NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3992 8.3349 115.4066 58.0147 64.3812 172.5942 4 R 4.1671 8.0934 119.3859 55.0392 31.5479 174.9326 5 I 4.2167 8.8724 124.3174 60.0542 39.2014 173.4937 6 P 5.0365 0.0000 0.0000 62.5826 32.6323 175.4965 7 V 4.9906 8.8479 123.2439 61.0804 35.3803 174.1062 8 V 4.9470 8.8408 126.6061 61.1614 34.4294 173.9229 9 L 5.1949 9.2329 128.1401 53.0967 44.0683 175.0251 10 L 5.2421 8.8666 125.3709 53.1497 44.8915 174.6285 11 A 5.1428 9.4170 128.5007 50.5918 21.2880 175.1695 12 C 5.3658 9.4181 120.0042 57.3213 30.9520 174.1450 13 G 3.6331 8.0198 107.0028 45.0489 0.0000 173.3727 14 S 3.9993 7.7867 114.9341 59.8741 63.7958 174.9513 15 F 3.6902 7.0108 117.2213 59.0802 36.4142 175.5047 16 N 5.3644 7.6631 117.5895 51.3578 38.9377 170.4415 17 P 5.2420 0.0000 0.0000 59.9489 34.1251 175.8874 18 I 4.1465 8.2212 118.6779 61.2838 38.4766 175.0564 19 T 4.7909 8.4941 115.9976 59.3957 73.0597 174.7379 20 N 4.5229 8.9477 120.5009 57.0275 38.3352 178.4721 21 M 4.1414 7.9736 121.7772 59.9498 31.3798 182.3488 22 H 4.5970 7.7796 116.2387 58.7928 29.1901 177.7037 23 L 4.2399 7.9485 120.3395 57.9274 41.5012 179.3984 24 R 4.0032 8.4392 119.0378 59.6158 29.9224 177.8909 25 M 4.0053 8.3130 118.0360 58.9102 32.0829 178.2818 26 F 4.1212 8.2987 117.1782 60.6696 39.1005 177.5019 27 E 4.2996 8.5413 117.7855 59.5418 29.3319 179.5168 28 V 3.6143 8.2121 118.1323 65.8966 31.6604 177.9102 29 A 3.9904 8.1231 120.5954 55.0882 18.1766 179.6518 30 R 3.6453 8.3387 117.2425 59.6939 30.1721 178.3727 31 D 4.2887 7.9953 118.7120 57.5571 40.2528 178.3387 32 H 4.0843 8.3542 118.5921 59.4540 29.7073 177.4052 33 L 4.0418 7.7402 119.1702 58.0544 41.6529 178.9858 34 H 4.6308 8.3948 116.4555 58.8260 28.4451 177.5744 35 Q 4.0674 8.1454 120.7309 59.0317 28.8696 178.0813 36 T 4.0152 7.4084 109.6295 62.9372 68.8999 175.5008 37 G 4.0054 8.1579 109.5513 45.4248 0.0000 174.0335 38 M 4.0863 7.8422 118.2486 56.9057 32.8893 175.5934 39 Y 5.2962 7.7384 114.4102 56.1926 42.9718 174.8163 40 Q 4.3297 9.0239 121.1824 54.2848 32.0289 174.2229 41 V 4.4264 8.8392 127.9173 62.9949 31.5260 175.4705 42 I 4.4324 8.7491 121.6372 61.6297 39.3218 175.3936 43 Q 5.1207 8.0192 121.9387 55.2349 32.4397 172.7499 44 G 4.4873 9.1850 111.6002 44.4347 0.0000 171.8709 45 I 5.0203 9.2291 123.7219 59.3369 41.1162 174.3365 46 I 4.5285 8.4967 128.6771 59.9710 38.6720 174.7832 47 S 4.9775 9.0511 123.4051 55.4440 63.6722 170.9197 48 P 5.1023 0.0000 0.0000 62.1243 31.8077 176.8827 49 V 4.2112 8.5931 123.8403 61.0714 32.1727 175.7289 50 N 4.6058 8.8069 120.0684 53.5428 39.5151 175.7409 51 D 4.5966 8.5908 122.5782 56.7844 41.1399 177.7512 52 T 4.1301 8.4019 108.7307 62.9971 69.3446 174.6419 53 Y 3.8034 7.8890 123.8576 59.6097 39.8524 177.7481 54 G 2.8293 6.9816 115.5790 46.4084 0.0000 174.9097 55 K 4.2428 7.7610 129.8679 53.9450 34.4111 173.3166 56 K 4.2302 7.9773 126.6465 54.1686 35.2551 172.5885 57 D 4.7587 8.4935 117.8086 53.0805 38.1492 175.1517 58 L 4.4573 7.5164 123.8730 53.6014 43.6046 176.3315 59 A 4.0890 8.9857 129.0288 51.4920 19.1992 177.0157 60 A 4.2083 8.5918 122.9721 52.6579 19.0951 179.1225 61 S 4.2010 9.7793 117.7137 62.0431 62.8351 177.0275 62 H 4.2435 8.1810 117.9566 58.5270 28.2334 177.3239 63 H 4.3196 7.7522 120.5305 58.3075 28.5693 177.9272 64 R 3.9467 7.9131 119.4464 59.1041 29.8636 179.1681 65 V 3.4894 8.2098 118.3507 65.7928 31.4625 177.9311 66 A 3.8100 7.9159 120.5038 55.4544 18.1582 179.5646 67 M 3.6572 7.7394 116.9720 58.2801 31.9735 178.9156 68 A 3.8792 7.8670 121.0211 54.9067 18.2732 179.6272 69 R 3.6985 7.8212 116.5186 59.5019 30.5473 178.4130 70 L 4.0600 8.0097 118.6786 57.8550 41.4260 179.4039 71 A 4.0175 8.1399 119.7218 54.5573 18.4783 178.6478 72 L 4.2456 7.5736 115.3689 55.0181 41.7753 178.4977 73 Q 3.9850 7.6486 119.4266 58.7008 28.6608 177.3128 74 T 4.3432 7.5571 107.1212 61.3754 69.2553 173.8212 75 S 4.6713 7.9364 117.6820 57.2172 63.5348 173.3018 76 D 4.9468 8.8214 125.7337 52.8907 39.6111 176.6013 77 W 5.3183 7.7093 114.6801 56.2584 31.4413 174.0533 78 I 4.3790 7.0689 122.0508 59.2520 38.1430 175.2692 79 R 4.6541 8.6321 122.6459 54.2679 33.3598 174.2139 80 V 4.4413 8.0870 119.3411 60.4996 33.3139 174.7970 81 D 4.9284 8.7314 123.4599 51.6104 43.1567 174.1637 82 P 4.5808 0.0000 0.0000 62.9311 31.4425 177.2305 83 W 4.2060 8.7142 129.6733 61.0902 30.4308 176.7983 84 E 3.7558 8.6408 118.5367 59.4478 28.8903 178.8934 85 S 4.1946 7.9765 111.7898 60.8166 63.3391 175.1328 86 E 4.1939 7.7072 120.1965 56.2247 29.6861 176.5814 87 Q 3.8887 6.6433 118.0915 54.9990 29.5518 176.3402 88 A 4.0266 8.3581 122.3089 54.7550 18.4951 177.3537 89 Q 4.6553 7.4141 113.2706 53.2868 32.6106 174.1552 90 W 4.3945 8.6345 130.5120 57.8015 31.2270 175.0645 91 M 4.1733 6.7548 121.3483 52.7613 35.5156 175.3879 92 E 3.4982 7.6064 120.9732 56.2444 30.7092 178.0306 93 T 3.9070 8.7549 119.4126 67.1840 68.5166 177.0204 94 V 3.6815 7.9856 120.0978 65.0083 31.2197 178.3244 95 K 4.0208 8.0822 118.8240 58.9145 31.8308 179.4637 96 V 3.8580 7.8689 118.9397 65.6946 31.3587 178.1113 97 L 3.7228 7.6431 118.4299 57.5212 41.3377 179.3849 98 R 4.0427 8.0390 118.0785 59.5258 30.0488 178.3039 99 H 3.7198 7.8614 117.6622 59.8110 29.8029 177.0367 100 H 3.9146 7.8592 117.4958 58.6284 28.5361 177.4337 101 H 4.2220 8.3349 120.7098 59.2353 29.7641 177.3315 102 S 4.0049 8.2455 117.3049 61.7646 62.4977 176.8536 103 K 3.8120 7.5913 119.3978 59.5304 31.7587 179.0566 104 L 4.1180 7.4322 118.2030 57.7138 41.6135 179.2033 105 L 4.0102 7.5609 117.4047 55.4683 41.5976 178.9854 106 R 3.8970 7.5548 121.9280 57.3482 29.7686 176.9230 *127 V 3.8780 7.4265 114.0529 61.9582 32.3943 172.8104 128 P 4.8430 0.0000 0.0000 62.3597 32.4499 175.5688 129 E 4.4180 9.4511 123.5133 55.9048 30.9556 175.1934 130 L 5.0151 8.7236 126.4917 53.6349 43.6025 175.4867 131 K 4.9177 8.7979 125.3270 54.3524 35.8632 175.2197 132 L 4.5831 8.9432 126.6273 54.7734 43.4379 175.0386 133 L 5.2319 8.8675 128.5459 53.5311 44.0933 174.9279 134 C 4.6151 8.7110 119.5392 57.5323 33.6999 173.4280 135 G 4.0863 8.4498 107.8298 44.3694 0.0000 174.7288 136 A 4.0435 8.6011 122.2627 54.8798 17.9296 180.0577 137 D 3.9819 7.7924 116.8350 56.4481 39.8141 178.5114 138 V 3.6429 7.6872 119.7400 65.5252 31.4510 177.6917 139 L 3.0143 7.4824 119.6961 57.7558 41.8169 178.7741 140 K 3.1576 7.6131 119.1480 58.9469 32.0200 178.5236 141 T 4.1248 7.6098 109.5332 63.7670 68.5448 176.2848 142 F 4.3511 7.4079 120.0039 60.2068 38.8719 176.5708 143 Q 4.4233 7.7045 116.2439 56.4234 29.0525 176.2142 144 T 3.9688 7.5731 118.2672 62.7105 68.7226 172.0012 145 P 4.3577 0.0000 0.0000 64.5329 31.7596 175.6246 146 N 4.2768 8.7914 117.8524 54.4913 36.2735 174.9014 147 L 4.5625 7.9387 120.1202 55.3047 44.1083 176.5584 148 W 5.1366 7.9249 116.0883 53.8322 33.0755 175.3395 149 K 4.2782 8.6805 122.0967 56.0432 33.2391 178.0112 150 D 4.3644 8.8683 123.5518 57.5667 40.7656 178.8703 151 A 4.0103 8.0538 120.6109 55.6725 18.3406 179.2902 152 H 4.2782 8.1419 114.0876 59.0566 29.0042 177.9484 153 I 3.2661 7.7014 121.4640 64.1332 36.7977 178.2137 154 Q 3.8404 8.2663 120.6954 59.1532 28.8285 177.9057 155 E 3.8494 8.3589 120.3930 59.2844 29.2613 178.7323 156 I 3.9453 7.9335 119.7712 64.5408 37.1000 178.2513 157 V 4.0729 7.4249 109.3638 61.9663 31.7845 176.9635 158 E 4.2274 7.8876 118.5210 57.6615 30.5204 176.5688 159 K 3.9570 7.8534 118.5318 57.9651 33.5830 177.1292 160 F 4.9582 6.5679 112.9537 56.9182 41.4053 177.9982 161 G 4.1784 8.6490 116.6658 46.7740 0.0000 170.2037 162 L 5.2676 9.0257 121.7036 53.2401 45.8148 174.9296 163 V 4.7516 9.0249 126.4582 61.2564 34.2175 173.4397 164 C 5.3013 9.2002 128.8981 57.6069 34.1193 172.4231 165 V 4.6443 8.5200 126.3594 61.0717 33.0709 175.5288 166 G 4.0844 8.3741 114.5879 46.6625 0.0000 173.1195 167 R 4.7838 8.2628 118.8318 53.7397 34.3464 175.0754 168 V 3.6838 8.0206 123.7114 65.6561 31.7052 177.1811 *169 S 4.4224 9.0990 122.2408 58.0426 60.1195 165.1401 170 H 5.1354 7.6444 115.1565 54.2271 31.2670 173.9425 171 D 4.5772 7.3466 121.5662 50.5574 41.1786 173.9258 172 P 3.9964 0.0000 0.0000 65.1064 31.6236 177.6643 173 K 3.9826 7.9492 116.6513 59.5439 31.9003 179.4542 174 G 3.5925 7.8617 105.9233 47.7970 0.0000 175.3699 175 Y 4.4466 7.7357 119.1062 61.0649 37.9844 178.9424 176 I 3.7898 8.1046 120.4041 64.5006 37.0815 178.3909 177 A 4.0605 7.8355 120.0792 55.0079 18.3007 178.7658 178 E 4.3417 8.3558 114.6676 56.1772 30.1071 176.3707 179 S 4.6624 7.5042 115.7227 55.8492 63.2197 172.7876 180 P 4.2617 0.0000 0.0000 66.0008 31.0221 178.3878 181 I 3.9080 7.6071 118.9335 64.2196 37.3055 178.1234 182 L 4.0566 7.8871 120.0840 57.7473 41.2977 179.7104 183 R 4.0642 8.0548 114.4397 58.7272 29.4536 177.8800 184 M 4.3103 7.5718 118.1238 56.2679 32.5852 175.8413 185 H 5.0523 8.0867 117.2556 55.3261 30.3780 175.7628 186 Q 4.0823 8.3439 120.7298 59.0752 28.8467 178.6585 187 H 4.1424 8.3139 116.6446 58.6261 30.1993 175.1227 188 N 4.9468 8.3972 115.1510 52.8697 39.7157 174.2551 189 I 4.9010 7.4497 120.4979 59.7250 39.6768 174.7096 190 H 4.8508 9.5692 124.3164 53.9537 31.6494 172.8712 191 L 4.9269 8.6500 123.7972 53.3585 42.8054 175.7502 192 A 4.3814 8.8635 127.8106 50.1469 20.7073 175.8557 193 K 4.4014 8.5891 122.5141 56.0523 34.1924 176.8104 194 E 4.4143 8.6542 125.6882 53.6544 28.6950 173.5515 195 P 4.3827 0.0000 0.0000 63.4528 31.6165 176.6942 196 V 4.1786 7.5029 119.2802 60.8430 33.0040 174.9617 197 Q 4.1231 8.6519 128.4912 56.3858 27.8294 174.4200 198 N 4.8521 8.1378 123.5069 51.4783 39.3940 174.0437 199 E 4.3482 7.9511 127.9285 54.2325 28.7542 175.6424 200 I 4.1307 7.3526 120.7141 60.5605 38.8344 176.5583 201 S 4.8178 8.4102 120.2127 56.4683 66.2133 175.1566 202 A 4.0167 8.5083 125.9221 55.4468 18.1731 180.1619 203 T 3.7611 7.8957 114.1056 67.0054 68.5200 175.9021 204 Y 4.0346 8.0267 121.3164 60.6343 38.7980 177.8851 205 I 3.4304 7.5901 120.6155 64.5131 37.2271 178.6150 206 R 3.5608 7.9891 118.9795 59.0699 29.8720 179.1465 207 R 3.7897 7.9430 118.2833 59.1247 29.9690 178.3376 208 A 3.7354 7.7672 120.9156 55.1632 18.3446 179.4775 209 L 3.9771 7.8875 117.5950 58.0752 41.4901 180.1745 210 G 3.6554 8.0104 104.3525 47.3825 0.0000 174.7820 211 Q 4.4073 7.7320 117.5657 55.2409 28.9846 176.4179 212 G 3.8580 7.8196 108.0788 46.2686 0.0000 174.0180 213 Q 4.4049 7.9290 118.2290 54.1603 30.0421 175.7457 214 S 4.3480 8.3100 114.3323 58.5988 63.2186 174.1618 215 V 4.4711 8.0711 117.3224 60.5215 33.0621 175.3109 216 K 3.8500 7.5726 121.5301 58.1122 32.1830 176.7201 217 Y 3.9516 8.2128 121.3132 58.3543 35.7566 169.5806 218 L 4.6267 8.1050 120.4095 55.1072 43.4423 176.2990 219 I 5.1708 7.2682 109.0614 57.1581 40.9693 173.5394 220 P 4.3379 0.0000 0.0000 62.7790 32.9474 177.1267 221 D 4.3157 8.8260 121.5628 57.8195 40.8558 179.3324 222 A 4.0613 7.9639 120.4196 55.0825 18.3018 179.7237 223 V 3.6350 7.6425 116.4786 66.0870 31.7102 178.1568 224 I 3.7445 7.8295 119.6932 64.6673 36.9638 178.5104 225 T 3.8812 8.0365 116.5081 66.7885 67.8777 176.0267 226 Y 3.9997 8.1895 121.3525 60.7414 38.7775 178.1165 227 I 3.8426 8.2850 121.0213 64.3062 37.3643 178.3746 228 K 3.8986 8.1696 120.2385 59.6895 31.8827 178.4676 229 D 4.2871 8.2723 118.0938 57.2166 40.7782 177.7233 230 H 4.5690 7.8861 113.3624 54.1280 29.2534 175.0541 231 G 3.9031 7.5528 108.1588 46.4421 0.0000 174.3851 232 L 4.0182 7.8236 118.1288 54.4445 42.6578 176.4985 233 Y 3.9794 7.5741 114.9680 59.3118 35.6349 171.0839 234 T 4.1897 7.2886 113.8671 61.8957 69.0992 174.2862 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 3 S 8.33 4.40 0.00 3.97 3.94 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 4 R 8.09 4.17 0.00 1.77 1.77 0.00 3.14 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 5 I 8.87 4.22 1.98 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 1.21 0.80 1.11 0.00 0.00 6 P 0.00 5.04 0.00 2.13 2.01 0.00 3.59 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 2.14 2.11 0.00 7 V 8.85 4.99 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 0.97 0.00 0.00 0.97 0.00 0.00 8 V 8.84 4.95 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 1.03 0.00 0.00 1.00 0.00 0.00 9 L 9.23 5.19 0.00 1.91 1.58 1.16 0.14 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 10 L 8.87 5.24 0.00 1.70 1.46 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 11 A 9.42 5.14 1.35 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 12 C 9.42 5.37 0.00 2.97 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 13 G 8.02 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.79 4.00 0.00 3.77 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 15 F 7.01 3.69 0.00 3.23 3.02 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 16 N 7.66 5.36 0.00 2.71 2.74 0.00 0.00 7.24 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 17 P 0.00 5.24 0.00 2.30 2.27 0.00 3.22 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.78 0.00 18 I 8.22 4.15 1.93 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.04 0.92 0.00 0.00 19 T 8.49 4.79 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 20 N 8.95 4.52 0.00 2.91 2.96 0.00 0.00 7.57 7.24 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 21 M 7.97 4.14 0.00 2.02 2.07 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 2.60 2.20 0.00 22 H 7.78 4.60 0.00 3.42 3.73 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.95 4.24 0.00 1.90 1.73 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.44 4.00 0.00 2.06 2.15 0.00 3.24 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 25 M 8.31 4.01 0.00 2.39 2.10 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 26 F 8.30 4.12 0.00 3.30 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 27 E 8.54 4.30 0.00 2.28 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 2.64 2.47 0.00 28 V 8.21 3.61 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 1.03 0.00 0.00 1.08 0.00 0.00 29 A 8.12 3.99 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 30 R 8.34 3.65 0.00 1.66 1.87 0.00 2.30 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.04 0.00 31 D 8.00 4.29 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 32 H 8.35 4.08 0.00 3.33 3.49 0.00 5.78 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 33 L 7.74 4.04 0.00 1.72 1.68 0.71 0.42 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 34 H 8.39 4.63 0.00 3.28 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 8.15 4.07 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 36 T 7.41 4.02 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 37 G 8.16 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 0.00 0.00 0.00 38 M 7.84 4.09 0.00 1.26 1.59 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 39 Y 7.74 5.30 0.00 2.78 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 40 Q 9.02 4.33 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.01 0.00 0.00 0.00 0.00 0.00 2.23 2.19 0.00 41 V 8.84 4.43 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.83 0.00 0.00 42 I 8.75 4.43 1.93 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 1.35 0.89 0.99 0.00 0.00 43 Q 8.02 5.12 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 44 G 9.19 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 0.00 0.00 0.00 0.00 45 I 9.23 5.02 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.66 0.81 0.00 0.00 46 I 8.50 4.53 1.48 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.21 -0.08 0.00 0.00 47 S 9.05 4.98 0.00 3.89 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 5.10 0.00 2.05 2.14 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 49 V 8.59 4.21 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 0.87 0.00 0.00 50 N 8.81 4.61 0.00 2.91 2.91 0.00 0.00 6.97 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 51 D 8.59 4.60 0.00 2.74 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 52 T 8.40 4.13 4.30 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 1.32 0.00 0.00 53 Y 7.89 3.80 0.00 2.88 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 54 G 6.98 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 0.00 0.00 0.00 55 K 7.76 4.24 0.00 1.72 1.56 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 0.97 7.81 56 K 7.98 4.23 0.00 1.71 1.56 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.12 0.84 7.81 57 D 8.49 4.76 0.00 2.69 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 58 L 7.52 4.46 0.00 1.64 1.64 1.02 1.24 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 59 A 8.99 4.09 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.59 4.21 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 61 S 9.78 4.20 0.00 4.03 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 62 H 8.18 4.24 0.00 3.41 3.58 0.00 5.65 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 63 H 7.75 4.32 0.00 3.37 3.38 0.00 5.63 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 64 R 7.91 3.95 0.00 2.02 2.16 0.00 3.59 0.00 0.00 3.59 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.90 0.00 65 V 8.21 3.49 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 1.05 0.00 0.00 0.98 0.00 0.00 66 A 7.92 3.81 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 67 M 7.74 3.66 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 68 A 7.87 3.88 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 69 R 7.82 3.70 0.00 1.81 2.03 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 70 L 8.01 4.06 0.00 1.81 1.67 0.97 1.30 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 71 A 8.14 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 72 L 7.57 4.25 0.00 1.70 1.60 0.58 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 Q 7.65 3.99 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.14 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 74 T 7.56 4.34 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 75 S 7.94 4.67 0.00 3.63 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.82 4.95 0.00 2.87 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 W 7.71 5.32 0.00 3.46 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 78 I 7.07 4.38 1.06 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.31 0.00 0.00 79 R 8.63 4.65 0.00 1.69 1.85 0.00 2.72 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.00 80 V 8.09 4.44 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 0.60 0.00 0.00 0.86 0.00 0.00 81 D 8.73 4.93 0.00 2.67 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.58 0.00 2.32 2.27 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 83 W 8.71 4.21 0.00 3.34 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.64 3.76 0.00 2.32 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 85 S 7.98 4.19 0.00 4.08 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 0.00 86 E 7.71 4.19 0.00 1.92 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 2.28 2.55 0.00 87 Q 6.64 3.89 0.00 1.69 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 1.35 1.28 0.00 88 A 8.36 4.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 7.41 4.66 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 90 W 8.63 4.39 0.00 3.40 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 91 M 6.75 4.17 0.00 1.72 1.59 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 92 E 7.61 3.50 0.00 1.92 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 2.42 2.01 0.00 93 T 8.75 3.91 4.60 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 1.40 0.00 0.00 94 V 7.99 3.68 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 0.58 0.00 0.00 1.11 0.00 0.00 95 K 8.08 4.02 0.00 1.93 1.92 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.37 7.81 96 V 7.87 3.86 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 1.26 0.00 0.00 1.14 0.00 0.00 97 L 7.64 3.72 0.00 1.50 0.32 0.79 0.60 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 98 R 8.04 4.04 0.00 2.03 2.04 0.00 3.19 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 1.84 1.98 0.00 99 H 7.86 3.72 0.00 2.58 2.80 0.00 5.78 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 0.00 100 H 7.86 3.91 0.00 3.12 3.25 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.33 4.22 0.00 3.51 3.62 0.00 5.79 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 0.00 102 S 8.25 4.00 0.00 3.88 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 0.00 103 K 7.59 3.81 0.00 1.69 1.76 0.00 1.30 0.00 0.00 1.28 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.23 1.11 7.81 104 L 7.43 4.12 0.00 1.85 1.73 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.56 4.01 0.00 1.71 1.67 0.84 0.66 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 0.00 106 R 7.55 3.90 0.00 1.95 2.03 0.00 3.18 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.82 0.00 *127 V 7.43 3.88 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 0.82 0.00 0.00 0.94 0.00 0.00 128 P 0.00 4.84 0.00 2.04 2.02 0.00 3.76 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 2.06 2.15 0.00 129 E 9.45 4.42 0.00 1.98 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 0.00 2.41 2.39 0.00 130 L 8.72 5.02 0.00 1.73 1.75 0.97 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.80 4.92 0.00 1.70 1.65 0.00 1.51 0.00 0.00 1.42 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.35 7.81 132 L 8.94 4.58 0.00 1.77 1.56 1.03 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 133 L 8.87 5.23 0.00 1.42 1.40 0.79 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 134 C 8.71 4.62 0.00 2.98 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.45 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.60 4.04 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 0.00 137 D 7.79 3.98 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 7.69 3.64 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 0.97 0.00 0.00 0.91 0.00 0.00 139 L 7.48 3.01 0.00 1.60 1.85 0.99 0.39 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 0.00 140 K 7.61 3.16 0.00 1.45 1.72 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.16 0.65 7.81 141 T 7.61 4.12 4.52 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 1.33 0.00 0.00 142 F 7.41 4.35 0.00 2.91 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 0.00 143 Q 7.70 4.42 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 144 T 7.57 3.97 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 1.25 0.00 0.00 145 P 0.00 4.36 0.00 2.06 2.04 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 146 N 8.79 4.28 0.00 2.86 2.89 0.00 0.00 6.77 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 0.00 147 L 7.94 4.56 0.00 1.65 1.96 0.87 1.53 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 0.00 148 W 7.92 5.14 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 0.00 149 K 8.68 4.28 0.00 1.61 1.67 0.00 1.63 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.49 7.81 150 D 8.87 4.36 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.05 4.01 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 0.00 152 H 8.14 4.28 0.00 3.56 3.58 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 I 7.70 3.27 1.76 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 1.05 0.27 0.00 0.00 154 Q 8.27 3.84 0.00 2.07 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 155 E 8.36 3.85 0.00 2.19 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 0.00 2.41 2.30 0.00 156 I 7.93 3.95 1.96 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 1.65 1.26 0.98 0.00 0.00 157 V 7.42 4.07 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 0.71 0.00 0.00 0.93 0.00 0.00 158 E 7.89 4.23 0.00 1.55 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 2.14 2.22 0.00 159 K 7.85 3.96 0.00 1.39 1.30 0.00 1.53 0.00 0.00 1.33 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.82 7.81 160 F 6.57 4.96 0.00 3.22 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 G 8.65 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 0.00 0.00 0.00 162 L 9.03 5.27 0.00 1.74 1.50 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 163 V 9.02 4.75 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.87 0.00 0.00 164 C 9.20 5.30 0.00 2.94 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 V 8.52 4.64 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 0.95 0.00 0.00 0.89 0.00 0.00 166 G 8.37 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 0.00 0.00 0.00 167 R 8.26 4.78 0.00 1.87 1.81 0.00 3.13 0.00 0.00 3.42 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 168 V 8.02 3.68 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 0.69 0.00 0.00 1.00 0.00 0.00 *169 S 9.10 4.42 0.00 3.80 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 0.00 170 H 7.64 5.14 0.00 3.30 3.27 0.00 5.72 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 0.00 171 D 7.35 4.58 0.00 2.52 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 0.00 0.00 0.00 172 P 0.00 4.00 0.00 2.10 2.05 0.00 3.49 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 173 K 7.95 3.98 0.00 1.72 1.82 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.46 7.81 174 G 7.86 3.59 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 0.00 0.00 0.00 175 Y 7.74 4.45 0.00 3.13 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 0.00 176 I 8.10 3.79 2.05 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 1.51 1.30 0.94 0.00 0.00 177 A 7.84 4.06 1.35 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 0.00 178 E 8.36 4.34 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.72 0.00 179 S 7.50 4.66 0.00 3.94 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 0.00 180 P 0.00 4.26 0.00 2.26 2.18 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 181 I 7.61 3.91 1.83 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 1.63 0.77 0.88 0.00 0.00 182 L 7.89 4.06 0.00 1.90 1.77 1.13 0.93 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 0.00 183 R 8.05 4.06 0.00 1.97 2.30 0.00 3.06 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.66 0.00 184 M 7.57 4.31 0.00 1.76 2.12 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.91 0.00 185 H 8.09 5.05 0.00 3.15 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 Q 8.34 4.08 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 187 H 8.31 4.14 0.00 3.15 3.37 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 N 8.40 4.95 0.00 2.88 2.85 0.00 0.00 6.68 6.97 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 0.00 189 I 7.45 4.90 1.86 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 0.78 0.92 0.00 0.00 190 H 9.57 4.85 0.00 2.97 3.23 0.00 5.60 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 8.65 4.93 0.00 1.48 1.57 0.89 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 0.00 192 A 8.86 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 K 8.59 4.40 0.00 1.76 1.81 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.44 7.81 194 E 8.65 4.41 0.00 1.91 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 2.21 2.50 0.00 195 P 0.00 4.38 0.00 2.22 2.16 0.00 3.76 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 2.00 1.96 0.00 196 V 7.50 4.18 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 0.80 0.00 0.00 0.94 0.00 0.00 197 Q 8.65 4.12 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.02 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 198 N 8.14 4.85 0.00 2.65 2.66 0.00 0.00 7.11 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 0.00 199 E 7.95 4.35 0.00 1.92 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 200 I 7.35 4.13 1.87 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 1.49 0.68 0.97 0.00 0.00 201 S 8.41 4.82 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 0.00 202 A 8.51 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 T 7.90 3.76 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 1.22 0.00 0.00 204 Y 8.03 4.03 0.00 3.11 3.18 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 0.00 205 I 7.59 3.43 1.90 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 1.79 0.69 0.78 0.00 0.00 206 R 7.99 3.56 0.00 1.82 1.83 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.54 0.00 207 R 7.94 3.79 0.00 1.82 1.89 0.00 3.11 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 208 A 7.77 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 7.89 3.98 0.00 1.83 1.78 0.90 0.74 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 0.00 210 G 8.01 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 Q 7.73 4.41 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.29 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 212 G 7.82 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 0.00 213 Q 7.93 4.40 0.00 2.10 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 2.36 2.27 0.00 214 S 8.31 4.35 0.00 3.84 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 0.00 215 V 8.07 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 0.64 0.00 0.00 0.90 0.00 0.00 216 K 7.57 3.85 0.00 1.52 1.40 0.00 1.63 0.00 0.00 1.36 0.00 0.00 2.81 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.97 7.81 217 Y 8.21 3.95 0.00 3.28 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 0.00 218 L 8.11 4.63 0.00 1.92 1.75 1.10 0.63 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 0.00 219 I 7.27 5.17 2.02 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 1.41 0.66 0.93 0.00 0.00 220 P 0.00 4.34 0.00 2.18 2.02 0.00 3.63 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 221 D 8.83 4.32 0.00 2.67 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 0.00 222 A 7.96 4.06 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 7.64 3.63 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 1.21 0.00 0.00 0.94 0.00 0.00 224 I 7.83 3.74 2.05 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 1.51 0.85 0.90 0.00 0.00 225 T 8.04 3.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 226 Y 8.19 4.00 0.00 3.16 3.14 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 0.00 227 I 8.28 3.84 2.16 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 1.70 0.77 1.08 0.00 0.00 228 K 8.17 3.90 0.00 1.83 1.93 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.46 7.81 229 D 8.27 4.29 0.00 2.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 H 7.89 4.57 0.00 2.80 3.07 0.00 5.81 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 G 7.55 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 0.00 232 L 7.82 4.02 0.00 1.42 0.65 0.78 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 233 Y 7.57 3.98 0.00 3.12 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 0.00 234 T 7.29 4.19 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.