NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 I 5.0499 8.0477 117.9463 60.0664 37.0059 175.1194 35 D 4.6886 8.4181 123.1833 50.1731 44.4968 170.8380 36 G 3.9024 8.6504 107.8249 47.1248 0.0000 171.9842 37 S 4.7323 7.1309 114.2644 55.6287 66.8521 174.3969 38 N 4.2454 8.2644 115.9383 55.8914 38.4130 175.8670 39 R 4.6747 8.3954 123.8188 56.3688 31.3280 176.1836 40 D 4.6390 8.2154 117.7842 53.8541 41.5917 175.8026 41 A 4.2294 8.5281 123.5888 51.7986 19.0956 178.2315 42 L 3.2307 8.7451 125.3601 58.1028 41.8802 179.0904 43 S 4.7362 7.7570 112.5939 59.9896 63.0147 175.2869 44 D 4.2796 8.1323 122.4886 56.2532 40.8399 176.5845 45 F 4.6144 8.8572 117.7211 57.5331 42.3928 175.5604 46 F 5.2357 7.9631 115.4276 55.6721 43.8439 173.6436 47 E 4.5533 9.3016 124.0944 54.5020 30.5033 175.3358 48 V 3.9429 8.3743 127.8101 62.4054 32.0683 175.0338 49 E 4.9237 9.3605 127.3933 56.5615 32.6947 177.4163 50 S 4.5736 8.7793 122.9236 58.8182 64.7915 172.9675 51 E 4.3292 8.7719 122.0771 56.5675 29.4956 176.1532 52 L 4.5040 8.4226 125.6819 55.4461 44.1837 176.1819 53 G 3.9148 7.2018 103.6624 46.8194 0.0000 171.8041 54 R 4.7689 8.3124 117.5087 56.4885 32.7282 174.4411 55 G 4.0013 9.0942 110.8214 44.7576 0.0000 172.1076 56 A 4.1776 8.6394 121.2160 54.7891 18.9256 179.3669 57 T 4.1832 7.9029 106.3452 64.3467 69.8011 174.5355 58 S 5.2048 7.2339 112.5952 58.2700 65.8233 174.8150 59 I 4.8045 8.1499 121.5740 59.5205 40.7771 174.3725 60 V 4.8194 8.4599 124.5374 61.4048 34.2976 174.0968 61 Y 5.1919 9.0299 124.4971 56.0475 42.1251 174.5775 62 R 4.9232 9.1056 122.4466 56.2096 31.8528 174.9926 63 C 5.3056 9.2414 119.2475 57.0847 33.9857 172.4667 64 K 5.1922 8.9401 119.1491 54.3921 34.7920 175.7460 65 Q 4.3469 9.4968 127.0337 55.8270 30.2202 175.5531 66 K 4.1292 8.5215 126.8924 58.1762 32.1194 175.6474 67 G 4.3069 9.2986 115.2429 45.7221 0.0000 174.4733 68 T 4.1815 7.5861 107.2202 60.9993 69.7627 175.1327 69 Q 3.5861 8.0998 118.9834 56.4479 27.1289 172.7886 70 K 4.3833 8.1749 121.1185 55.1947 33.0761 174.5926 71 P 5.0850 0.0000 0.0000 63.4235 32.2875 174.9492 72 Y 4.8816 9.4702 118.7114 56.7760 43.3447 173.5191 73 A 5.1193 8.9727 122.1196 50.5543 21.9777 176.2058 74 L 5.0361 9.1472 122.4625 53.2684 45.1522 175.2803 75 K 4.8530 9.1065 129.7674 55.1970 33.9123 175.2129 76 V 4.7210 9.3662 131.5267 61.9946 33.3360 174.8514 77 L 5.2645 8.7768 130.6232 52.8861 43.8387 172.6244 78 K 4.4882 8.5069 126.0108 56.1795 32.8088 177.5303 79 K 4.4626 8.3543 128.8502 54.8877 33.0569 177.6620 *90 I 4.1658 8.3833 118.8541 59.4261 37.8328 178.5466 91 G 3.7839 8.3334 107.0008 49.2467 0.0000 176.4317 92 V 3.8766 7.8907 123.7161 66.1651 31.8367 181.0185 93 L 4.2866 7.8856 125.6927 60.4026 40.4703 182.1420 94 L 4.3095 8.1151 123.7658 59.6606 40.8498 181.1481 95 R 4.5648 7.8494 118.3197 57.9199 30.1105 179.6449 96 L 4.3918 7.0116 116.7575 56.3395 42.1541 176.9977 97 S 4.4979 9.4438 117.8130 57.3508 65.5781 172.7892 98 H 4.4188 8.3474 125.7560 54.0501 32.4061 172.3689 99 P 4.2304 0.0000 0.0000 65.1873 31.3413 176.6153 100 N 5.1260 8.2460 114.7758 52.0217 38.8854 173.4782 101 I 5.0650 7.5970 118.7050 59.0413 40.4518 175.6858 102 I 3.9867 8.5622 129.6581 62.3412 37.7791 176.6272 103 K 4.2986 9.2509 131.0392 54.7537 32.9366 173.0752 104 L 4.4448 8.5407 127.9168 54.2481 42.3029 175.9253 105 K 4.3025 9.4784 129.2238 58.3638 32.7698 175.9641 106 E 4.6938 7.7828 118.8427 54.7541 33.7980 172.9666 107 I 5.0606 8.0181 123.6072 59.5608 40.6633 174.4163 108 F 5.2756 9.4638 125.9050 55.6249 42.2963 174.2209 109 E 5.1848 9.0303 122.6052 54.8807 32.8204 175.4213 110 T 4.7803 8.5755 117.5059 59.2293 71.4630 172.3566 111 P 4.3381 0.0000 0.0000 65.9719 31.2242 177.4225 112 T 4.3069 7.4744 114.1258 64.8021 69.0054 174.7661 113 E 4.9075 8.6024 120.6462 55.3963 32.3388 174.7856 114 I 4.9148 8.7624 121.9901 59.6207 41.1500 174.0219 115 S 5.2993 9.3992 126.4109 56.7731 65.5899 173.1077 116 L 5.1258 8.8486 124.7738 52.9691 44.1330 175.5920 117 V 4.3276 8.9319 124.9444 62.0085 32.7744 174.7937 118 L 5.4887 9.0905 127.7002 52.2903 45.7981 175.9215 119 E 4.4190 8.8523 119.7192 56.7252 30.3538 176.2314 120 L 4.4565 8.3203 123.7623 53.7480 42.8904 176.3818 121 V 4.2909 8.1564 119.6199 60.6354 33.1554 175.8425 122 T 4.6062 8.7925 110.0267 61.4284 69.2480 175.5249 123 G 3.7524 8.4490 110.3221 45.3735 0.0000 175.3751 124 G 3.9224 7.9179 109.3660 44.9661 0.0000 172.3965 125 E 4.7072 8.3380 117.2207 55.2937 31.6353 177.0988 126 L 4.0172 8.5674 124.9457 59.0978 41.6426 179.9813 127 F 4.4068 8.0895 116.3515 60.1186 38.7377 177.1666 128 D 4.2758 8.1557 117.6846 56.8120 41.1511 178.4392 129 R 4.2931 8.1917 120.2810 58.8365 30.1701 179.0239 130 I 3.5144 7.6916 119.5850 64.3747 36.8541 178.5362 131 V 3.8180 7.1748 110.7342 63.0303 31.7819 177.3626 132 E 4.2979 7.9814 118.0628 55.9322 29.7106 176.1336 133 K 4.1785 7.3450 119.5431 55.6457 32.8675 177.1111 134 G 3.7909 8.9594 113.2303 48.4156 0.0000 173.1755 135 Y 4.8806 7.7660 115.3271 55.9501 41.9863 174.4547 136 Y 5.2528 9.1833 123.8412 56.0214 42.4208 174.0839 137 S 4.8929 9.0812 120.5058 55.6950 66.8232 174.9559 138 E 4.0371 8.1802 118.5294 59.3021 28.8653 179.9804 139 R 3.7703 7.7134 118.0987 59.0397 30.0542 178.7561 140 D 4.3237 7.8014 118.0459 57.3198 41.0196 178.4299 141 A 4.1851 7.9017 120.7733 55.2681 18.3422 179.5850 142 A 3.4897 8.1942 119.5754 55.0267 18.0595 179.4622 143 D 4.2199 8.1971 117.4287 57.4532 40.8862 179.0669 144 A 3.9651 7.8856 120.6843 55.2397 18.4447 179.8795 145 V 3.6182 7.9531 116.8443 65.9178 31.4982 178.1174 146 K 3.9607 8.3913 119.7438 59.5346 32.0005 178.8154 147 Q 3.9730 7.8641 118.1134 59.0124 28.6183 178.6165 148 I 3.6592 7.7450 120.7119 64.5671 37.1750 178.2790 149 L 4.0158 8.3171 119.8937 57.9568 41.4904 179.3896 150 E 4.0048 8.4879 118.3113 59.4779 29.4203 179.4039 151 A 3.8068 8.1472 120.6777 55.0581 18.4668 179.8812 152 V 3.4733 8.2083 116.9649 65.9949 31.5365 177.8848 153 A 3.9954 8.3770 120.9797 55.4798 18.3029 178.9407 154 Y 4.0100 8.1108 117.7701 60.8284 38.8877 178.2119 155 L 3.9683 8.1761 119.8801 58.3060 41.6900 179.3396 156 H 4.4316 8.6995 116.4065 58.9090 28.3960 177.5806 157 E 3.9868 8.2323 119.7609 59.3266 29.2967 178.2043 158 N 4.7283 7.5811 113.8661 52.7087 38.7522 175.7034 159 G 3.8218 7.9387 107.4571 46.2280 0.0000 173.8737 160 I 4.2449 8.1318 121.0125 59.2077 37.9336 175.5102 161 V 4.1403 8.2350 126.0584 61.9715 32.4245 175.1242 162 H 4.1246 10.0337 130.7503 59.8388 29.8398 178.3043 163 R 4.2193 9.3564 113.9665 56.7408 28.4023 177.4636 164 D 4.9564 7.9963 116.1253 54.1685 41.5995 175.3169 165 L 4.0941 8.1630 118.1649 54.3380 42.6658 176.7605 166 K 3.9422 8.4997 120.0474 55.3259 35.4950 174.3329 167 P 4.5485 0.0000 0.0000 65.9286 31.3165 178.8125 168 E 4.0694 8.1114 116.2475 58.2869 29.8309 176.9394 169 N 4.9028 8.3323 115.7327 52.4146 38.9627 174.3029 170 L 4.9234 7.7867 121.0719 53.7892 42.4367 175.2522 171 L 5.1875 8.8717 124.1892 52.8529 45.8963 175.4733 172 Y 4.6213 8.8742 120.0600 57.1331 39.1928 176.0090 173 A 4.2018 9.0338 127.1924 54.9375 19.2133 177.4987 174 T 5.0182 7.5166 100.4845 58.6311 72.0045 171.9506 175 P 4.3402 0.0000 0.0000 63.1853 31.6768 177.0356 176 A 4.0457 7.8244 122.7725 51.8840 18.8399 176.8574 177 P 4.1533 0.0000 0.0000 65.6157 31.4709 177.1621 178 D 4.6404 7.9230 114.0149 52.8762 39.6641 176.1390 179 A 4.0971 7.5757 123.2456 52.3151 19.0522 176.3281 180 P 4.7131 0.0000 0.0000 62.3954 32.7768 175.3326 181 L 4.1839 9.3064 125.7496 54.4688 43.5888 175.5999 182 K 4.8111 9.5044 125.5466 54.4659 35.8413 175.4664 183 I 4.4140 8.9225 126.3299 61.2495 38.3573 175.6004 184 A 4.9392 9.1100 128.9000 51.1462 21.9972 177.1587 185 D 4.6412 8.2913 118.4678 56.1561 38.8153 175.9357 *186 F 3.4948 7.3240 118.3854 57.6628 37.0217 181.5991 *203 G 4.1366 7.9997 113.6805 45.6234 0.0000 173.4322 204 T 4.8323 7.4181 108.3064 59.2548 68.5578 172.8586 205 P 4.4965 0.0000 0.0000 65.6463 32.1484 179.2466 206 G 3.6562 8.1581 107.1625 47.6318 0.0000 173.5629 207 Y 4.6298 7.8570 116.0428 58.0833 38.8084 175.4604 208 C 4.4251 7.9012 118.7650 58.3153 29.1840 173.6064 209 A 2.5800 8.1815 126.8249 51.0637 18.7613 176.5878 210 P 3.9097 0.0000 0.0000 65.3688 31.2939 179.0968 211 E 3.8665 7.7488 115.9849 59.3400 29.4952 179.2790 212 I 3.4681 7.2409 120.6849 64.1891 36.9314 178.4239 213 L 3.9171 7.5484 117.9745 57.2699 41.5615 178.6592 214 R 4.1851 7.7077 115.6860 56.0394 30.3857 177.4998 215 G 3.8980 7.7345 107.5441 45.1200 0.0000 173.7884 216 C 4.1939 7.5362 119.2659 58.6840 32.1594 173.0406 217 A 4.1085 8.3795 127.0793 52.8472 18.3896 176.4404 218 Y 4.9388 7.5868 118.1494 55.5670 41.9512 174.2561 219 G 4.2358 8.4636 107.2152 42.1210 0.0000 171.2127 220 P 4.4154 0.0000 0.0000 65.1688 31.0656 177.8328 221 E 4.1895 8.2260 118.3489 59.1434 29.5049 179.1304 222 V 3.8606 7.8973 112.6070 64.3126 31.5213 178.1447 223 D 4.5573 8.2928 118.7813 57.4450 40.6365 178.6414 224 M 4.1936 8.0867 119.0433 57.9320 32.0718 178.1845 225 W 4.3178 8.3219 128.4947 60.8897 30.8755 178.2348 226 S 4.3943 8.3726 114.5903 61.7019 62.1718 176.9078 227 V 3.8137 8.1845 121.2062 65.6834 31.1303 178.3386 228 G 3.4659 8.0732 105.7556 47.7131 0.0000 175.7439 229 I 3.5246 7.5075 122.2874 64.0590 37.1363 178.5753 230 I 3.9990 7.8792 120.5846 64.7865 37.0006 178.5930 231 T 3.9219 8.2262 116.6873 66.8447 68.1994 175.7584 232 Y 4.1733 8.2844 121.6985 61.0541 38.7288 178.5354 233 I 3.8684 7.9067 121.7002 63.8989 36.9714 178.3875 234 L 4.3842 8.0609 118.6294 57.9046 41.5134 179.2393 235 L 4.0412 7.6103 118.0258 56.4016 41.6779 177.3579 236 C 4.1429 7.1180 108.5914 56.5100 30.7361 175.0879 237 G 3.9014 9.8580 109.1822 45.0948 0.0000 172.6261 238 F 4.7375 6.5250 113.0648 54.9267 40.9448 173.4768 239 E 4.2640 8.6034 120.8795 55.5160 29.8482 175.8894 240 P 3.5394 0.0000 0.0000 64.3312 31.5458 177.0943 241 F 4.9117 7.6064 116.0403 56.9754 39.5590 174.3629 242 Y 4.1399 8.2584 121.6083 58.3937 38.9375 175.3905 243 D 4.3627 8.0247 127.6108 53.0424 43.9414 176.3045 244 E 3.8205 8.4174 122.7778 58.3664 29.9381 174.5861 245 R 3.9339 7.9727 114.9940 57.2959 30.4832 175.5165 246 G 3.7588 7.9105 103.8525 44.0532 0.0000 174.3777 247 D 4.0054 8.7282 117.8065 57.1741 40.4918 179.0936 248 Q 4.0676 8.0074 117.7365 59.4048 28.5170 178.6529 249 F 4.0650 8.0483 119.1122 60.0406 39.1699 177.2054 250 M 4.1451 8.0979 117.9037 58.7331 31.8824 178.1385 251 F 4.3856 8.3775 117.9993 60.9084 39.1366 177.6985 252 R 3.9107 7.9459 117.3957 59.6714 29.8857 179.4171 253 R 4.1351 8.3205 117.5450 58.9436 30.0687 179.2023 254 I 2.7478 7.7158 119.8678 64.1760 36.8962 178.5330 255 L 3.9581 7.9313 118.2629 56.9935 41.4874 178.2908 256 N 4.6281 8.0511 114.1684 52.0655 39.7603 174.0797 257 C 4.3884 7.8315 120.0613 60.5963 30.4527 174.2205 258 E 4.2716 8.8933 120.8945 54.4959 28.5200 173.7076 259 Y 4.6498 6.9735 122.2932 54.8358 41.4532 174.2639 260 Y 4.2764 7.9597 116.1853 56.5342 42.1775 176.3236 261 F 3.6422 7.7197 123.2464 55.6637 37.8132 174.6418 262 I 4.0986 7.8791 116.3615 60.4606 38.4754 176.9273 263 S 4.5836 8.8891 122.2590 58.1372 63.3572 172.4803 264 P 5.3988 0.0000 0.0000 62.7718 32.0612 177.7830 265 W 4.1686 8.0857 118.7297 59.3690 29.2833 176.7532 266 W 4.4284 8.6186 116.2496 56.9606 29.4364 177.8809 267 D 4.4312 8.3590 119.7569 57.1779 40.3314 177.7212 268 E 4.4002 7.9589 115.1811 55.9795 29.8463 175.8454 269 V 3.9827 7.4367 120.2388 61.5266 32.6097 176.6061 270 S 4.2711 9.2609 122.5666 58.7629 64.5881 175.7408 271 L 3.9716 8.4624 123.2028 58.1020 41.4353 179.6254 272 N 4.3861 8.1932 115.8279 56.1156 38.5650 177.1341 273 A 2.6584 8.0514 122.2673 54.7536 18.3310 179.8119 274 K 3.4593 7.6269 116.8287 59.3978 31.7530 179.1240 275 D 4.3070 7.9126 117.6942 57.0855 41.4669 177.6998 276 L 3.9060 7.7014 120.7970 58.1958 42.0798 178.9672 277 V 3.5222 7.6226 118.0459 66.2900 31.1996 178.1385 278 R 4.2121 8.1755 118.0654 58.0351 30.1708 178.1330 279 K 4.4752 7.9343 116.2758 56.1081 32.1067 177.2342 280 L 4.4237 7.4319 117.9477 56.5408 43.6047 178.0510 281 I 3.4352 7.1255 120.8936 59.7055 35.0357 174.2364 282 V 4.5907 7.7184 121.2346 60.3798 34.5676 174.8787 283 L 4.1183 9.1036 129.5352 58.2409 42.2706 176.6781 284 D 4.4442 8.0930 120.6532 53.5626 41.2025 174.7783 285 P 4.3855 0.0000 0.0000 65.5342 31.5898 178.9632 286 K 4.1240 8.7267 117.1862 58.5588 32.0114 177.8340 287 K 4.4193 7.8849 116.3680 56.4056 32.5225 176.9766 288 R 4.5164 7.5777 118.7922 55.5618 30.7286 176.7041 289 L 4.4593 8.4956 122.8645 55.6150 42.4836 177.4021 290 T 4.4801 9.6461 113.3446 61.1031 70.4825 175.8182 291 T 3.9129 8.7367 112.4701 64.8684 68.2984 176.2096 292 F 4.1564 8.2046 122.0993 61.3662 39.8780 176.5659 293 Q 3.9981 8.2703 117.4542 59.0081 28.4293 178.8813 294 A 4.1007 8.4308 122.0228 55.0712 18.1911 179.4938 295 L 4.0858 7.6951 116.1819 57.0319 41.9041 177.9638 296 Q 4.1710 7.2563 115.6131 56.2951 29.4193 175.6573 297 H 4.1773 7.7719 119.5636 55.4280 30.4786 174.0045 298 P 4.2707 0.0000 0.0000 65.6187 31.5891 178.4141 299 W 4.0574 8.6290 126.7396 60.4711 31.1577 177.2726 300 V 3.6341 8.3643 120.1593 66.9518 30.8378 179.0056 301 T 4.3749 8.3844 113.1649 61.6467 67.7803 177.5834 302 G 4.0692 8.5407 113.0675 48.5180 0.0000 177.1482 303 K 3.8403 9.2632 120.1792 57.2940 31.5936 183.4087 304 A 4.7255 8.1528 120.6554 51.5075 19.3046 175.6169 305 A 4.6486 7.4240 124.1552 52.2001 19.7453 178.8254 306 N 4.6074 8.8700 122.3251 53.4308 38.8259 171.9519 307 F 4.9215 7.7701 113.2473 56.6499 39.1433 175.4189 308 V 3.6837 7.0352 119.8498 62.6125 32.1311 175.1421 309 H 4.3250 8.8810 127.1908 57.1955 30.1364 175.4716 310 M 4.3442 8.8560 126.5150 53.3825 30.9770 176.2646 311 D 4.3932 8.2886 123.3066 56.8999 39.8800 178.8144 312 T 4.0037 7.9505 117.1090 65.7362 68.3497 176.1884 313 A 4.1557 7.6885 121.6024 55.5914 18.4355 179.8323 314 Q 3.9486 8.1512 115.8905 58.7135 28.2742 178.7985 315 K 3.9751 7.7870 119.5277 59.5086 32.2475 179.1221 316 K 4.0945 8.2143 118.8342 59.4017 31.9618 179.1629 317 L 4.1136 8.3743 121.0364 58.0201 42.0296 178.7348 318 Q 4.0119 8.3786 119.7804 59.2622 28.9049 178.2507 319 E 3.9735 7.9188 118.4453 59.2612 29.5136 178.9410 320 F 4.1605 8.6194 121.0526 61.4991 39.4622 176.7269 321 N 4.0084 8.6452 116.0755 56.2995 38.3784 177.2536 322 A 3.9277 7.7660 121.3730 55.0195 18.4964 179.4472 323 R 3.7969 8.1347 117.7593 59.7565 30.1793 178.9981 324 R 3.8322 8.1800 115.9886 59.0746 29.3460 178.9208 325 K 3.9353 8.0624 119.3289 58.9176 32.0292 179.0625 326 L 3.9670 8.1513 123.1590 58.7896 41.9953 179.7307 327 K 4.0042 8.1457 123.3922 59.8566 31.5547 180.6512 328 A 4.1587 8.0610 121.5897 54.9192 18.2522 179.6831 329 A 3.9161 7.9777 119.3904 55.1239 18.3939 179.8118 330 V 3.5114 8.2549 117.1081 66.3386 31.5593 178.2324 331 K 3.8963 8.3330 117.9943 59.6329 31.6792 179.2157 332 A 3.9971 7.8314 119.9971 54.9970 18.2235 179.6355 333 V 3.6828 8.0017 116.9201 66.0023 31.4348 178.4342 334 V 3.5920 7.9465 117.0648 65.9811 31.5432 177.4289 335 A 4.1916 8.1611 118.0014 52.7639 18.7069 177.9655 336 S 4.2687 7.2110 115.8985 59.4643 63.6434 175.3027 337 S 4.2687 8.2996 118.2782 58.9186 62.7718 175.5096 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 34 I 8.05 5.05 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 1.27 0.95 0.91 0.00 0.00 35 D 8.42 4.69 0.00 2.70 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 0.00 0.00 0.00 0.00 36 G 8.65 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.13 4.73 0.00 3.59 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 38 N 8.26 4.25 0.00 2.05 1.58 0.00 0.00 7.56 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 39 R 8.40 4.67 0.00 2.12 1.99 0.00 3.39 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 40 D 8.22 4.64 0.00 3.27 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.53 4.23 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 42 L 8.75 3.23 0.00 1.14 1.47 0.36 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 43 S 7.76 4.74 0.00 4.02 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 44 D 8.13 4.28 0.00 2.46 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.86 4.61 0.00 3.03 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 46 F 7.96 5.24 0.00 2.84 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.30 4.55 0.00 2.03 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 2.25 2.24 0.00 48 V 8.37 3.94 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 0.31 0.00 0.00 0.74 0.00 0.00 49 E 9.36 4.92 0.00 1.96 1.50 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 2.25 2.44 0.00 50 S 8.78 4.57 0.00 3.95 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 51 E 8.77 4.33 0.00 1.94 1.84 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 2.21 2.08 0.00 52 L 8.42 4.50 0.00 1.50 1.67 1.00 0.81 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 53 G 7.20 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 54 R 8.31 4.77 0.00 1.85 1.69 0.00 3.19 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.47 0.00 55 G 9.09 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 56 A 8.64 4.18 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 57 T 7.90 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 58 S 7.23 5.20 0.00 3.92 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 59 I 8.15 4.80 1.73 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 1.13 0.83 0.34 0.00 0.00 60 V 8.46 4.82 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 1.06 0.00 0.00 0.91 0.00 0.00 61 Y 9.03 5.19 0.00 2.85 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 62 R 9.11 4.92 0.00 1.92 1.95 0.00 3.11 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 0.00 63 C 9.24 5.31 0.00 3.22 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.94 5.19 0.00 1.78 1.81 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.41 7.81 65 Q 9.50 4.35 0.00 2.63 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.99 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 66 K 8.52 4.13 0.00 1.51 1.63 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.56 7.81 67 G 9.30 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 68 T 7.59 4.18 4.30 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 1.31 0.00 0.00 69 Q 8.10 3.59 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 70 K 8.17 4.38 0.00 2.02 1.91 0.00 1.55 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.38 7.81 71 P 0.00 5.09 0.00 2.06 2.05 0.00 3.69 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 1.92 1.98 0.00 72 Y 9.47 4.88 0.00 2.81 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.97 5.12 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 74 L 9.15 5.04 0.00 1.65 1.62 0.82 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 75 K 9.11 4.85 0.00 1.88 1.69 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.38 7.81 76 V 9.37 4.72 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 0.97 0.00 0.00 1.05 0.00 0.00 77 L 8.78 5.26 0.00 1.33 1.49 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.51 4.49 0.00 1.88 1.78 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.47 1.27 7.81 79 K 8.35 4.46 0.00 1.55 1.58 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.25 7.81 *90 I 8.38 4.17 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 1.35 0.55 0.91 0.00 0.00 91 G 8.33 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 92 V 7.89 3.88 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 93 L 7.89 4.29 0.00 1.66 1.73 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.12 4.31 0.00 1.73 1.63 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 95 R 7.85 4.56 0.00 1.90 1.86 0.00 3.26 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 96 L 7.01 4.39 0.00 1.94 1.87 1.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 97 S 9.44 4.50 0.00 3.75 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 98 H 8.35 4.42 0.00 1.84 2.63 0.00 5.73 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.23 0.00 2.15 2.10 0.00 3.11 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.85 0.00 100 N 8.25 5.13 0.00 2.88 2.87 0.00 0.00 7.38 7.41 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 0.00 101 I 7.60 5.07 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.48 0.96 0.00 0.00 102 I 8.56 3.99 1.90 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 1.17 0.75 0.94 0.00 0.00 103 K 9.25 4.30 0.00 1.45 1.69 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.37 1.26 7.81 104 L 8.54 4.44 0.00 1.66 1.62 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 105 K 9.48 4.30 0.00 1.80 1.77 0.00 1.38 0.00 0.00 1.19 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.38 7.81 106 E 7.78 4.69 0.00 1.97 1.69 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 1.66 2.05 0.00 107 I 8.02 5.06 1.77 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 1.33 0.55 0.89 0.00 0.00 108 F 9.46 5.28 0.00 2.86 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 0.00 109 E 9.03 5.18 0.00 2.04 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 110 T 8.58 4.78 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 1.25 0.00 0.00 111 P 0.00 4.34 0.00 2.08 2.17 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 112 T 7.47 4.31 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 113 E 8.60 4.91 0.00 1.96 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 114 I 8.76 4.91 1.90 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 1.94 0.99 0.00 0.00 115 S 9.40 5.30 0.00 3.83 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.85 5.13 0.00 1.57 1.56 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.93 4.33 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 0.28 0.00 0.00 0.50 0.00 0.00 118 L 9.09 5.49 0.00 1.59 1.54 0.95 0.73 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 0.00 119 E 8.85 4.42 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 120 L 8.32 4.46 0.00 1.56 1.55 0.95 0.93 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 0.00 121 V 8.16 4.29 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.95 0.00 0.00 122 T 8.79 4.61 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 123 G 8.45 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.92 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 0.00 125 E 8.34 4.71 0.00 2.23 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 2.42 2.40 0.00 126 L 8.57 4.02 0.00 1.45 1.44 0.83 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 127 F 8.09 4.41 0.00 3.28 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 0.00 128 D 8.16 4.28 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 R 8.19 4.29 0.00 2.06 1.82 0.00 3.32 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 130 I 7.69 3.51 1.71 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 -0.07 0.00 0.00 131 V 7.17 3.82 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.05 0.00 0.00 132 E 7.98 4.30 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 133 K 7.34 4.18 0.00 1.83 1.95 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.15 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.60 1.56 7.81 134 G 8.96 3.79 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 0.00 0.00 0.00 135 Y 7.77 4.88 0.00 2.84 2.84 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 0.00 136 Y 9.18 5.25 0.00 3.01 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 0.00 137 S 9.08 4.89 0.00 3.77 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.18 4.04 0.00 2.19 2.32 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 2.43 2.31 0.00 139 R 7.71 3.77 0.00 1.81 1.89 0.00 3.12 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 140 D 7.80 4.32 0.00 2.97 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 0.00 141 A 7.90 4.19 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 0.00 142 A 8.19 3.49 0.08 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 0.00 143 D 8.20 4.22 0.00 2.88 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 0.00 144 A 7.89 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 V 7.95 3.62 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.25 0.00 0.00 146 K 8.39 3.96 0.00 1.88 1.96 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.48 7.81 147 Q 7.86 3.97 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 148 I 7.75 3.66 2.05 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.76 0.92 0.00 0.00 149 L 8.32 4.02 0.00 1.91 1.77 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 150 E 8.49 4.00 0.00 2.15 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 0.00 2.62 2.52 0.00 151 A 8.15 3.81 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 8.21 3.47 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 0.77 0.00 0.00 0.98 0.00 0.00 153 A 8.38 4.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.11 4.01 0.00 3.06 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.18 3.97 0.00 1.96 1.98 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 156 H 8.70 4.43 0.00 3.28 3.35 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 0.00 157 E 8.23 3.99 0.00 2.08 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 2.33 2.39 0.00 158 N 7.58 4.73 0.00 2.45 2.66 0.00 0.00 7.06 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.28 2.58 0.00 3.08 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 168 E 8.11 4.07 0.00 1.91 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 2.30 2.35 0.00 169 N 8.33 4.90 0.00 2.98 3.00 0.00 0.00 6.69 6.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 7.79 4.92 0.00 1.49 1.50 0.93 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 171 L 8.87 5.19 0.00 1.47 1.51 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.87 4.62 0.00 3.03 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 9.03 4.20 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 T 7.52 5.02 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 1.22 0.00 0.00 175 P 0.00 4.34 0.00 2.04 2.11 0.00 3.70 0.00 0.00 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1.17 0.00 241 F 7.61 4.91 0.00 3.01 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 0.00 242 Y 8.26 4.14 0.00 2.91 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 0.00 243 D 8.02 4.36 0.00 2.64 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 E 8.42 3.82 0.00 2.03 1.86 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 2.23 1.90 0.00 245 R 7.97 3.93 0.00 1.71 1.88 0.00 2.21 0.00 0.00 2.66 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.28 0.00 246 G 7.91 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 D 8.73 4.01 0.00 2.67 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 Q 8.01 4.07 0.00 2.12 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.93 0.00 0.00 0.00 0.00 0.00 1.99 2.25 0.00 249 F 8.05 4.07 0.00 3.20 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 M 8.10 4.15 0.00 1.81 1.97 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.47 0.00 251 F 8.38 4.39 0.00 3.19 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 0.00 252 R 7.95 3.91 0.00 1.99 2.01 0.00 2.87 0.00 0.00 2.68 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 253 R 8.32 4.14 0.00 2.07 2.47 0.00 3.33 0.00 0.00 3.42 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 254 I 7.72 2.75 1.89 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 0.59 0.74 0.64 0.00 0.00 255 L 7.93 3.96 0.00 1.68 1.66 0.83 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 256 N 8.05 4.63 0.00 2.82 2.89 0.00 0.00 7.03 7.79 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 0.00 257 C 7.83 4.39 0.00 3.33 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 E 8.89 4.27 0.00 1.97 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 2.16 2.22 0.00 259 Y 6.97 4.65 0.00 2.52 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 0.00 0.00 0.00 260 Y 7.96 4.28 0.00 2.84 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 0.00 261 F 7.72 3.64 0.00 2.86 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 I 7.88 4.10 2.37 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 1.93 1.41 1.06 0.00 0.00 263 S 8.89 4.58 0.00 3.92 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 0.00 264 P 0.00 5.40 0.00 1.83 2.01 0.00 2.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.37 0.00 265 W 8.09 4.17 0.00 3.87 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 0.00 266 W 8.62 4.43 0.00 3.76 3.31 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 0.00 267 D 8.36 4.43 0.00 2.77 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 0.00 268 E 7.96 4.40 0.00 1.86 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 2.21 2.17 0.00 269 V 7.44 3.98 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 0.63 0.00 0.00 0.31 0.00 0.00 270 S 9.26 4.27 0.00 4.09 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 0.00 271 L 8.46 3.97 0.00 1.72 1.77 0.93 0.67 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 0.00 272 N 8.19 4.39 0.00 3.07 3.14 0.00 0.00 7.04 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 A 8.05 2.66 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 274 K 7.63 3.46 0.00 1.81 1.47 0.00 1.53 0.00 0.00 1.29 0.00 0.00 2.90 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.30 1.33 7.81 275 D 7.91 4.31 0.00 2.73 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 L 7.70 3.91 0.00 1.38 1.41 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 277 V 7.62 3.52 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.88 0.00 0.00 278 R 8.18 4.21 0.00 2.16 2.06 0.00 3.24 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 279 K 7.93 4.48 0.00 1.85 1.87 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.49 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.68 7.81 280 L 7.43 4.42 0.00 1.52 1.80 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 281 I 7.13 3.44 1.08 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 -0.29 0.00 0.00 282 V 7.72 4.59 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 0.93 0.00 0.00 1.04 0.00 0.00 283 L 9.10 4.12 0.00 1.77 1.78 0.93 1.24 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 0.00 284 D 8.09 4.44 0.00 2.75 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 0.00 285 P 0.00 4.39 0.00 2.25 2.14 0.00 3.67 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 286 K 8.73 4.12 0.00 1.91 1.90 0.00 1.70 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.43 7.81 287 K 7.88 4.42 0.00 1.91 1.89 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.58 7.81 288 R 7.58 4.52 0.00 1.87 1.96 0.00 3.45 0.00 0.00 3.58 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.76 0.00 289 L 8.50 4.46 0.00 1.60 1.68 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 290 T 9.65 4.48 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 291 T 8.74 3.91 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 292 F 8.20 4.16 0.00 3.06 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 293 Q 8.27 4.00 0.00 2.34 2.18 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 2.49 2.57 0.00 294 A 8.43 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 295 L 7.70 4.09 0.00 1.80 1.70 1.06 0.99 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 0.00 296 Q 7.26 4.17 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 1.82 1.71 0.00 297 H 7.77 4.18 0.00 3.22 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 P 0.00 4.27 0.00 2.26 2.12 0.00 3.24 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 2.05 2.06 0.00 299 W 8.63 4.06 0.00 3.30 3.32 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 0.00 300 V 8.36 3.63 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.25 0.00 0.00 301 T 8.38 4.37 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 0.00 302 G 8.54 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 303 K 9.26 3.84 0.00 1.79 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.28 7.81 304 A 8.15 4.73 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 0.00 305 A 7.42 4.65 0.70 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 0.00 0.00 306 N 8.87 4.61 0.00 2.42 2.72 0.00 0.00 6.13 7.81 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 0.00 307 F 7.77 4.92 0.00 2.96 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 0.00 308 V 7.04 3.68 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.40 0.00 0.00 309 H 8.88 4.33 0.00 3.40 3.34 0.00 5.95 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 M 8.86 4.34 0.00 1.92 1.85 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 311 D 8.29 4.39 0.00 2.91 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 T 7.95 4.00 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 1.45 0.00 0.00 313 A 7.69 4.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 314 Q 8.15 3.95 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 315 K 7.79 3.98 0.00 1.92 2.06 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.53 7.81 316 K 8.21 4.09 0.00 2.12 2.04 0.00 1.82 0.00 0.00 1.78 0.00 0.00 2.53 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.86 1.91 7.81 317 L 8.37 4.11 0.00 2.04 1.83 0.83 0.89 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 0.00 318 Q 8.38 4.01 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 319 E 7.92 3.97 0.00 2.31 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 2.34 2.47 0.00 320 F 8.62 4.16 0.00 3.19 3.15 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 0.00 321 N 8.65 4.01 0.00 2.96 2.85 0.00 0.00 6.99 6.83 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 0.00 322 A 7.77 3.93 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 323 R 8.13 3.80 0.00 2.06 2.00 0.00 3.16 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 324 R 8.18 3.83 0.00 1.79 1.59 0.00 2.44 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 325 K 8.06 3.94 0.00 1.83 1.86 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.45 7.81 326 L 8.15 3.97 0.00 1.74 1.78 0.91 0.60 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 0.00 327 K 8.15 4.00 0.00 1.81 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.34 7.81 328 A 8.06 4.16 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 0.00 329 A 7.98 3.92 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 0.00 330 V 8.25 3.51 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 1.10 0.00 0.00 0.97 0.00 0.00 331 K 8.33 3.90 0.00 1.93 1.87 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.46 1.34 7.81 332 A 7.83 4.00 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 0.00 333 V 8.00 3.68 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 0.99 0.00 0.00 0.93 0.00 0.00 334 V 7.95 3.59 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 0.88 0.00 0.00 0.99 0.00 0.00 335 A 8.16 4.19 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 336 S 7.21 4.27 0.00 4.07 3.82 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 0.00 337 S 8.30 4.27 0.00 3.57 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.