NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 W 5.3708 8.2593 118.0735 56.8425 29.4304 173.0373 6 C 4.4555 9.4156 116.8723 53.7946 45.5042 171.6325 7 Y 4.7477 9.9587 118.4453 57.5199 39.3038 178.1066 8 E 3.9491 9.3600 121.9991 60.0944 29.3771 180.4985 9 V 3.9879 7.7187 118.0092 64.3822 31.7151 177.9317 10 Q 3.9904 8.2817 118.8495 58.6379 28.3017 178.3228 11 A 4.1066 7.8670 120.5005 54.8067 18.7768 179.0921 11A E 4.2117 8.1020 113.3420 57.5349 28.9599 178.4497 11B S 4.6347 8.1252 111.7113 58.0612 66.5340 171.8149 11G C 3.9915 8.4381 112.1443 54.7923 41.7935 172.7236 11H L 4.5117 8.2191 121.4650 53.3059 41.5251 176.3809 12 V 4.4253 8.0601 119.7613 60.3623 32.7069 175.8896 13 P 2.0000 0.0000 0.0000 64.8476 31.0564 179.5130 14 V 3.5236 7.4595 110.1592 63.4998 31.4710 176.8371 15 K 4.5322 7.8730 117.0756 55.4073 32.6786 176.2862 16 W 4.5051 7.7474 120.1992 57.5145 30.5397 175.1343 *20 G 4.2194 8.3150 109.6768 43.2899 0.0000 171.4217 21 G 3.6242 8.5433 112.6419 47.1719 0.0000 173.4687 22 N 4.7462 8.6905 121.7107 53.7075 38.5087 176.0586 23 C 4.9252 8.1183 115.8916 58.4106 40.3867 174.3037 24 Q 4.5346 7.9111 117.4103 55.5402 28.7923 176.0804 25 K 4.4601 7.5651 118.7766 55.9755 34.1264 175.6452 26 D 4.7205 8.6466 117.2452 55.6576 42.4151 176.8193 27 R 4.7375 8.7805 118.0949 55.1243 30.5495 174.6255 28 Q 4.7707 7.6624 117.8722 55.0576 30.9007 175.5634 29 S 4.6994 8.7018 115.0659 56.2256 66.7575 172.4598 30 P 4.4698 0.0000 0.0000 61.8271 33.6640 173.9118 31 I 4.7865 7.3426 111.8069 58.9629 41.5671 173.4680 32 N 4.6973 8.3684 120.9306 52.4248 40.0230 174.1358 33 I 4.0492 8.3875 127.2284 59.2753 39.5746 175.6402 34 V 4.1503 8.1248 128.6713 62.3220 30.6083 176.6196 35 T 3.8894 9.0773 120.3240 64.5253 68.9129 176.9304 36 T 4.0893 7.8070 110.7605 63.2949 69.2721 175.3134 37 K 4.1561 7.6070 119.5707 56.9326 32.6531 176.4556 38 A 4.8404 7.4031 121.5777 51.1005 18.9672 177.5865 39 K 4.2213 8.7014 122.8826 55.9345 33.6046 177.0045 40 V 4.0830 8.4398 124.7181 63.3249 32.5291 174.6243 41 D 4.7706 9.0205 126.7199 52.3737 43.3753 176.5013 42 K 4.0403 8.9322 125.8979 58.8508 32.3222 178.1800 43 K 4.1816 8.4093 117.0347 57.3414 32.1456 177.8685 44 L 4.2984 7.6425 120.6040 53.6276 40.0246 176.3316 45 G 4.2084 7.8203 111.1097 44.1972 0.0000 170.4140 46 R 4.4176 8.3830 115.6137 56.2499 30.6553 176.1358 47 F 4.5101 8.6868 118.4272 57.0670 40.5152 175.1560 48 F 4.4499 8.7166 120.4629 55.8974 40.7231 174.9585 49 F 4.7986 8.6664 122.7280 56.3069 40.8121 175.4403 50 S 4.6627 9.1997 116.5190 57.7789 65.2727 174.9968 50A G 4.4356 9.5698 113.9536 46.4814 0.0000 173.6146 51 Y 4.2063 8.0956 117.4423 59.8313 38.8890 177.5977 52 D 4.3248 8.3469 119.9067 56.0049 40.0570 176.2094 53 K 4.4686 7.8793 120.7793 55.2830 32.9360 176.5303 54 K 4.3834 8.6074 127.0843 56.7278 32.8186 176.2920 55 Q 4.2749 8.9795 122.7127 54.3541 33.6006 174.5342 56 T 4.6913 7.9239 112.0484 59.9848 68.7466 174.2536 57 W 4.4591 8.2583 128.5198 57.1434 31.0336 175.2077 58 T 4.8599 8.6627 119.4805 63.1285 69.5261 174.0943 59 V 5.0938 8.8168 125.8556 59.9458 34.6719 174.6301 60 Q 5.0078 8.9808 120.3159 54.6868 32.5792 173.1270 61 N 5.3322 8.8218 119.6826 52.1539 40.3152 174.6359 62 N 4.7887 8.8333 123.3657 52.5335 37.6912 176.1395 63 G 3.9878 9.3032 108.2586 45.9815 0.0000 174.0578 64 H 5.1457 8.6765 113.9589 55.6135 31.1233 172.5540 65 S 4.6437 7.9634 112.0474 57.6327 65.2474 172.4174 66 V 4.9504 8.6465 119.6609 60.2443 34.1907 174.4963 67 M 5.2876 8.9754 122.7338 54.3152 35.5795 173.7524 68 M 4.8546 9.1179 126.7491 54.7218 33.9297 175.5499 69 L 4.6831 8.7527 124.0767 54.4025 41.7412 176.7024 70 L 4.4695 8.9625 124.8103 53.6153 42.9237 176.8633 71 E 3.7498 8.8553 116.7070 58.1441 27.0210 173.9980 72 N 4.2280 8.1516 110.6226 54.4904 37.1117 175.8048 *76 K 4.3297 7.8173 115.2291 55.9196 34.0992 174.7425 77 A 5.2077 7.4521 119.9106 51.1549 23.0340 174.9572 78 S 5.3225 9.1539 112.8336 57.7740 66.9661 173.3587 79 I 5.3405 8.8950 113.5550 59.8214 41.5933 174.2452 80 S 4.4472 8.7457 116.1782 58.6810 66.6972 173.6816 81 G 4.0861 8.9838 107.4416 46.3608 0.0000 174.5082 82 G 2.2158 8.1250 109.6511 45.7017 0.0000 174.2211 83 G 3.9205 8.0780 104.2588 45.7957 0.0000 174.5540 84 L 4.3238 7.3541 118.6901 53.2843 42.2975 175.5874 85 P 4.4083 0.0000 0.0000 64.5875 31.8843 175.4319 86 A 4.5424 7.5164 119.8081 50.3548 22.1965 173.5364 87 P 4.8430 0.0000 0.0000 62.9686 32.9252 175.4996 88 Y 5.1088 9.2316 120.1134 56.4068 41.5950 174.6376 89 Q 4.9720 9.2180 122.7700 54.4366 31.1766 175.0181 90 A 4.3609 9.1306 126.2746 52.4027 19.2079 177.5196 91 K 4.3662 9.1888 122.1443 57.6810 34.4477 176.3540 92 Q 4.9769 7.5144 115.1526 55.1953 31.9717 172.4858 93 L 5.3025 8.6813 121.8146 53.7912 45.7522 174.9794 94 H 5.7376 8.7485 119.6800 54.6726 32.5720 171.6165 95 L 5.4450 8.7457 116.5663 53.6272 45.7781 176.0735 96 H 5.0823 9.2146 117.9809 54.1460 32.5874 172.8983 97 W 5.2820 8.3302 117.3051 57.0261 31.6064 172.4168 98 S 4.9932 8.4278 115.3937 57.3069 64.7476 174.1579 99 D 4.9599 8.8038 120.4177 52.6157 40.5383 174.9868 100 L 4.8026 7.3450 119.4956 52.4883 44.5713 175.9370 101 P 4.3074 0.0000 0.0000 64.9637 31.6946 176.5055 102 Y 4.6576 7.5113 116.0540 56.3903 38.0388 176.6097 103 K 4.3261 7.5614 116.8615 58.0773 33.1472 176.2785 104 G 3.9340 8.5001 107.5625 45.8878 0.0000 174.5191 105 S 4.5634 7.8230 114.3198 57.4085 64.5821 174.0948 106 E 4.2092 8.8914 120.5425 59.2473 29.7625 177.2724 107 H 4.6130 8.3168 114.9274 55.4879 29.3045 174.4943 108 S 5.0039 8.5111 115.0284 56.5191 66.6990 172.5922 109 L 4.7251 8.5960 121.1332 53.3288 44.0528 176.5605 110 D 4.3625 10.0869 125.5134 55.3510 38.9722 175.2000 111 G 3.8535 8.5465 105.4816 45.5322 0.0000 173.8766 112 E 4.3976 8.0257 120.6136 55.1862 30.5776 175.2884 113 H 5.2040 8.5706 120.7322 54.9005 31.0722 173.9104 114 F 4.8539 9.2659 118.6146 55.4013 41.9262 176.4292 115 A 4.1203 8.8771 120.7509 55.4073 19.2134 177.3118 116 M 4.8320 7.8315 112.9048 54.6990 37.2180 173.4784 117 E 5.0718 9.4259 120.8844 55.0168 33.5301 173.4363 118 M 5.0953 9.7541 127.2424 54.3205 34.8806 173.9974 119 H 5.6838 9.3768 122.9997 54.1545 32.2793 172.8483 120 I 4.7689 9.1084 124.4964 59.6585 39.6811 174.7480 121 V 4.4601 8.7057 128.7849 61.8704 32.8696 174.5576 122 H 5.5277 9.5914 124.8224 53.9572 33.0848 172.2634 123 E 5.1875 9.0549 121.0555 54.0257 32.1158 175.1931 124 K 2.8577 8.7597 129.0332 56.3095 33.0681 176.6885 125 E 4.1773 8.1639 127.1364 55.3078 28.7600 176.8741 126 K 4.2060 8.0597 133.2610 55.1480 32.7898 174.8977 *137 P 4.1934 0.0000 0.0000 63.4288 32.4958 177.4743 138 E 4.1719 8.7594 120.4153 58.0230 29.9226 177.1666 139 D 4.8941 7.7145 118.7871 52.8725 40.1879 176.5637 140 E 4.0562 8.2167 123.9081 59.2732 30.1268 176.2621 141 I 5.1052 8.0598 119.2696 59.2254 40.5236 174.6236 142 A 4.9885 8.6871 128.4703 49.4557 20.9958 175.4102 143 V 4.4491 7.4824 122.7457 61.4815 33.7659 174.4352 144 L 4.6614 9.0534 128.5547 53.5872 43.2854 175.2703 145 A 5.5547 8.9286 126.5193 50.1689 21.8204 174.9129 146 F 5.2137 9.6938 121.1899 55.6431 42.6230 174.4598 147 L 4.9287 8.5435 122.4564 53.3957 44.1306 175.4159 148 V 4.9286 8.7618 122.7400 61.0487 34.2531 174.0168 149 E 5.1498 9.4360 125.9978 54.5234 32.3375 175.0073 150 A 4.7182 8.6156 123.6958 52.0574 19.6745 177.5688 151 G 3.9394 8.7159 108.4330 46.4586 0.0000 174.4758 151A T 4.4060 8.6460 113.9079 61.1523 69.6281 173.8326 152 Q 4.2021 7.7767 124.2101 55.0479 29.3625 175.2332 153 V 3.6211 8.3555 126.1914 62.7326 31.9974 174.7887 154 N 4.7050 9.1818 127.3794 52.2032 38.5537 174.7206 155 E 4.2504 8.8678 127.0988 59.4588 29.3992 179.5223 156 G 3.8966 8.0910 105.5174 46.9374 0.0000 174.8238 157 F 4.1166 8.4130 118.3163 58.7086 39.0497 177.6271 158 Q 4.0393 8.0959 118.9409 58.3526 28.5798 176.4904 159 P 4.1942 0.0000 0.0000 65.3869 31.2381 178.4042 160 L 3.8420 7.6949 118.5583 58.2133 41.9494 179.0432 161 V 3.2792 7.6929 116.8812 65.9164 31.5234 177.4808 162 E 4.0154 8.8894 118.5742 59.2984 29.1882 179.1897 163 A 4.0959 7.8725 120.5141 54.7517 18.3810 179.4787 164 L 3.8374 7.5253 118.1648 57.8001 41.4062 179.0271 165 S 4.3976 7.4333 110.1058 59.4863 63.3421 174.8981 166 N 4.7693 8.1443 119.9518 53.1014 39.4336 174.5506 167 I 4.7399 7.6414 114.1738 59.2853 37.7848 175.2280 168 P 4.7886 0.0000 0.0000 64.8069 32.5635 176.6666 169 K 4.9519 7.3974 118.5027 53.2789 34.7492 173.7269 170 P 4.6859 0.0000 0.0000 64.7554 31.6370 176.4067 171 E 3.9351 9.9396 121.0738 56.9419 27.7195 174.0684 172 M 4.7115 7.7723 119.0880 54.2936 33.8063 175.4352 173 S 5.1966 8.4593 115.7677 57.2945 66.9983 172.2382 174 T 4.6576 8.8562 114.2527 61.6365 71.5065 171.8523 175 T 5.0703 8.2627 120.3381 61.9689 70.2883 174.7489 176 M 4.4802 9.3317 126.3787 54.5734 33.0899 176.3291 177 A 4.2337 8.4471 122.6500 51.6222 19.4975 177.2298 178 E 4.2362 8.6548 118.9804 57.5164 30.3441 176.6690 179 S 4.7927 8.2535 116.5020 58.3549 66.9391 174.6956 180 S 5.3242 9.2005 114.7984 56.0544 65.5524 175.1328 181 L 3.8882 8.5544 119.4465 57.7272 41.2717 179.6667 182 L 3.8209 8.2801 119.2257 57.6905 41.3254 179.0326 183 D 4.3908 8.0213 118.9408 57.2098 40.5077 178.2684 184 L 4.0854 7.6466 117.2652 54.4922 42.0513 176.2494 185 L 4.3935 6.6889 117.8926 51.4787 44.4748 174.0996 186 P 4.4457 0.0000 0.0000 61.8914 32.1020 176.7351 187 K 3.9486 8.3781 118.6814 56.7021 32.6807 178.0952 187A E 3.8502 8.7425 122.7559 59.3905 29.7436 178.6274 187B E 4.1299 8.0794 116.1147 58.1198 29.7057 177.2995 188 K 4.4188 7.9427 117.1532 56.5688 32.4189 176.8216 189 L 4.8774 7.8352 118.5347 54.6655 41.6898 177.8940 189A R 4.1954 8.1806 120.2783 59.0585 30.4214 176.3739 190 H 4.6812 8.2814 116.1129 54.7142 29.9702 174.2150 191 Y 4.9020 7.8662 120.6060 55.8731 41.8488 173.6022 192 F 5.0404 9.2268 118.7885 55.9532 42.2913 175.0436 193 R 5.5848 9.5715 121.7301 54.1233 33.4438 173.4886 194 Y 5.2058 8.4515 122.2647 56.4043 41.5461 172.7705 195 L 4.8719 8.4650 119.8947 53.4495 43.3272 176.9147 196 G 4.4961 8.5496 110.9548 46.9905 0.0000 172.2741 197 S 5.4995 9.3152 119.4022 55.9489 66.5529 174.6809 198 L 4.3961 8.6312 120.8467 55.4240 42.3663 178.1248 199 T 4.6846 8.8694 111.6208 61.7392 69.5755 174.3099 200 T 3.8770 7.2386 111.7226 58.5451 71.8176 171.3932 201 P 4.0299 0.0000 0.0000 63.3678 31.7404 176.1803 202 T 4.1591 8.2979 111.1334 61.3334 68.8583 175.5038 203 C 4.4738 7.9773 116.2925 57.1475 37.9555 173.1902 204 D 4.4769 7.9863 117.8521 54.7716 41.4666 176.8867 205 E 5.0961 8.4333 123.8349 54.5638 27.5253 176.1278 206 K 4.8435 7.5511 116.4490 55.4209 35.4125 176.6906 207 V 4.7660 8.0369 121.2981 61.7645 33.8823 174.6554 208 V 4.3374 8.6547 128.3117 60.3374 33.1581 175.0609 209 W 4.4735 8.6906 126.4704 55.7695 30.9367 175.5855 210 T 5.0649 8.6512 120.1386 61.7174 71.5619 172.9633 211 V 4.6631 8.7398 126.8005 60.8800 33.9314 174.6876 212 F 4.5125 8.5774 127.7210 57.3289 38.8885 176.0367 213 R 4.2363 8.8239 124.2117 59.1470 30.6954 176.5909 214 E 4.3375 8.2779 119.8627 54.7896 30.2836 174.0482 215 P 4.7475 0.0000 0.0000 62.3017 32.8767 175.8122 216 I 4.1654 8.8149 123.1511 61.0712 38.6373 175.0297 217 Q 4.9452 8.5503 125.3374 54.7485 29.9502 175.0910 218 L 4.7340 8.4957 123.3653 52.5651 46.0707 175.9951 219 H 4.5085 8.9934 121.4901 56.0782 30.8082 176.1366 220 R 3.9321 8.6092 125.3364 59.8885 30.0995 179.2104 221 E 4.0785 8.4544 116.7815 58.7699 29.3546 179.0441 222 Q 4.0737 7.9288 117.9841 58.6288 29.1699 178.1454 223 I 3.8675 7.6476 120.5140 64.4077 37.2072 178.1778 224 L 4.0153 8.3292 119.8942 57.7155 41.3633 179.1649 225 A 3.8600 7.9006 120.3981 55.3194 17.6971 179.8135 226 F 3.4303 8.0454 115.9622 60.5522 38.7231 177.9928 227 S 4.8401 7.8825 112.3136 60.2120 63.1969 175.5932 227A Q 4.0928 8.0847 121.6554 57.7757 28.5899 177.2574 228 K 4.2966 8.0890 118.1045 55.4740 33.1929 176.0282 229 L 4.8899 6.8035 118.5504 52.9060 44.4095 174.9941 230 Y 5.1793 8.6767 118.4215 56.1947 41.7094 175.8444 231 Y 4.4281 8.8120 120.7382 60.3259 38.2456 176.2663 232 D 5.2307 7.8913 116.5036 50.9809 42.1414 176.2284 233 K 4.0075 8.4694 119.0814 58.8983 32.3988 177.9680 231 E 4.2281 9.1120 120.6382 59.0259 30.3456 176.9663 232 Q 4.9307 7.8713 115.9036 52.4809 30.4414 175.9284 233 T 4.0375 8.3294 112.2814 64.4983 69.0988 176.0680 239 V 4.4985 7.6467 121.1429 60.7509 33.7049 174.9180 240 S 4.1341 8.7533 123.6172 58.5519 63.7754 173.8860 241 M 3.2575 8.7972 124.7413 55.5075 32.6370 175.1300 242 K 3.8208 8.4499 123.8039 55.9177 35.5350 173.8481 243 D 4.1887 8.1969 117.5892 55.2692 39.3780 175.1012 244 N 3.7644 7.1887 113.6071 51.2719 36.2299 174.7329 245 V 4.3558 6.3868 117.2657 61.2570 34.6350 174.6801 246 R 4.1967 9.5936 129.1189 55.1239 30.5387 174.4328 247 P 4.3912 0.0000 0.0000 62.7161 31.7607 175.6827 248 L 4.2633 8.1930 119.2679 55.0993 42.1379 176.7375 249 Q 4.6126 8.8018 122.3126 54.1606 31.4670 175.1535 250 Q 4.1568 8.3506 119.5794 55.4387 28.8394 176.6741 251 L 3.9417 8.7702 125.4604 56.0982 43.4474 177.6371 252 G 3.9087 7.6361 106.8983 47.2522 0.0000 174.2587 253 Q 4.3279 8.6654 122.9996 55.9282 29.0542 176.1302 254 R 4.2498 7.4882 117.6230 56.2246 30.7272 175.8974 255 T 4.6714 8.1817 109.0562 59.8331 71.8507 173.2173 256 V 4.6978 8.1486 122.8108 61.5117 33.8229 174.7388 257 I 5.2621 8.6561 120.8635 59.3205 41.0989 173.9935 258 K 4.8944 8.3879 119.4866 55.2080 36.1735 176.3744 259 S 4.0591 7.6697 115.5562 58.5908 62.5746 173.9071 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 5 W 8.26 5.37 0.00 2.84 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 6 C 9.42 4.46 0.00 2.92 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 7 Y 9.96 4.75 0.00 3.04 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 9.36 3.95 0.00 2.04 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 2.39 2.38 0.00 9 V 7.72 3.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.01 0.00 0.00 10 Q 8.28 3.99 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 1.29 1.77 0.00 11 A 7.87 4.11 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 11A E 8.10 4.21 0.00 2.25 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 2.36 0.00 11B S 8.13 4.63 0.00 3.84 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 11G C 8.44 3.99 0.00 3.10 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 11H L 8.22 4.51 0.00 1.85 1.83 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.06 4.43 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 0.73 0.00 0.00 0.90 0.00 0.00 13 P 0.00 2.00 0.00 1.56 0.52 0.00 3.46 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 2.14 1.82 0.00 14 V 7.46 3.52 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.84 0.00 0.00 15 K 7.87 4.53 0.00 1.84 1.85 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.35 7.81 16 W 7.75 4.51 0.00 3.44 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 *20 G 8.32 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 21 G 8.54 3.62 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 0.00 0.00 0.00 22 N 8.69 4.75 0.00 3.11 2.85 0.00 0.00 7.44 7.77 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 23 C 8.12 4.93 0.00 3.39 3.38 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 24 Q 7.91 4.53 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 25 K 7.57 4.46 0.00 1.99 1.85 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.42 7.81 26 D 8.65 4.72 0.00 2.66 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 27 R 8.78 4.74 0.00 1.91 1.92 0.00 3.15 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 28 Q 7.66 4.77 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.77 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.35 0.00 29 S 8.70 4.70 0.00 4.15 3.42 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 30 P 0.00 4.47 0.00 1.77 1.72 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 31 I 7.34 4.79 1.57 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.51 0.76 0.00 0.00 32 N 8.37 4.70 0.00 2.63 2.63 0.00 0.00 7.21 7.94 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 33 I 8.39 4.05 1.44 0.00 0.00 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 0.78 0.35 0.16 0.00 0.00 34 V 8.12 4.15 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 0.97 0.00 0.00 0.85 0.00 0.00 35 T 9.08 3.89 4.48 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 0.99 0.00 0.00 36 T 7.81 4.09 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 37 K 7.61 4.16 0.00 1.78 1.88 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.35 7.81 38 A 7.40 4.84 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 39 K 8.70 4.22 0.00 1.74 1.74 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.45 7.81 40 V 8.44 4.08 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 0.68 0.00 0.00 0.90 0.00 0.00 41 D 9.02 4.77 0.00 2.68 2.43 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 42 K 8.93 4.04 0.00 1.77 1.84 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 43 K 8.41 4.18 0.00 1.79 1.84 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.47 7.81 44 L 7.64 4.30 0.00 1.50 1.59 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 45 G 7.82 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.38 4.42 0.00 1.76 2.04 0.00 2.79 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.19 0.00 47 F 8.69 4.51 0.00 2.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.72 4.45 0.00 2.98 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 49 F 8.67 4.80 0.00 2.88 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 50 S 9.20 4.66 0.00 3.99 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 50A G 9.57 4.44 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 0.00 51 Y 8.10 4.21 0.00 3.10 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 52 D 8.35 4.32 0.00 2.97 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 53 K 7.88 4.47 0.00 1.83 1.77 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.46 7.81 54 K 8.61 4.38 0.00 1.63 1.70 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.40 7.81 55 Q 8.98 4.27 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.09 1.29 0.00 56 T 7.92 4.69 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 57 W 8.26 4.46 0.00 3.27 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.66 4.86 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 59 V 8.82 5.09 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 0.75 0.00 0.00 0.97 0.00 0.00 60 Q 8.98 5.01 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 61 N 8.82 5.33 0.00 2.97 2.90 0.00 0.00 7.15 6.73 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 62 N 8.83 4.79 0.00 2.87 2.96 0.00 0.00 7.24 7.89 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 63 G 9.30 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 H 8.68 5.15 0.00 3.35 3.71 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.96 4.64 0.00 3.92 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 9.15 5.32 0.00 4.13 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 79 I 8.90 5.34 1.84 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.32 0.91 0.00 0.00 80 S 8.75 4.45 0.00 3.91 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 81 G 8.98 4.09 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 0.00 0.00 0.00 82 G 8.13 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 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.08 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 84 L 7.35 4.32 0.00 1.73 1.72 0.83 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.41 0.00 2.21 2.21 0.00 4.00 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.28 0.00 86 A 7.52 4.54 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.84 0.00 2.11 2.02 0.00 3.49 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 2.22 2.12 0.00 88 Y 9.23 5.11 0.00 2.86 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 89 Q 9.22 4.97 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.01 0.00 0.00 0.00 0.00 0.00 2.46 2.33 0.00 90 A 9.13 4.36 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 91 K 9.19 4.37 0.00 1.65 1.85 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.53 7.81 92 Q 7.51 4.98 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 93 L 8.68 5.30 0.00 1.52 1.30 0.63 0.74 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 94 H 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.56 4.33 0.00 1.57 1.05 0.00 1.26 0.00 0.00 1.33 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.03 1.18 7.81 104 G 8.50 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 0.00 105 S 7.82 4.56 0.00 4.31 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.89 4.21 0.00 1.93 1.94 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 2.25 2.15 0.00 107 H 8.32 4.61 0.00 3.08 3.18 0.00 5.89 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 8.51 5.00 0.00 3.78 3.45 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 0.00 109 L 8.60 4.73 0.00 1.79 1.61 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 110 D 10.09 4.36 0.00 2.72 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 0.00 111 G 8.55 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.03 4.40 0.00 2.05 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 2.18 2.20 0.00 113 H 8.57 5.20 0.00 3.25 3.25 0.00 5.65 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 9.27 4.85 0.00 2.96 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 0.00 115 A 8.88 4.12 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 0.00 116 M 7.83 4.83 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 117 E 9.43 5.07 0.00 2.05 1.79 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 2.27 2.49 0.00 118 M 9.75 5.10 0.00 2.31 2.02 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 2.68 2.61 0.00 119 H 9.38 5.68 0.00 2.89 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 9.11 4.77 2.15 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.00 0.87 0.00 0.00 121 V 8.71 4.46 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 1.01 0.00 0.00 1.08 0.00 0.00 122 H 9.59 5.53 0.00 3.19 3.47 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.05 5.19 0.00 2.07 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 2.18 2.36 0.00 124 K 8.76 2.86 0.00 1.53 1.60 0.00 1.91 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.06 0.62 7.81 125 E 8.16 4.18 0.00 1.91 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 2.26 2.21 0.00 126 K 8.06 4.21 0.00 1.69 1.61 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.32 7.81 *137 P 0.00 4.19 0.00 2.24 2.23 0.00 3.69 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 138 E 8.76 4.17 0.00 2.20 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 0.00 2.38 2.32 0.00 139 D 7.71 4.89 0.00 2.84 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 0.00 140 E 8.22 4.06 0.00 2.04 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 2.34 0.00 141 I 8.06 5.11 1.89 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 1.17 0.55 0.83 0.00 0.00 142 A 8.69 4.99 0.48 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 0.00 143 V 7.48 4.45 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 0.78 0.00 0.00 0.35 0.00 0.00 144 L 9.05 4.66 0.00 1.85 1.68 0.99 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 145 A 8.93 5.55 1.60 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 0.00 0.00 146 F 9.69 5.21 0.00 3.01 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 0.00 147 L 8.54 4.93 0.00 1.03 0.62 0.53 0.71 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 0.00 148 V 8.76 4.93 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 0.91 0.00 0.00 0.91 0.00 0.00 149 E 9.44 5.15 0.00 2.11 2.33 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 2.32 2.31 0.00 150 A 8.62 4.72 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 0.00 151 G 8.72 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 151A T 8.65 4.41 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 1.17 0.00 0.00 152 Q 7.78 4.20 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 153 V 8.36 3.62 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.94 0.00 0.00 154 N 9.18 4.71 0.00 2.79 2.70 0.00 0.00 7.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 E 8.87 4.25 0.00 2.04 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 2.41 2.33 0.00 156 G 8.09 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 0.00 157 F 8.41 4.12 0.00 3.22 3.16 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 0.00 158 Q 8.10 4.04 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.78 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 159 P 0.00 4.19 0.00 2.13 2.26 0.00 3.72 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 2.10 2.14 0.00 160 L 7.69 3.84 0.00 1.59 1.70 0.87 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 161 V 7.69 3.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.03 0.00 0.00 162 E 8.89 4.02 0.00 1.97 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 2.29 2.40 0.00 163 A 7.87 4.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 L 7.53 3.84 0.00 1.45 1.46 -0.40 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 165 S 7.43 4.40 0.00 4.05 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 0.00 166 N 8.14 4.77 0.00 2.79 2.88 0.00 0.00 6.70 7.19 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 0.00 167 I 7.64 4.74 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 1.49 0.96 0.96 0.00 0.00 168 P 0.00 4.79 0.00 2.43 2.59 0.00 3.83 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 169 K 7.40 4.95 0.00 2.01 1.73 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.37 7.81 170 P 0.00 4.69 0.00 2.06 2.02 0.00 4.05 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 2.10 2.28 0.00 171 E 9.94 3.94 0.00 1.98 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 0.00 2.23 2.28 0.00 172 M 7.77 4.71 0.00 2.03 2.11 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 2.58 2.49 0.00 173 S 8.46 5.20 0.00 3.84 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 0.00 174 T 8.86 4.66 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 1.33 0.00 0.00 175 T 8.26 5.07 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 0.00 176 M 9.33 4.48 0.00 1.91 2.11 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 2.67 2.50 0.00 177 A 8.45 4.23 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.65 4.24 0.00 1.84 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 2.28 2.25 0.00 179 S 8.25 4.79 0.00 3.99 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 0.00 180 S 9.20 5.32 0.00 4.06 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 0.00 181 L 8.55 3.89 0.00 1.59 1.41 -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.28 3.82 0.00 1.78 1.65 0.74 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 183 D 8.02 4.39 0.00 2.83 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 0.00 184 L 7.65 4.09 0.00 1.42 1.29 0.49 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 185 L 6.69 4.39 0.00 1.26 1.03 0.40 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 186 P 0.00 4.45 0.00 2.00 2.00 0.00 3.42 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 187 K 8.38 3.95 0.00 1.80 1.73 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.43 7.81 187A E 8.74 3.85 0.00 1.95 1.94 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 2.42 2.14 0.00 187B E 8.08 4.13 0.00 2.01 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 2.32 2.33 0.00 188 K 7.94 4.42 0.00 1.93 1.89 0.00 1.70 0.00 0.00 1.91 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.42 7.81 189 L 7.84 4.88 0.00 1.83 1.68 0.57 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 189A R 8.18 4.20 0.00 1.79 1.98 0.00 3.20 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 190 H 8.28 4.68 0.00 3.15 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 Y 7.87 4.90 0.00 2.63 2.51 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 0.00 192 F 9.23 5.04 0.00 2.98 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 0.00 193 R 9.57 5.58 0.00 2.05 1.84 0.00 3.23 0.00 0.00 3.47 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 194 Y 8.45 5.21 0.00 3.14 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 0.00 195 L 8.46 4.87 0.00 1.64 1.68 0.96 0.87 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 0.00 196 G 8.55 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 S 9.32 5.50 0.00 4.15 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 L 8.63 4.40 0.00 1.65 1.65 0.90 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 199 T 8.87 4.68 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 200 T 7.24 3.88 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 1.27 0.00 0.00 201 P 0.00 4.03 0.00 0.96 1.40 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 202 T 8.30 4.16 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 1.12 0.00 0.00 203 C 7.98 4.47 0.00 3.11 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 0.00 204 D 7.99 4.48 0.00 2.67 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 0.00 205 E 8.43 5.10 0.00 1.88 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 2.33 2.34 0.00 206 K 7.55 4.84 0.00 1.85 1.93 0.00 1.63 0.00 0.00 1.89 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.24 7.81 207 V 8.04 4.77 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.33 0.00 0.00 0.84 0.00 0.00 208 V 8.65 4.34 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 0.51 0.00 0.00 0.85 0.00 0.00 209 W 8.69 4.47 0.00 2.58 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 0.00 210 T 8.65 5.06 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 0.21 0.00 0.00 211 V 8.74 4.66 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 0.84 0.00 0.00 0.88 0.00 0.00 212 F 8.58 4.51 0.00 2.83 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 0.00 213 R 8.82 4.24 0.00 1.82 2.04 0.00 3.29 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 214 E 8.28 4.34 0.00 2.15 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 2.32 2.44 0.00 215 P 0.00 4.75 0.00 2.05 1.96 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 216 I 8.81 4.17 1.85 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 1.19 0.60 0.81 0.00 0.00 217 Q 8.55 4.95 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 218 L 8.50 4.73 0.00 1.39 1.35 -0.25 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 219 H 8.99 4.51 0.00 3.23 3.15 0.00 5.70 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 R 8.61 3.93 0.00 1.83 1.99 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 221 E 8.45 4.08 0.00 2.03 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 2.42 2.45 0.00 222 Q 7.93 4.07 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 223 I 7.65 3.87 2.00 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 1.51 0.97 0.88 0.00 0.00 224 L 8.33 4.02 0.00 1.68 1.73 0.93 0.97 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 0.00 225 A 7.90 3.86 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 0.00 226 F 8.05 3.43 0.00 2.34 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 0.00 227 S 7.88 4.84 0.00 4.12 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 227A Q 8.08 4.09 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 228 K 8.09 4.30 0.00 1.67 1.74 0.00 1.50 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.41 7.81 229 L 6.80 4.89 0.00 1.85 1.59 0.98 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 230 Y 8.68 5.18 0.00 2.97 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 0.00 231 Y 8.81 4.43 0.00 3.13 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 0.00 232 D 7.89 5.23 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 0.00 233 K 8.47 4.01 0.00 1.76 1.90 0.00 1.78 0.00 0.00 1.94 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.47 7.81 231 E 9.11 4.23 0.00 2.16 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 2.33 2.39 0.00 232 Q 7.87 4.93 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.04 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 233 T 8.33 4.04 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 0.00 239 V 7.65 4.50 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 1.07 0.00 0.00 1.02 0.00 0.00 240 S 8.75 4.13 0.00 3.78 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 0.00 241 M 8.80 3.26 0.00 2.12 1.51 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.78 0.00 242 K 8.45 3.82 0.00 1.76 1.87 0.00 1.89 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.41 7.81 243 D 8.20 4.19 0.00 2.79 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 0.00 244 N 7.19 3.76 0.00 2.42 2.50 0.00 0.00 5.97 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 V 6.39 4.36 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 0.85 0.00 0.00 0.84 0.00 0.00 246 R 9.59 4.20 0.00 2.28 2.04 0.00 3.91 0.00 0.00 3.60 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.34 0.00 247 P 0.00 4.39 0.00 2.13 1.98 0.00 3.55 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.01 0.00 248 L 8.19 4.26 0.00 1.51 1.57 0.89 0.81 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 0.00 249 Q 8.80 4.61 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 250 Q 8.35 4.16 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 7.09 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 251 L 8.77 3.94 0.00 1.59 1.59 0.76 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 252 G 7.64 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 0.00 253 Q 8.67 4.33 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 254 R 7.49 4.25 0.00 1.96 1.96 0.00 3.43 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.62 0.00 255 T 8.18 4.67 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 0.00 256 V 8.15 4.70 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.75 0.00 0.00 257 I 8.66 5.26 1.97 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 1.48 1.21 0.98 0.00 0.00 258 K 8.39 4.89 0.00 1.47 1.84 0.00 1.22 0.00 0.00 1.87 0.00 0.00 3.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.30 7.81 259 S 7.67 4.06 0.00 3.56 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 * Residues marked with a * may have inaccurate shift predictions.