NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.2862 8.4449 118.7932 56.0876 31.5749 176.0682 6 K 4.1616 7.6823 118.0337 54.9148 33.6058 175.0038 7 T 4.3124 9.1043 121.4803 63.0589 70.1482 173.8904 8 E 4.7930 8.9046 126.7076 56.3175 30.9446 176.0395 9 V 4.9964 9.1456 123.6627 61.0428 35.5380 174.1668 10 V 4.8957 8.9048 125.9307 61.1393 34.3909 174.1454 11 L 4.9271 9.0988 128.6606 53.8357 43.2753 175.3138 12 L 5.2314 9.1109 126.4211 53.1266 44.8300 174.6408 13 A 5.1042 9.3021 128.5517 50.6336 21.1939 175.3982 14 C 5.1519 9.7598 120.1280 58.1153 30.8034 173.3985 15 G 3.9059 8.0845 109.5118 44.5047 0.0000 173.6470 16 S 4.1309 7.8192 114.0083 58.7524 64.3447 174.3544 17 F 3.5853 7.1151 118.8038 58.8641 36.3387 175.1930 18 N 5.3235 7.9127 118.2598 50.5305 39.0243 170.3197 19 P 5.5960 0.0000 0.0000 59.7675 34.4218 175.5454 20 I 4.0180 8.1939 118.6411 61.4048 38.3133 174.9421 21 T 4.8344 8.4718 115.3247 59.3137 73.3240 174.4503 22 N 4.3632 8.8759 117.6980 56.5414 38.2212 177.4590 23 M 4.0326 7.8652 119.8526 58.9928 32.1221 177.8783 24 H 4.2721 8.1021 114.6608 59.0594 29.0852 177.3086 25 L 4.3198 7.9147 120.6998 57.8205 41.3974 179.6039 26 R 4.0402 8.4942 118.5389 59.1966 29.9924 178.7084 27 L 3.9498 8.3305 119.1692 58.2257 41.6702 179.8431 28 F 4.2307 8.2640 117.1942 60.4926 38.7999 177.4663 29 E 4.2727 8.5963 117.7630 59.6357 29.3051 179.0727 30 L 4.0331 8.4061 118.8575 58.1025 41.7452 179.6680 31 A 4.0403 8.1286 120.4334 54.8528 18.1612 179.7009 32 K 3.8163 8.3783 118.1706 59.8211 32.2689 178.6550 33 D 4.3440 8.2758 119.3431 57.6664 40.6268 178.2874 34 Y 3.9374 8.3801 119.9745 60.9244 38.6672 177.7279 35 M 3.9924 8.3645 118.8073 58.7940 32.6225 178.3944 36 N 4.8311 7.9248 117.9935 55.7075 38.4123 177.7241 37 G 3.5982 8.0642 107.0904 47.7868 0.0000 175.5377 38 T 3.9032 7.3218 110.8026 62.6108 68.7714 175.8169 39 G 3.9094 7.8058 108.4366 45.7304 0.0000 174.0801 40 R 4.2473 7.9530 117.9984 56.5254 31.8874 175.4991 41 Y 5.3436 7.7336 115.2937 56.3870 43.0866 174.6607 42 T 4.6771 8.7449 116.4740 61.9319 72.3409 173.7875 43 V 4.3408 8.9725 128.4729 62.8108 31.2029 176.0931 44 V 4.1629 8.8080 122.5420 62.9961 32.6864 176.2820 45 K 4.9825 7.9898 119.2641 55.5322 35.6414 174.3021 46 G 4.4597 8.9727 111.2758 44.4324 0.0000 171.8573 47 I 4.9859 9.2855 123.4909 59.3427 41.1897 174.2753 48 I 4.6012 8.6760 128.5273 59.9655 38.8695 174.7694 49 S 5.0800 8.7985 122.5520 54.4618 62.9598 171.2662 50 P 5.1189 0.0000 0.0000 62.0011 31.9871 176.5952 51 V 3.8825 8.3574 123.7910 61.4074 32.3753 176.5515 52 G 3.8968 8.6741 111.4854 45.2286 0.0000 174.4039 53 D 4.4665 8.6739 119.1298 56.7239 40.9420 178.4091 54 A 4.3366 7.9894 120.2807 53.6990 18.7958 177.6880 55 Y 3.9207 8.2568 117.8695 58.4002 38.9963 177.1042 56 K 3.8037 8.0875 116.4494 56.6867 30.4140 175.5627 57 K 3.7888 7.5162 120.0433 55.7552 32.7206 176.1432 58 K 4.1888 8.3477 126.4097 57.7576 32.5709 177.1375 59 G 3.8943 8.8037 113.0864 45.6051 0.0000 173.2905 60 L 4.1222 7.6561 122.4115 54.5933 42.0340 176.8793 61 I 4.2239 7.9902 119.5096 58.8203 39.1222 174.2093 62 P 4.6291 0.0000 0.0000 62.2245 32.5994 177.2120 63 A 4.0570 9.0958 124.2140 55.6437 18.3455 179.4189 64 Y 4.0593 8.1017 117.3111 61.2677 38.7393 178.1019 65 H 4.2420 8.2193 116.4418 59.0912 29.0121 177.9026 66 R 3.9819 7.8531 119.9871 59.1733 29.8345 179.3493 67 V 3.4871 8.2166 118.6254 65.8359 31.4243 178.2782 68 I 3.3682 7.3574 119.5585 64.4726 36.8187 178.1765 69 M 3.8005 8.0136 119.6354 58.4022 31.7512 178.7676 70 A 3.8388 7.7767 120.6503 54.9387 18.2992 179.6250 71 E 3.7636 7.8562 117.2565 59.4318 29.2985 179.4870 72 L 3.8852 7.9041 118.2551 57.7274 41.7306 179.2065 73 A 4.1385 8.1059 120.4064 54.1812 18.4962 178.7667 74 T 4.2784 7.2955 106.5053 61.2249 68.8840 176.0519 75 K 3.7151 7.3798 124.3358 60.1283 32.0798 177.5379 76 N 4.7984 7.9517 112.7985 53.1424 38.7098 174.2232 77 S 4.6962 7.6513 113.7450 56.3705 63.5709 174.5016 78 K 4.2712 8.7612 126.8541 58.6447 33.1324 177.2630 79 W 5.0479 7.9570 113.7456 55.3504 30.3331 174.6389 80 V 4.1500 7.2152 121.7139 60.9365 32.1847 174.5482 81 E 4.6310 8.7311 125.0696 54.4740 33.5986 174.2685 82 V 4.6202 8.0740 119.2539 61.1244 33.0881 174.0452 83 D 5.1157 8.9435 127.3076 52.6893 43.7909 176.3334 84 T 4.3978 8.6637 116.4170 61.0111 69.4311 176.2570 85 W 4.2875 8.5062 132.7576 61.2157 30.7761 177.4069 86 E 3.6547 8.5179 117.7767 59.3779 29.0560 179.4481 87 S 4.2878 8.1144 113.8336 60.8461 62.8167 175.6743 88 L 4.4614 7.2930 120.1198 54.1396 41.8345 176.7583 89 Q 3.8319 6.8738 119.1170 55.4696 28.7653 176.7356 90 K 4.0703 8.5809 123.1295 58.1468 32.5099 176.9165 91 E 4.6170 7.7393 118.0795 53.5004 31.3362 175.4711 92 W 4.2020 8.9695 133.5067 57.9699 31.1140 174.8590 93 K 4.0163 7.3549 124.3437 53.9743 33.5257 176.2421 94 E 3.2755 7.6974 122.4753 56.2767 30.2415 178.0190 95 T 3.8902 8.5974 119.1733 66.9600 68.4591 176.3525 96 L 3.9226 8.0704 121.4907 58.3192 42.0816 179.1609 97 K 3.9788 8.0869 118.3167 59.2204 31.8743 179.5689 98 V 3.6431 7.6417 118.2047 65.9178 31.5221 177.8569 99 L 3.7545 8.0284 119.0351 57.6219 41.2788 179.4451 100 R 3.9231 7.7134 119.8519 59.0497 30.0010 177.6851 101 H 3.6478 8.3915 118.2409 59.8320 29.6539 176.8819 102 H 4.0011 8.1563 117.6839 58.4902 28.4346 177.7407 103 Q 3.9735 8.2573 121.6686 59.2595 28.9950 177.9938 104 E 4.1715 8.3739 121.3659 58.7791 29.2515 179.2426 105 K 3.8068 7.7562 118.6193 59.5119 32.2453 178.5591 106 L 4.1470 7.5793 118.3981 57.6701 41.7523 178.9591 107 E 4.1341 8.1618 118.5710 58.8151 29.3579 178.2943 108 A 4.0888 7.7376 120.6534 51.9661 18.8723 177.5711 *147 A 4.1032 7.8289 121.0029 53.0895 20.2374 177.2128 148 V 4.2982 7.7363 119.0523 61.7197 32.9748 173.4972 149 P 4.5776 0.0000 0.0000 63.4358 32.1541 175.5778 150 K 4.7756 9.0483 122.3752 54.9124 34.4245 175.6733 151 V 4.5766 8.9725 125.3202 62.2489 32.4189 175.3457 152 K 4.8063 9.1253 127.0604 54.2895 36.1689 175.1035 153 L 4.5876 8.6209 126.6708 54.8890 43.1378 175.1018 154 L 4.9754 8.8630 129.8175 54.0794 43.5046 175.0961 155 C 4.5247 8.8593 120.0357 58.0940 33.6409 172.0762 156 G 4.5799 8.1093 105.6200 43.7412 0.0000 174.3639 157 A 3.9064 8.4995 120.2959 55.2287 18.2353 179.1632 158 D 4.1824 7.9963 116.8478 57.6723 40.6702 178.9501 159 L 3.9055 7.6388 118.3590 57.9684 42.4098 178.2500 160 L 2.9619 7.1732 120.1980 57.9179 42.0123 178.9216 161 E 2.5400 7.7755 118.6120 58.2871 29.2132 178.9178 162 S 4.4130 7.6925 113.6151 60.1029 62.9221 176.0405 163 F 4.1930 7.7498 121.2819 60.1428 38.6758 176.1239 164 A 4.6526 8.0191 118.0441 51.1350 19.4516 177.3273 165 V 3.7711 7.7439 119.6699 61.5660 32.1421 173.6954 166 P 4.4206 0.0000 0.0000 64.5080 31.4827 176.1581 167 N 4.3681 9.0024 118.2089 53.6910 36.4241 174.8813 168 L 4.1437 8.0291 121.0021 56.5803 42.5243 177.0508 169 W 5.1038 7.9473 116.3253 54.3903 32.8870 174.7533 170 K 4.3301 8.7738 122.2019 55.8780 32.6045 177.9877 171 S 4.1495 9.0628 119.3402 62.0899 62.6564 176.8068 172 E 4.0540 8.1949 121.1785 58.8022 29.0939 179.0241 173 D 4.3698 8.4621 119.7643 57.4345 41.0029 178.4236 174 I 3.1847 7.7573 119.7871 64.6998 36.9061 178.3408 175 T 3.8111 7.7275 116.0865 66.9156 68.2709 176.8434 176 Q 4.0063 8.0744 119.6366 58.6072 28.5946 178.8605 177 I 3.9879 8.0748 121.3610 64.7366 37.0209 178.9163 178 V 3.6875 7.6829 111.4908 64.1306 31.4612 178.2728 179 A 4.0108 8.0828 120.2409 54.2587 18.3872 178.4542 180 N 4.5754 8.1931 112.3301 53.9174 39.8403 173.9737 181 Y 4.3660 7.9749 115.1397 56.6045 41.6348 174.6429 182 G 4.3485 8.0383 105.0420 43.7252 0.0000 172.3419 183 L 5.2288 9.0312 119.8697 52.7523 46.0255 176.0993 184 I 4.7102 9.1100 123.5875 59.8628 39.8034 174.1271 185 C 4.8715 8.9677 129.6762 57.6964 33.0909 172.5504 186 V 4.4798 8.2671 127.5312 62.1395 33.0163 174.5803 187 T 4.3230 8.1074 118.9745 61.9649 70.9775 173.8739 188 R 4.0535 8.7902 123.8055 57.1055 31.0094 177.0592 189 A 4.5920 7.7805 122.0394 49.7322 18.8062 176.7459 190 G 3.4925 7.8954 109.2553 47.1921 0.0000 172.1064 191 N 4.6881 8.0586 118.4685 55.6199 39.0521 176.4870 192 D 4.2793 8.0007 119.2396 57.4683 41.4140 177.8250 193 A 4.0388 7.7707 120.9081 55.2111 18.2937 179.5450 194 Q 4.0084 8.6156 117.0392 58.9109 28.7578 178.9691 195 K 4.0495 8.3227 120.6167 59.6739 32.1078 178.3581 196 F 4.0152 8.1544 119.3766 61.5377 39.4041 176.8757 197 I 3.9689 8.3541 119.5260 64.6387 36.7291 177.7926 198 Y 4.4767 8.2637 119.5178 60.7394 38.7611 177.2907 199 E 3.9077 8.4067 116.8408 55.9984 29.8040 176.4312 200 S 4.5078 7.2955 114.8695 55.6704 65.0697 174.0784 201 D 4.4159 8.8655 128.1329 57.5331 40.3908 179.2186 202 V 3.6948 7.6597 117.9644 64.7600 31.9356 178.0339 203 L 4.1761 7.8421 119.3038 57.1998 41.5323 179.0918 204 W 4.0033 8.4209 128.5424 60.4861 30.3620 177.7646 205 K 3.9669 8.2261 118.1828 59.0852 31.7867 177.4560 206 H 4.7868 7.7133 114.4735 55.4969 29.2441 176.6116 207 R 4.0381 7.5252 122.1479 59.3441 28.5378 178.5047 208 S 4.0870 7.9226 112.6212 60.5266 63.3180 174.2635 209 N 4.8228 8.6637 117.9370 52.9054 39.7312 174.3392 210 I 4.6740 7.6276 120.6266 59.9887 39.1053 174.9233 211 H 4.6635 9.2377 126.5085 54.2550 30.0816 174.7598 212 V 4.2601 8.2053 124.3959 61.8067 32.6563 175.0877 213 V 3.8738 8.7525 129.1498 60.7134 33.4487 174.4560 214 N 4.4863 8.6639 126.0140 53.1601 39.2801 174.5100 215 E 4.2651 8.1591 124.9053 54.2853 29.9871 175.6074 216 W 4.2821 8.5539 128.0117 58.9939 29.6440 177.1444 217 I 3.9379 7.7700 119.1992 60.1462 36.5706 175.5404 218 A 4.0805 8.6077 129.2415 52.2947 17.3640 175.8059 219 N 4.9942 8.5087 117.7669 52.6484 41.7122 175.8211 220 D 4.8040 8.3175 123.9962 53.2946 41.7844 178.1003 221 I 4.1326 7.2755 121.0041 60.2264 36.5788 176.7269 222 S 4.3510 7.7824 119.0914 57.7392 65.5220 175.2470 223 S 4.1024 8.6515 120.0942 62.3271 62.6144 177.2366 224 T 3.8061 7.7954 117.7675 66.6066 68.1829 176.6363 225 K 4.0828 8.0721 120.1433 58.8832 31.9723 179.6996 226 I 3.6464 7.4554 120.1869 64.4494 36.9894 178.5014 227 R 3.6599 7.8607 118.9605 59.0941 29.7036 179.1059 228 R 3.8279 7.9852 118.2060 59.3291 30.0509 178.2966 229 A 4.1428 8.2840 120.9063 55.2402 18.3202 179.5908 230 L 3.9314 8.2540 117.7149 58.1896 41.5434 179.9282 231 R 4.0575 8.0906 116.8147 59.0558 30.0274 178.3107 232 R 4.4299 7.5453 115.1001 55.4221 30.2166 176.8866 233 G 3.8990 8.1012 106.9385 46.4065 0.0000 174.0928 234 Q 4.4388 7.9027 117.8501 54.0573 30.0778 175.9123 235 S 4.3149 8.3867 115.0713 58.5350 63.3449 173.8054 236 I 4.5741 8.0463 117.6748 60.2210 38.2565 175.0650 237 R 3.8461 7.7082 121.0337 58.2205 30.1421 176.4281 238 Y 3.9151 8.2513 119.8914 58.4068 35.6244 169.6757 239 L 4.6820 7.7594 119.0906 54.8643 43.4977 176.5474 240 V 4.8773 7.3331 109.6980 57.7253 35.8931 173.6406 241 P 4.3894 0.0000 0.0000 62.7218 33.0597 177.1630 242 D 4.3671 8.7751 121.1266 58.0197 40.7373 179.6797 243 L 4.0723 7.8825 118.4656 57.5577 41.5295 179.7217 244 V 3.6089 7.6695 117.9486 66.0034 31.6167 177.7215 245 Q 4.0001 8.1996 119.3445 59.2521 28.8755 178.0618 246 E 3.9563 8.6242 120.0780 59.4805 29.5522 178.7030 247 Y 4.0092 8.3729 119.7819 60.7447 38.7933 178.1068 248 I 3.7484 8.2928 121.0951 64.6499 37.0445 178.3815 249 E 4.0086 8.1746 118.1713 59.0373 29.3246 178.9178 250 K 3.9679 7.9667 119.1561 59.0366 32.3017 177.6350 251 H 4.5936 7.5544 112.7814 54.1424 28.9838 174.3213 252 N 4.1738 8.0543 118.0381 53.8692 36.7196 176.3192 253 L 3.9765 7.9320 118.0093 56.9379 42.3703 177.7157 254 Y 4.7591 7.2036 117.0061 56.1158 40.2803 175.0867 255 S 4.6031 8.8233 117.7382 56.5972 66.2516 175.7610 256 S 4.1287 8.8325 116.0149 61.8024 62.6467 176.2150 257 E 4.0892 8.1207 121.5784 59.4060 29.5634 178.8774 258 S 4.1664 7.9763 113.9027 61.4475 62.7410 175.9833 259 E 4.0669 8.2477 121.9333 58.8074 29.6669 177.8922 260 D 4.5055 8.1174 118.1095 54.8486 41.3841 176.5969 261 R 4.1315 7.4183 119.4585 57.9232 30.7790 176.3894 262 N 4.2225 9.0491 116.0543 53.8719 36.4067 174.0518 263 A 4.1202 7.8466 120.7076 53.6328 18.7353 178.8951 264 G 3.8562 8.5902 107.4148 45.9942 0.0000 173.7756 265 V 4.1615 7.5438 118.7756 61.1227 33.0060 175.1137 266 I 4.0518 7.8926 125.8434 59.7813 38.2090 176.2177 267 L 3.4457 8.3212 125.8106 55.2957 43.2981 177.1078 268 A 3.7605 7.7506 128.3259 55.1147 18.2888 178.2389 269 P 4.0734 0.0000 0.0000 65.6084 31.3291 178.6927 270 L 3.8717 7.4994 116.9620 57.8126 41.7488 178.8400 271 Q 3.9044 7.8092 119.3071 59.6350 28.7275 178.9730 272 R 4.0002 8.0131 117.6971 58.8967 30.1771 177.3985 273 N 4.6673 8.1367 115.0595 55.2387 39.0145 177.1169 274 T 4.1003 7.9154 116.6061 65.8034 68.7367 174.4899 275 A 4.2308 7.7618 126.9656 52.2806 18.7935 176.7692 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 2.05 2.12 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 2.15 2.30 0.00 6 K 7.68 4.16 0.00 1.72 1.84 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.49 7.81 7 T 9.10 4.31 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 8 E 8.90 4.79 0.00 1.97 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 2.43 2.33 0.00 9 V 9.15 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 1.02 0.00 0.00 0.90 0.00 0.00 10 V 8.90 4.90 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 1.07 0.00 0.00 1.00 0.00 0.00 11 L 9.10 4.93 0.00 1.99 1.63 1.24 0.18 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 12 L 9.11 5.23 0.00 1.71 1.63 nan 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 13 A 9.30 5.10 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 9.76 5.15 0.00 2.95 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 15 G 8.08 3.91 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 0.00 0.00 0.00 16 S 7.82 4.13 0.00 4.04 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 17 F 7.12 3.59 0.00 3.28 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 18 N 7.91 5.32 0.00 2.71 2.75 0.00 0.00 7.25 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 5.60 0.00 2.33 2.32 0.00 3.22 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 1.88 1.79 0.00 20 I 8.19 4.02 1.92 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.01 0.92 0.00 0.00 21 T 8.47 4.83 4.43 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 1.36 0.00 0.00 22 N 8.88 4.36 0.00 2.86 2.96 0.00 0.00 7.09 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 23 M 7.87 4.03 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.59 0.00 24 H 8.10 4.27 0.00 3.51 3.75 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.91 4.32 0.00 1.89 1.75 0.92 0.75 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 26 R 8.49 4.04 0.00 2.02 2.03 0.00 3.40 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 1.85 1.87 0.00 27 L 8.33 3.95 0.00 1.98 1.53 0.93 1.07 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 28 F 8.26 4.23 0.00 3.26 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 29 E 8.60 4.27 0.00 2.29 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 2.80 2.51 0.00 30 L 8.41 4.03 0.00 1.84 1.75 0.94 0.85 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 8.13 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 32 K 8.38 3.82 0.00 1.72 1.98 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.12 1.06 7.81 33 D 8.28 4.34 0.00 2.94 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 8.38 3.94 0.00 3.19 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 35 M 8.36 3.99 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.95 0.00 36 N 7.92 4.83 0.00 2.76 2.81 0.00 0.00 6.44 8.51 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 37 G 8.06 3.60 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 0.00 0.00 0.00 38 T 7.32 3.90 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 0.99 0.00 0.00 39 G 7.81 3.91 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 0.00 0.00 0.00 40 R 7.95 4.25 0.00 1.19 1.38 0.00 2.91 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.63 0.00 41 Y 7.73 5.34 0.00 3.04 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 42 T 8.74 4.68 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 8.97 4.34 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 0.75 0.00 0.00 0.96 0.00 0.00 44 V 8.81 4.16 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 0.77 0.00 0.00 1.07 0.00 0.00 45 K 7.99 4.98 0.00 1.91 1.70 0.00 1.70 0.00 0.00 1.97 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.48 7.81 46 G 8.97 4.46 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 0.00 47 I 9.29 4.99 1.86 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 1.19 0.84 0.85 0.00 0.00 48 I 8.68 4.60 1.50 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.18 -0.10 0.00 0.00 49 S 8.80 5.08 0.00 3.89 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 50 P 0.00 5.12 0.00 2.02 2.12 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.82 0.00 51 V 8.36 3.88 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 0.60 0.00 0.00 0.90 0.00 0.00 52 G 8.67 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.67 4.47 0.00 2.75 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 54 A 7.99 4.34 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 55 Y 8.26 3.92 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 56 K 8.09 3.80 0.00 1.73 1.74 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.43 7.81 57 K 7.52 3.79 0.00 1.63 1.76 0.00 1.95 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.38 7.81 58 K 8.35 4.19 0.00 1.70 1.66 0.00 1.90 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.59 7.81 59 G 8.80 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.66 4.12 0.00 1.75 1.71 1.04 1.60 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 61 I 7.99 4.22 1.78 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 1.57 0.77 0.81 0.00 0.00 62 P 0.00 4.63 0.00 2.27 2.08 0.00 3.94 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.06 0.00 63 A 9.10 4.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 8.10 4.06 0.00 3.02 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 8.22 4.24 0.00 3.49 3.39 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 7.85 3.98 0.00 2.00 2.17 0.00 3.61 0.00 0.00 3.42 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 67 V 8.22 3.49 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 0.87 0.00 0.00 0.96 0.00 0.00 68 I 7.36 3.37 1.51 0.00 0.00 0.62 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 -0.13 0.23 0.00 0.00 69 M 8.01 3.80 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.55 0.00 70 A 7.78 3.84 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 7.86 3.76 0.00 1.98 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 2.16 2.25 0.00 72 L 7.90 3.89 0.00 1.61 1.65 0.66 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.11 4.14 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 74 T 7.30 4.28 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 0.87 0.00 0.00 75 K 7.38 3.72 0.00 1.85 1.85 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.39 7.81 76 N 7.95 4.80 0.00 2.73 2.80 0.00 0.00 6.73 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 7.65 4.70 0.00 3.64 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.76 4.27 0.00 2.03 2.00 0.00 1.73 0.00 0.00 2.09 0.00 0.00 3.29 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.56 7.81 79 W 7.96 5.05 0.00 3.50 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 80 V 7.22 4.15 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 -0.38 0.00 0.00 -1.20 0.00 0.00 81 E 8.73 4.63 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.12 0.00 82 V 8.07 4.62 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 0.69 0.00 0.00 0.70 0.00 0.00 83 D 8.94 5.12 0.00 2.84 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 84 T 8.66 4.40 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 1.21 0.00 0.00 85 W 8.51 4.29 0.00 3.46 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 86 E 8.52 3.65 0.00 2.21 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 2.45 2.65 0.00 87 S 8.11 4.29 0.00 4.11 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.29 4.46 0.00 1.58 1.65 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 6.87 3.83 0.00 1.86 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.02 0.00 0.00 0.00 0.00 0.00 1.83 1.51 0.00 90 K 8.58 4.07 0.00 1.69 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.40 7.81 91 E 7.74 4.62 0.00 1.87 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 92 W 8.97 4.20 0.00 3.33 3.27 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 93 K 7.35 4.02 0.00 1.33 1.43 0.00 1.48 0.00 0.00 1.59 0.00 0.00 3.10 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.11 1.45 7.81 94 E 7.70 3.28 0.00 1.89 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 2.57 2.35 0.00 95 T 8.60 3.89 4.62 0.00 0.00 0.00 0.00 0.00 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 96 L 8.07 3.92 0.00 1.86 1.72 1.04 0.89 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 97 K 8.09 3.98 0.00 1.97 1.91 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.40 7.81 98 V 7.64 3.64 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 1.36 0.00 0.00 1.17 0.00 0.00 99 L 8.03 3.75 0.00 1.23 0.34 0.81 0.77 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 108 A 7.74 4.09 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 *147 A 7.83 4.10 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 0.00 148 V 7.74 4.30 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 0.89 0.00 0.00 0.94 0.00 0.00 149 P 0.00 4.58 0.00 2.01 2.05 0.00 3.73 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 2.07 2.36 0.00 150 K 9.05 4.78 0.00 1.75 1.77 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 151 V 8.97 4.58 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.05 0.00 0.00 152 K 9.13 4.81 0.00 1.65 1.65 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.39 7.81 153 L 8.62 4.59 0.00 1.85 1.69 1.03 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.86 4.98 0.00 1.60 1.32 -0.19 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 0.00 155 C 8.86 4.52 0.00 2.88 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 0.00 156 G 8.11 4.58 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 0.00 0.00 0.00 157 A 8.50 3.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 D 8.00 4.18 0.00 2.60 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 0.00 159 L 7.64 3.91 0.00 1.58 1.68 1.03 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.17 2.96 0.00 1.34 1.42 0.72 0.90 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 0.00 161 E 7.78 2.54 0.00 1.84 1.63 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 1.79 1.47 0.00 162 S 7.69 4.41 0.00 4.29 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 0.00 163 F 7.75 4.19 0.00 3.18 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 0.00 164 A 8.02 4.65 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 V 7.74 3.77 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 1.06 0.00 0.00 166 P 0.00 4.42 0.00 2.11 2.04 0.00 3.90 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 2.07 2.18 0.00 167 N 9.00 4.37 0.00 2.90 2.97 0.00 0.00 7.05 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 8.03 4.14 0.00 1.70 2.09 0.77 1.29 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 0.00 169 W 7.95 5.10 0.00 3.26 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 0.00 170 K 8.77 4.33 0.00 1.92 2.13 0.00 1.74 0.00 0.00 1.93 0.00 0.00 3.07 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.60 1.58 7.81 171 S 9.06 4.15 0.00 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 0.00 172 E 8.19 4.05 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 8.46 4.37 0.00 3.05 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 0.00 174 I 7.76 3.18 1.79 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.61 0.37 0.00 0.00 175 T 7.73 3.81 4.36 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 1.19 0.00 0.00 176 Q 8.07 4.01 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 177 I 8.07 3.99 2.04 0.00 0.00 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 1.64 0.83 1.05 0.00 0.00 178 V 7.68 3.69 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 0.81 0.00 0.00 0.99 0.00 0.00 179 A 8.08 4.01 1.09 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 0.00 180 N 8.19 4.58 0.00 2.45 2.37 0.00 0.00 6.85 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Y 7.97 4.37 0.00 3.31 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 0.00 182 G 8.04 4.35 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 0.00 0.00 0.00 183 L 9.03 5.23 0.00 1.54 1.48 0.86 1.04 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 0.00 184 I 9.11 4.71 1.80 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 1.03 0.82 0.82 0.00 0.00 185 C 8.97 4.87 0.00 2.84 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 8.27 4.48 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 0.76 0.00 0.00 0.82 0.00 0.00 187 T 8.11 4.32 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 8.79 4.05 0.00 1.74 1.86 0.00 3.25 0.00 0.00 3.48 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 189 A 7.78 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 0.00 190 G 7.90 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 0.00 0.00 0.00 191 N 8.06 4.69 0.00 2.79 2.84 0.00 0.00 6.84 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 8.00 4.28 0.00 2.81 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 0.00 193 A 7.77 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 Q 8.62 4.01 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 195 K 8.32 4.05 0.00 2.11 2.11 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.23 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.57 7.81 196 F 8.15 4.02 0.00 3.21 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 0.00 197 I 8.35 3.97 2.20 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 1.00 0.00 0.00 198 Y 8.26 4.48 0.00 3.10 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 0.00 199 E 8.41 3.91 0.00 1.88 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 2.24 2.32 0.00 200 S 7.30 4.51 0.00 3.50 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 0.00 201 D 8.87 4.42 0.00 2.71 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 0.00 202 V 7.66 3.69 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 0.79 0.00 0.00 0.97 0.00 0.00 203 L 7.84 4.18 0.00 1.95 1.85 1.17 0.92 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 8.42 4.00 0.00 3.59 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 0.00 205 K 8.23 3.97 0.00 1.91 2.01 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.11 1.42 7.81 206 H 7.71 4.79 0.00 3.23 3.24 0.00 5.70 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 7.53 4.04 0.00 1.77 1.89 0.00 2.21 0.00 0.00 2.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.27 0.00 208 S 7.92 4.09 0.00 3.98 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.66 4.82 0.00 2.80 2.92 0.00 0.00 6.62 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 7.63 4.67 1.82 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 1.25 0.74 0.89 0.00 0.00 211 H 9.24 4.66 0.00 2.95 3.26 0.00 5.60 0.00 0.00 0.00 0.00 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.21 4.26 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 0.63 0.00 0.00 0.88 0.00 0.00 213 V 8.75 3.87 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 0.80 0.00 0.00 0.22 0.00 0.00 214 N 8.66 4.49 0.00 2.47 1.56 0.00 0.00 6.94 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 8.16 4.27 0.00 1.82 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 2.12 2.24 0.00 216 W 8.55 4.28 0.00 3.38 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 0.00 217 I 7.77 3.94 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 0.57 0.95 0.00 0.00 218 A 8.61 4.08 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 0.00 219 N 8.51 4.99 0.00 2.85 2.71 0.00 0.00 6.75 7.94 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 0.00 220 D 8.32 4.80 0.00 2.57 2.52 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 0.00 221 I 7.28 4.13 1.86 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 0.48 0.95 0.00 0.00 222 S 7.78 4.35 0.00 4.01 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 0.00 223 S 8.65 4.10 0.00 3.86 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 0.00 224 T 7.80 3.81 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 225 K 8.07 4.08 0.00 1.91 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 226 I 7.46 3.65 1.93 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 0.90 0.81 0.00 0.00 227 R 7.86 3.66 0.00 1.72 1.87 0.00 3.15 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.48 0.00 228 R 7.99 3.83 0.00 1.87 2.05 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 229 A 8.28 4.14 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 0.00 230 L 8.25 3.93 0.00 1.85 1.81 0.96 0.86 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 0.00 231 R 8.09 4.06 0.00 1.92 2.03 0.00 3.22 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 232 R 7.55 4.43 0.00 1.85 1.96 0.00 3.36 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 1.64 0.00 233 G 8.10 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Q 7.90 4.44 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 235 S 8.39 4.31 0.00 3.83 3.78 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 0.00 236 I 8.05 4.57 1.86 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 1.29 0.56 0.90 0.00 0.00 237 R 7.71 3.85 0.00 1.55 1.53 0.00 3.04 0.00 0.00 2.77 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.90 0.00 238 Y 8.25 3.92 0.00 3.22 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 0.00 239 L 7.76 4.68 0.00 1.88 1.70 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 240 V 7.33 4.88 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 0.79 0.00 0.00 0.99 0.00 0.00 241 P 0.00 4.39 0.00 2.14 1.98 0.00 3.64 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 242 D 8.78 4.37 0.00 2.75 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 0.00 243 L 7.88 4.07 0.00 1.67 1.72 0.90 0.89 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 0.00 244 V 7.67 3.61 2.28 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 1.18 0.00 0.00 0.94 0.00 0.00 245 Q 8.20 4.00 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 246 E 8.62 3.96 0.00 2.26 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 2.32 2.35 0.00 247 Y 8.37 4.01 0.00 3.20 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 8.29 3.75 2.11 0.00 0.00 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 1.80 1.65 1.09 0.00 0.00 249 E 8.17 4.01 0.00 1.91 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 2.65 2.44 0.00 250 K 7.97 3.97 0.00 1.68 1.64 0.00 1.67 0.00 0.00 1.44 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.01 1.30 7.81 251 H 7.55 4.59 0.00 2.83 3.05 0.00 5.86 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 N 8.05 4.17 0.00 2.76 2.79 0.00 0.00 6.99 8.07 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 0.00 253 L 7.93 3.98 0.00 1.30 1.04 0.93 0.44 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 0.00 254 Y 7.20 4.76 0.00 3.31 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 0.00 255 S 8.82 4.60 0.00 3.96 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 0.00 256 S 8.83 4.13 0.00 3.87 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 0.00 257 E 8.12 4.09 0.00 2.03 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 2.37 2.37 0.00 258 S 7.98 4.17 0.00 4.12 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 8.25 4.07 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 260 D 8.12 4.51 0.00 3.02 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 0.00 261 R 7.42 4.13 0.00 1.97 1.88 0.00 3.28 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 262 N 9.05 4.22 0.00 2.87 2.90 0.00 0.00 6.95 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 A 7.85 4.12 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 8.59 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 0.00 265 V 7.54 4.16 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 0.74 0.00 0.00 0.93 0.00 0.00 266 I 7.89 4.05 1.79 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 1.23 0.62 0.83 0.00 0.00 267 L 8.32 3.45 0.00 1.44 1.21 0.06 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 268 A 7.75 3.76 1.03 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 0.00 269 P 0.00 4.07 0.00 1.81 1.83 0.00 2.86 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.44 0.00 270 L 7.50 3.87 0.00 1.70 1.63 0.83 0.81 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 3.90 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 272 R 8.01 4.00 0.00 1.92 2.04 0.00 3.63 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 273 N 8.14 4.67 0.00 2.93 2.89 0.00 0.00 7.05 7.16 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 0.00 274 T 7.92 4.10 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 1.21 0.00 0.00 275 A 7.76 4.23 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 * Residues marked with a * may have inaccurate shift predictions.