326 W 4.5289 8.7398 128.3142 60.6828 30.4895 177.6133 327 A 3.8958 8.5763 120.9596 55.2091 17.6778 179.7804 328 K 3.9313 7.9946 116.8809 59.6905 32.1714 179.7237 329 I 3.7742 7.8040 120.1475 64.2508 36.9185 178.4039 330 Q 3.6156 7.8673 119.1241 58.8425 28.2627 178.8308 331 A 3.9530 7.5135 120.6323 55.0953 18.4460 179.4359 332 L 4.0848 7.3718 116.8497 57.6831 41.6867 179.3528 333 L 4.3310 7.4337 118.5606 56.8735 41.9637 177.9129 334 E 4.0768 7.9536 125.8634 57.2474 28.4680 176.8577 335 H 4.3504 8.3615 122.5968 56.7137 29.7596 173.5270 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 K 8.31 4.45 0.00 1.57 1.74 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.41 7.81 3 V 8.30 4.20 1.66 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 -0.13 0.00 0.00 0.48 0.00 0.00 4 T 8.38 4.45 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 1.26 0.00 0.00 5 F 9.12 4.03 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.29 3.84 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 2.58 2.40 0.00 7 Q 8.02 4.02 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 8 L 7.73 3.69 0.00 1.75 1.38 0.94 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 9 K 7.77 3.79 0.00 1.32 1.54 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.42 1.53 7.81 10 A 8.27 3.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.47 3.78 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 F 7.19 3.63 0.00 3.08 2.63 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 13 N 8.55 4.36 0.00 2.93 2.97 0.00 0.00 7.26 7.22 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 14 R 8.50 3.97 0.00 1.98 1.98 0.00 3.14 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 15 V 7.71 3.83 2.63 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 0.97 0.00 0.00 1.11 0.00 0.00 16 L 8.36 4.24 0.00 2.01 1.84 1.17 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.89 4.54 1.90 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 1.73 0.78 0.99 0.00 0.00 18 S 7.73 4.28 0.00 4.04 4.17 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 19 R 7.98 4.57 0.00 1.87 1.83 0.00 3.35 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 20 G 8.00 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 21 V 7.56 4.26 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 1.13 0.00 0.00 0.99 0.00 0.00 22 D 8.64 4.80 0.00 2.96 2.82 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 23 S 8.85 4.16 0.00 4.09 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 0.00 24 E 8.60 3.84 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 25 T 8.69 3.94 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 26 A 8.50 4.15 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.52 4.28 0.00 2.88 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.55 4.01 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.41 4.24 0.00 3.18 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 30 A 8.37 4.32 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.17 3.88 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 *33 F 8.00 4.19 0.00 2.80 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 0.00 0.00 0.00 34 A 8.34 4.28 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 35 R 8.51 4.07 0.00 1.81 1.94 0.00 3.27 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.88 0.00 36 T 7.83 3.63 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 1.14 0.00 0.00 37 T 7.71 3.69 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 38 E 8.53 4.11 0.00 2.39 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 2.30 2.44 0.00 39 S 7.38 4.41 0.00 3.74 3.48 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 40 G 8.03 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 41 V 6.51 4.00 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 0.79 0.00 0.00 0.72 0.00 0.00 42 Y 7.90 4.36 0.00 3.16 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.52 4.21 0.00 4.04 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 44 H 8.33 5.03 0.00 3.15 3.33 0.00 5.64 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 45 G 7.91 4.20 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 0.00 46 V 8.56 4.16 2.49 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 1.08 0.00 0.00 1.28 0.00 0.00 47 N 8.49 4.59 0.00 3.22 3.06 0.00 0.00 6.76 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.30 4.45 0.00 2.20 2.15 0.00 3.23 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 49 F 8.27 3.88 0.00 2.80 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.14 0.00 2.25 2.14 0.00 3.92 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 51 R 7.99 3.87 0.00 1.96 2.18 0.00 3.26 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.83 0.00 52 F 8.53 4.23 0.00 3.28 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 53 I 7.63 3.03 1.60 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 -0.17 0.68 0.00 0.00 54 Q 7.81 3.87 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 55 Q 7.93 3.94 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 56 L 7.48 3.77 0.00 1.08 1.40 0.80 0.49 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 57 E 7.91 3.94 0.00 2.03 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 2.24 2.42 0.00 58 N 8.02 4.47 0.00 2.80 2.81 0.00 0.00 7.35 7.21 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 59 G 7.50 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 60 D 7.52 3.71 0.00 2.69 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.29 4.60 1.79 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 1.51 0.55 1.04 0.00 0.00 62 I 8.41 4.34 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 1.27 0.70 0.93 0.00 0.00 63 P 0.00 4.27 0.00 2.04 2.18 0.00 3.67 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 64 D 8.13 4.42 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 7.45 4.13 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 66 Q 8.22 4.61 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 67 P 0.00 4.81 0.00 2.13 2.12 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 68 K 9.26 4.47 0.00 1.80 1.59 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.18 1.26 7.81 69 R 7.37 2.54 0.00 0.67 0.97 0.00 3.13 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.57 0.00 70 I 8.43 4.27 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.02 0.86 0.00 0.00 71 T 7.54 4.61 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 1.20 0.00 0.00 72 S 8.75 4.81 0.00 3.80 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 73 L 8.89 4.71 0.00 1.61 1.59 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.07 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 75 A 9.16 3.97 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.67 5.03 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 1.36 0.98 0.94 0.00 0.00 77 E 8.97 5.18 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 Q 9.29 5.05 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 79 W 9.66 5.22 0.00 3.19 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 9.32 5.26 0.00 2.65 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 9.40 4.09 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 82 Q 8.91 3.84 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 83 R 8.69 4.17 0.00 2.00 2.02 0.00 3.49 0.00 0.00 3.58 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 84 S 7.74 4.91 0.00 4.07 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 85 I 8.48 3.82 1.97 0.00 0.00 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 1.46 1.30 1.16 0.00 0.00 86 G 9.20 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 N 7.89 5.00 0.00 3.00 3.00 0.00 0.00 6.72 6.67 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 88 L 7.98 3.96 0.00 1.74 1.79 1.04 0.77 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 89 T 7.54 3.77 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 1.16 0.00 0.00 90 A 7.62 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.86 4.29 0.00 1.94 2.02 0.00 1.83 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 1.42 1.71 7.81 92 K 7.51 4.04 0.00 1.77 1.50 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.60 7.81 *95 D 7.97 4.43 0.00 2.83 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 7.63 3.77 0.00 1.47 1.41 0.00 3.10 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.56 0.00 97 A 7.64 4.00 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 98 I 7.27 3.17 1.80 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.45 0.27 0.00 0.00 99 E 7.83 3.91 0.00 2.14 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 2.28 2.53 0.00 100 L 7.88 4.15 0.00 1.85 1.70 0.99 1.11 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 0.00 101 A 8.08 4.04 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 0.00 102 A 8.35 4.40 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 0.00 103 D 7.58 4.74 0.00 2.74 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 0.00 104 H 8.83 4.83 0.00 3.30 3.35 0.00 5.85 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 10.36 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 0.00 0.00 0.00 0.00 106 I 7.23 5.00 1.92 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 1.31 0.99 0.95 0.00 0.00 107 G 9.37 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.79 5.26 0.00 1.70 1.47 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 109 V 9.31 5.00 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 0.80 0.00 0.00 0.79 0.00 0.00 110 A 8.97 5.02 1.29 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.37 0.00 120 G 8.55 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 0.00 0.00 0.00 121 G 7.88 3.48 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 0.00 122 S 7.20 3.67 0.00 2.72 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 0.00 123 Y 5.69 4.49 0.00 2.87 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.86 3.65 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 0.00 125 W 8.47 3.99 0.00 3.43 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.55 4.07 0.00 2.34 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.61 0.00 0.00 0.00 0.00 0.00 2.54 2.39 0.00 127 A 7.78 4.06 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 0.00 128 A 7.79 4.65 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 0.00 129 E 8.02 3.83 0.00 2.06 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 2.14 2.17 0.00 130 K 7.84 4.38 0.00 2.15 2.12 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.77 1.62 7.81 131 G 8.19 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 7.58 4.62 0.00 3.00 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 0.00 133 I 8.94 4.51 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 1.17 0.73 1.00 0.00 0.00 134 G 8.88 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 8.66 5.51 2.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.91 1.23 0.00 0.00 136 C 9.35 5.17 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 8.30 6.01 0.00 3.53 3.36 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 0.00 138 T 8.25 4.68 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 0.25 0.00 0.00 139 N 8.17 6.18 0.00 2.72 2.83 0.00 0.00 6.75 7.80 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 0.00 140 S 7.88 4.47 0.00 4.18 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 0.00 141 I 7.61 3.80 1.86 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 1.25 0.61 0.88 0.00 0.00 142 A 8.59 4.34 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 0.00 143 V 8.17 4.50 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.08 0.00 0.00 *145 P 0.00 4.91 0.00 2.41 2.19 0.00 3.52 0.00 0.00 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 146 P 0.00 4.54 0.00 2.33 2.29 0.00 3.94 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 2.11 1.99 0.00 147 W 9.02 4.62 0.00 3.47 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 0.00 148 G 8.30 3.57 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 0.00 0.00 0.00 149 A 7.53 4.59 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 0.00 150 K 8.37 4.47 0.00 1.77 1.74 0.00 1.45 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.35 7.81 151 E 7.66 4.67 0.00 1.98 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 2.27 2.29 0.00 152 C 8.62 4.71 0.00 3.04 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 0.00 153 R 8.55 4.69 0.00 1.76 1.90 0.00 3.32 0.00 0.00 3.29 7.25 0.00 0.00 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0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.27 4.12 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.21 0.00 185 V 7.84 3.57 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.06 0.00 0.00 186 N 8.09 4.33 0.00 2.82 2.98 0.00 0.00 6.67 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 R 8.12 3.84 0.00 1.97 2.08 0.00 3.27 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 188 L 8.32 4.02 0.00 1.76 1.73 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 189 A 7.95 4.32 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 0.00 190 G 7.72 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 R 8.32 4.54 0.00 1.74 1.82 0.00 3.14 0.00 0.00 3.22 7.39 0.00 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8.26 3.86 0.00 1.79 2.11 0.00 3.21 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 278 D 8.30 4.35 0.00 2.94 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 0.00 279 A 8.12 3.96 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 0.00 280 K 8.36 3.94 0.00 1.85 1.84 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.54 7.81 281 L 7.59 3.99 0.00 1.91 1.71 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 282 Q 7.94 4.09 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 283 R 8.03 4.09 0.00 2.00 2.03 0.00 3.08 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 284 I 7.40 3.99 2.02 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 1.51 1.27 0.95 0.00 0.00 *286 D 8.00 4.94 0.00 2.83 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 0.00 287 Y 7.82 4.23 0.00 3.10 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 0.00 288 V 7.95 3.69 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 0.88 0.00 0.00 1.00 0.00 0.00 289 T 7.90 3.94 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 1.20 0.00 0.00 290 S 8.31 4.39 0.00 3.98 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 0.00 291 A 7.16 4.09 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 0.00 292 E 8.37 4.04 0.00 1.93 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 2.27 2.25 0.00 293 R 8.37 4.13 0.00 1.78 1.94 0.00 3.18 0.00 0.00 3.43 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 294 A 8.33 4.19 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 0.00 295 D 7.65 4.45 0.00 2.61 2.49 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 0.00 0.00 0.00 296 E 8.94 3.98 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 297 N 8.54 4.44 0.00 2.97 2.85 0.00 0.00 6.87 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 0.00 298 Q 8.02 4.27 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 299 A 8.28 4.35 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 0.00 300 I 8.05 4.02 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.92 0.00 0.00 301 R 8.20 4.64 0.00 1.81 1.83 0.00 2.98 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 302 L 8.00 4.28 0.00 1.18 1.31 0.86 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 303 P 0.00 4.34 0.00 2.21 2.08 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 304 G 9.01 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 0.00 0.00 0.00 0.00 305 H 8.14 4.42 0.00 3.33 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 E 7.89 4.05 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 1.47 1.73 0.00 307 F 7.61 4.38 0.00 3.19 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 308 T 8.06 4.07 4.47 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 1.28 0.00 0.00 309 T 7.85 3.91 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 0.00 310 L 8.59 4.03 0.00 1.74 1.77 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 311 L 7.97 4.28 0.00 1.71 1.88 0.85 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 312 A 7.88 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 E 8.39 4.02 0.00 2.15 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 2.46 2.51 0.00 314 N 8.04 4.66 0.00 3.01 2.91 0.00 0.00 7.00 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 0.00 315 R 8.15 4.12 0.00 1.81 1.94 0.00 3.09 0.00 0.00 3.07 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 316 R 7.25 4.34 0.00 2.17 1.98 0.00 3.20 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 317 N 7.89 4.86 0.00 2.84 2.82 0.00 0.00 7.09 6.89 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 0.00 318 G 7.95 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 0.00 319 I 7.82 4.52 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.71 1.06 0.00 0.00 320 T 8.40 4.69 4.12 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 1.11 0.00 0.00 321 V 7.81 4.31 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.88 0.00 0.00 322 D 8.46 4.42 0.00 2.76 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 0.00 323 D 8.89 4.52 0.00 2.71 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 0.00 324 S 8.14 4.18 0.00 4.08 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 0.00 325 V 7.69 3.60 2.39 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 1.23 0.00 0.00 1.09 0.00 0.00 326 W 8.74 4.53 0.00 3.35 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 327 A 8.58 3.90 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 328 K 7.99 3.93 0.00 2.09 1.91 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.67 7.81 329 I 7.80 3.77 1.60 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.32 0.60 0.00 0.00 330 Q 7.87 3.62 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.73 2.22 0.00 331 A 7.51 3.95 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 0.00 332 L 7.37 4.08 0.00 1.79 1.78 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 333 L 7.43 4.33 0.00 1.74 1.62 0.86 0.78 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 0.00 334 E 7.95 4.08 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.18 0.00 335 H 8.36 4.35 0.00 3.00 3.05 0.00 5.78 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.