NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5515 8.3349 116.8098 58.2084 64.9473 174.4824 3 V 3.5642 7.8857 113.0491 61.9182 31.7772 174.0815 4 I 4.1469 8.5144 121.5786 59.3225 38.4724 174.5680 5 K 4.7762 8.1925 126.8327 54.0861 34.1951 175.7004 6 P 4.7739 0.0000 0.0000 65.1987 31.4797 176.0102 7 D 5.3621 7.6749 114.5313 52.7799 43.4732 175.5941 8 M 5.1989 9.2124 122.5888 53.5957 36.6122 175.1721 9 K 5.0179 8.8805 121.0621 55.2579 35.4982 175.3828 10 I 5.1196 8.6438 121.2501 59.7340 41.3468 174.9293 11 K 5.1584 8.9337 125.4094 54.6027 36.1974 175.2398 12 L 5.1736 8.7018 122.5954 54.5448 44.6097 174.5897 13 R 5.1443 8.9226 120.1609 54.9543 33.6923 173.1910 14 M 5.2586 9.6372 126.3172 53.8820 34.8828 174.0479 15 E 4.8433 8.7101 125.3975 54.8531 33.0824 175.4394 16 G 4.0280 7.9300 108.7072 46.2467 0.0000 171.5042 17 A 5.5651 8.9804 120.0891 50.6403 23.1921 175.6734 18 V 4.6965 8.6103 120.0165 61.7139 34.6967 175.4971 19 N 4.3132 10.3954 125.5897 54.4003 36.6894 175.4766 20 G 3.8551 8.5809 103.9310 45.7771 0.0000 173.5982 21 H 4.8563 8.2411 118.5668 53.3208 29.5650 172.7701 22 P 5.2810 0.0000 0.0000 63.0183 32.6158 175.0887 23 F 5.2322 8.9120 115.1734 56.4098 42.0495 172.4954 24 A 5.1267 9.1701 119.6643 50.7140 22.9531 175.4057 25 I 5.2299 9.1188 121.1578 59.7602 41.8222 174.3141 26 E 5.2169 9.2602 125.2939 54.6378 33.0122 175.2981 27 G 4.4473 8.9368 108.4836 44.6440 0.0000 171.8285 28 V 5.0158 8.5301 114.5224 59.6056 35.9696 175.3026 29 G 4.1522 8.8734 110.7029 45.7766 0.0000 171.1852 30 L 5.2898 8.7692 117.9776 53.5796 46.6458 175.9093 31 G 4.0524 9.3471 107.6846 45.2728 0.0000 172.2016 32 K 5.5001 9.2061 120.1291 52.9281 33.1125 175.6014 33 P 4.3085 0.0000 0.0000 65.1837 31.4880 178.1804 34 F 4.6336 7.9132 114.7198 58.8659 39.2568 175.8676 35 E 4.4495 8.2472 118.3817 55.4541 30.5762 175.6284 36 G 4.1025 8.1767 107.4677 46.2038 0.0000 173.0573 37 K 5.3562 7.7274 116.2602 55.3862 36.8773 175.2296 38 Q 4.8201 8.7797 117.7277 55.6311 32.1762 173.0421 39 S 5.1169 8.7522 114.2954 57.6181 66.8975 172.5699 40 M 5.0739 8.9454 117.1216 54.4647 35.0458 172.8832 41 D 5.3522 9.0772 120.6220 52.6850 43.5891 175.3382 42 L 5.2572 9.0837 123.7128 52.6154 45.1562 175.6026 43 K 5.1800 9.0411 121.8655 54.9283 35.8409 175.4862 44 V 4.2700 8.7278 125.0413 63.1614 31.3047 175.5585 45 K 4.5304 9.3452 127.8174 57.6060 33.7988 176.7997 46 E 4.6395 8.0007 117.4917 55.6800 34.0650 176.7183 47 G 4.0382 9.3119 110.5910 45.5772 0.0000 173.8040 48 G 3.9519 7.6791 107.8804 43.5079 0.0000 172.1506 49 P 4.3702 0.0000 0.0000 61.7205 32.0843 176.4335 50 L 3.6591 8.3244 122.2687 54.7189 41.7111 175.0643 51 P 4.5558 0.0000 0.0000 62.4949 31.5123 175.1346 52 F 4.8974 6.4810 112.2455 54.5082 41.1845 174.0713 53 A 3.7897 8.6058 124.8025 52.2988 18.4355 178.3734 54 Y 3.8080 8.1482 124.1522 60.6503 38.5709 177.6870 55 D 4.6556 8.2775 119.8163 57.3804 40.6116 178.5328 56 I 4.3205 7.6194 112.1272 63.4720 37.7965 177.4637 57 L 3.9899 8.1787 121.0552 56.2394 41.9612 178.8678 58 T 4.3737 8.0337 109.8352 64.8875 68.9133 176.2758 59 T 4.2288 8.0394 109.9136 62.9163 69.3563 175.4887 60 V 4.1465 7.7993 122.3620 65.8151 32.3413 177.1874 61 F 4.8131 7.2356 117.5408 57.4020 36.9893 176.7223 *65 N 4.5921 7.6571 118.8945 53.4572 39.0259 174.3251 66 R 3.8928 8.1311 122.5435 56.9726 29.8897 179.5825 67 V 3.5816 7.4771 112.5172 63.8417 31.6251 176.3162 68 F 4.7703 7.8327 118.2956 57.8146 39.2960 174.5082 69 A 5.0136 7.4264 122.2626 49.9145 21.2313 177.2841 70 K 4.3049 9.0163 124.3637 56.4759 33.2709 175.1149 71 Y 4.8820 8.7581 125.7319 55.5707 39.7834 174.2932 72 P 4.6255 0.0000 0.0000 61.8587 32.7091 176.7649 73 E 3.9512 8.8634 119.6168 59.4011 29.4015 177.1817 74 N 4.7536 8.1351 112.4999 52.8932 37.7270 174.2497 75 I 4.5110 7.3662 119.9806 59.2426 39.6608 175.6179 76 V 3.5028 8.4823 125.4990 63.0940 32.0681 175.1734 77 D 3.7249 8.1939 127.1376 52.2633 40.2109 175.4473 78 Y 3.7409 7.8433 126.8551 60.2666 39.0431 177.5120 79 F 3.8152 7.2700 117.8432 60.3609 38.9152 177.9641 80 K 4.2107 8.2483 118.0441 59.5387 31.5667 179.4792 81 Q 4.0737 7.6295 117.4423 58.6560 28.7948 178.5878 82 S 3.9706 7.6287 114.7881 59.6957 63.0671 174.4706 83 F 4.8260 6.9468 119.7439 55.9130 39.5840 174.1752 84 P 4.6934 0.0000 0.0000 65.4776 31.6016 177.6880 85 E 3.9470 8.1514 118.5015 57.6616 29.8631 177.4663 86 G 3.0338 9.6533 105.8855 44.5693 0.0000 170.9395 87 Y 5.2939 7.3881 114.9434 56.2650 41.8851 173.5816 88 S 5.1394 9.3089 114.1674 56.2563 66.9252 172.8403 89 W 5.9250 8.7312 117.3237 54.8809 31.8986 173.7110 90 E 5.2817 9.1838 118.2515 55.0080 32.9249 174.4062 91 R 5.1618 9.1607 120.9456 55.0965 34.2202 173.5341 92 S 5.0348 8.8377 120.3917 56.8281 65.9864 173.0237 93 M 4.5311 8.8886 122.4308 53.6464 34.8008 174.2381 94 N 4.9224 8.7571 124.7031 51.9911 40.3743 173.6349 95 Y 4.7141 9.1362 125.4663 57.0790 39.0344 177.2072 96 E 3.9557 8.7082 120.6902 58.9639 29.8003 177.5244 97 D 4.7333 8.3999 117.4378 53.1123 39.6556 177.2024 98 G 3.9478 8.4772 109.5087 45.0488 0.0000 174.6010 99 G 2.9175 7.7425 107.7528 46.1777 0.0000 172.7080 100 I 5.1945 8.0127 123.7956 59.3102 41.6366 173.3775 101 C 5.1975 9.2268 127.0789 57.9999 31.0307 172.4542 102 N 5.3429 8.8505 121.1509 51.4842 40.7631 173.8403 103 A 5.2067 8.9720 124.1389 50.5151 23.4258 174.8694 104 T 4.6215 8.4560 108.6428 59.8485 72.9297 172.4650 105 N 4.7990 7.6798 121.1142 51.8023 42.5102 172.2201 106 D 4.8853 8.7751 126.3702 52.6684 42.9849 174.7421 107 I 5.1509 8.3051 127.5273 59.8638 39.6724 175.0962 108 T 4.8188 9.0473 116.7859 59.6827 72.6007 172.4462 109 L 5.1214 8.5853 122.5522 53.3267 44.9323 175.0673 110 D 4.6988 9.2522 125.8984 52.6297 43.9826 178.0064 111 G 3.8849 9.0865 119.4036 46.7684 0.0000 172.3242 112 D 4.5560 9.0813 124.1311 53.9955 42.6420 173.5492 113 C 5.1451 7.9797 116.8681 58.8585 30.9508 172.6049 114 Y 4.9600 8.8567 121.6318 57.5246 39.4560 174.4771 115 I 4.9310 9.1812 124.5184 59.7822 40.6146 173.9402 116 Y 5.3637 8.9014 124.9461 56.2369 40.7258 174.3180 117 E 4.6266 9.1327 125.5320 54.7173 31.7385 174.3873 118 I 4.8695 8.6106 128.2362 59.3726 40.6114 174.8100 119 R 5.0911 8.4772 126.1803 54.5227 33.3788 174.1656 120 F 5.1254 8.9351 126.9394 56.7650 43.1434 172.8835 121 D 5.1456 9.0543 125.9275 52.6633 44.6353 174.6354 122 G 4.6150 9.3190 111.5275 44.5185 0.0000 172.0903 123 V 4.7575 8.0878 115.7847 59.9507 36.6402 175.3546 124 N 3.9781 8.8120 116.8709 54.2786 35.6728 174.4322 125 F 4.3494 7.8618 117.8209 56.3443 39.4847 174.1311 126 P 4.4231 0.0000 0.0000 62.1308 31.8635 177.4824 127 A 4.0211 8.7049 125.0744 54.9050 18.4394 178.0715 128 N 4.8260 8.1231 110.6624 52.9518 38.0093 175.6886 129 G 3.9509 7.8408 107.5335 43.1250 0.0000 173.1323 130 P 4.1380 0.0000 0.0000 65.3200 30.9970 179.0007 131 V 3.2762 7.2655 117.7586 66.2734 31.3997 177.8593 132 M 4.0679 7.8366 116.0349 57.4334 31.9900 177.5342 133 Q 4.2743 7.7144 116.0168 54.2247 30.3241 175.3311 134 K 3.6623 7.6076 118.3161 58.2006 29.5421 175.2631 135 R 4.6573 8.3257 114.0249 56.1464 31.9303 177.8114 136 T 4.5624 7.6764 109.2707 61.2166 70.2098 173.6255 137 V 4.3726 8.3717 120.9541 63.6058 33.2634 175.4852 138 K 4.5586 7.4419 116.3601 55.5808 36.1828 173.9675 139 W 4.9245 8.7677 121.5841 56.4730 29.8187 176.3098 140 E 4.3394 9.3221 124.9281 55.5248 29.6751 175.2982 141 P 4.5173 0.0000 0.0000 63.5976 32.3797 175.2588 142 S 4.5232 8.3347 115.9399 57.7359 66.8481 172.2174 143 T 4.9962 8.1692 117.0684 61.5758 70.8804 173.9294 144 E 4.3997 9.3376 128.8437 55.8072 31.4123 175.2445 145 K 4.7031 9.1486 126.1760 54.9674 34.1761 175.3307 146 L 5.4258 8.2405 125.4033 52.2267 44.6635 175.1961 147 Y 4.8773 7.4616 119.2575 55.9799 41.3494 173.2456 148 V 4.4694 8.3428 120.5653 61.8101 32.9862 175.3152 149 R 4.5526 8.4268 126.7490 56.1199 33.2652 174.5304 150 D 4.1462 9.7586 124.6378 55.6417 38.3435 174.6057 151 G 3.9616 8.5609 103.6724 45.6492 0.0000 173.6819 152 V 4.5584 7.3031 118.2663 59.5867 35.5381 174.0054 153 L 4.4397 7.8985 123.3219 53.6931 43.7424 175.4841 154 K 4.8821 8.6051 124.8904 54.6272 35.6559 175.4901 155 G 4.8603 8.6040 108.6765 44.2419 0.0000 171.3285 156 D 5.8052 9.1188 125.2179 52.7259 44.8394 175.4998 157 V 4.6063 8.2957 119.2300 60.8137 35.2375 172.6423 158 N 4.9943 8.8117 121.7877 52.9515 38.7460 174.4643 159 M 4.5564 9.1383 124.2796 53.8844 34.8773 175.4031 160 A 5.2231 8.5238 121.2627 50.3616 22.9857 174.5036 161 L 4.8636 8.9880 125.5741 53.1531 43.8683 176.1146 162 S 4.7358 9.0472 121.8085 58.4884 64.6152 173.2674 163 L 5.1551 8.3700 121.3305 52.6578 45.2773 176.0346 164 E 4.3119 9.1932 119.8991 56.8389 28.2507 177.5546 165 G 5.0719 8.9317 127.0700 46.6044 0.0000 169.4814 166 G 3.4207 7.2993 114.0761 45.6510 0.0000 174.8553 167 G 3.9631 7.6607 109.5840 44.7337 0.0000 171.3133 168 H 5.5288 8.4898 114.5605 54.0891 32.7967 172.6720 169 Y 5.0460 9.2686 123.0360 56.1944 41.0823 174.9621 170 R 5.0712 9.5479 126.1010 55.4402 33.1324 175.1380 171 C 4.9420 8.7766 120.8219 58.3262 35.6333 172.2964 172 D 5.1986 9.0018 126.6390 53.4132 42.3405 175.3012 173 F 5.0701 9.3790 123.4588 56.0086 41.3673 175.2673 174 K 5.0072 8.9819 122.2313 55.1480 35.7639 175.3546 175 T 4.8884 8.9083 122.1600 61.8006 72.1224 173.3173 176 T 4.8360 8.7495 121.8131 61.9504 71.4983 172.5961 177 Y 5.5267 9.2808 124.2407 56.3595 41.0414 175.2072 178 K 4.9136 9.7574 122.5271 54.3184 35.5098 175.6777 179 A 4.3037 9.1035 127.7735 51.8549 18.8833 177.1560 180 K 4.3375 8.6939 120.4898 55.9708 32.1657 176.3790 181 K 4.4775 7.1883 117.4148 55.2650 35.4126 175.2985 182 V 3.7348 8.1236 119.2313 62.5927 31.6100 175.2687 183 V 4.4188 7.8607 119.2500 58.9042 35.1001 174.8072 184 Q 4.1305 8.6914 122.8268 55.8455 29.3563 175.4965 185 L 4.3965 8.3025 125.4668 53.4110 42.6803 175.0701 186 P 4.5226 0.0000 0.0000 62.0610 32.3330 175.5001 187 D 4.6736 8.2614 119.4247 53.5302 41.6770 175.5333 188 Y 4.3319 8.3773 121.7823 59.1023 39.2933 174.8772 189 H 4.5145 8.0026 120.2596 55.0255 32.5014 171.9034 190 F 5.2583 8.8241 115.5189 55.8021 43.4502 174.7920 191 V 4.6716 8.6260 120.8388 61.1658 34.2522 174.4213 192 D 5.1897 8.9865 129.1594 54.5868 42.2438 175.4362 193 H 5.3987 9.0195 117.2027 54.5855 32.9660 171.9999 194 H 4.9814 8.9436 119.1782 54.9728 32.9221 171.6259 195 I 4.9923 8.4319 126.0510 59.2289 40.5670 174.3049 196 E 4.6853 9.1457 129.6173 54.8286 33.3390 173.8951 197 I 4.4081 8.6466 128.2130 61.4558 36.8069 175.9843 198 K 4.3595 9.0410 128.7055 58.8350 32.7229 177.6272 199 S 4.6973 7.7106 112.5190 57.8654 66.0432 173.1535 200 H 4.9531 7.9462 114.4341 54.8493 30.9982 172.9604 201 D 4.4957 8.1187 120.5184 52.0291 41.2552 177.1716 202 K 3.8010 8.6755 119.3525 59.1914 32.0485 176.8344 203 D 4.7616 7.9501 114.4274 52.9184 39.7180 175.9359 204 Y 3.3355 7.6587 115.3212 59.0760 35.9446 170.3546 205 S 4.3928 8.2499 118.9700 61.1788 64.2457 174.3095 206 N 5.4529 8.9558 117.0484 51.2806 41.8172 174.1328 207 V 4.6251 8.6239 122.8211 61.0000 35.4235 173.3037 208 N 5.3636 9.0919 126.6544 51.8331 40.9843 172.9139 209 L 5.2655 9.0538 128.4337 53.6224 45.2831 174.6931 210 H 5.4217 9.2411 122.3888 54.1662 32.6369 172.4134 211 E 5.3388 9.1634 121.4177 54.9944 33.7966 173.6131 212 H 5.6798 9.0850 119.6797 54.0224 32.3666 172.0321 213 A 5.2024 9.1938 121.7998 50.6852 23.2419 174.9094 214 E 4.9849 9.1494 119.7356 54.6236 33.8246 174.9724 215 A 4.7743 8.6310 127.4674 52.0563 19.4516 176.1034 216 H 4.9583 9.1276 115.5127 54.7340 32.0550 174.3743 217 S 4.6778 8.9704 114.3783 59.4286 63.8253 174.4922 218 E 4.3936 8.2247 123.4977 56.4357 29.9943 175.4563 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 S 8.33 4.55 0.00 3.91 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 3 V 7.89 3.56 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 0.68 0.00 0.00 1.06 0.00 0.00 4 I 8.51 4.15 1.86 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.59 1.13 0.00 0.00 5 K 8.19 4.78 0.00 1.87 1.76 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.45 7.81 6 P 0.00 4.77 0.00 2.29 2.27 0.00 3.64 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 7 D 7.67 5.36 0.00 2.52 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 M 9.21 5.20 0.00 1.95 2.26 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.83 0.00 9 K 8.88 5.02 0.00 1.68 1.71 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.41 7.81 10 I 8.64 5.12 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.95 0.41 0.00 0.00 11 K 8.93 5.16 0.00 1.59 1.60 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.31 7.81 12 L 8.70 5.17 0.00 1.95 1.59 1.14 0.73 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 13 R 8.92 5.14 0.00 1.93 1.79 0.00 3.29 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 14 M 9.64 5.26 0.00 2.38 2.09 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 15 E 8.71 4.84 0.00 1.85 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 16 G 7.93 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 17 A 8.98 5.57 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 18 V 8.61 4.70 1.65 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 0.82 0.00 0.00 0.23 0.00 0.00 19 N 10.40 4.31 0.00 2.94 2.95 0.00 0.00 7.14 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 20 G 8.58 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 21 H 8.24 4.86 0.00 3.51 3.36 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 5.28 0.00 2.13 2.09 0.00 3.92 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 23 F 8.91 5.23 0.00 3.43 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 9.17 5.13 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 25 I 9.12 5.23 2.29 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.22 1.02 0.00 0.00 26 E 9.26 5.22 0.00 1.92 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 2.39 2.27 0.00 27 G 8.94 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 0.00 0.00 0.00 0.00 28 V 8.53 5.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.90 0.00 0.00 29 G 8.87 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 0.00 0.00 0.00 30 L 8.77 5.29 0.00 1.50 1.50 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 31 G 9.35 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 32 K 9.21 5.50 0.00 1.73 1.86 0.00 1.74 0.00 0.00 1.97 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.27 7.81 33 P 0.00 4.31 0.00 1.31 1.76 0.00 3.80 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 34 F 7.91 4.63 0.00 3.13 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 35 E 8.25 4.45 0.00 2.18 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 0.00 2.34 2.42 0.00 36 G 8.18 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 37 K 7.73 5.36 0.00 1.81 1.93 0.00 1.58 0.00 0.00 1.90 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.46 7.81 38 Q 8.78 4.82 0.00 1.46 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.70 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 39 S 8.75 5.12 0.00 3.47 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.95 5.07 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 41 D 9.08 5.35 0.00 2.53 2.56 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 0.00 0.00 0.00 0.00 42 L 9.08 5.26 0.00 1.46 1.39 0.70 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 43 K 9.04 5.18 0.00 1.71 1.86 0.00 1.31 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.50 7.81 44 V 8.73 4.27 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 0.86 0.00 0.00 1.14 0.00 0.00 45 K 9.35 4.53 0.00 1.69 1.88 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.58 7.81 46 E 8.00 4.64 0.00 2.02 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 2.33 2.35 0.00 47 G 9.31 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 48 G 7.68 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 0.00 0.00 0.00 49 P 0.00 4.37 0.00 2.15 2.22 0.00 3.78 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 1.96 1.97 0.00 50 L 8.32 3.66 0.00 1.13 0.40 0.51 0.73 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 51 P 0.00 4.56 0.00 2.18 2.09 0.00 3.50 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.96 0.00 52 F 6.48 4.90 0.00 2.78 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.61 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.15 3.81 0.00 2.41 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 55 D 8.28 4.66 0.00 2.61 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 56 I 7.62 4.32 2.19 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.43 0.73 0.00 0.00 57 L 8.18 3.99 0.00 1.46 1.10 0.28 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.03 4.37 4.59 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 1.73 0.00 0.00 59 T 8.04 4.23 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 0.76 0.00 0.00 60 V 7.80 4.15 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 0.97 0.00 0.00 1.28 0.00 0.00 61 F 7.24 4.81 0.00 3.52 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 *65 N 7.66 4.59 0.00 2.69 3.09 0.00 0.00 7.06 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 66 R 8.13 3.89 0.00 0.67 0.66 0.00 3.07 0.00 0.00 2.94 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.98 0.00 67 V 7.48 3.58 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 0.95 0.00 0.00 -0.39 0.00 0.00 68 F 7.83 4.77 0.00 3.34 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 69 A 7.43 5.01 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 70 K 9.02 4.30 0.00 1.93 1.77 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.66 7.81 71 Y 8.76 4.88 0.00 3.05 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 72 P 0.00 4.63 0.00 2.45 2.24 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.98 0.00 73 E 8.86 3.95 0.00 1.99 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 0.00 2.32 2.34 0.00 74 N 8.14 4.75 0.00 2.91 2.94 0.00 0.00 5.80 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.37 4.51 2.07 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 1.24 0.75 0.92 0.00 0.00 76 V 8.48 3.50 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 0.72 0.00 0.00 0.92 0.00 0.00 77 D 8.19 3.72 0.00 2.34 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 7.84 3.74 0.00 2.40 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 0.00 0.00 0.00 0.00 79 F 7.27 3.82 0.00 3.10 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 80 K 8.25 4.21 0.00 1.87 1.90 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.62 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.39 1.50 7.81 81 Q 7.63 4.07 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 82 S 7.63 3.97 0.00 3.89 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 83 F 6.95 4.83 0.00 3.21 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 84 P 0.00 4.69 0.00 2.25 2.26 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 85 E 8.15 3.95 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 86 G 9.65 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 0.00 0.00 0.00 87 Y 7.39 5.29 0.00 3.13 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 88 S 9.31 5.14 0.00 3.83 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 89 W 8.73 5.92 0.00 3.18 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.18 5.28 0.00 2.01 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 2.18 2.20 0.00 91 R 9.16 5.16 0.00 1.77 1.89 0.00 2.63 0.00 0.00 2.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.41 0.00 92 S 8.84 5.03 0.00 3.81 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 M 8.89 4.53 0.00 1.42 1.79 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.81 0.00 94 N 8.76 4.92 0.00 2.68 2.63 0.00 0.00 6.94 7.29 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 95 Y 9.14 4.71 0.00 3.16 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 96 E 8.71 3.96 0.00 2.14 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 0.00 2.39 2.44 0.00 97 D 8.40 4.73 0.00 2.93 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 98 G 8.48 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 0.00 0.00 0.00 99 G 7.74 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 0.00 0.00 0.00 100 I 8.01 5.19 1.79 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.23 0.80 0.00 0.00 101 C 9.23 5.20 0.00 2.92 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 0.00 0.00 0.00 0.00 102 N 8.85 5.34 0.00 2.43 2.57 0.00 0.00 6.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.97 5.21 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.46 4.62 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 1.09 0.00 0.00 105 N 7.68 4.80 0.00 1.44 1.42 0.00 0.00 6.84 8.27 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 0.00 106 D 8.78 4.89 0.00 2.70 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.31 5.15 1.61 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.46 1.27 0.00 0.00 108 T 9.05 4.82 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 0.00 109 L 8.59 5.12 0.00 1.77 1.77 0.43 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.25 4.70 0.00 2.70 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 0.00 111 G 9.09 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 0.00 112 D 9.08 4.56 0.00 2.71 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 0.00 113 C 7.98 5.15 0.00 2.83 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 0.00 114 Y 8.86 4.96 0.00 3.11 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 0.00 115 I 9.18 4.93 1.96 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 1.24 0.83 0.95 0.00 0.00 116 Y 8.90 5.36 0.00 2.91 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 0.00 117 E 9.13 4.63 0.00 2.04 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 118 I 8.61 4.87 2.07 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.69 0.93 0.00 0.00 119 R 8.48 5.09 0.00 1.84 1.62 0.00 3.16 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 1.43 1.65 0.00 120 F 8.94 5.13 0.00 3.15 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 0.00 121 D 9.05 5.15 0.00 2.42 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 9.32 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 0.00 0.00 0.00 0.00 123 V 8.09 4.76 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 0.71 0.00 0.00 0.85 0.00 0.00 124 N 8.81 3.98 0.00 2.73 2.84 0.00 0.00 6.99 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 0.00 125 F 7.86 4.35 0.00 3.18 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 0.00 126 P 0.00 4.42 0.00 2.21 2.00 0.00 3.83 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.12 0.00 127 A 8.70 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.12 4.83 0.00 2.83 2.92 0.00 0.00 5.95 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 0.00 129 G 7.84 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 0.00 0.00 0.00 130 P 0.00 4.14 0.00 1.80 1.99 0.00 3.36 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 0.60 1.13 0.00 131 V 7.27 3.28 1.67 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 0.27 0.00 0.00 0.58 0.00 0.00 132 M 7.84 4.07 0.00 2.03 2.35 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 133 Q 7.71 4.27 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.56 0.00 134 K 7.61 3.66 0.00 1.79 1.71 0.00 1.60 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.16 1.32 7.81 135 R 8.33 4.66 0.00 1.57 1.80 0.00 3.05 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 136 T 7.68 4.56 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 137 V 8.37 4.37 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 0.83 0.00 0.00 0.95 0.00 0.00 138 K 7.44 4.56 0.00 2.03 1.89 0.00 1.45 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.45 7.81 139 W 8.77 4.92 0.00 3.26 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 0.00 140 E 9.32 4.34 0.00 1.91 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 2.48 2.44 0.00 141 P 0.00 4.52 0.00 1.94 2.02 0.00 3.73 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 2.08 2.29 0.00 142 S 8.33 4.52 0.00 3.80 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 0.00 143 T 8.17 5.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 144 E 9.34 4.40 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 145 K 9.15 4.70 0.00 1.95 1.61 0.00 2.11 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.67 1.66 7.81 146 L 8.24 5.43 0.00 0.98 1.21 0.78 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 7.46 4.88 0.00 3.07 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 0.00 148 V 8.34 4.47 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.88 0.00 0.00 149 R 8.43 4.55 0.00 1.98 1.71 0.00 3.35 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 150 D 9.76 4.15 0.00 2.83 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 0.00 151 G 8.56 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 0.00 152 V 7.30 4.56 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 0.68 0.00 0.00 1.02 0.00 0.00 153 L 7.90 4.44 0.00 0.47 0.84 0.60 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.61 4.88 0.00 0.79 1.13 0.00 1.59 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.03 1.14 7.81 155 G 8.60 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 0.00 156 D 9.12 5.81 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.30 4.61 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 0.52 0.00 0.00 0.84 0.00 0.00 158 N 8.81 4.99 0.00 2.62 2.83 0.00 0.00 6.96 7.66 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 0.00 159 M 9.14 4.56 0.00 1.55 1.72 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.78 0.00 160 A 8.52 5.22 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 0.00 161 L 8.99 4.86 0.00 1.76 1.56 -0.44 0.54 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 0.00 162 S 9.05 4.74 0.00 3.88 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.37 5.16 0.00 1.57 1.53 0.87 0.56 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 0.00 164 E 9.19 4.31 0.00 1.91 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 2.29 2.22 0.00 165 G 8.93 5.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 G 7.30 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.66 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 0.00 168 H 8.49 5.53 0.00 3.06 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 9.27 5.05 0.00 2.93 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 0.00 170 R 9.55 5.07 0.00 1.75 1.82 0.00 3.19 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 171 C 8.78 4.94 0.00 2.64 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 0.00 172 D 9.00 5.20 0.00 2.62 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 0.00 173 F 9.38 5.07 0.00 2.91 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 0.00 174 K 8.98 5.01 0.00 1.59 1.63 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.38 7.81 175 T 8.91 4.89 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 0.22 0.00 0.00 176 T 8.75 4.84 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 1.18 0.00 0.00 177 Y 9.28 5.53 0.00 2.81 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 0.00 178 K 9.76 4.91 0.00 1.73 1.78 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.46 7.81 179 A 9.10 4.30 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.69 4.34 0.00 1.78 1.80 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.35 7.81 181 K 7.19 4.48 0.00 1.75 1.69 0.00 1.51 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.30 7.81 182 V 8.12 3.73 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 0.80 0.00 0.00 0.91 0.00 0.00 183 V 7.86 4.42 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 0.51 0.00 0.00 0.50 0.00 0.00 184 Q 8.69 4.13 0.00 1.97 2.08 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 2.36 2.36 0.00 185 L 8.30 4.40 0.00 1.67 1.54 0.92 1.19 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 0.00 186 P 0.00 4.52 0.00 2.20 2.20 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 187 D 8.26 4.67 0.00 2.75 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 0.00 188 Y 8.38 4.33 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 H 8.00 4.51 0.00 3.33 3.35 0.00 5.26 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 8.82 5.26 0.00 2.63 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 0.00 191 V 8.63 4.67 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 1.02 0.00 0.00 0.86 0.00 0.00 192 D 8.99 5.19 0.00 2.70 2.56 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 0.00 0.00 0.00 0.00 193 H 9.02 5.40 0.00 3.29 3.29 0.00 5.42 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 8.94 4.98 0.00 3.17 2.88 0.00 5.72 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 I 8.43 4.99 1.93 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 1.43 1.39 1.06 0.00 0.00 196 E 9.15 4.69 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 197 I 8.65 4.41 2.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 1.00 0.00 0.00 198 K 9.04 4.36 0.00 1.83 1.81 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.60 1.24 7.81 199 S 7.71 4.70 0.00 3.75 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 H 7.95 4.95 0.00 2.33 2.87 0.00 5.71 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.12 4.50 0.00 2.75 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 0.00 202 K 8.68 3.80 0.00 1.69 1.86 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.41 7.81 203 D 7.95 4.76 0.00 2.81 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 0.00 204 Y 7.66 3.34 0.00 3.08 2.88 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 0.00 205 S 8.25 4.39 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 0.00 206 N 8.96 5.45 0.00 2.66 2.61 0.00 0.00 6.37 7.75 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 0.00 207 V 8.62 4.63 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 0.73 0.00 0.00 0.23 0.00 0.00 208 N 9.09 5.36 0.00 2.85 2.64 0.00 0.00 6.32 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 0.00 209 L 9.05 5.27 0.00 1.85 1.52 1.19 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 210 H 9.24 5.42 0.00 3.17 3.20 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 9.16 5.34 0.00 2.05 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 2.26 2.38 0.00 212 H 9.08 5.68 0.00 3.44 3.38 0.00 5.48 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 0.00 213 A 9.19 5.20 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 0.00 214 E 9.15 4.98 0.00 1.95 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 2.26 2.35 0.00 215 A 8.63 4.77 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 H 9.13 4.96 0.00 3.24 3.38 0.00 5.45 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.97 4.68 0.00 3.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 E 8.22 4.39 0.00 1.93 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 2.27 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.