NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4188 8.1233 122.4608 51.8816 20.2840 175.5632 3 E 5.0378 8.8002 120.8912 53.5267 33.8946 173.2851 4 L 4.8296 9.6124 124.4844 53.6194 45.8799 175.7335 5 R 5.3069 9.6953 124.7498 53.7305 33.7397 174.9604 *7 A 4.3622 8.1946 120.6653 52.6844 20.1859 175.4315 8 T 5.2666 8.7695 119.0044 60.0104 71.2701 172.1777 9 T 5.2471 8.3950 115.1092 61.9985 71.5865 174.5050 10 T 4.3030 8.8832 123.9135 67.3986 68.3481 176.8078 11 S 4.1832 8.1201 114.7677 62.0599 63.0945 176.7668 12 T 4.0408 7.8042 117.6329 66.7936 68.3191 175.7956 13 D 4.4101 9.0824 121.0816 57.8929 40.9488 178.2151 14 N 4.5287 8.2044 115.2008 55.5892 38.5758 177.0227 15 T 4.1203 7.9414 111.3715 62.7851 69.0899 175.6887 16 G 4.1211 8.3701 109.5110 45.1523 0.0000 174.7468 17 L 3.7418 7.8466 122.1386 58.1358 41.9003 178.9900 18 L 3.5780 7.5584 118.2327 57.6639 41.3155 178.8061 19 D 4.6419 8.0671 118.3710 57.6407 40.9076 179.1330 20 V 3.5546 7.4685 118.5673 65.8208 31.4250 178.1737 21 L 4.2979 8.0279 118.7203 57.6910 41.4389 178.8985 22 A 4.0876 8.4045 121.1457 55.1842 18.3413 177.7822 23 P 4.2482 0.0000 0.0000 65.8193 31.4375 178.7662 24 A 4.1561 7.8359 118.2834 55.3607 17.9339 179.1095 25 Y 3.2662 8.3484 118.5145 60.2067 38.6483 177.7415 26 K 4.2012 8.3867 122.5262 58.6413 32.0231 178.7759 27 K 3.8840 7.7066 118.9499 59.7023 32.3576 178.3639 28 D 4.5766 7.7856 116.7375 56.4642 40.9045 176.9804 29 T 4.2234 7.1338 109.5735 60.4284 69.7990 174.7955 30 G 3.8492 8.1460 108.9900 45.0048 0.0000 173.5948 31 V 3.9965 6.8181 119.9664 62.4439 33.3284 174.4283 32 D 4.9833 8.7566 127.6158 53.0913 42.0687 175.3980 33 L 4.6674 8.6476 126.7483 54.6368 43.0351 175.9321 34 K 4.8370 9.3584 125.9806 54.3404 35.4146 175.2112 35 W 5.3740 8.0527 120.0718 55.0848 31.5272 174.2771 36 V 4.4589 8.6588 114.1448 59.6232 34.2806 174.5244 37 A 5.0736 8.7692 126.7533 50.9999 20.1110 175.5866 38 V 4.6012 8.4155 116.8616 60.3281 36.1708 176.1181 39 G 4.0390 8.6255 108.9350 46.0756 0.0000 174.6578 40 T 3.9241 8.8438 117.5725 66.7167 68.3974 176.8466 41 G 3.7096 8.1313 106.6449 48.0811 0.0000 175.1376 42 N 4.3674 8.1783 118.3103 55.8883 38.7536 177.2286 43 A 4.0136 8.5249 122.5078 55.2364 18.4258 179.7181 44 L 3.7781 8.1594 117.7861 57.5147 41.5819 179.5998 45 K 3.8686 8.5114 120.0557 59.5637 32.1766 178.4358 46 L 4.0545 8.5312 119.7121 58.2080 41.6984 180.0623 47 G 3.8324 8.0401 106.1454 47.2785 0.0000 175.4613 48 E 3.6708 8.2886 121.1731 58.7377 29.6856 177.9143 49 N 4.4442 8.5881 114.0688 53.0579 39.4966 173.8181 50 C 4.0132 7.9304 116.5048 58.8192 37.6232 173.1587 51 D 4.6888 8.2057 116.6213 54.1275 42.8000 176.8295 52 V 4.6258 7.4092 110.4771 59.9385 36.0546 174.3610 53 D 4.8158 9.2495 120.3929 56.0503 42.1910 177.2388 54 V 4.9639 7.6661 108.8081 59.6909 36.3868 174.8558 55 V 4.6981 8.4900 121.3324 61.3652 34.5863 174.2762 56 F 5.2203 9.3227 128.7855 56.9295 41.5673 173.2137 57 V 4.7553 8.5318 119.7355 59.0099 35.9420 174.4940 58 H 5.0080 8.2547 116.5036 55.0117 29.7211 175.9430 59 A 4.5900 9.0143 123.2342 49.2931 20.8708 175.3372 60 P 4.7640 0.0000 0.0000 64.7850 31.8047 177.7734 61 K 3.8737 7.9987 117.5974 59.7303 32.1757 178.8029 62 V 3.8699 7.7787 117.8450 65.9350 31.5480 177.6636 63 E 4.0332 8.3861 118.7685 59.4459 29.3469 179.3165 64 L 4.1012 8.2478 119.1657 57.7522 41.6574 179.4006 65 E 4.0069 8.1839 118.2456 59.5550 29.1509 178.7048 66 Y 4.2337 8.2522 119.6568 60.5386 38.7254 178.4456 67 V 3.8711 7.9996 120.6182 65.6096 31.5492 177.7121 68 E 3.8538 7.9710 117.5579 59.1011 29.5677 178.4859 69 K 3.8288 8.1419 117.3290 57.2773 32.0572 178.1157 70 G 3.7972 7.7639 107.7770 45.0022 0.0000 174.5350 71 F 4.4832 7.1046 118.8457 59.3730 39.7331 175.6781 72 G 4.8607 7.8172 104.4143 44.3904 0.0000 171.9255 73 I 4.7696 8.4207 113.9073 58.6984 41.5366 173.9303 74 D 4.4371 8.9342 118.2478 54.8045 38.3321 174.4137 75 R 4.2211 8.2171 118.0372 57.4920 30.9693 176.0051 76 T 4.5663 9.2703 122.8069 61.1392 71.8913 171.5541 77 P 4.8633 0.0000 0.0000 63.1685 32.0855 176.7550 78 V 4.5609 9.1514 123.7728 62.1529 35.1623 173.4611 *80 Y 4.4985 8.4509 118.7304 58.6494 40.0863 174.7677 81 N 3.5668 8.1507 121.7977 53.9413 36.7208 173.2564 82 D 4.2613 7.1771 119.3983 53.7319 41.2091 177.3330 83 F 5.0769 8.4690 118.7743 57.3488 40.0951 175.6074 84 V 4.6812 8.9908 114.4883 59.8613 36.5137 174.2366 85 I 4.8789 8.4664 123.3610 59.9138 39.3356 175.1354 86 I 4.8506 8.3729 119.4924 59.0123 41.2958 174.2257 87 G 4.4129 8.0969 109.5831 45.9029 0.0000 172.8039 88 N 5.4315 8.4045 116.5361 51.2844 38.3032 174.3474 89 P 4.4446 0.0000 0.0000 65.6942 31.5206 178.8834 90 S 4.1271 8.1833 111.7241 60.4438 63.1795 174.8924 91 F 4.5270 8.4292 119.7842 57.3849 39.0650 177.2692 92 K 3.9522 8.0475 123.2843 59.0641 32.2830 177.3101 93 Q 4.4914 7.8337 114.7563 55.1238 29.6415 176.7481 94 K 3.5725 7.6401 120.2260 59.0076 31.9556 177.5342 95 F 5.0234 7.4954 114.8678 56.8292 39.6017 175.3761 96 T 3.7363 7.5605 111.2140 63.6096 68.9955 173.4004 97 G 3.4097 8.5843 114.3623 46.0850 0.0000 172.2465 *99 S 4.3294 7.3033 115.2072 58.1691 66.0541 175.2278 100 V 3.3179 8.8219 115.3154 64.2647 30.9967 178.7427 101 A 3.7793 7.6991 119.9885 55.2570 18.2538 179.4241 102 E 3.9032 7.9206 116.9032 59.3404 29.4639 179.3765 103 A 4.0521 8.0475 120.8798 55.2814 18.4828 179.7716 104 F 3.7307 8.6106 116.6616 60.4529 38.8555 177.9510 105 K 4.0237 8.4716 118.6021 59.5457 31.8620 179.1304 106 L 3.9909 8.0471 120.4605 58.0068 42.0494 178.8246 107 I 3.6361 8.1571 120.5533 64.5292 36.8081 178.2459 108 E 2.6082 7.8995 117.8443 58.6293 29.2392 179.0559 109 K 3.8878 7.7292 119.9682 58.9916 32.4434 177.9091 110 E 4.1882 8.3686 115.9285 55.3459 30.5971 175.9155 111 Q 2.5200 6.8940 117.1413 56.5699 26.7991 174.2740 112 V 4.1450 7.3266 109.5814 60.4714 33.2194 178.2616 113 K 4.4813 8.8622 123.1842 57.4642 33.2383 175.6317 114 F 5.1273 9.6243 126.0073 56.7401 43.3355 172.8939 115 V 4.5377 7.7297 126.3159 61.1385 33.1717 174.5315 116 S 4.8065 8.9874 123.6046 56.5754 64.3092 174.6271 117 R 3.6634 8.9376 125.2704 57.8239 31.2185 178.1952 118 G 4.0010 7.8403 105.3040 46.2322 0.0000 172.3709 119 D 5.0260 7.6499 119.3709 50.9773 42.2453 173.8092 120 K 4.4779 8.3481 118.6990 56.3568 33.7755 176.3561 121 S 4.7383 8.3272 116.4336 56.2373 66.1901 177.2656 122 G 3.8463 8.4521 110.6995 48.6761 0.0000 176.0162 123 T 3.7576 7.9747 117.6287 66.4584 68.5204 176.0104 124 H 4.3004 8.2620 120.0436 59.4464 29.8566 177.2732 125 S 4.0625 8.5554 117.2357 61.6200 62.7476 176.5394 126 K 3.6682 8.3844 122.3957 59.4682 31.7466 178.3535 127 E 3.8725 8.0982 119.2931 59.4165 29.6628 178.8850 128 R 4.2011 8.4911 118.5835 59.3343 30.1224 178.4734 129 E 3.8934 8.3977 119.2382 59.4783 29.5029 179.1909 130 V 3.3122 7.5541 117.9795 65.5272 31.4528 177.9508 131 W 4.4497 8.0342 118.7798 59.7331 28.8264 178.4771 132 K 3.9533 8.3257 118.3900 59.4579 31.3168 178.8242 133 E 3.8556 7.8455 117.6810 59.3983 29.6660 178.4712 134 A 4.1660 8.1441 119.5879 54.4279 18.5945 178.0651 135 L 4.5877 8.4492 114.0336 53.4779 43.8978 177.8361 136 G 3.8819 9.0745 106.4389 44.8692 0.0000 172.7898 137 K 4.1173 7.0701 116.8707 56.6583 34.3270 173.7230 138 I 4.0264 7.6477 119.4742 59.5910 38.5230 173.8279 139 P 3.7013 0.0000 0.0000 62.7749 30.5705 173.9392 140 E 4.3843 8.2990 122.4932 57.3097 31.2865 176.3546 141 K 4.4668 7.6112 113.8070 55.8480 32.9484 176.3143 142 E 3.9867 7.4529 119.6860 56.0055 29.8130 178.3011 143 S 4.1190 8.4575 116.9267 60.4564 63.5672 175.0977 144 W 4.5175 7.5184 116.6879 56.9038 28.7618 174.3836 145 Y 4.8320 6.7126 121.3982 56.1659 39.2221 174.8175 146 I 4.1894 8.2202 128.9741 59.4654 39.5414 174.8605 147 E 4.4160 8.4435 127.4782 55.5662 29.4318 176.5581 148 A 3.9545 9.2882 128.1469 51.7984 19.6660 177.8061 149 G 3.8649 8.3914 102.7761 46.3832 0.0000 173.1407 150 Q 4.7194 7.8114 116.1498 53.5733 34.5336 178.5424 151 G 4.0986 8.0420 113.0300 45.4353 0.0000 175.2668 *153 L 4.2132 8.9265 126.3127 54.6724 43.7319 177.9631 154 A 4.0434 7.9751 119.7315 55.5506 18.2865 179.5494 155 T 3.7635 8.0661 114.2426 66.7815 68.3790 176.9928 156 I 3.5647 7.5945 121.2940 64.2993 37.0857 178.0419 157 N 4.4108 8.1852 117.4011 56.3295 38.3167 177.5491 158 I 3.6756 7.9984 121.1080 64.2401 37.1109 178.2897 159 A 3.8922 8.0251 121.6366 55.0896 18.2893 179.2238 160 E 3.8874 8.3005 117.9090 59.6703 29.5269 178.9861 161 E 4.0838 8.4204 117.5958 58.9030 29.5672 178.3457 162 Q 4.3587 8.1211 115.4384 54.3908 29.8307 175.5137 163 K 3.9192 7.9411 118.7029 57.9150 30.2260 173.4150 164 G 4.3779 8.3078 104.8327 44.8094 0.0000 172.4836 165 L 4.9011 8.3247 118.8373 53.6572 44.8230 175.7839 166 T 3.8350 7.9958 113.1346 60.8579 71.3086 171.6931 167 L 5.0865 8.1859 127.6019 54.0711 43.5774 175.4102 168 T 4.9789 8.9506 119.9220 60.2056 71.4260 172.8483 169 D 4.7017 8.9550 126.1520 53.0809 40.4339 177.2344 170 R 4.0640 8.7315 121.9251 59.6474 29.9633 178.8433 171 G 3.8503 8.7739 105.7979 48.7642 0.0000 175.7284 172 T 3.9621 8.3870 118.6177 65.8162 68.4457 176.6950 173 F 4.3425 8.1091 122.5990 61.3465 39.3984 177.3378 174 I 3.5558 8.1743 119.9835 63.8879 36.6633 177.9570 175 K 3.7632 7.9139 119.6706 59.8621 32.1280 177.5831 176 Y 4.1809 8.1661 119.5096 60.9044 38.6362 177.6750 177 E 3.8223 8.0089 119.5043 59.5137 29.3874 179.4206 178 S 4.1383 8.1825 113.9441 60.8956 62.7372 175.1220 179 N 4.9320 7.2333 118.4629 52.2505 38.9577 173.2134 180 H 4.3604 7.9034 119.3654 53.7044 30.5908 173.9215 181 K 3.9647 8.2402 127.6146 57.1436 32.3528 176.4619 182 G 3.7240 8.7217 109.1000 43.9705 0.0000 172.6425 183 K 4.1254 8.2158 119.1927 54.7571 32.7906 174.1739 184 P 4.2066 0.0000 0.0000 62.6679 31.4030 174.4861 185 P 4.4363 0.0000 0.0000 63.4837 31.2429 176.0863 *187 V 4.3388 7.4628 118.4165 62.5494 33.0271 174.5614 188 I 4.2643 8.3202 126.4750 61.5154 37.1212 176.1900 189 V 4.5584 8.6006 124.3366 61.1283 33.1756 175.3934 190 L 4.5885 7.6595 121.0202 54.6026 45.1542 173.1447 191 E 4.8335 8.9353 121.8806 56.1301 31.8734 174.3107 192 G 4.0928 9.0278 107.4704 45.9464 0.0000 174.4353 193 D 4.4399 7.9666 118.6908 54.2432 41.6866 176.8300 194 N 4.2759 8.8557 120.7191 57.1484 39.0327 176.8158 195 T 4.0483 7.7340 110.3391 64.0571 67.7851 174.3571 196 L 4.5671 7.8216 120.7131 54.9880 41.7581 176.2487 197 K 4.3125 7.8979 119.3404 56.2750 32.6125 175.9322 198 N 5.0474 8.1697 122.0765 51.8979 41.0295 173.7064 199 F 5.2931 8.5950 122.2891 56.0162 43.2356 173.5587 200 Y 4.7365 9.3914 119.6542 56.3593 41.2861 174.7251 201 S 5.2160 8.8889 119.7041 57.4630 65.0481 173.8784 202 I 5.5532 8.8854 124.6643 58.7586 40.9691 173.6620 *204 A 4.5412 8.1832 124.1127 51.4411 20.0622 176.2917 205 V 4.0252 8.5521 121.8894 62.6270 32.6665 175.2725 206 N 4.4503 9.0236 127.2642 53.2603 39.0335 173.8847 207 P 4.7220 0.0000 0.0000 65.7522 31.6329 178.2701 208 K 4.0498 7.9852 117.6866 58.6804 31.8979 178.6824 209 R 4.4249 7.7363 117.6464 57.4952 31.3543 177.0789 210 C 4.7761 8.3819 120.3418 54.9051 39.6152 174.2017 211 E 3.8137 8.5339 124.3127 58.5638 29.3620 178.3091 212 K 4.3183 7.9147 115.6294 56.0301 32.6212 176.4878 213 A 4.1812 7.9265 123.9203 52.0749 19.0162 179.0040 214 D 4.6969 9.1599 123.3152 53.6399 39.0612 176.2972 215 Y 4.1672 8.1308 125.0745 59.8044 39.3111 176.3764 216 K 3.8157 8.2748 120.3704 59.6656 32.1815 178.7020 217 G 3.6268 8.6488 105.6795 47.5934 0.0000 175.3400 218 A 3.9997 7.9242 123.0831 54.9421 18.4510 179.4418 219 K 3.6497 7.8491 118.3318 59.7039 32.1800 178.6228 220 Q 3.9942 8.1827 119.6611 59.2786 28.9432 178.0818 221 F 3.9802 8.5765 121.9105 61.1855 39.1323 177.2259 222 I 3.5432 7.9350 118.8654 64.2973 37.0986 177.5600 223 D 4.5338 8.1760 119.8409 57.3053 40.8301 178.9471 224 W 4.0847 8.0635 128.3241 60.5657 30.5917 177.8600 225 I 3.0826 7.6962 117.2651 62.4451 37.3456 176.4659 226 V 4.1410 6.7885 117.1975 60.9351 31.8447 176.0062 227 S 4.2340 7.2092 115.2643 58.1228 63.3429 174.0633 228 E 3.9068 8.6242 121.9955 59.2862 29.7280 178.6597 229 K 3.8896 7.8420 115.7522 57.9265 31.7778 177.3519 *231 Q 3.9866 8.0612 119.4187 56.3101 30.3011 176.5504 232 A 3.9739 7.2024 118.8354 54.3334 18.7150 178.7428 233 E 3.7055 7.8533 115.3299 59.5405 29.7844 180.0736 234 I 2.7242 7.0648 118.2949 64.0899 37.0522 178.1847 235 A 4.1290 7.2283 118.5202 54.1608 18.2200 178.2832 236 N 4.5813 7.4009 113.3079 52.8418 39.6525 175.7000 237 F 4.8626 7.1765 119.5277 57.9824 39.6789 175.8857 238 K 4.6714 8.3372 122.4652 54.8486 32.7441 176.4512 239 L 4.2111 8.0969 121.3444 54.7683 41.6917 177.0325 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 A 8.12 4.42 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 3 E 8.80 5.04 0.00 1.88 1.81 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 2.29 2.36 0.00 4 L 9.61 4.83 0.00 1.70 1.34 0.95 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 5 R 9.70 5.31 0.00 1.76 1.83 0.00 3.22 0.00 0.00 3.27 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.40 0.00 *7 A 8.19 4.36 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.77 5.27 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 1.42 0.00 0.00 9 T 8.39 5.25 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 10 T 8.88 4.30 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 1.26 0.00 0.00 11 S 8.12 4.18 0.00 3.89 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 12 T 7.80 4.04 4.40 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 0.97 0.00 0.00 13 D 9.08 4.41 0.00 2.86 2.95 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 14 N 8.20 4.53 0.00 2.99 2.91 0.00 0.00 7.09 7.06 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 15 T 7.94 4.12 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 1.29 0.00 0.00 16 G 8.37 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.85 3.74 0.00 1.30 1.43 0.56 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.56 3.58 0.00 0.87 0.13 0.33 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.07 4.64 0.00 2.86 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 20 V 7.47 3.55 1.90 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 0.61 0.00 0.00 0.68 0.00 0.00 21 L 8.03 4.30 0.00 1.97 1.81 1.07 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.40 4.09 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.25 0.00 2.22 2.17 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 24 A 7.84 4.16 1.73 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 0.00 0.00 25 Y 8.35 3.27 0.00 2.17 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 26 K 8.39 4.20 0.00 1.84 1.96 0.00 1.52 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.30 7.81 27 K 7.71 3.88 0.00 2.02 1.99 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.54 7.81 28 D 7.79 4.58 0.00 2.68 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 29 T 7.13 4.22 3.34 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 0.12 0.00 0.00 30 G 8.15 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 31 V 6.82 4.00 1.77 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 1.05 0.00 0.00 0.83 0.00 0.00 32 D 8.76 4.98 0.00 2.63 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 33 L 8.65 4.67 0.00 1.61 1.70 0.52 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 34 K 9.36 4.84 0.00 1.71 1.61 0.00 1.56 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.24 7.81 35 W 8.05 5.37 0.00 3.26 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.66 4.46 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 0.73 0.00 0.00 0.99 0.00 0.00 37 A 8.77 5.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.42 4.60 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 0.77 0.00 0.00 1.03 0.00 0.00 39 G 8.63 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 0.00 0.00 0.00 40 T 8.84 3.92 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 41 G 8.13 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.18 4.37 0.00 2.99 2.90 0.00 0.00 6.98 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 43 A 8.52 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.16 3.78 0.00 1.82 1.77 0.86 -0.02 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 45 K 8.51 3.87 0.00 1.82 1.96 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.54 7.81 46 L 8.53 4.05 0.00 1.91 1.77 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.04 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 48 E 8.29 3.67 0.00 1.54 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 1.83 1.47 0.00 49 N 8.59 4.44 0.00 2.90 2.83 0.00 0.00 7.08 8.15 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 50 C 7.93 4.01 0.00 3.17 3.19 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 0.00 51 D 8.21 4.69 0.00 2.91 2.68 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 0.00 0.00 0.00 0.00 52 V 7.41 4.63 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.06 0.00 0.00 53 D 9.25 4.82 0.00 2.67 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 54 V 7.67 4.96 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 0.72 0.00 0.00 0.86 0.00 0.00 55 V 8.49 4.70 2.18 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 0.93 0.00 0.00 1.04 0.00 0.00 56 F 9.32 5.22 0.00 3.09 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 57 V 8.53 4.76 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 0.67 0.00 0.00 0.95 0.00 0.00 58 H 8.25 5.01 0.00 2.99 3.12 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 9.01 4.59 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 60 P 0.00 4.76 0.00 2.14 2.09 0.00 3.84 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 61 K 8.00 3.87 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.52 1.51 7.81 62 V 7.78 3.87 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 1.06 0.00 0.00 0.96 0.00 0.00 63 E 8.39 4.03 0.00 2.22 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 2.32 2.48 0.00 64 L 8.25 4.10 0.00 1.84 1.73 0.92 0.93 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 65 E 8.18 4.01 0.00 2.30 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 2.35 2.45 0.00 66 Y 8.25 4.23 0.00 3.31 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 67 V 8.00 3.87 2.26 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 1.18 0.00 0.00 1.08 0.00 0.00 68 E 7.97 3.85 0.00 1.98 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 2.27 2.46 0.00 69 K 8.14 3.83 0.00 1.44 0.74 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.28 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.27 1.31 7.81 70 G 7.76 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 71 F 7.10 4.48 0.00 1.51 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 72 G 7.82 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.42 4.77 1.92 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.96 0.90 0.00 0.00 74 D 8.93 4.44 0.00 2.96 2.86 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 0.00 0.00 0.00 75 R 8.22 4.22 0.00 1.91 1.92 0.00 3.25 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 76 T 9.27 4.57 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 77 P 0.00 4.86 0.00 1.87 1.95 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.06 0.00 78 V 9.15 4.56 2.54 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 1.07 0.00 0.00 1.14 0.00 0.00 *80 Y 8.45 4.50 0.00 2.90 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 81 N 8.15 3.57 0.00 1.44 2.43 0.00 0.00 7.06 8.47 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 82 D 7.18 4.26 0.00 2.78 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.47 5.08 0.00 2.91 2.95 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 84 V 8.99 4.68 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 0.70 0.00 0.00 0.87 0.00 0.00 85 I 8.47 4.88 1.83 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.09 0.98 0.00 0.00 86 I 8.37 4.85 1.66 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.57 0.16 0.00 0.00 87 G 8.10 4.41 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 0.00 88 N 8.40 5.43 0.00 3.10 3.09 0.00 0.00 6.73 7.76 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 89 P 0.00 4.44 0.00 2.22 2.20 0.00 3.65 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 90 S 8.18 4.13 0.00 3.78 3.87 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 91 F 8.43 4.53 0.00 3.35 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0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.75 0.00 0.00 101 A 7.70 3.78 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 0.00 102 E 7.92 3.90 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 103 A 8.05 4.05 0.72 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 0.00 104 F 8.61 3.73 0.00 2.82 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 0.00 105 K 8.47 4.02 0.00 1.95 1.90 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.65 1.73 7.81 106 L 8.05 3.99 0.00 1.97 2.03 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.16 3.64 1.83 0.00 0.00 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 1.67 0.87 0.77 0.00 0.00 108 E 7.90 2.61 0.00 2.24 2.18 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 2.38 2.49 0.00 109 K 7.73 3.89 0.00 1.77 2.02 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.45 7.81 110 E 8.37 4.19 0.00 1.96 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 2.28 2.31 0.00 111 Q 6.89 2.52 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.86 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 112 V 7.33 4.15 2.25 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 0.72 0.00 0.00 0.96 0.00 0.00 113 K 8.86 4.48 0.00 1.81 1.85 0.00 1.75 0.00 0.00 1.92 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.68 1.50 7.81 114 F 9.62 5.13 0.00 3.41 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.73 4.54 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 0.71 0.00 0.00 0.82 0.00 0.00 116 S 8.99 4.81 0.00 4.19 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 0.00 117 R 8.94 3.66 0.00 1.70 2.14 0.00 3.71 0.00 0.00 3.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 118 G 7.84 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 7.65 5.03 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 0.00 120 K 8.35 4.48 0.00 1.89 1.90 0.00 1.54 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.50 7.81 121 S 8.33 4.74 0.00 4.06 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 0.00 122 G 8.45 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 0.00 123 T 7.97 3.76 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 1.28 0.00 0.00 124 H 8.26 4.30 0.00 3.24 3.44 0.00 5.62 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 0.00 125 S 8.56 4.06 0.00 3.97 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 0.00 126 K 8.38 3.67 0.00 1.42 1.35 0.00 1.39 0.00 0.00 1.46 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.30 0.93 7.81 127 E 8.10 3.87 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.86 0.00 128 R 8.49 4.20 0.00 1.99 2.02 0.00 2.86 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 129 E 8.40 3.89 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 130 V 7.55 3.31 1.49 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 -0.39 0.00 0.00 0.52 0.00 0.00 131 W 8.03 4.45 0.00 3.62 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 0.00 132 K 8.33 3.95 0.00 2.04 1.87 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.61 7.81 133 E 7.85 3.86 0.00 1.91 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 0.00 2.25 2.28 0.00 134 A 8.14 4.17 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 0.00 135 L 8.45 4.59 0.00 1.82 1.74 1.09 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 136 G 9.07 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 0.00 137 K 7.07 4.12 0.00 1.75 1.76 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.15 1.35 7.81 138 I 7.65 4.03 1.72 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.64 0.68 0.00 0.00 139 P 0.00 3.70 0.00 0.49 0.49 0.00 2.52 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 1.17 0.00 140 E 8.30 4.38 0.00 1.86 1.77 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 2.14 2.24 0.00 141 K 7.61 4.47 0.00 1.67 1.70 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.34 7.81 142 E 7.45 3.99 0.00 1.16 1.46 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 1.90 1.47 0.00 143 S 8.46 4.12 0.00 4.01 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 0.00 144 W 7.52 4.52 0.00 3.90 3.52 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 0.00 145 Y 6.71 4.83 0.00 1.43 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 I 8.22 4.19 1.74 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.80 0.81 0.00 0.00 147 E 8.44 4.42 0.00 1.76 1.81 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 2.13 2.16 0.00 148 A 9.29 3.95 1.19 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 0.00 0.00 0.00 149 G 8.39 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 7.81 4.72 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.48 0.00 151 G 8.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *153 L 8.93 4.21 0.00 1.83 1.77 1.14 1.10 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 0.00 154 A 7.98 4.04 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 T 8.07 3.76 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 156 I 7.59 3.56 1.89 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 1.52 0.55 0.07 0.00 0.00 157 N 8.19 4.41 0.00 2.98 2.94 0.00 0.00 7.04 7.36 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 0.00 158 I 8.00 3.68 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.87 0.00 0.00 159 A 8.03 3.89 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 0.00 160 E 8.30 3.89 0.00 2.11 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 2.39 2.67 0.00 161 E 8.42 4.08 0.00 2.21 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 0.00 2.38 2.40 0.00 162 Q 8.12 4.36 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 163 K 7.94 3.92 0.00 1.97 1.97 0.00 1.57 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.47 7.81 164 G 8.31 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 0.00 0.00 0.00 0.00 165 L 8.32 4.90 0.00 1.58 1.45 0.94 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 166 T 8.00 3.83 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 1.04 0.00 0.00 167 L 8.19 5.09 0.00 1.97 1.72 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 168 T 8.95 4.98 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 0.00 169 D 8.95 4.70 0.00 2.70 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 0.00 170 R 8.73 4.06 0.00 1.98 1.89 0.00 3.13 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 171 G 8.77 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 0.00 172 T 8.39 3.96 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 1.28 0.00 0.00 173 F 8.11 4.34 0.00 3.08 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 0.00 174 I 8.17 3.56 1.99 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 1.39 0.54 0.87 0.00 0.00 175 K 7.91 3.76 0.00 1.88 2.06 0.00 1.85 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.48 7.81 176 Y 8.17 4.18 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 0.00 177 E 8.01 3.82 0.00 1.90 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 1.52 0.00 178 S 8.18 4.14 0.00 3.92 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 0.00 179 N 7.23 4.93 0.00 2.59 2.75 0.00 0.00 6.94 7.74 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 0.00 180 H 7.90 4.36 0.00 2.89 3.01 0.00 5.81 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.24 3.96 0.00 1.73 1.70 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.33 7.81 182 G 8.72 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 0.00 183 K 8.22 4.13 0.00 1.75 1.73 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.43 7.81 184 P 0.00 4.21 0.00 2.16 2.16 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 185 P 0.00 4.44 0.00 2.30 2.11 0.00 3.68 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 1.73 2.00 0.00 *187 V 7.46 4.34 2.18 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 1.04 0.00 0.00 1.04 0.00 0.00 188 I 8.32 4.26 1.84 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 0.93 0.22 0.89 0.00 0.00 189 V 8.60 4.56 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 0.98 0.00 0.00 1.11 0.00 0.00 190 L 7.66 4.59 0.00 1.69 1.40 0.67 0.76 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 0.00 191 E 8.94 4.83 0.00 2.04 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 2.15 2.26 0.00 192 G 9.03 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 0.00 193 D 7.97 4.44 0.00 2.67 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 N 8.86 4.28 0.00 2.80 2.81 0.00 0.00 6.72 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 T 7.73 4.05 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 1.08 0.00 0.00 196 L 7.82 4.57 0.00 1.93 1.90 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 197 K 7.90 4.31 0.00 1.92 1.38 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.32 7.81 198 N 8.17 5.05 0.00 1.94 2.55 0.00 0.00 6.83 7.02 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 0.00 199 F 8.59 5.29 0.00 2.86 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 0.00 200 Y 9.39 4.74 0.00 2.87 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 S 8.89 5.22 0.00 4.00 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 0.00 202 I 8.89 5.55 2.05 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 2.84 1.07 0.00 0.00 *204 A 8.18 4.54 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 V 8.55 4.03 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 0.85 0.00 0.00 1.14 0.00 0.00 206 N 9.02 4.45 0.00 2.97 2.74 0.00 0.00 6.67 7.60 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 0.00 207 P 0.00 4.72 0.00 2.17 2.12 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.25 0.00 208 K 7.99 4.05 0.00 1.84 1.88 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.34 7.81 209 R 7.74 4.42 0.00 1.84 2.13 0.00 3.44 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 210 C 8.38 4.78 0.00 2.99 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 0.00 211 E 8.53 3.81 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 212 K 7.91 4.32 0.00 1.76 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.44 7.81 213 A 7.93 4.18 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 0.00 214 D 9.16 4.70 0.00 2.75 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 0.00 215 Y 8.13 4.17 0.00 3.15 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 K 8.27 3.82 0.00 1.94 1.81 0.00 1.72 0.00 0.00 1.90 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.59 7.81 217 G 8.65 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 A 7.92 4.00 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 0.00 219 K 7.85 3.65 0.00 1.18 1.73 0.00 1.48 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.35 1.60 7.81 220 Q 8.18 3.99 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 221 F 8.58 3.98 0.00 2.86 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 0.00 222 I 7.94 3.54 1.89 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 1.61 0.91 0.93 0.00 0.00 223 D 8.18 4.53 0.00 2.98 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 0.00 224 W 8.06 4.08 0.00 3.57 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 0.00 225 I 7.70 3.08 1.15 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.64 0.00 0.00 226 V 6.79 4.14 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 0.75 0.00 0.00 0.91 0.00 0.00 227 S 7.21 4.23 0.00 3.95 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 0.00 228 E 8.62 3.91 0.00 1.97 1.93 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 2.32 2.25 0.00 229 K 7.84 3.89 0.00 1.76 1.63 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.35 7.81 *231 Q 8.06 3.99 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 232 A 7.20 3.97 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 0.00 233 E 7.85 3.71 0.00 1.66 1.64 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 2.26 2.41 0.00 234 I 7.06 2.72 1.60 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.54 0.73 0.00 0.00 235 A 7.23 4.13 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 0.00 236 N 7.40 4.58 0.00 2.79 2.83 0.00 0.00 6.99 7.14 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 0.00 237 F 7.18 4.86 0.00 3.36 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 0.00 238 K 8.34 4.67 0.00 1.75 1.74 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.71 7.81 239 L 8.10 4.21 0.00 1.80 1.56 0.68 0.98 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 * Residues marked with a * may have inaccurate shift predictions.