NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.3250 8.4444 120.2374 56.1079 30.5976 175.7843 8 W 4.6083 8.4799 133.5575 54.2002 29.5178 171.4009 9 V 3.7311 8.6037 125.6081 64.0284 32.1404 178.9533 10 G 3.8045 8.5833 108.7234 47.5516 0.0000 175.1531 11 F 3.4233 7.1068 121.5718 60.5172 39.3854 176.8316 12 Q 4.0844 7.5482 118.3301 57.5346 28.7035 176.5249 13 Q 4.2467 7.1072 114.9087 55.7258 29.2521 176.0594 14 F 4.5923 6.8226 116.5290 56.1162 39.8160 174.2197 15 P 4.3106 0.0000 0.0000 62.6225 33.1711 177.4220 16 A 3.8716 8.5163 121.7336 55.5679 18.1779 180.0862 17 A 4.2360 7.6919 119.3689 54.3084 18.4939 179.8633 18 T 3.6095 7.4624 114.3944 66.6373 68.4726 176.8909 19 Q 3.3821 7.5240 119.5493 58.5129 28.6412 178.1236 20 E 3.8416 7.7185 119.2465 59.5701 29.5740 179.8814 21 K 3.4331 7.4577 117.6758 59.1843 32.1248 179.2225 22 L 3.6239 7.6395 119.4134 57.9681 41.5561 179.7552 23 I 3.6447 7.8543 119.5927 64.4352 37.2006 178.1622 24 E 3.8579 7.7431 119.5103 59.0387 29.4298 178.8255 25 F 4.6646 7.6438 117.8661 60.2964 39.1835 177.9662 26 F 4.1566 8.2610 117.7223 60.4267 37.6489 177.9898 27 G 3.7200 8.2239 105.4232 47.6149 0.0000 175.6296 28 K 4.2311 7.6442 119.8591 58.9421 32.3829 178.6264 29 L 4.3137 7.6358 118.8683 57.3290 41.5776 178.7487 30 K 4.6062 7.8382 114.2819 57.4793 31.9149 177.3121 31 Q 4.5208 7.4409 114.0270 55.9689 29.9445 176.2737 32 K 4.3267 8.2040 116.8309 55.7330 32.0684 176.3985 33 D 4.4588 8.0576 116.3913 55.3510 38.3885 173.0151 34 M 4.3724 7.8398 119.5367 55.0881 32.8506 176.0835 35 N 5.1800 8.2999 119.3971 52.4155 40.8601 173.5928 36 S 4.3663 7.6545 111.4637 58.7702 65.6200 174.0431 37 M 4.9099 7.8288 116.2324 54.5931 34.6493 173.4123 38 T 4.9535 8.7429 117.3692 62.0336 71.2359 173.3920 39 V 4.6752 8.5335 127.6975 61.1869 33.3512 174.3528 40 L 4.6095 8.8329 131.3609 54.2692 42.6146 175.4065 41 V 4.7811 8.6151 126.0247 61.3821 33.4937 174.1055 42 L 4.9362 8.4472 128.1592 52.6521 45.2824 176.1731 43 G 3.9819 7.9172 108.3237 45.9172 0.0000 172.5346 44 K 4.5664 8.5094 119.9181 55.4292 32.8065 177.6222 45 G 3.6744 8.2262 109.4161 46.8056 0.0000 174.2243 46 G 3.9877 8.7962 109.4137 45.3111 0.0000 175.0706 47 V 3.7117 7.4238 111.0912 62.4977 32.2145 176.5619 48 G 3.9480 8.1124 108.3243 46.0321 0.0000 176.2564 49 K 3.9647 8.2426 120.6185 59.3591 32.2430 179.0291 50 S 4.3364 7.9736 114.9480 61.5871 62.7240 176.8030 51 S 4.2157 8.0160 117.5483 61.9178 62.6158 176.6032 52 T 4.2519 7.9169 118.0390 66.5508 68.0482 176.9141 53 V 3.6620 7.7980 119.7139 66.2308 31.6387 177.8308 54 N 4.6500 8.2057 117.5238 55.8417 38.1186 177.6656 55 S 4.2330 8.3458 115.8226 61.6632 63.1319 176.3349 56 L 4.3452 8.1071 120.2865 58.2221 41.8013 179.6439 57 I 4.4582 8.5196 119.9025 62.4176 36.7125 177.9893 58 G 3.6889 9.3087 106.9003 45.2085 0.0000 172.7882 59 E 4.7403 7.5456 115.4167 54.8002 32.2892 175.2596 60 Q 4.6371 8.4704 120.5056 56.3691 26.1026 175.7719 61 V 4.0137 7.8442 119.2610 62.9939 33.0194 175.7076 62 V 4.4108 7.8491 118.0220 60.3477 33.8292 174.7845 63 R 4.1008 8.2845 123.3723 55.8798 30.5850 175.6835 64 V 4.3657 8.1185 123.7300 60.9958 33.5050 174.7608 65 S 4.4463 8.2894 120.3477 56.3796 65.1090 172.2836 66 P 4.2993 0.0000 0.0000 64.0764 32.8344 176.4214 67 F 4.6417 8.0187 114.3281 57.6303 39.4893 177.3327 *71 G 3.9178 8.9496 118.8337 46.0379 0.0000 171.7404 72 L 4.6239 8.3587 114.8062 55.6410 42.6489 176.7143 73 R 4.5297 7.6464 116.5503 53.4271 31.8950 174.1468 74 P 4.4358 0.0000 0.0000 62.8007 32.4319 175.8264 75 V 4.1658 8.0249 120.8164 61.3339 34.6239 173.9064 76 M 4.8144 8.8470 127.6985 54.6121 33.8380 175.2865 77 V 4.3043 8.7640 125.4060 61.4361 34.2632 173.9798 78 S 5.2217 8.6022 124.3156 56.8834 64.6531 174.1488 79 R 4.4686 8.4449 122.9479 54.5031 33.8799 174.4730 80 T 4.8699 8.5074 119.5466 61.9320 70.5187 173.7251 81 M 4.5521 9.1387 125.6392 54.4381 34.6602 174.4427 82 G 4.1138 9.8818 115.6381 46.6329 0.0000 172.8809 83 G 3.9636 8.1958 104.0864 45.5902 0.0000 171.0741 84 F 4.7419 7.8779 122.3573 56.3774 42.6957 173.8407 85 T 4.6940 7.0872 122.1443 61.7454 71.1868 172.7816 86 I 4.3692 8.3826 128.4116 59.4734 39.8686 173.8227 87 N 5.3477 8.7626 127.4496 51.6825 40.9918 174.1042 88 I 4.9960 8.4759 123.7552 59.6224 40.9823 174.4193 89 I 4.6634 8.8982 129.1920 60.3044 38.8613 174.2597 90 D 5.2845 8.9132 127.3909 52.7038 43.1125 175.2131 91 T 4.9710 7.6671 113.0389 58.6530 71.7073 172.2796 92 P 4.3648 0.0000 0.0000 62.2433 31.9069 176.3513 93 G 3.8818 8.5295 108.3665 46.6547 0.0000 173.3014 94 L 4.4701 8.6219 120.8897 54.4526 42.0770 176.6193 95 V 4.8196 7.0772 117.8179 61.1078 34.2365 174.1126 96 E 4.5850 9.5097 123.0197 56.6409 32.9795 175.2410 97 A 3.4177 9.5315 127.1894 53.5999 16.1097 177.5847 98 G 3.8934 8.4882 103.9216 47.5399 0.0000 173.5842 99 Y 4.7348 7.3302 114.9507 55.1112 41.2631 175.4204 100 V 3.8177 8.4867 122.5034 63.2202 32.0773 175.2330 101 N 4.6328 9.0296 126.9420 53.1917 38.5141 175.1133 102 H 4.5180 8.6792 124.2111 58.1646 28.9580 177.8636 103 Q 3.9557 8.1660 119.7955 58.9675 28.6691 177.9645 104 A 4.0525 8.4391 121.7481 55.1818 18.3059 179.4524 105 L 4.0243 7.6864 117.4962 58.2650 42.2319 178.9234 106 E 4.0788 8.2656 118.2838 58.9208 29.4913 179.2194 107 L 4.1008 8.0450 119.5725 57.6149 41.4128 179.5112 108 I 3.8491 7.4173 119.2632 64.1475 37.5263 177.8175 109 K 4.0801 8.2656 120.6807 59.5946 31.2839 178.9968 110 G 3.6379 8.2232 105.8371 47.7490 0.0000 175.1521 111 F 4.1392 8.1651 120.5861 59.5543 39.6968 175.2942 112 L 4.5985 7.7108 116.5068 54.7904 43.3065 176.8217 113 V 3.7856 6.8686 119.3496 63.3182 31.3263 176.3790 114 N 4.3579 9.4671 120.8218 53.4358 37.2276 174.3184 115 R 4.3892 7.6555 117.8871 54.8732 31.9050 175.3822 116 T 4.7219 8.1171 117.8444 62.1767 69.7825 174.4135 117 I 4.0020 8.5868 129.2871 61.0918 37.6058 176.6617 118 D 4.5166 9.2082 128.1778 55.7195 42.0636 177.4927 119 V 4.6156 7.5420 116.7956 60.9256 35.4904 173.7863 120 L 4.9537 8.7663 129.0987 53.3430 44.6269 174.9511 121 L 4.9951 8.8819 126.5901 53.1895 43.8841 175.0438 122 Y 4.5765 9.0751 127.6574 57.0063 39.7533 174.1378 123 V 4.6786 7.8104 127.6630 61.4582 33.2971 174.2128 124 D 4.7474 8.7175 125.9507 52.7154 45.5734 173.8834 125 R 4.4742 8.3175 119.2810 55.5521 30.5083 177.1129 126 L 4.2038 8.9148 125.6753 57.1472 42.8278 177.1920 127 D 3.4287 7.4060 118.1348 52.6372 39.3806 176.3547 128 V 4.4707 7.2452 116.9530 62.6682 34.8121 173.8905 129 Y 4.4386 8.7392 123.0673 57.4980 38.0615 174.9329 130 R 4.4986 7.1431 114.5699 55.8250 31.6284 174.0585 131 V 4.5512 8.1490 111.1373 59.6026 35.7297 175.1438 132 D 4.9433 7.8012 121.4628 51.3457 42.3060 175.2528 133 E 3.9296 8.8916 117.5769 59.8882 29.4729 179.1693 134 L 3.9114 7.9765 119.7105 58.4800 42.1929 178.4588 135 D 4.4257 8.1345 118.2940 57.3082 40.6876 178.8434 136 K 3.9244 7.6910 119.1772 59.3957 32.2463 178.7657 137 Q 4.0308 8.4487 118.8178 59.0012 28.5855 179.4370 138 V 3.6140 8.0190 119.1183 66.0936 31.6371 178.0211 139 V 3.7006 7.5680 117.5240 66.4181 31.1119 178.1118 140 I 3.9414 8.0679 119.0864 64.3340 36.8710 178.2756 141 A 4.1379 8.1567 121.7137 55.2646 18.1921 179.8017 142 I 4.0047 8.2385 118.4745 64.6840 37.0995 178.9089 143 T 4.1253 8.0218 116.4926 66.9426 68.2251 177.0020 144 Q 4.1859 8.4150 118.8138 58.8519 28.6781 178.8028 145 T 3.9834 7.6164 116.0442 65.7767 68.8970 176.2204 146 F 4.7013 8.3518 116.3144 55.8063 41.3602 176.7629 147 G 4.1114 8.2081 105.8711 45.0347 0.0000 174.7292 148 K 4.2344 8.9028 120.0185 59.3233 31.5039 178.8244 149 E 4.2019 8.1567 117.4907 58.0539 29.0371 178.1990 150 I 3.6761 7.5778 118.8930 62.8209 37.7668 176.9511 151 W 5.0341 7.3602 119.4977 57.7941 29.2811 177.5155 152 C 4.4431 7.7732 114.8337 60.9196 27.9436 174.0045 153 K 4.6739 7.5653 119.5317 56.4359 33.2317 175.7091 154 T 5.0430 8.0078 115.9686 61.9224 71.4879 173.4556 155 L 5.0320 8.6587 124.6423 52.7903 45.0739 175.3158 156 L 4.7371 8.7528 126.2441 54.5094 43.5346 175.3720 157 V 4.6745 9.1301 127.2063 61.2305 34.0090 174.2816 158 L 5.0467 8.6271 130.0814 53.2626 43.3338 176.9164 159 T 4.5307 8.7293 116.3543 61.2783 71.2390 174.0684 160 H 4.3543 9.0066 114.0165 55.4383 26.3022 176.9997 161 A 4.2237 8.1907 123.9252 55.1444 18.3104 179.0947 162 Q 4.3055 8.1432 115.2816 56.1073 28.9812 175.2796 163 F 4.4377 7.9646 118.6059 57.6627 39.9670 175.0689 164 S 4.1654 7.7672 120.9265 55.0732 62.7108 171.8061 165 P 3.6322 0.0000 0.0000 62.3622 30.9855 175.0580 166 P 4.3750 0.0000 0.0000 64.6058 31.6380 176.3605 167 D 4.8022 7.9229 118.0678 53.0722 40.3624 175.8074 168 E 3.6725 8.5022 114.1837 57.0479 26.0816 174.6232 169 L 4.3679 7.2126 116.8817 53.0224 45.7602 174.9488 170 S 4.5844 8.4462 121.1456 57.7070 65.7548 174.6649 171 Y 3.9944 8.3890 122.8469 60.9017 38.5972 177.7042 172 E 3.9060 8.2456 119.8141 59.2165 29.9481 178.6699 173 T 3.8287 7.5972 114.6877 66.5490 68.6796 176.3416 174 F 4.0034 8.4845 123.0458 61.2976 39.4061 177.2815 175 S 4.1688 8.1254 114.0755 61.0913 63.0264 176.5480 176 S 4.1137 8.0320 118.0018 61.0089 62.7536 176.4297 177 K 3.8598 7.8358 123.1143 59.0278 31.9164 178.9243 178 R 3.5979 7.3826 118.6062 59.2230 29.9707 178.2723 179 S 4.0442 7.9899 115.1019 61.7772 62.8082 176.1716 180 D 4.2873 8.0424 120.1867 57.6333 40.9369 178.1255 181 S 4.0366 7.9336 115.4313 62.1030 62.9069 177.1402 182 L 3.9739 7.7471 120.5063 57.6564 41.4741 179.4465 183 L 4.0687 8.0842 119.0886 57.9412 41.5778 179.8484 184 K 3.7909 8.2856 118.4693 59.4455 31.8347 179.6810 185 T 3.7468 7.7284 116.3000 66.3425 68.4547 176.6865 186 I 3.0232 7.9032 122.1167 64.2042 36.7577 178.2120 187 R 3.2424 7.3630 118.7830 59.1222 29.6700 178.2419 188 A 3.9389 7.5848 120.4213 55.2542 18.2158 179.9607 189 G 3.5120 7.8297 102.9642 47.2097 0.0000 175.0423 190 S 4.5210 7.7768 115.0844 58.1030 64.7821 175.5814 191 K 4.0954 7.2028 120.3404 58.5828 31.0420 174.0327 192 M 4.4324 7.5272 123.4798 55.0939 33.8026 177.9146 193 R 4.3070 8.3627 121.4922 54.9884 32.6690 177.8628 194 K 3.9763 8.5729 120.8061 60.7731 31.8982 178.7057 195 Q 4.1223 8.0619 120.8291 58.4563 28.8838 177.5086 196 E 3.9791 8.1178 118.8832 59.0964 30.0248 178.1967 197 F 4.2933 8.6065 121.2734 61.2285 39.1719 176.8611 198 E 4.0523 8.4924 116.1726 58.0492 29.2093 177.4260 199 D 5.2482 7.4058 118.8173 54.0814 41.4602 176.7709 200 S 4.3156 7.5498 114.0396 57.8615 64.8879 174.2052 201 A 3.4792 6.8742 123.3073 52.7756 15.8949 177.1122 202 I 3.8385 7.0004 122.7538 61.0622 38.1962 178.1302 203 A 4.3258 8.6751 129.0818 51.5684 20.3021 175.7719 204 V 4.6707 8.2294 119.3881 61.2674 33.2918 175.3520 205 V 4.6146 8.7527 121.3914 59.8198 34.8293 174.3312 206 Y 5.1479 8.8069 120.5194 56.3993 40.3385 174.9650 207 A 2.8498 8.6241 123.4304 49.4572 22.7339 174.8306 208 E 4.4361 5.9000 121.6000 54.5007 31.5355 175.7567 209 N 4.8235 8.7043 124.9420 54.8435 39.5010 176.3615 210 S 4.1471 8.4057 114.1100 58.1980 62.7706 175.2207 211 G 3.8262 8.8951 116.3884 48.7960 0.0000 174.4322 212 R 4.0211 7.9293 116.2584 57.4798 30.0880 175.8452 213 C 4.6642 7.7203 120.5849 58.7967 32.1106 173.3970 214 S 4.1861 9.2442 122.0091 59.3860 63.2000 174.2550 215 K 4.8431 8.6380 123.2845 55.6067 33.3842 177.3370 216 N 4.7463 8.2538 121.2946 52.6503 39.1728 175.3385 217 D 4.6925 8.6263 120.8690 54.2102 39.6874 176.4702 218 K 4.4080 7.7395 116.5169 56.0651 33.1618 176.3236 219 D 4.5149 8.2722 116.3300 54.8239 38.4537 173.4045 220 E 4.2277 7.8022 119.4253 55.5005 31.2759 176.1077 221 K 4.4415 8.6256 123.1485 56.8315 33.0302 175.6225 222 A 5.4348 8.5534 127.3412 49.9978 21.5940 176.2621 223 L 4.3376 8.7474 120.9809 53.2987 42.6598 176.5595 224 P 4.1896 0.0000 0.0000 65.5146 31.0860 177.5606 225 N 4.4172 7.8789 113.3670 53.1624 37.7350 175.6618 226 G 4.0509 8.2189 106.8229 45.3178 0.0000 173.4835 227 E 4.2873 8.4507 120.2583 54.7255 30.8822 175.2864 228 A 4.5115 8.5089 125.2406 52.1061 19.1012 178.2946 229 W 4.3666 8.9300 123.2663 60.1605 28.4027 178.7958 230 I 3.2511 6.8458 120.5430 63.4495 36.4687 176.0172 231 P 4.3315 0.0000 0.0000 65.9633 31.3488 178.0293 232 N 4.2714 8.0208 114.5008 56.5497 38.4678 177.2303 233 L 4.0537 8.1630 121.4258 58.2363 42.2178 179.2180 234 V 3.8168 7.7253 117.7746 65.4754 30.9224 177.9422 235 K 2.7060 7.9047 119.7206 58.9385 32.0586 178.7243 236 A 3.9276 7.6864 120.5774 55.0688 18.2432 179.4796 237 I 3.6444 8.1375 118.7248 65.1661 37.0754 178.6478 238 T 3.8883 7.8203 114.8811 66.7376 68.6053 175.6521 239 D 4.5457 7.5954 119.7156 56.6981 40.7583 179.0105 240 V 3.5961 7.7145 118.1852 65.8387 31.3846 177.8689 241 A 4.2451 8.1548 120.6254 54.6446 18.5549 177.9537 242 T 4.5615 7.4484 110.2889 63.6143 70.6579 175.5515 243 N 4.3460 7.8604 116.8279 53.5143 37.0371 175.2118 244 Q 3.5783 8.1189 116.3577 56.8644 27.0840 174.0124 245 R 4.1442 7.6198 116.7863 55.6853 30.6244 176.8279 246 K 4.0356 8.4225 120.3588 56.1682 32.5852 177.1274 247 A 4.1635 8.4547 125.1398 52.4191 19.6943 177.4486 248 I 4.2125 8.5471 120.9521 60.1846 37.6742 173.8172 249 H 5.1609 8.5111 126.5119 54.7294 30.7111 174.1606 250 V 4.3328 8.3099 126.2655 61.6323 33.2630 175.5057 251 D 4.3406 8.3982 126.0417 53.6599 39.4507 175.0047 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 7 E 8.44 4.32 0.00 2.04 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 2.27 2.35 0.00 8 W 8.48 4.61 0.00 3.58 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 9 V 8.60 3.73 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.94 0.00 0.00 10 G 8.58 3.80 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 0.00 0.00 0.00 11 F 7.11 3.42 0.00 1.58 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 12 Q 7.55 4.08 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.59 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 13 Q 7.11 4.25 0.00 1.83 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 14 F 6.82 4.59 0.00 2.81 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.31 0.00 2.04 2.07 0.00 3.57 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 16 A 8.52 3.87 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.69 4.24 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 18 T 7.46 3.61 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 0.39 0.00 0.00 19 Q 7.52 3.38 0.00 1.83 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.71 0.00 0.00 0.00 0.00 0.00 1.58 2.29 0.00 20 E 7.72 3.84 0.00 2.12 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 2.26 2.30 0.00 21 K 7.46 3.43 0.00 1.69 1.48 0.00 1.45 0.00 0.00 1.50 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.20 1.08 7.81 22 L 7.64 3.62 0.00 1.56 1.40 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.85 3.64 1.91 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.07 0.91 0.00 0.00 24 E 7.74 3.86 0.00 1.94 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 2.22 0.00 25 F 7.64 4.66 0.00 2.96 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 26 F 8.26 4.16 0.00 2.89 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.22 3.72 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 0.00 0.00 0.00 28 K 7.64 4.23 0.00 2.10 2.13 0.00 1.90 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.70 7.81 29 L 7.64 4.31 0.00 2.19 1.92 1.20 1.10 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 30 K 7.84 4.61 0.00 2.02 1.96 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.88 1.83 7.81 31 Q 7.44 4.52 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.12 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 32 K 8.20 4.33 0.00 1.87 1.86 0.00 1.90 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.58 7.81 33 D 8.06 4.46 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 34 M 7.84 4.37 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 35 N 8.30 5.18 0.00 2.48 2.83 0.00 0.00 6.70 7.46 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 36 S 7.65 4.37 0.00 3.54 3.41 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 37 M 7.83 4.91 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.73 0.00 38 T 8.74 4.95 4.45 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 1.21 0.00 0.00 39 V 8.53 4.68 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.86 0.00 0.00 76 M 8.85 4.81 0.00 2.37 2.31 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 77 V 8.76 4.30 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 0.88 0.00 0.00 0.93 0.00 0.00 78 S 8.60 5.22 0.00 3.69 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 79 R 8.44 4.47 0.00 0.67 0.86 0.00 3.21 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.97 0.00 80 T 8.51 4.87 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 1.20 0.00 0.00 81 M 9.14 4.55 0.00 1.95 2.28 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.48 0.00 82 G 9.88 4.11 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 0.00 0.00 0.00 83 G 8.20 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 0.00 0.00 0.00 84 F 7.88 4.74 0.00 3.06 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 85 T 7.09 4.69 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 1.03 0.00 0.00 86 I 8.38 4.37 1.87 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 1.20 1.48 0.48 0.00 0.00 87 N 8.76 5.35 0.00 2.63 2.66 0.00 0.00 6.32 6.95 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 88 I 8.48 5.00 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.71 0.95 0.00 0.00 89 I 8.90 4.66 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.95 0.95 0.00 0.00 90 D 8.91 5.28 0.00 2.77 2.46 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 91 T 7.67 4.97 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 1.24 0.00 0.00 92 P 0.00 4.36 0.00 2.20 2.09 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 93 G 8.53 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.62 4.47 0.00 1.82 1.77 1.08 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 95 V 7.08 4.82 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 0.82 0.00 0.00 0.97 0.00 0.00 96 E 9.51 4.58 0.00 2.00 1.75 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 2.20 2.22 0.00 97 A 9.53 3.42 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.49 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 99 Y 7.33 4.73 0.00 3.05 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 0.00 100 V 8.49 3.82 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 0.76 0.00 0.00 1.01 0.00 0.00 101 N 9.03 4.63 0.00 2.87 2.87 0.00 0.00 6.80 8.33 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 0.00 102 H 8.68 4.52 0.00 3.24 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 8.17 3.96 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 104 A 8.44 4.05 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 0.00 105 L 7.69 4.02 0.00 2.04 1.90 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.27 4.08 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 107 L 8.05 4.10 0.00 1.89 1.73 0.99 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.42 3.85 2.01 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 1.43 0.68 1.10 0.00 0.00 109 K 8.27 4.08 0.00 1.83 1.98 0.00 1.33 0.00 0.00 1.13 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.43 7.81 110 G 8.22 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 8.17 4.14 0.00 3.16 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.71 4.60 0.00 1.87 1.76 1.28 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 113 V 6.87 3.79 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 0.69 0.00 0.00 0.90 0.00 0.00 114 N 9.47 4.36 0.00 2.76 3.00 0.00 0.00 6.97 7.54 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 0.00 115 R 7.66 4.39 0.00 1.96 1.76 0.00 3.02 0.00 0.00 3.05 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.41 0.00 116 T 8.12 4.72 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 0.00 117 I 8.59 4.00 1.95 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 1.15 0.50 0.84 0.00 0.00 118 D 9.21 4.52 0.00 2.66 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 0.00 119 V 7.54 4.62 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 1.08 0.00 0.00 0.98 0.00 0.00 120 L 8.77 4.95 0.00 1.56 1.32 0.75 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.88 5.00 0.00 1.59 1.60 0.98 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 9.08 4.58 0.00 3.30 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 V 7.81 4.68 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.87 0.00 0.00 124 D 8.72 4.75 0.00 2.68 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 0.00 125 R 8.32 4.47 0.00 1.64 1.96 0.00 3.18 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 126 L 8.91 4.20 0.00 1.75 1.91 1.11 1.58 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 0.00 127 D 7.41 3.43 0.00 1.80 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 0.00 0.00 0.00 128 V 7.25 4.47 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.87 0.00 0.00 129 Y 8.74 4.44 0.00 3.03 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 0.00 130 R 7.14 4.50 0.00 1.87 1.91 0.00 2.99 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 131 V 8.15 4.55 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 0.74 0.00 0.00 0.88 0.00 0.00 132 D 7.80 4.94 0.00 2.99 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 0.00 133 E 8.89 3.93 0.00 2.07 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 2.37 2.43 0.00 134 L 7.98 3.91 0.00 1.71 1.86 0.93 1.18 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 0.00 135 D 8.13 4.43 0.00 2.85 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 0.00 136 K 7.69 3.92 0.00 1.88 1.91 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 137 Q 8.45 4.03 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.60 0.00 0.00 0.00 0.00 0.00 2.56 2.58 0.00 138 V 8.02 3.61 2.34 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 1.26 0.00 0.00 1.04 0.00 0.00 139 V 7.57 3.70 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 0.52 0.00 0.00 0.60 0.00 0.00 140 I 8.07 3.94 1.92 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 1.62 0.65 0.96 0.00 0.00 141 A 8.16 4.14 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 8.24 4.00 2.33 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.99 0.62 0.00 0.00 143 T 8.02 4.13 4.55 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 1.41 0.00 0.00 144 Q 8.41 4.19 0.00 2.05 2.20 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 2.44 2.56 0.00 145 T 7.62 3.98 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 0.42 0.00 0.00 146 F 8.35 4.70 0.00 2.95 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 G 8.21 4.11 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 0.00 0.00 0.00 148 K 8.90 4.23 0.00 1.91 2.07 0.00 1.84 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.82 1.66 7.81 149 E 8.16 4.20 0.00 2.07 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 2.42 2.46 0.00 150 I 7.58 3.68 1.60 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.68 -0.04 0.00 0.00 151 W 7.36 5.03 0.00 3.42 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 0.00 152 C 7.77 4.44 0.00 3.15 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 0.00 153 K 7.57 4.67 0.00 1.61 1.86 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.50 7.81 154 T 8.01 5.04 4.61 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 1.47 0.00 0.00 155 L 8.66 5.03 0.00 1.60 1.56 0.98 0.38 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 0.00 156 L 8.75 4.74 0.00 1.85 1.65 1.16 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 157 V 9.13 4.67 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 0.88 0.00 0.00 0.95 0.00 0.00 158 L 8.63 5.05 0.00 1.30 1.52 0.73 0.39 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 0.00 159 T 8.73 4.53 4.13 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 1.17 0.00 0.00 160 H 9.01 4.35 0.00 3.35 3.42 0.00 5.91 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.19 4.22 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 0.00 162 Q 8.14 4.31 0.00 2.01 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 163 F 7.96 4.44 0.00 2.99 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 7.77 4.17 0.00 3.66 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 3.63 0.00 2.23 1.64 0.00 3.56 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.91 0.00 166 P 0.00 4.38 0.00 2.21 2.24 0.00 4.00 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 167 D 7.92 4.80 0.00 2.83 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 E 8.50 3.67 0.00 2.16 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 2.21 2.29 0.00 169 L 7.21 4.37 0.00 1.61 1.57 1.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.45 4.58 0.00 4.13 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 Y 8.39 3.99 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.25 3.91 0.00 2.19 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 2.39 2.45 0.00 173 T 7.60 3.83 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 174 F 8.48 4.00 0.00 3.10 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 0.00 175 S 8.13 4.17 0.00 4.15 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 0.00 176 S 8.03 4.11 0.00 4.08 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 K 7.84 3.86 0.00 1.87 1.71 0.00 1.58 0.00 0.00 1.45 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.35 7.81 178 R 7.38 3.60 0.00 1.34 1.77 0.00 3.04 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 179 S 7.99 4.04 0.00 4.08 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 0.00 180 D 8.04 4.29 0.00 2.91 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 0.00 181 S 7.93 4.04 0.00 4.02 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 0.00 182 L 7.75 3.97 0.00 1.68 1.71 0.90 0.78 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 L 8.08 4.07 0.00 1.73 1.95 0.99 0.81 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 0.00 184 K 8.29 3.79 0.00 1.91 1.72 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.33 1.49 7.81 185 T 7.73 3.75 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 1.11 0.00 0.00 186 I 7.90 3.02 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.83 0.17 0.00 0.00 187 R 7.36 3.24 0.00 0.67 1.35 0.00 2.32 0.00 0.00 2.57 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.88 0.00 188 A 7.58 3.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 G 7.83 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 7.78 4.52 0.00 4.02 3.39 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 0.00 191 K 7.20 4.10 0.00 1.92 2.25 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.41 7.81 192 M 7.53 4.43 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 193 R 8.36 4.31 0.00 1.88 1.85 0.00 3.17 0.00 0.00 3.40 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 194 K 8.57 3.98 0.00 2.00 2.12 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.57 7.81 195 Q 8.06 4.12 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 196 E 8.12 3.98 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 197 F 8.61 4.29 0.00 3.14 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 E 8.49 4.05 0.00 2.23 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 0.00 2.59 2.35 0.00 199 D 7.41 5.25 0.00 2.73 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 0.00 200 S 7.55 4.32 0.00 4.01 3.97 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 0.00 201 A 6.87 3.48 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 I 7.00 3.84 1.78 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 0.96 0.00 0.00 203 A 8.68 4.33 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 0.00 204 V 8.23 4.67 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 0.41 0.00 0.00 0.89 0.00 0.00 205 V 8.75 4.61 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 0.70 0.00 0.00 0.95 0.00 0.00 206 Y 8.81 5.15 0.00 2.82 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 0.00 207 A 8.62 2.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 E 5.90 4.44 0.00 1.74 1.83 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 2.33 2.25 0.00 209 N 8.70 4.82 0.00 2.76 2.95 0.00 0.00 7.09 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 0.00 210 S 8.41 4.15 0.00 3.92 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 G 8.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 R 7.93 4.02 0.00 1.83 2.01 0.00 3.39 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 213 C 7.72 4.66 0.00 3.13 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 0.00 214 S 9.24 4.19 0.00 3.92 4.01 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 0.00 215 K 8.64 4.84 0.00 1.66 1.77 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.42 1.38 7.81 216 N 8.25 4.75 0.00 2.81 2.93 0.00 0.00 6.94 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 0.00 217 D 8.63 4.69 0.00 2.79 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 K 7.74 4.41 0.00 1.80 1.75 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.33 7.81 219 D 8.27 4.51 0.00 2.80 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 0.00 220 E 7.80 4.23 0.00 2.07 1.75 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 2.24 2.24 0.00 221 K 8.63 4.44 0.00 1.49 2.02 0.00 1.72 0.00 0.00 2.13 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.44 7.81 222 A 8.55 5.43 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 L 8.75 4.34 0.00 1.76 1.59 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 224 P 0.00 4.19 0.00 1.31 1.63 0.00 3.42 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.73 0.00 225 N 7.88 4.42 0.00 2.80 2.92 0.00 0.00 6.26 7.00 0.00 0.00 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 G 8.22 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 0.00 0.00 0.00 227 E 8.45 4.29 0.00 2.31 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 2.31 2.27 0.00 228 A 8.51 4.51 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 0.00 229 W 8.93 4.37 0.00 3.81 3.39 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 0.00 230 I 6.85 3.25 1.25 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.01 0.45 0.00 0.00 231 P 0.00 4.33 0.00 2.28 2.20 0.00 3.50 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.01 0.00 232 N 8.02 4.27 0.00 3.06 2.99 0.00 0.00 6.75 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 L 8.16 4.05 0.00 2.17 1.93 1.02 0.97 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 0.00 234 V 7.73 3.82 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.09 0.00 0.00 235 K 7.90 2.71 0.00 0.96 1.57 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.17 0.82 7.81 236 A 7.69 3.93 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 0.00 237 I 8.14 3.64 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.74 0.99 0.00 0.00 238 T 7.82 3.89 4.49 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 1.24 0.00 0.00 239 D 7.60 4.55 0.00 2.93 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 V 7.71 3.60 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 1.02 0.00 0.00 1.01 0.00 0.00 241 A 8.15 4.25 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 T 7.45 4.56 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 1.23 0.00 0.00 243 N 7.86 4.35 0.00 2.85 3.10 0.00 0.00 6.97 6.69 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 0.00 244 Q 8.12 3.58 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 245 R 7.62 4.14 0.00 1.91 1.87 0.00 3.34 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 246 K 8.42 4.04 0.00 1.75 1.76 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.44 7.81 247 A 8.45 4.16 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 0.00 248 I 8.55 4.21 1.85 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 1.08 0.85 1.01 0.00 0.00 249 H 8.51 5.16 0.00 3.13 3.20 0.00 5.73 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 0.00 250 V 8.31 4.33 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 0.90 0.00 0.00 1.10 0.00 0.00 251 D 8.40 4.34 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.