NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.3362 8.0433 120.6257 54.1441 43.4849 177.4839 3 K 3.7306 8.5677 121.6552 57.9624 31.9027 178.1501 4 Q 3.9785 8.8034 118.9035 59.1283 28.9844 178.3149 5 K 3.9263 7.8420 122.7903 59.6699 32.0440 179.8041 6 E 3.9417 8.0013 118.3046 60.9735 29.6852 181.7881 7 L 4.0089 7.6677 119.3518 57.6262 41.5678 179.5756 8 I 3.8357 8.1145 119.9978 64.3574 36.9508 178.3108 9 A 3.9614 8.0886 121.5430 55.2525 18.1861 179.3260 10 N 4.1489 8.1014 114.9572 56.3692 38.4850 177.7722 11 V 3.4775 7.7599 119.4586 65.7521 31.6445 177.7030 12 K 3.8809 8.1832 119.5488 59.7803 32.1674 178.0256 13 N 4.2508 8.3514 116.7635 56.5805 38.5563 177.4485 14 L 4.1639 8.0763 120.2687 58.0530 41.5480 179.7137 15 T 4.0398 8.1986 109.1375 64.6443 68.8123 175.9686 16 E 2.5400 7.8802 118.9318 57.2700 29.8830 177.9205 17 S 4.6397 7.2759 112.2169 57.4572 64.8337 173.5078 18 D 4.5968 7.7734 126.3181 54.0399 41.3980 177.5063 19 E 4.1911 8.8580 122.9358 58.6058 30.1343 174.6208 20 R 4.2654 8.7011 115.6002 57.9773 30.5798 175.6314 21 I 4.6755 7.4643 119.1317 60.1676 38.1587 175.7617 22 T 4.5534 9.2182 124.1147 65.5930 70.1845 174.7646 23 A 5.2144 7.9209 120.3707 50.9881 23.0266 174.6470 24 C 5.6859 9.7183 119.6368 56.7958 36.1051 172.6684 *27 Y 4.4637 8.2134 119.1382 57.3066 38.8278 174.4715 28 G 4.0626 8.7265 106.9320 45.4126 0.0000 173.7161 29 S 3.9372 8.3832 111.6234 61.4262 62.7251 175.8402 30 F 4.4349 7.9614 116.9398 58.6581 38.7358 175.5023 31 T 4.5836 8.1610 110.1872 61.2819 68.9171 174.5516 32 K 4.3805 7.5458 118.6515 55.8305 33.4583 176.5549 33 G 3.9161 8.3782 105.7561 46.3053 0.0000 174.1744 34 E 4.5108 8.0771 116.1713 55.4130 30.2872 176.5780 35 G 2.5915 7.5031 108.8180 45.0711 0.0000 173.0810 36 D 4.6117 8.2527 121.3142 52.0693 42.0800 175.6003 37 Q 4.0051 8.4623 115.9077 58.8914 28.4703 176.2944 38 Y 4.7019 8.1749 115.2293 57.9500 38.5686 176.1042 39 S 4.3750 7.9286 116.8820 58.2977 63.5069 173.4001 40 D 5.1352 8.3611 122.9756 52.5651 41.4782 175.0404 41 I 4.7250 8.4193 111.9490 59.3657 40.9721 174.4733 42 E 5.1476 7.2495 118.8413 56.3485 32.4582 173.8542 43 F 5.2079 8.1402 119.3116 56.6075 43.7336 172.4585 44 Y 4.6601 9.1380 119.5608 56.7577 40.0049 174.3941 45 I 4.6599 8.5523 125.1952 59.5135 39.8639 174.4239 46 F 5.1642 9.3838 126.7074 55.9662 40.9585 174.9211 47 L 5.0628 9.0915 124.0490 52.3757 44.6846 176.1139 48 K 4.1762 8.7512 121.4728 57.5651 32.2350 177.3193 49 H 4.1624 9.7442 125.1455 59.3456 29.9617 177.4997 50 S 4.2495 8.1372 112.4018 60.1709 63.0152 174.5111 51 I 4.3227 7.3145 112.3329 61.1261 38.3624 177.2677 52 T 4.0711 7.1322 118.0795 63.4748 65.5319 172.0234 *55 F 4.1830 7.8184 124.1495 57.6804 40.6651 174.3708 56 D 4.4886 7.4558 127.1078 52.6637 41.6938 176.7958 57 S 3.7469 8.1193 124.1118 61.1356 63.1175 176.3473 58 S 4.1888 7.9944 117.4639 61.1952 62.7098 176.0292 59 N 4.3072 8.0309 119.6390 55.9064 38.2588 177.0242 60 W 4.0922 7.8597 129.4639 60.4773 30.8997 178.0338 61 L 3.8980 8.7609 119.4800 57.6714 40.7937 179.1550 62 F 4.4752 8.2921 121.2693 60.9127 39.3264 176.6326 63 D 4.3595 7.6361 118.0153 56.9314 40.5682 178.4841 64 V 3.3205 6.9151 117.8738 63.6572 32.1065 175.9724 65 A 4.0847 7.0594 118.7954 50.6513 22.5944 173.8067 66 P 3.6531 0.0000 0.0000 62.8818 31.9392 175.3489 67 Y 5.3690 7.7329 119.0764 55.2236 40.7289 175.5963 68 L 4.1230 8.8843 121.3171 56.3678 42.2494 176.8143 *70 L 4.4182 7.6523 120.6332 55.0379 42.9808 175.0835 71 Y 4.9640 9.0445 125.3987 56.6278 42.3698 173.9405 72 K 4.8412 8.3521 122.9615 53.3303 33.6783 174.9130 73 N 4.3553 8.4285 126.0016 51.3783 38.6135 176.2113 74 E 3.9852 8.4217 113.2041 58.0638 29.5536 173.3513 75 Y 4.6456 7.8078 112.9577 58.4297 38.7909 176.5548 76 G 3.9826 8.2879 108.8937 45.1490 0.0000 173.9207 77 T 4.0220 7.5033 117.1074 63.0743 70.0518 173.6421 78 E 4.5292 8.9005 126.2747 56.2611 30.8309 175.7979 79 V 4.9829 8.8550 125.8574 60.9384 34.1759 174.6674 80 V 4.6253 8.9593 127.1057 59.8393 34.7993 174.5745 81 I 4.7548 8.0640 123.8361 59.5346 38.9989 175.5863 82 F 4.8509 9.0660 127.0477 57.0940 39.3926 176.3719 83 D 4.6116 9.2242 122.0971 55.0140 39.2879 176.6164 84 N 4.7337 8.1895 116.6500 52.5718 37.4839 175.5324 85 L 3.8536 8.3572 116.7662 55.5040 40.1577 174.7454 86 I 4.0824 7.8615 120.6014 61.3394 37.8344 175.0556 87 R 4.9940 8.6833 123.5135 55.2257 32.0358 175.5881 88 G 4.7514 9.3635 109.9631 44.5563 0.0000 171.2164 89 E 5.3252 9.0517 122.3871 54.3266 33.0935 174.9336 90 F 5.1725 9.5004 123.2810 55.9226 43.0194 173.5677 91 H 4.8044 8.8257 121.1256 54.0828 30.6178 173.6100 92 F 4.9015 8.7715 122.6766 55.9948 40.1807 175.3357 93 L 4.9444 8.6127 122.9976 52.4955 46.5322 176.1449 94 S 4.7084 8.7349 115.7177 58.3700 63.0923 174.5278 95 E 4.1763 9.3999 124.3926 59.7705 29.1568 178.7092 96 K 4.0708 8.4152 118.0710 58.2107 32.3983 177.2890 97 D 4.5352 8.0314 120.8501 52.7466 39.2930 176.4942 *99 N 3.6943 8.2133 117.8857 51.4802 39.1794 176.6293 100 I 3.7015 7.2851 113.6389 62.7951 37.7734 177.9410 101 I 2.1546 6.6796 122.0620 63.5901 36.4647 176.1642 102 P 4.1779 0.0000 0.0000 65.1601 31.1266 178.3096 103 S 3.9266 7.4774 112.4733 60.3959 63.0503 176.2854 104 F 4.5917 8.0346 122.4537 60.2009 38.3740 177.0997 105 K 4.2078 7.5031 117.0952 59.1917 32.3888 178.2061 106 D 4.5212 8.0023 119.3324 56.0286 41.0035 176.9826 107 S 4.5567 7.7784 113.9671 58.3073 64.1603 173.6364 108 G 4.0324 7.2279 104.9019 46.0608 0.0000 171.6544 109 Y 4.7768 8.7561 121.4670 57.6931 39.7103 175.7248 110 I 4.1827 8.4315 128.3344 58.9281 37.3266 174.3677 111 P 3.8381 0.0000 0.0000 64.6889 31.6661 177.0561 112 D 4.5463 7.3707 118.3744 53.1891 41.5971 174.9004 113 T 3.9129 8.2659 116.7004 63.3901 69.8054 177.6380 114 K 4.1293 7.9285 124.0469 57.7035 31.8417 184.8465 115 A 4.2038 7.3187 122.9202 51.4923 17.4628 177.6347 *117 L 4.1230 7.8341 122.1206 56.5949 42.7634 175.5682 118 I 4.3618 8.6403 127.0214 62.9535 38.4619 175.8954 119 Y 4.9270 7.6427 119.2719 56.5513 41.5534 173.4282 120 D 4.4966 7.2017 125.1001 52.8933 42.1242 174.1170 121 E 3.8077 8.3957 127.0019 58.6285 29.7753 178.1723 122 T 4.1863 7.7711 105.4759 61.4284 69.9357 175.4885 123 G 3.8944 8.0774 110.8792 45.3849 0.0000 175.2369 124 Q 3.7442 7.7371 121.0328 58.7309 28.8677 177.5623 125 L 3.9393 8.0565 121.0534 58.1565 42.1660 178.2645 126 E 3.8901 8.6118 119.3264 59.3720 29.2530 178.5426 127 N 4.1921 7.5129 115.3790 56.6262 39.0274 176.6286 128 Y 4.3097 7.6840 117.9029 61.1289 37.9347 178.7822 129 L 4.0682 8.2907 120.3525 57.7833 41.5148 179.7235 130 S 4.2070 8.0985 113.2124 61.2968 62.8726 176.1352 131 E 4.1081 7.9144 121.4837 58.2374 29.4662 178.0371 132 I 4.3467 7.5778 111.0589 59.5252 38.5133 175.4680 133 S 4.2247 7.6136 116.3283 59.8548 62.5282 174.3391 134 G 4.0332 8.8315 115.6844 45.5714 0.0000 173.6106 135 A 4.4072 7.7850 123.1874 52.0787 19.2906 176.5437 136 R 5.0010 7.8576 113.7338 54.6761 31.7185 173.1624 137 P 4.3575 0.0000 0.0000 62.4229 32.3182 175.2010 138 N 4.6147 8.2678 118.1244 52.2035 39.1440 174.9092 139 R 3.6891 8.1368 124.4413 56.9810 30.6802 177.7786 140 L 4.4200 7.8131 120.0870 53.4603 40.2785 176.3104 141 T 4.7897 7.1570 111.8777 58.7084 73.6267 174.4293 142 E 3.5931 8.6295 122.0927 59.3455 29.7201 178.8496 143 E 3.9668 8.0623 118.1831 59.4693 29.4770 179.0357 144 N 4.4262 8.0322 115.9882 56.3276 38.7203 177.2285 145 A 3.9632 7.5689 122.0808 55.3141 18.3761 179.5023 146 N 4.2870 8.4119 115.0743 56.3715 38.6843 177.3625 147 F 4.0989 8.3755 122.0037 61.3760 39.4857 177.1656 148 L 4.0162 8.4012 118.7043 57.8477 41.4785 179.5456 149 L 4.0436 8.0022 118.8880 57.9876 41.5569 179.4167 150 C 4.1283 8.1615 116.6892 62.7697 28.0322 175.7111 151 N 4.0609 8.3492 118.9529 56.3414 38.4096 176.6027 152 F 4.0516 8.5575 122.4777 61.5465 39.5508 177.2526 153 S 4.1591 8.2773 114.6680 61.5526 62.3895 175.8767 154 N 4.2242 7.9692 118.5479 57.1489 38.7407 176.6039 155 L 4.0842 7.8132 119.0266 57.2858 41.8794 179.1550 156 W 4.0838 8.2855 128.9481 60.0899 30.5983 178.3415 157 L 4.4113 8.1177 117.7027 55.7646 41.3257 178.5479 *159 G 4.0857 7.9983 107.7556 45.0909 0.0000 175.7381 160 I 2.7232 7.2160 119.9436 63.0894 37.6871 177.8604 161 N 4.2396 7.7912 117.5303 56.4769 38.3675 177.8688 162 V 3.5165 7.4585 113.1737 63.9101 31.6140 178.2957 163 L 3.5834 7.4261 120.2587 57.9991 41.6363 179.1790 164 K 4.0206 7.5978 117.0910 59.4918 32.0397 179.0491 165 R 3.9590 7.6728 118.0469 57.5810 29.8640 177.4088 166 G 3.1990 7.4854 105.7140 45.5862 0.0000 175.0061 167 E 4.1095 7.7241 122.0333 54.8132 26.8447 176.4902 168 Y 4.1495 7.3595 120.6339 60.9054 38.5572 177.5609 169 A 4.0490 8.0123 121.2691 55.0623 18.5571 179.5028 170 R 3.8409 7.9051 117.1058 59.5552 30.2375 178.7721 171 S 4.1146 8.1129 114.1483 61.2692 62.8260 176.2800 172 L 3.9909 8.0217 124.1007 57.7508 41.5865 178.4977 173 E 3.9226 8.2496 119.3776 59.4126 29.5936 178.9072 174 L 4.0034 8.0761 118.9678 57.5681 41.5307 179.2180 175 L 3.7057 8.1806 120.8209 58.0248 41.5346 179.2316 176 S 4.5422 7.8621 115.2971 60.9141 62.6913 176.5727 177 Q 4.0313 7.7770 121.7365 58.7200 28.3502 178.5136 178 L 4.0821 8.1201 120.1691 57.8611 41.5159 179.3575 179 Q 4.2551 8.4654 118.3661 59.1951 28.7545 179.3362 180 K 3.9435 7.8575 118.7025 59.5430 32.0766 179.1505 181 N 4.3291 7.9636 116.5758 56.6592 38.3802 177.6496 182 T 3.8370 8.2255 117.3548 66.5482 68.5570 176.7960 183 L 3.6867 7.9993 121.0402 57.7565 41.3316 179.6259 184 Q 3.6347 7.4461 116.6098 58.6848 28.5688 178.3846 185 L 4.1695 7.7205 119.1522 57.8261 41.8615 179.3158 186 I 3.9065 7.9684 119.9940 64.2465 36.9150 179.5644 187 R 4.2781 7.9111 116.5678 56.6436 29.5677 178.4830 *189 A 4.2601 7.9725 123.7679 51.9400 20.3088 178.2782 190 E 4.3299 8.4286 112.3665 55.4511 30.4166 175.8886 191 K 3.8888 8.0308 117.2014 57.6230 29.5946 176.4083 192 N 4.8775 8.5116 114.7690 51.7554 39.0662 173.0533 193 A 4.9130 7.9167 118.9524 51.4726 20.4495 177.3675 194 D 4.5764 8.4302 117.9317 58.1771 40.8706 177.9547 195 N 4.7251 7.9842 117.8067 52.2493 36.9408 173.8222 196 W 4.6569 8.3004 129.9143 58.9517 32.4275 177.4920 197 L 4.1010 8.2317 117.0959 56.8860 41.6469 177.2452 198 N 4.7376 7.8931 115.5741 51.4126 38.9630 175.8436 *200 S 4.3107 8.3961 116.2016 57.8580 65.0169 173.8394 201 K 3.9888 7.9457 121.9801 57.9464 32.2869 175.6465 202 N 4.2644 9.0837 121.9114 53.9830 36.6934 176.0572 203 L 3.9949 7.8002 121.9004 58.3137 42.3069 179.0020 204 E 3.6819 8.3640 116.5600 58.8225 29.4236 177.9486 205 K 4.3059 7.9277 116.1140 56.8030 32.8649 176.9914 206 E 4.5245 7.9648 116.8209 55.8446 30.9220 175.7205 207 I 4.7713 7.3625 110.9433 58.0216 40.6648 175.9195 208 S 4.2900 8.9148 116.7731 58.4285 64.6592 175.2404 209 L 3.9818 8.4614 124.6898 58.2563 41.8913 178.8591 210 E 3.9654 8.1951 118.7356 59.7008 29.6527 178.6074 211 N 4.4655 8.2026 116.1433 56.1337 38.4395 176.9091 212 Y 4.0276 8.2655 121.2807 60.7118 38.6985 178.3267 213 K 4.1169 8.2452 118.2667 59.2398 32.5108 179.2145 214 K 4.1060 8.0920 118.8166 59.5041 31.9662 178.9095 215 F 4.1076 8.6483 120.9812 61.4654 39.1038 176.8870 216 A 3.6560 8.1483 120.3608 55.0114 18.2072 179.2116 217 K 4.1571 7.8491 115.2709 58.0263 31.9363 178.2536 218 T 4.5394 7.3966 109.3701 61.3699 69.0549 174.5307 219 T 4.3877 6.9991 112.0084 60.4812 70.8255 173.5962 220 A 4.5455 7.8385 123.5795 51.2161 21.9918 176.3110 221 R 4.3649 8.3239 120.0010 54.6265 31.5784 178.0688 222 L 4.2539 8.0348 121.1479 54.4873 40.0270 174.5151 223 D 4.3168 7.9621 119.5095 51.1522 44.9946 174.1926 224 K 3.6758 8.3039 128.4312 59.8574 32.1519 178.6615 225 V 3.6598 7.7558 117.4650 66.2758 31.5490 177.7018 226 E 4.2255 8.5341 118.1970 59.2722 29.2192 179.4726 227 L 4.0753 8.3856 119.5643 57.8631 41.7602 179.3810 228 F 4.0343 8.5155 117.8968 60.6153 38.8252 177.5638 229 E 4.0779 8.5195 117.8759 59.4860 29.2723 179.3181 230 A 4.2649 8.1455 122.0506 54.9421 18.4798 179.3455 231 Y 3.9606 8.3767 115.3227 60.8663 37.9181 178.5621 232 K 4.2424 8.5057 120.6105 59.9219 32.3792 178.6597 233 N 4.4080 8.4960 116.8028 56.1462 38.4581 177.1615 234 S 4.1688 8.6199 115.1173 61.5621 62.2870 176.1020 235 L 3.9166 7.9562 121.2745 58.2169 41.8630 178.6019 236 L 4.1026 7.8761 117.8251 57.5469 41.7457 178.9290 237 L 4.1241 8.1462 120.5220 57.8916 42.1028 180.4434 238 V 3.6653 7.3484 117.9537 62.7736 30.9880 177.6205 *240 D 4.5663 8.0988 117.7129 54.0407 42.9407 178.1638 241 L 4.0798 8.0412 119.1949 57.8714 41.6176 179.6481 242 Q 4.0488 8.5747 117.9247 58.8527 28.3219 178.5028 243 S 4.3364 8.0144 115.4276 61.4366 63.1919 175.8733 244 H 4.3050 7.9356 118.6756 58.8437 28.5631 177.7621 245 L 4.1887 8.2312 120.9704 57.7001 41.1773 179.3525 246 I 3.8393 8.1438 118.4452 64.0894 37.9275 177.5039 247 E 4.1446 8.0928 120.9136 58.9882 29.2872 178.2206 248 Q 4.1923 7.7090 115.6566 55.3182 29.8792 179.9052 249 Y 4.9238 7.7087 113.4159 55.8166 41.3791 174.6956 250 N 4.6643 9.0287 121.2483 52.8898 39.0868 174.4598 251 L 5.0378 8.4140 128.0216 53.4862 44.3068 177.7018 252 K 4.0670 9.3790 124.9176 56.8691 31.9866 176.1316 253 V 3.9721 7.6966 119.0295 62.2840 31.5590 175.8804 254 T 4.5221 8.0695 118.2131 60.2637 72.0639 174.7013 255 H 3.9979 8.6878 120.4652 59.8391 29.7552 176.7296 256 D 4.3789 8.1650 119.8411 57.4536 40.7190 178.8299 257 I 3.6787 7.6628 119.7764 64.4529 37.1397 178.4923 258 L 3.9640 7.9056 122.0522 58.3989 41.3149 180.1663 259 E 3.9574 8.2624 118.3914 61.0347 29.7243 181.9902 260 R 4.1679 7.9622 118.6219 59.1822 29.8481 179.1946 261 L 4.1434 7.6203 117.9836 57.6664 41.4967 178.9041 262 L 4.1456 7.9358 120.3844 58.3032 41.4997 178.8475 263 N 4.5518 8.5433 116.5645 56.2534 38.4445 176.7822 264 Y 4.4845 8.1168 120.5559 60.4335 38.5927 177.7266 265 I 3.8921 7.6848 121.7213 64.8432 37.3948 177.5590 266 S 4.5137 7.5698 111.5798 58.1828 62.7832 175.9493 267 E 4.2280 7.8791 124.5317 57.5082 29.2555 176.1447 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 L 8.04 4.34 0.00 1.72 1.67 1.04 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.57 3.73 0.00 1.87 1.85 0.00 1.67 0.00 0.00 1.86 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.54 7.81 4 Q 8.80 3.98 0.00 2.03 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.79 0.00 5 K 7.84 3.93 0.00 1.86 1.81 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.27 1.18 7.81 6 E 8.00 3.94 0.00 1.97 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 2.31 1.97 0.00 7 L 7.67 4.01 0.00 1.74 1.54 0.64 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.11 3.84 1.90 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.74 0.99 0.00 0.00 9 A 8.09 3.96 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 10 N 8.10 4.15 0.00 2.84 2.69 0.00 0.00 6.69 6.96 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 11 V 7.76 3.48 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 0.53 0.00 0.00 0.93 0.00 0.00 12 K 8.18 3.88 0.00 1.90 1.98 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.22 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.59 7.81 13 N 8.35 4.25 0.00 2.87 2.84 0.00 0.00 7.13 6.78 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 14 L 8.08 4.16 0.00 1.75 1.92 0.35 0.43 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 15 T 8.20 4.04 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 16 E 7.88 2.54 0.00 1.90 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 2.55 2.24 0.00 17 S 7.28 4.64 0.00 4.10 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.77 4.60 0.00 3.13 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 19 E 8.86 4.19 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 20 R 8.70 4.27 0.00 2.11 2.09 0.00 3.29 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 21 I 7.46 4.68 2.03 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.45 1.05 0.00 0.00 22 T 9.22 4.55 4.34 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 1.26 0.00 0.00 23 A 7.92 5.21 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 C 9.72 5.69 0.00 3.11 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 *27 Y 8.21 4.46 0.00 3.02 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 28 G 8.73 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 0.00 0.00 0.00 29 S 8.38 3.94 0.00 3.63 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 30 F 7.96 4.43 0.00 2.98 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 31 T 8.16 4.58 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 32 K 7.55 4.38 0.00 1.66 1.78 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.25 1.51 7.81 33 G 8.38 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 34 E 8.08 4.51 0.00 1.84 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 2.20 2.39 0.00 35 G 7.50 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.25 4.61 0.00 2.74 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 37 Q 8.46 4.01 0.00 1.90 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.90 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 38 Y 8.17 4.70 0.00 3.06 2.97 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 47 L 9.09 5.06 0.00 1.45 1.41 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.75 4.18 0.00 1.84 1.82 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.48 7.81 49 H 9.74 4.16 0.00 3.22 3.36 0.00 5.78 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 50 S 8.14 4.25 0.00 4.04 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.31 4.32 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.80 0.96 0.00 0.00 52 T 7.13 4.07 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 1.26 0.00 0.00 *55 F 7.82 4.18 0.00 3.07 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 56 D 7.46 4.49 0.00 2.63 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 0.00 0.00 0.00 57 S 8.12 3.75 0.00 3.45 3.49 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 58 S 7.99 4.19 0.00 4.23 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 59 N 8.03 4.31 0.00 2.80 2.88 0.00 0.00 6.77 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 60 W 7.86 4.09 0.00 3.17 3.33 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 61 L 8.76 3.90 0.00 1.72 1.58 0.82 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.29 4.48 0.00 3.25 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 63 D 7.64 4.36 0.00 2.47 2.48 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 64 V 6.92 3.32 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 0.53 0.00 0.00 0.17 0.00 0.00 65 A 7.06 4.08 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 3.65 0.00 2.08 1.86 0.00 3.32 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.48 0.00 67 Y 7.73 5.37 0.00 3.02 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 68 L 8.88 4.12 0.00 1.71 1.82 0.98 0.83 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 *70 L 7.65 4.42 0.00 1.04 1.54 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 9.04 4.96 0.00 3.08 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 72 K 8.35 4.84 0.00 1.55 1.63 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 0.98 7.81 73 N 8.43 4.36 0.00 2.84 2.70 0.00 0.00 6.68 7.17 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 74 E 8.42 3.99 0.00 2.01 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 2.23 1.91 0.00 75 Y 7.81 4.65 0.00 2.95 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 76 G 8.29 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 T 7.50 4.02 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 1.07 0.00 0.00 78 E 8.90 4.53 0.00 2.28 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 2.47 2.77 0.00 79 V 8.85 4.98 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 1.16 0.00 0.00 0.88 0.00 0.00 80 V 8.96 4.63 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.03 0.00 0.00 81 I 8.06 4.75 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.79 0.99 0.00 0.00 82 F 9.07 4.85 0.00 3.38 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 83 D 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0.00 0.00 0.00 1.74 0.48 0.86 0.00 0.00 101 I 6.68 2.15 1.28 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.03 0.75 0.00 0.00 102 P 0.00 4.18 0.00 2.03 2.06 0.00 3.29 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.21 0.00 103 S 7.48 3.93 0.00 3.95 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.03 4.59 0.00 3.04 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 0.00 105 K 7.50 4.21 0.00 1.77 1.97 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.48 7.81 106 D 8.00 4.52 0.00 2.88 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 0.00 107 S 7.78 4.56 0.00 4.00 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 0.00 108 G 7.23 4.03 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 0.00 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0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.45 1.08 0.00 0.00 119 Y 7.64 4.93 0.00 3.04 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 0.00 120 D 7.20 4.50 0.00 2.51 2.37 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 0.00 121 E 8.40 3.81 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 2.33 2.34 0.00 122 T 7.77 4.19 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 123 G 8.08 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 7.74 3.74 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 125 L 8.06 3.94 0.00 1.73 1.91 0.93 1.02 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 0.00 126 E 8.61 3.89 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 127 N 7.51 4.19 0.00 2.56 2.56 0.00 0.00 7.10 7.31 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 0.00 128 Y 7.68 4.31 0.00 3.03 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 8.29 4.07 0.00 1.84 1.74 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.10 4.21 0.00 4.00 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 0.00 131 E 7.91 4.11 0.00 2.26 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 0.00 2.33 2.46 0.00 132 I 7.58 4.35 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.78 0.95 0.00 0.00 133 S 7.61 4.22 0.00 3.85 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 0.00 134 G 8.83 4.03 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 0.00 0.00 0.00 135 A 7.78 4.41 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 0.00 136 R 7.86 5.00 0.00 1.93 2.08 0.00 2.93 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 137 P 0.00 4.36 0.00 2.04 2.01 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.08 0.00 138 N 8.27 4.61 0.00 2.62 2.69 0.00 0.00 7.04 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.14 3.69 0.00 1.30 0.66 0.00 2.21 0.00 0.00 2.56 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.02 0.00 140 L 7.81 4.42 0.00 1.77 1.78 0.94 0.72 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 0.00 141 T 7.16 4.79 4.38 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 1.18 0.00 0.00 142 E 8.63 3.59 0.00 2.19 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 2.41 2.55 0.00 143 E 8.06 3.97 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 144 N 8.03 4.43 0.00 2.78 3.00 0.00 0.00 6.92 7.39 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 0.00 145 A 7.57 3.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 N 8.41 4.29 0.00 2.90 2.92 0.00 0.00 6.68 8.65 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 0.00 147 F 8.38 4.10 0.00 3.26 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.40 4.02 0.00 1.88 1.75 1.08 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.00 4.04 0.00 1.78 1.72 0.94 0.68 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 0.00 150 C 8.16 4.13 0.00 3.03 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 0.00 151 N 8.35 4.06 0.00 2.01 2.57 0.00 0.00 6.88 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 8.56 4.05 0.00 3.21 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 8.28 4.16 0.00 4.08 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 0.00 154 N 7.97 4.22 0.00 2.73 3.05 0.00 0.00 7.30 7.34 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 0.00 155 L 7.81 4.08 0.00 1.54 1.65 0.92 0.85 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 0.00 156 W 8.29 4.08 0.00 2.56 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 0.00 157 L 8.12 4.41 0.00 2.08 1.84 0.74 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 *159 G 8.00 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 0.00 160 I 7.22 2.72 0.56 0.00 0.00 0.23 0.00 0.00 0.00 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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 0.00 195 N 7.98 4.73 0.00 2.76 3.02 0.00 0.00 6.72 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 0.00 196 W 8.30 4.66 0.00 3.51 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 0.00 197 L 8.23 4.10 0.00 1.72 1.73 1.02 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 198 N 7.89 4.74 0.00 2.90 2.93 0.00 0.00 6.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *200 S 8.40 4.31 0.00 3.93 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 0.00 201 K 7.95 3.99 0.00 1.75 1.82 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.47 7.81 202 N 9.08 4.26 0.00 3.06 2.85 0.00 0.00 6.77 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 L 7.80 3.99 0.00 1.87 1.81 0.79 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 204 E 8.36 3.68 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.09 0.00 205 K 7.93 4.31 0.00 1.82 1.84 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.38 7.81 206 E 7.96 4.52 0.00 2.06 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 2.26 2.30 0.00 207 I 7.36 4.77 2.04 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 1.77 0.81 0.90 0.00 0.00 208 S 8.91 4.29 0.00 4.09 4.05 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 0.00 209 L 8.46 3.98 0.00 1.77 1.72 0.92 0.80 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 0.00 210 E 8.20 3.97 0.00 2.10 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 2.41 2.44 0.00 211 N 8.20 4.47 0.00 2.97 2.88 0.00 0.00 6.74 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 0.00 0.00 212 Y 8.27 4.03 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 K 8.25 4.12 0.00 2.01 1.92 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.75 7.81 214 K 8.09 4.11 0.00 2.04 1.89 0.00 1.87 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.60 7.81 215 F 8.65 4.11 0.00 3.00 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 0.00 216 A 8.15 3.66 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 0.00 217 K 7.85 4.16 0.00 2.01 1.84 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.56 7.81 218 T 7.40 4.54 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 1.27 0.00 0.00 219 T 7.00 4.39 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 0.80 0.00 0.00 220 A 7.84 4.55 1.24 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 0.00 0.00 221 R 8.32 4.36 0.00 1.93 1.88 0.00 3.16 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 222 L 8.03 4.25 0.00 1.59 1.60 0.99 1.11 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 0.00 223 D 7.96 4.32 0.00 2.72 2.40 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 0.00 224 K 8.30 3.68 0.00 1.18 1.62 0.00 1.95 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.72 1.92 7.81 225 V 7.76 3.66 2.20 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 1.03 0.00 0.00 0.92 0.00 0.00 226 E 8.53 4.23 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 227 L 8.39 4.08 0.00 1.88 1.71 1.06 1.02 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 0.00 228 F 8.52 4.03 0.00 3.23 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 0.00 229 E 8.52 4.08 0.00 2.27 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 0.00 2.40 2.56 0.00 230 A 8.15 4.26 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 0.00 231 Y 8.38 3.96 0.00 3.12 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 0.00 232 K 8.51 4.24 0.00 2.17 2.12 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.65 7.81 233 N 8.50 4.41 0.00 2.91 2.88 0.00 0.00 6.72 7.08 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 0.00 234 S 8.62 4.17 0.00 4.03 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 0.00 235 L 7.96 3.92 0.00 1.30 1.80 0.41 0.55 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 0.00 236 L 7.88 4.10 0.00 1.82 1.73 0.96 0.84 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 0.00 237 L 8.15 4.12 0.00 1.83 1.90 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 238 V 7.35 3.67 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 0.50 0.00 0.00 -0.26 0.00 0.00 *240 D 8.10 4.57 0.00 2.98 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 0.00 241 L 8.04 4.08 0.00 1.73 1.69 0.83 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 242 Q 8.57 4.05 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 243 S 8.01 4.34 0.00 4.01 4.05 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 0.00 244 H 7.94 4.31 0.00 3.51 3.41 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 L 8.23 4.19 0.00 1.78 1.95 0.97 1.22 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 0.00 246 I 8.14 3.84 2.02 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 1.53 0.63 0.97 0.00 0.00 247 E 8.09 4.14 0.00 2.04 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 2.31 2.29 0.00 248 Q 7.71 4.19 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.19 1.92 0.00 249 Y 7.71 4.92 0.00 2.93 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 0.00 250 N 9.03 4.66 0.00 2.72 2.97 0.00 0.00 6.99 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 0.00 251 L 8.41 5.04 0.00 1.68 1.57 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 252 K 9.38 4.07 0.00 1.73 1.72 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.39 1.24 7.81 253 V 7.70 3.97 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 0.98 0.00 0.00 0.98 0.00 0.00 254 T 8.07 4.52 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 1.22 0.00 0.00 255 H 8.69 4.00 0.00 3.27 3.37 0.00 5.88 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 D 8.17 4.38 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 I 7.66 3.68 2.00 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 1.03 0.89 0.00 0.00 258 L 7.91 3.96 0.00 1.73 1.57 0.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 259 E 8.26 3.96 0.00 1.98 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 2.24 2.22 0.00 260 R 7.96 4.17 0.00 2.04 2.02 0.00 3.10 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 1.67 1.81 0.00 261 L 7.62 4.14 0.00 1.53 1.13 0.81 1.06 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 0.00 262 L 7.94 4.15 0.00 1.81 1.84 0.97 0.55 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 0.00 263 N 8.54 4.55 0.00 3.00 2.92 0.00 0.00 6.64 7.01 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 0.00 264 Y 8.12 4.48 0.00 3.30 3.40 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 0.00 265 I 7.68 3.89 2.14 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.37 1.17 0.00 0.00 266 S 7.57 4.51 0.00 3.66 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 0.00 267 E 7.88 4.23 0.00 1.95 1.85 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 2.34 2.45 0.00 * Residues marked with a * may have inaccurate shift predictions.