NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.2870 8.4449 118.7923 55.8800 30.7614 178.9870 6 K 4.1276 8.9201 113.1772 55.8731 33.1780 174.1348 7 T 4.3963 9.1561 122.4761 62.4585 70.1274 173.9315 8 E 4.7422 8.8957 127.4923 56.3823 30.8450 176.5606 9 V 5.0028 8.9697 123.1677 59.8622 35.4855 174.4037 10 V 4.8603 8.9969 122.1777 61.2220 34.2556 174.3493 11 L 4.7538 8.9630 128.5275 53.8731 42.8700 175.5555 12 L 4.8276 8.8605 127.8814 53.6995 43.8424 175.2446 13 A 5.0497 9.1754 130.3389 50.5682 20.1666 174.5905 14 C 4.8794 8.6155 118.7889 60.4121 29.7012 173.6331 15 G 3.3638 7.8970 107.4342 46.2762 0.0000 174.4411 16 S 4.0011 8.4719 115.2425 60.4769 63.8169 175.0992 17 F 3.7892 7.3252 116.7396 59.1603 36.1762 175.5098 18 N 5.5643 7.7807 118.2121 51.4665 38.8582 170.4446 19 P 5.7312 0.0000 0.0000 59.5992 34.4934 175.5937 20 I 4.0536 8.2219 118.9003 61.4481 37.9774 174.5054 21 T 4.8226 8.4345 114.8998 59.0099 72.3023 174.2621 22 N 4.3796 9.0156 118.5371 56.5413 38.1715 177.2143 23 M 4.4242 7.5054 120.1270 58.6077 31.8190 178.1121 24 H 4.3540 7.7777 114.9695 58.8185 28.8261 177.8269 25 L 3.9803 7.8528 120.5367 57.4618 41.6058 178.9303 26 R 3.9695 8.6182 119.1625 59.4824 30.1139 177.9687 27 L 3.9328 8.2726 120.1796 58.5739 41.9099 179.1822 28 F 4.1049 8.1085 117.0752 60.4245 38.7742 177.4286 29 E 4.2737 8.3352 117.8396 59.6372 29.3361 179.1366 30 L 4.0223 8.2211 118.6029 58.1577 41.7197 179.5024 31 A 4.1101 7.9921 119.9777 55.0496 18.1470 179.7160 32 K 3.8168 8.4239 118.0896 59.8442 32.2773 178.6494 33 D 4.3409 8.3120 119.4301 57.6088 40.6313 178.4506 34 Y 3.9496 8.5018 120.0777 61.0425 38.6880 177.8457 35 M 4.0610 8.1681 118.2806 58.6357 32.2895 178.3255 36 N 4.8977 7.9525 118.2193 55.5890 38.5366 177.6683 37 G 3.6055 8.1985 106.5541 47.2821 0.0000 175.2451 38 T 3.9638 7.3258 111.2604 62.7181 69.0689 175.9620 39 G 3.9304 8.3436 110.0683 45.1822 0.0000 173.9627 40 R 4.4026 7.8634 115.0858 56.0023 30.3072 175.1764 41 Y 5.3183 7.6535 116.4954 56.9209 43.1023 174.5139 42 T 4.8515 8.5525 116.6334 61.8709 72.2477 173.7907 43 V 4.2778 9.2257 128.7752 62.8226 31.1402 176.1208 44 V 4.1781 8.5288 122.1185 62.5380 32.7312 176.4810 45 K 4.8248 7.9824 118.7215 55.6780 35.4884 173.8246 46 G 4.5456 8.9765 113.5498 44.5665 0.0000 172.3981 47 I 5.0520 9.0953 123.0984 59.3722 41.0814 174.4382 48 I 4.4210 8.7481 129.2724 60.1928 38.6882 174.9539 49 S 5.3505 8.7144 122.4683 54.4689 63.2171 171.1394 50 P 5.1855 0.0000 0.0000 62.1334 32.1917 176.1903 51 V 3.8820 8.2211 123.2831 60.9763 32.1255 176.5197 52 G 3.9198 8.8212 113.0606 45.7121 0.0000 173.7467 53 D 4.4629 8.6065 117.8052 56.2640 41.0635 178.6765 54 A 4.2008 8.0357 121.0879 54.3451 18.8561 177.7885 55 Y 3.8923 7.9381 117.5889 59.1901 38.8756 177.8739 56 K 3.8950 8.0397 115.1444 56.3897 30.4263 175.9506 57 K 3.7051 7.6555 120.4720 55.9959 32.5815 175.9718 58 K 4.2358 8.3633 126.7243 58.0158 32.4336 177.1339 59 G 4.2502 8.8752 114.5455 44.9010 0.0000 173.0038 60 L 4.0360 7.5849 121.3627 55.0322 41.3236 176.5999 61 I 4.1101 8.2001 120.1419 59.0760 38.6365 174.6003 62 P 4.3697 0.0000 0.0000 63.0623 32.5453 176.9551 63 A 4.0436 8.9784 124.5120 55.7011 18.2942 179.2253 64 Y 3.9304 8.2141 117.3077 61.4613 38.5904 178.2530 65 H 4.2662 8.2263 116.1639 59.0959 28.9527 177.9113 66 R 3.9882 7.8623 119.9668 59.1046 29.9212 179.3919 67 V 3.4517 8.4378 118.6000 65.9407 31.4774 178.1042 68 I 3.3768 7.5969 119.8282 64.6388 36.7879 178.3557 69 M 3.7597 8.1038 119.5270 58.1631 31.8149 178.7270 70 A 3.7686 7.8038 121.0517 54.9427 18.2406 179.5920 71 E 3.7995 7.6771 116.3034 59.2018 29.7170 179.2046 72 L 4.0077 7.9070 118.9392 57.8553 41.5476 179.5179 73 A 4.0550 7.9531 119.3590 54.2552 18.4681 178.7067 74 T 4.2671 7.1714 106.0820 61.2752 68.8873 175.9544 75 K 3.7533 7.5911 124.2197 59.8483 32.1436 177.3091 76 N 4.8570 7.8897 113.3887 53.1526 38.9464 174.1578 77 S 4.7251 7.5959 113.0507 56.4155 64.0547 174.2716 78 K 4.3257 8.7973 126.5870 57.8685 32.5362 177.3092 79 W 5.1121 7.8663 113.1361 55.3505 30.5451 174.6476 80 V 4.1079 6.7444 121.6157 60.9947 31.8696 174.7473 81 E 4.6321 8.5733 125.0525 54.4616 33.4131 174.6072 82 V 4.5500 8.0587 119.5806 61.5006 33.3581 174.4561 83 D 4.9501 8.7625 125.7397 52.3341 43.7348 176.2293 84 T 4.2770 8.8226 117.7612 61.9303 69.3232 176.1342 85 W 4.3345 8.3631 132.6668 61.0726 30.5247 177.4443 86 E 3.7589 8.5214 117.8620 59.3515 28.4811 179.2382 87 S 4.2946 8.2492 113.5423 60.4331 62.8533 175.5618 88 L 4.3501 7.2750 120.7248 54.4109 42.1343 176.7841 89 Q 3.8701 6.8271 119.2845 55.4049 29.0471 176.6852 90 K 4.0747 8.5798 122.6479 58.6581 32.5077 177.1972 91 E 4.5532 7.6869 117.5204 53.8937 30.8878 175.6524 92 W 4.2816 8.8072 133.1032 57.6093 31.3237 174.7012 93 K 4.0029 7.1835 124.9925 53.8489 33.8300 175.5412 94 E 3.2336 7.6595 125.2669 55.9648 30.3053 177.8339 95 T 3.8317 8.5355 120.1343 66.8824 68.4769 176.1499 96 L 3.9531 8.0646 121.4860 58.2235 42.0135 179.1348 97 K 3.9547 8.1945 118.5150 59.4948 31.9662 179.3336 98 V 3.6818 7.8412 117.9785 66.1755 31.3214 177.8983 99 L 3.7598 7.9369 118.5915 57.5420 41.2412 179.4514 100 R 4.0336 7.6609 119.9593 59.0280 30.0324 177.7549 101 H 3.7682 8.2560 118.3803 59.7534 29.6526 176.8938 102 H 4.0131 8.1196 117.7749 58.6482 28.2731 177.6656 103 Q 3.9999 8.2394 120.8745 59.3999 29.3510 177.9227 104 E 4.3350 8.8597 121.6146 58.6171 29.1985 179.2674 105 K 3.7981 8.1446 119.2396 59.4751 32.3698 178.6717 106 L 4.2498 8.1130 118.1598 56.4135 42.7781 178.2578 107 E 4.4227 7.7607 119.2334 53.2043 28.0021 176.1297 108 A 5.1452 7.8929 135.0000 52.5962 21.7150 176.6819 *147 A 4.0549 7.8535 121.9814 53.3424 19.8354 177.0404 148 V 4.2475 8.1393 121.5860 60.3178 32.9124 173.7787 149 P 4.6113 0.0000 0.0000 63.4016 32.2524 175.4489 150 K 4.7722 8.9897 121.9468 54.9697 34.3926 175.6519 151 V 4.6071 8.9214 125.1789 62.0699 32.5385 175.3237 152 K 4.7946 8.9462 126.7636 54.2566 36.1619 175.1385 153 L 4.5548 8.4448 126.3761 54.9415 43.0072 175.2778 154 L 4.9548 8.4718 129.7719 54.2849 43.5287 175.0137 155 C 4.5443 8.7105 119.3433 58.0912 33.6641 172.6245 156 G 4.5070 8.0756 106.3755 44.0172 0.0000 174.6313 157 A 3.9463 8.3438 120.1723 54.1772 17.9616 179.2085 158 D 4.1221 7.8027 116.0917 57.2892 41.6766 177.7672 159 L 4.0302 7.5858 120.1607 57.9407 42.2892 178.0385 160 L 2.7103 6.9824 120.3282 58.1806 41.8790 179.0537 161 E 2.6766 7.6103 118.0956 58.5704 29.1905 179.1252 162 S 4.3952 7.5862 113.2579 60.3797 62.8621 176.0772 163 F 4.2227 7.6596 121.1265 59.9182 38.6586 176.0575 164 A 4.6997 7.9652 118.1371 50.7810 19.8941 177.0143 165 V 3.7889 7.8643 120.1450 61.7181 32.2313 173.7720 166 P 4.4745 0.0000 0.0000 64.3243 31.4177 176.4612 167 N 4.4648 9.0877 118.9151 53.5515 36.7290 175.2570 168 L 4.0922 8.1067 120.1368 57.3138 42.3920 176.8653 169 W 4.9057 8.0811 116.0022 54.4263 32.0494 175.3508 170 K 4.3310 8.7579 121.4522 55.9209 32.5305 177.8336 171 S 4.0965 9.1733 120.0894 62.1164 62.4676 176.6117 172 E 4.1376 8.1738 120.6697 58.1560 29.2457 178.8384 173 D 4.4115 8.9137 120.8204 57.3281 40.9273 178.4073 174 I 3.1810 7.7209 119.7867 64.5284 36.9212 178.4181 175 T 3.7697 7.6648 115.8129 66.9309 68.4052 176.8779 176 Q 4.0427 7.9293 119.3609 58.4437 28.6027 178.7234 177 I 3.9461 7.8976 121.3290 64.7432 37.0153 178.8570 178 V 3.6696 7.4397 111.5021 64.1591 31.4430 178.4543 179 A 3.9796 7.8882 119.7981 55.0354 18.4285 178.8541 180 N 4.4260 8.2808 112.6763 54.2669 39.1472 174.6059 181 Y 4.3976 8.3338 114.9397 59.0211 40.9327 174.8843 182 G 4.2396 7.3628 103.9636 43.4190 0.0000 172.4270 183 L 4.8071 9.0300 122.8024 53.9371 45.6729 174.6855 184 I 4.5270 8.9676 129.0567 60.0978 38.5241 174.3518 185 C 4.8125 8.5643 129.3694 57.7142 32.9958 172.5992 186 V 4.3606 8.4130 127.8047 62.4280 32.8506 174.6599 187 T 4.2663 8.1004 119.0987 61.9061 70.8372 174.1080 188 R 3.9353 8.8211 124.8381 57.9962 30.7511 177.2813 189 A 4.5258 7.5866 122.5650 50.1855 18.1345 177.1110 190 G 3.4843 7.8088 109.3661 47.1277 0.0000 172.1931 191 N 4.4178 8.0566 118.8793 56.5749 39.0054 176.6690 192 D 4.4272 8.0748 119.8023 57.0982 40.9550 178.4268 193 A 3.9632 7.7657 121.3643 55.1935 18.4177 179.6328 194 Q 4.0275 8.1640 116.6018 58.9976 28.7279 179.0952 195 K 4.1093 8.5602 120.9509 59.6835 32.1116 178.5155 196 F 4.0311 8.3665 119.6783 61.3978 39.5445 176.9395 197 I 4.0431 8.1659 119.5126 64.6351 36.8066 177.7956 198 Y 4.5389 8.2223 119.0550 60.4933 38.6756 176.9684 199 E 3.8974 8.1509 117.2141 55.3271 29.8925 176.1027 200 S 4.4997 7.4391 114.8578 55.6609 65.0752 174.3053 201 D 4.3892 8.7768 127.8000 57.4090 40.6885 178.9431 202 V 3.6315 7.7143 118.1481 65.9838 31.4368 177.8409 203 L 4.0190 7.9594 117.4078 57.5810 41.8608 178.7078 204 W 4.3334 8.4516 128.5021 60.6730 30.3565 177.4854 205 K 3.8404 8.2398 118.1456 59.7122 31.6776 177.4132 206 H 4.7875 7.7912 114.1020 55.6889 29.1845 177.0535 207 R 3.8298 8.0183 122.6285 59.3356 28.5550 178.1652 208 S 4.1961 7.8929 112.1258 60.1166 63.4704 174.0711 209 N 4.8606 8.5310 118.3376 53.0682 39.8601 174.0592 210 I 4.7208 7.4805 120.8764 60.0066 39.1095 175.0970 211 H 4.7066 9.0280 126.2702 53.8612 30.3472 174.4082 212 V 4.1413 8.2422 124.6044 62.4142 32.3079 175.1550 213 V 3.9535 8.8201 129.0503 60.8420 33.7118 174.2642 214 N 4.4239 8.5921 125.5825 53.0428 39.3011 174.8793 215 E 4.2696 7.9188 125.4857 54.1591 28.8723 175.3814 216 W 4.2999 8.3400 125.8514 58.8592 29.6391 176.7280 217 I 3.9577 7.7535 118.7564 59.7894 35.7882 174.8739 218 A 3.9672 8.6108 129.4758 52.5290 17.9043 175.7719 219 N 4.9840 8.5749 119.9063 52.7853 41.7772 174.5711 220 D 5.0801 8.3047 125.7348 53.4512 41.6007 177.1431 221 I 4.1565 7.3882 121.4224 60.1570 36.3996 176.7523 222 S 4.3108 7.6910 118.6622 57.9083 65.3837 175.3134 223 S 4.0896 8.6948 120.4568 62.3253 62.6335 177.1824 224 T 3.8109 7.8353 117.7037 66.6874 68.1835 176.6345 225 K 4.0760 8.1377 120.2125 58.9704 32.0308 179.6436 226 I 3.6369 7.5092 120.2450 64.5208 37.0140 178.4660 227 R 3.7265 7.9850 119.0903 59.2128 29.5195 179.1222 228 R 3.8441 7.9888 118.1679 59.2722 30.1043 178.4397 229 A 3.9995 8.0621 120.5623 55.1249 18.3518 179.2516 230 L 3.9313 8.3722 117.7895 58.4574 41.6002 180.1058 231 R 3.9494 8.1154 116.3615 59.0425 30.0784 178.3954 232 R 4.3872 7.5367 114.9915 55.4781 30.4686 176.7691 233 G 3.8461 8.0348 107.0435 46.5424 0.0000 173.8558 234 Q 4.5047 7.7436 117.6107 53.7033 30.4135 175.8384 235 S 4.2949 8.4344 115.0368 58.5526 63.0143 173.8476 236 I 4.5563 8.1220 118.9517 60.3512 38.0360 174.9228 237 R 3.7999 7.8870 121.2313 58.2177 30.1702 176.3428 238 Y 3.8724 8.3149 120.4593 58.3800 35.5160 169.5915 239 L 4.6412 7.7103 119.9467 54.9313 43.4369 176.5860 240 V 4.8750 7.3205 109.4868 57.7553 35.7878 173.8982 241 P 4.4378 0.0000 0.0000 62.4271 33.0759 177.4280 242 D 4.2998 8.6079 120.7720 57.8103 40.8081 179.1816 243 L 3.8490 7.9696 118.7417 57.8716 41.5612 179.8116 244 V 3.6026 7.6607 117.5930 65.8874 31.5586 177.6478 245 Q 3.9919 8.2358 119.4085 59.2801 28.8925 178.0013 246 E 3.9388 8.8965 120.1109 59.7801 29.6413 178.7274 247 Y 3.9894 8.2615 119.4095 60.8389 38.9184 178.4025 248 I 3.8442 8.1542 120.6920 64.3898 37.0459 178.2166 249 E 3.9791 8.2753 118.7383 59.2456 29.3475 179.0477 250 K 3.9626 7.9288 118.6649 59.2202 32.3837 177.7188 251 H 4.5602 7.5328 112.2720 54.3284 29.0628 174.4187 252 N 4.2010 8.0960 117.6044 53.4838 36.7994 176.3379 253 L 3.9241 8.0884 118.5056 57.1570 42.0107 177.6887 254 Y 4.7035 6.7248 115.6136 56.0983 40.2256 175.4642 255 S 4.5881 9.0303 118.0326 56.6247 67.1825 177.0771 256 S 4.1108 8.8651 117.7990 62.1565 62.7207 176.2441 257 E 4.0892 8.2592 121.1152 59.5826 29.4730 178.9963 258 S 4.2285 7.8383 113.8321 61.0956 62.9074 175.9021 259 E 4.0956 8.1922 122.2499 58.6333 29.6862 177.5552 260 D 4.5783 7.8496 117.3331 54.1236 41.4700 176.5126 261 R 4.0853 7.4274 119.5276 57.9577 30.6638 176.6527 262 N 4.3178 9.0834 117.0410 53.5958 36.1882 173.9693 263 A 4.1096 7.8314 121.3512 53.5764 18.7476 179.4801 264 G 3.9170 8.6267 107.7753 45.8479 0.0000 174.0378 265 V 4.0412 7.5353 119.4742 61.5645 32.6198 175.2069 266 I 3.9782 7.9486 126.7969 59.9995 38.2034 176.1659 267 L 3.3974 8.3844 125.4353 55.4072 43.0704 177.1074 268 A 3.7341 8.0546 129.1223 55.0644 18.3836 177.9641 269 P 4.0406 0.0000 0.0000 65.7674 31.1279 178.7208 270 L 3.9305 7.4826 115.5830 57.7256 41.8196 178.9020 271 Q 4.0441 7.8115 119.2217 59.3473 28.8307 178.5191 272 R 4.0263 7.8406 118.0299 58.6985 30.0658 177.1143 273 N 4.9229 7.6610 113.7216 53.1683 38.9486 175.4653 274 T 4.5456 7.9997 115.6086 62.5014 70.8786 173.9614 275 A 4.3309 7.9921 128.5271 52.1146 19.2860 175.8504 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 5 E 8.44 4.29 0.00 2.06 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 2.16 2.32 0.00 6 K 8.92 4.13 0.00 1.73 1.76 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.49 7.81 7 T 9.16 4.40 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 1.36 0.00 0.00 8 E 8.90 4.74 0.00 1.97 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 0.00 2.43 2.34 0.00 9 V 8.97 5.00 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 0.78 0.00 0.00 0.97 0.00 0.00 10 V 9.00 4.86 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 1.14 0.00 0.00 1.00 0.00 0.00 11 L 8.96 4.75 0.00 1.89 1.53 1.13 0.09 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 12 L 8.86 4.83 0.00 1.73 1.54 0.77 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 13 A 9.18 5.05 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 14 C 8.62 4.88 0.00 2.93 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 15 G 7.90 3.36 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 0.00 16 S 8.47 4.00 0.00 3.77 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 7.33 3.79 0.00 3.32 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 7.78 5.56 0.00 2.71 2.76 0.00 0.00 7.18 7.69 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 19 P 0.00 5.73 0.00 2.32 2.31 0.00 3.21 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 20 I 8.22 4.05 1.82 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.87 0.92 0.00 0.00 21 T 8.43 4.82 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 1.35 0.00 0.00 22 N 9.02 4.38 0.00 2.83 2.95 0.00 0.00 7.07 8.23 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 23 M 7.51 4.42 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 24 H 7.78 4.35 0.00 3.41 3.67 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.85 3.98 0.00 1.89 1.71 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.62 3.97 0.00 2.10 2.21 0.00 3.24 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 27 L 8.27 3.93 0.00 2.11 1.65 0.90 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.11 4.10 0.00 3.19 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 29 E 8.34 4.27 0.00 2.30 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 2.75 2.66 0.00 30 L 8.22 4.02 0.00 1.86 1.74 0.92 0.89 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 31 A 7.99 4.11 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 32 K 8.42 3.82 0.00 1.82 1.84 0.00 0.61 0.00 0.00 0.66 0.00 0.00 2.40 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.08 0.98 7.81 33 D 8.31 4.34 0.00 2.93 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 34 Y 8.50 3.95 0.00 3.11 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 35 M 8.17 4.06 0.00 1.94 2.17 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.96 0.00 36 N 7.95 4.90 0.00 2.67 2.81 0.00 0.00 6.46 7.98 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 37 G 8.20 3.61 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 38 T 7.33 3.96 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 0.95 0.00 0.00 39 G 8.34 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.86 4.40 0.00 1.41 1.90 0.00 2.47 0.00 0.00 3.03 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.05 0.00 41 Y 7.65 5.32 0.00 3.13 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 42 T 8.55 4.85 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 1.20 0.00 0.00 43 V 9.23 4.28 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 0.75 0.00 0.00 0.92 0.00 0.00 44 V 8.53 4.18 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 0.81 0.00 0.00 1.07 0.00 0.00 45 K 7.98 4.82 0.00 1.89 1.69 0.00 1.71 0.00 0.00 2.16 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.46 7.81 46 G 8.98 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 0.00 0.00 0.00 0.00 47 I 9.10 5.05 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.84 0.86 0.00 0.00 48 I 8.75 4.42 1.51 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.14 0.00 0.00 0.00 49 S 8.71 5.35 0.00 4.00 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 50 P 0.00 5.19 0.00 2.05 2.14 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 51 V 8.22 3.88 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.78 0.00 0.00 52 G 8.82 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.61 4.46 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 54 A 8.04 4.20 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 0.00 0.00 0.00 0.00 0.00 55 Y 7.94 3.89 0.00 3.11 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 56 K 8.04 3.90 0.00 1.76 1.81 0.00 1.82 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.52 1.42 7.81 57 K 7.66 3.71 0.00 1.83 1.81 0.00 1.97 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.42 7.81 58 K 8.36 4.24 0.00 1.71 1.68 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.57 7.81 59 G 8.88 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 0.00 0.00 0.00 0.00 60 L 7.58 4.04 0.00 1.78 1.77 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 61 I 8.20 4.11 1.80 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.75 0.87 0.00 0.00 62 P 0.00 4.37 0.00 2.27 2.10 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 63 A 8.98 4.04 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 64 Y 8.21 3.93 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 65 H 8.23 4.27 0.00 3.49 3.42 0.00 5.70 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 66 R 7.86 3.99 0.00 2.00 2.08 0.00 3.57 0.00 0.00 3.47 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.75 0.00 67 V 8.44 3.45 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 0.85 0.00 0.00 0.92 0.00 0.00 68 I 7.60 3.38 1.57 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 1.15 -0.16 0.23 0.00 0.00 69 M 8.10 3.76 0.00 1.99 2.18 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 2.70 2.39 0.00 70 A 7.80 3.77 1.10 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 71 E 7.68 3.80 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.49 0.00 72 L 7.91 4.01 0.00 1.71 1.63 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.95 4.06 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 7.17 4.27 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 0.84 0.00 0.00 75 K 7.59 3.75 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.39 7.81 76 N 7.89 4.86 0.00 2.70 2.80 0.00 0.00 6.65 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 77 S 7.60 4.73 0.00 3.62 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 78 K 8.80 4.33 0.00 1.92 1.92 0.00 1.97 0.00 0.00 1.99 0.00 0.00 3.24 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.53 1.56 7.81 79 W 7.87 5.11 0.00 3.46 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 80 V 6.74 4.11 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 -0.43 0.00 0.00 -1.16 0.00 0.00 81 E 8.57 4.63 0.00 1.93 1.87 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 2.22 2.14 0.00 82 V 8.06 4.55 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 0.70 0.00 0.00 0.72 0.00 0.00 83 D 8.76 4.95 0.00 2.85 2.55 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 0.00 84 T 8.82 4.28 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 1.18 0.00 0.00 85 W 8.36 4.33 0.00 3.42 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 86 E 8.52 3.76 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 87 S 8.25 4.29 0.00 4.08 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.27 4.35 0.00 1.57 1.65 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 6.83 3.87 0.00 1.72 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.99 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 90 K 8.58 4.07 0.00 1.69 1.84 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.40 7.81 91 E 7.69 4.55 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 92 W 8.81 4.28 0.00 3.45 3.26 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 93 K 7.18 4.00 0.00 1.30 1.34 0.00 1.47 0.00 0.00 1.52 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.12 1.36 7.81 94 E 7.66 3.23 0.00 1.88 1.70 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 2.35 2.14 0.00 95 T 8.54 3.83 4.56 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 1.38 0.00 0.00 96 L 8.06 3.95 0.00 1.87 1.73 1.08 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.19 3.95 0.00 1.98 1.91 0.00 1.75 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.42 7.81 98 V 7.84 3.68 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 1.33 0.00 0.00 1.10 0.00 0.00 99 L 7.94 3.76 0.00 1.39 0.40 0.79 0.46 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.53 0.00 108 A 7.89 5.15 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *147 A 7.85 4.05 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 0.00 148 V 8.14 4.25 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 0.90 0.00 0.00 0.94 0.00 0.00 149 P 0.00 4.61 0.00 2.01 2.05 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 150 K 8.99 4.77 0.00 1.76 1.77 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.42 7.81 151 V 8.92 4.61 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 0.74 0.00 0.00 1.02 0.00 0.00 152 K 8.95 4.79 0.00 1.64 1.64 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.39 7.81 153 L 8.44 4.55 0.00 1.79 1.59 1.04 1.08 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 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0.00 4.26 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 F 7.66 4.22 0.00 3.20 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 0.00 164 A 7.97 4.70 1.51 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 0.00 165 V 7.86 3.79 2.35 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 1.01 0.00 0.00 1.02 0.00 0.00 166 P 0.00 4.47 0.00 2.11 2.04 0.00 3.87 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 2.16 0.00 167 N 9.09 4.46 0.00 2.91 3.01 0.00 0.00 7.07 7.85 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 0.00 168 L 8.11 4.09 0.00 1.75 2.12 0.81 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 169 W 8.08 4.91 0.00 3.29 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 K 8.76 4.33 0.00 2.12 1.96 0.00 1.75 0.00 0.00 1.93 0.00 0.00 3.03 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.60 1.53 7.81 171 S 9.17 4.10 0.00 4.04 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.17 4.14 0.00 2.11 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 2.42 2.48 0.00 173 D 8.91 4.41 0.00 3.02 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 0.00 174 I 7.72 3.18 1.76 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 1.12 0.29 0.00 0.00 175 T 7.66 3.77 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 176 Q 7.93 4.04 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 177 I 7.90 3.95 2.03 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.88 1.05 0.00 0.00 178 V 7.44 3.67 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 0.80 0.00 0.00 1.00 0.00 0.00 179 A 7.89 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 N 8.28 4.43 0.00 2.53 2.39 0.00 0.00 6.91 7.49 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 0.00 181 Y 8.33 4.40 0.00 3.26 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 7.36 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 0.00 0.00 0.00 0.00 183 L 9.03 4.81 0.00 1.73 1.51 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 184 I 8.97 4.53 1.78 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 1.04 0.49 0.80 0.00 0.00 185 C 8.56 4.81 0.00 2.88 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 0.00 186 V 8.41 4.36 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 0.78 0.00 0.00 0.82 0.00 0.00 187 T 8.10 4.27 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 1.11 0.00 0.00 188 R 8.82 3.94 0.00 1.76 1.88 0.00 3.39 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 189 A 7.59 4.53 1.20 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 0.00 0.00 0.00 190 G 7.81 3.48 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 0.00 191 N 8.06 4.42 0.00 2.79 2.84 0.00 0.00 7.24 8.49 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 0.00 192 D 8.07 4.43 0.00 2.92 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 A 7.77 3.96 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 0.00 194 Q 8.16 4.03 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 195 K 8.56 4.11 0.00 2.00 2.10 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.59 7.81 196 F 8.37 4.03 0.00 3.20 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 I 8.17 4.04 2.25 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 1.58 1.26 1.05 0.00 0.00 198 Y 8.22 4.54 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 0.00 199 E 8.15 3.90 0.00 1.75 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 2.21 2.64 0.00 200 S 7.44 4.50 0.00 3.62 3.48 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 0.00 201 D 8.78 4.39 0.00 2.71 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 0.00 202 V 7.71 3.63 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 1.10 0.00 0.00 0.93 0.00 0.00 203 L 7.96 4.02 0.00 1.88 1.84 1.23 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 204 W 8.45 4.33 0.00 3.61 3.20 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 0.00 205 K 8.24 3.84 0.00 1.89 2.03 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.11 1.44 7.81 206 H 7.79 4.79 0.00 3.23 3.25 0.00 5.70 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 8.02 3.83 0.00 1.72 1.96 0.00 2.21 0.00 0.00 2.29 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.35 0.00 208 S 7.89 4.20 0.00 3.99 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 0.00 209 N 8.53 4.86 0.00 2.80 2.96 0.00 0.00 6.68 6.93 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 0.00 210 I 7.48 4.72 1.84 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 0.59 0.90 0.00 0.00 211 H 9.03 4.71 0.00 2.95 3.21 0.00 5.61 0.00 0.00 0.00 0.00 6.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.24 4.14 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 0.62 0.00 0.00 0.89 0.00 0.00 213 V 8.82 3.95 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 0.77 0.00 0.00 0.11 0.00 0.00 214 N 8.59 4.42 0.00 2.40 1.42 0.00 0.00 6.90 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 0.00 215 E 7.92 4.27 0.00 1.81 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 2.32 2.21 0.00 216 W 8.34 4.30 0.00 3.38 3.25 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 0.00 217 I 7.75 3.96 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 0.95 0.00 0.00 218 A 8.61 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 N 8.57 4.98 0.00 2.81 2.87 0.00 0.00 6.31 8.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 D 8.30 5.08 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 I 7.39 4.16 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.67 0.96 0.00 0.00 222 S 7.69 4.31 0.00 4.02 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 0.00 223 S 8.69 4.09 0.00 3.88 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 0.00 224 T 7.84 3.81 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 225 K 8.14 4.08 0.00 1.80 1.84 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 226 I 7.51 3.64 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.86 0.81 0.00 0.00 227 R 7.99 3.73 0.00 1.73 1.91 0.00 3.18 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.52 0.00 228 R 7.99 3.84 0.00 1.94 2.13 0.00 3.09 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 229 A 8.06 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 L 8.37 3.93 0.00 1.85 1.85 0.98 0.96 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 0.00 231 R 8.12 3.95 0.00 1.78 2.04 0.00 3.23 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.95 0.00 232 R 7.54 4.39 0.00 1.90 1.97 0.00 3.24 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 233 G 8.03 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 0.00 234 Q 7.74 4.50 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 235 S 8.43 4.29 0.00 3.85 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 0.00 236 I 8.12 4.56 1.87 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 1.30 0.88 0.96 0.00 0.00 237 R 7.89 3.80 0.00 1.60 1.61 0.00 3.07 0.00 0.00 2.74 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 238 Y 8.31 3.87 0.00 3.21 3.10 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 0.00 239 L 7.71 4.64 0.00 1.82 1.70 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 240 V 7.32 4.87 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 0.76 0.00 0.00 0.99 0.00 0.00 241 P 0.00 4.44 0.00 2.13 1.95 0.00 3.61 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 242 D 8.61 4.30 0.00 2.65 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 0.00 243 L 7.97 3.85 0.00 1.66 1.73 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 244 V 7.66 3.60 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 1.09 0.00 0.00 0.91 0.00 0.00 245 Q 8.24 3.99 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 246 E 8.90 3.94 0.00 2.26 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 2.33 2.31 0.00 247 Y 8.26 3.99 0.00 3.23 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 I 8.15 3.84 2.14 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.28 1.10 0.00 0.00 249 E 8.28 3.98 0.00 2.00 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 2.63 2.45 0.00 250 K 7.93 3.96 0.00 1.69 1.68 0.00 1.65 0.00 0.00 1.36 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.06 1.31 7.81 251 H 7.53 4.56 0.00 2.88 3.08 0.00 5.86 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 N 8.10 4.20 0.00 2.85 2.82 0.00 0.00 6.94 6.05 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 0.00 253 L 8.09 3.92 0.00 1.34 1.05 1.03 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 254 Y 6.72 4.70 0.00 3.18 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 0.00 255 S 9.03 4.59 0.00 3.98 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 0.00 256 S 8.87 4.11 0.00 3.87 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 0.00 257 E 8.26 4.09 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 258 S 7.84 4.23 0.00 4.07 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 E 8.19 4.10 0.00 2.17 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 2.35 2.41 0.00 260 D 7.85 4.58 0.00 2.88 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 0.00 261 R 7.43 4.09 0.00 1.96 1.88 0.00 3.24 0.00 0.00 3.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 262 N 9.08 4.32 0.00 2.90 2.97 0.00 0.00 7.01 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 0.00 263 A 7.83 4.11 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 0.00 264 G 8.63 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 265 V 7.54 4.04 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 0.73 0.00 0.00 0.92 0.00 0.00 266 I 7.95 3.98 1.78 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.61 0.83 0.00 0.00 267 L 8.38 3.40 0.00 1.44 1.23 -0.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 268 A 8.05 3.73 1.04 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 0.00 269 P 0.00 4.04 0.00 1.77 1.88 0.00 2.82 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 270 L 7.48 3.93 0.00 1.60 1.66 0.83 0.87 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 0.00 271 Q 7.81 4.04 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 272 R 7.84 4.03 0.00 1.95 2.16 0.00 3.60 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 273 N 7.66 4.92 0.00 2.87 2.84 0.00 0.00 6.78 7.10 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 0.00 274 T 8.00 4.55 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 1.20 0.00 0.00 275 A 7.99 4.33 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 * Residues marked with a * may have inaccurate shift predictions.