NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 4.1082 8.0549 120.3948 61.8139 32.1512 175.2820 13 P 4.2933 0.0000 0.0000 62.3163 31.9141 174.7593 14 T 4.4453 8.9184 118.3570 62.1025 70.4026 173.1937 15 P 4.9107 0.0000 0.0000 63.0813 32.1539 175.4364 16 T 4.6377 8.6525 109.6579 59.9931 71.8986 172.8603 17 N 4.0851 8.6643 117.5629 54.6007 37.1770 174.4235 18 V 4.5347 7.6850 117.3898 63.3569 32.5951 175.7534 19 T 4.9357 9.1828 117.8189 59.9537 72.6595 172.7919 20 I 5.0164 8.2409 121.7429 59.6216 40.4657 174.8340 21 E 4.9432 9.0564 125.1655 54.7101 33.9702 174.8459 22 S 4.9058 8.7287 116.6455 57.0091 66.3069 171.6519 23 Y 5.0505 8.5442 127.5672 56.1391 41.5972 174.9991 24 N 3.7365 8.6482 125.1296 55.5420 36.8544 173.8556 25 M 3.2184 7.8431 109.4258 57.1093 30.3922 178.0240 26 N 5.1763 7.5280 112.2874 51.0387 38.4454 171.8820 27 P 4.7165 0.0000 0.0000 62.8075 33.3733 176.6770 28 I 4.8406 8.7542 123.8599 59.4226 41.2195 174.3622 29 V 4.6892 8.5645 126.5493 61.8506 33.3797 174.2740 30 Y 5.3247 9.2168 124.6649 56.3801 42.1629 174.2191 31 W 5.7382 7.8237 117.2281 56.7716 31.7622 172.9285 32 E 4.8750 9.5571 119.0671 55.0532 33.1520 174.6157 33 Y 5.1642 8.2358 120.7867 56.4120 42.0317 174.4193 34 Q 4.3067 7.8166 123.0244 55.2124 29.9621 175.4875 35 I 4.1112 7.9788 119.2854 61.4519 37.7740 175.8000 36 M 4.9603 8.2858 123.0505 52.7134 35.7861 173.9302 37 P 4.3769 0.0000 0.0000 65.0683 31.8781 176.6415 38 Q 4.5447 7.6559 115.9939 53.5995 30.7989 175.1851 39 V 3.7849 8.1097 120.6458 61.9808 31.6905 174.0639 40 P 4.5974 0.0000 0.0000 62.4489 32.5755 175.8849 41 V 4.2127 7.9237 113.7370 59.5285 35.5904 174.7719 42 F 5.3655 9.0663 122.2924 56.1027 42.5885 174.6285 43 T 5.0112 8.5604 116.8998 61.8500 72.2436 173.0785 44 V 4.6952 8.4602 125.8666 61.0763 34.3117 174.1458 45 E 5.3042 9.1020 126.2842 54.5746 33.5835 174.9190 46 V 5.1797 9.2092 122.3459 61.0739 35.2000 174.0808 47 K 4.5700 9.0683 128.0213 54.5835 34.7488 174.2863 48 N 5.4790 8.5236 124.1331 51.3633 41.2609 173.9207 49 Y 4.1978 9.0707 124.8976 59.3303 39.3549 176.3017 50 G 3.7340 7.8141 114.5765 44.6885 0.0000 173.9795 51 V 3.6557 6.7692 119.1156 61.2705 31.9617 176.3817 52 K 4.1191 8.8013 122.8462 59.3655 33.5787 177.1808 53 N 4.8587 8.0452 109.9441 53.4261 38.5791 175.4033 54 S 4.6157 9.0235 117.0260 58.6313 63.9250 173.3997 55 E 4.4018 8.1421 119.9849 56.1818 30.2773 175.6861 56 W 4.7261 8.7041 123.0085 55.4695 30.9743 175.5399 57 I 4.6000 8.7050 125.2387 59.3416 39.3656 174.8381 58 D 4.8358 8.8664 126.4065 54.9413 40.5516 175.8417 59 A 4.4788 9.3004 126.5304 53.7394 20.3282 176.9362 60 C 4.8682 7.7403 107.8290 57.1360 33.2886 173.6295 61 I 4.7305 7.9799 119.9100 60.9898 40.8440 175.1060 62 N 4.0672 8.6096 120.1561 54.2469 36.3170 173.9816 63 I 4.4260 7.4644 110.3305 59.4947 39.9705 176.6209 64 S 4.6183 8.4124 114.9698 58.4652 63.9918 173.8296 65 H 4.5640 7.7327 116.7874 55.4086 29.9922 174.1718 66 H 3.4243 7.9699 114.6678 54.1719 28.5943 173.6708 67 Y 4.5274 6.5152 113.5606 56.1046 41.3968 174.3107 68 C 4.5975 8.8386 120.8054 58.2516 35.2714 172.3263 69 N 4.8005 9.0686 126.4538 53.0262 39.2799 174.4934 70 I 4.5475 8.5431 119.5252 60.7186 38.1320 177.4669 71 S 4.0992 8.5344 120.0131 62.7987 62.6286 175.5497 72 D 4.6599 8.0922 116.0357 55.5302 40.6663 176.0466 73 H 4.9030 8.3009 116.5859 55.6450 29.6050 175.4290 74 V 3.9040 8.0068 119.4717 64.9465 32.8249 177.3517 75 G 4.0037 7.7614 107.6993 45.7951 0.0000 174.3090 76 D 4.5576 8.6531 125.2139 52.8065 41.6723 175.2195 77 P 4.4098 0.0000 0.0000 65.3696 31.4502 177.9799 78 S 4.5871 8.6468 114.3926 59.7513 63.3082 174.1210 79 N 4.7755 7.8482 118.3150 52.5029 39.4066 175.2560 80 S 4.5667 8.3648 117.9873 58.5574 64.5519 172.9610 81 L 5.2274 8.2348 121.0451 54.3236 44.1482 174.8620 82 W 5.3829 9.5370 119.4405 55.0970 33.5522 174.5361 83 V 5.4032 8.9139 120.9917 61.4916 35.0122 174.4258 84 R 5.0867 8.8175 121.0819 54.6150 33.2850 173.9385 85 V 4.8338 8.8871 120.9035 60.9989 35.0531 174.3013 86 K 4.8789 8.7635 125.0513 55.0398 36.3986 174.6737 87 A 5.0789 8.7375 122.2153 50.1775 22.5904 175.3659 88 R 4.8380 8.4724 119.1581 54.5297 34.2239 174.4131 89 V 4.3412 8.4680 125.1713 60.9413 34.4445 176.1252 90 G 3.8498 8.9588 120.7336 47.1221 0.0000 173.7814 91 Q 4.4073 8.9040 123.0843 55.1217 29.4535 174.8630 92 K 4.4633 7.8139 119.2214 54.9391 33.5167 175.2050 93 E 5.1485 8.3810 122.3375 54.4810 32.3696 175.9974 94 S 4.6492 8.5960 118.2714 57.3526 64.9599 173.2263 95 A 4.2473 8.2206 122.1653 51.4883 19.4423 176.5432 96 Y 4.5233 8.3362 116.4608 57.7387 39.1310 175.2972 97 A 4.6836 9.2030 125.7154 50.4730 21.0904 175.8620 98 K 5.0311 8.5701 122.4614 54.5702 34.1701 176.8100 99 S 4.5921 9.0030 120.5402 57.9429 64.5139 173.4013 100 E 4.5514 8.5631 120.1439 54.8960 30.5794 175.9388 101 E 3.2420 8.5560 121.1056 56.3870 30.3630 175.6805 102 F 4.9415 8.4983 127.4054 56.2824 43.3673 173.2587 103 A 4.3955 7.6235 126.3318 49.9575 21.5324 176.6256 104 V 3.2769 8.5691 122.9974 66.3620 31.6615 178.8111 105 C 4.3042 8.0121 118.0915 58.9570 43.7847 174.2748 106 R 3.5542 7.0528 118.4052 57.6473 29.8626 176.4548 107 D 4.3896 7.5838 115.6883 54.4152 41.6773 176.5671 108 G 4.1590 7.5006 106.3426 45.0535 0.0000 173.0362 109 K 4.9271 9.1114 118.7648 54.5015 35.5462 175.8495 110 I 4.5690 8.1505 123.1647 59.1711 40.5686 175.7357 111 G 4.6326 8.7894 114.1120 45.1038 0.0000 171.1294 112 P 5.1832 0.0000 0.0000 61.0449 32.4776 174.3884 113 P 4.8074 0.0000 0.0000 62.6491 33.0428 175.1111 114 K 4.7561 8.8133 119.4148 54.7013 34.4079 175.6861 115 L 5.2274 8.6361 123.7276 53.0256 45.0210 175.4885 116 D 4.9338 8.5809 120.8063 52.5759 44.2381 174.4973 117 I 4.9582 8.5083 123.7978 59.1638 40.3967 174.5676 118 R 4.8140 8.8065 124.4406 54.3436 33.5094 174.1986 119 K 4.4686 8.5134 120.2391 56.0800 33.0356 176.3720 120 E 4.4004 8.5188 132.3563 56.2928 30.3767 177.1526 121 E 4.0979 8.9142 120.1576 60.3919 29.7883 178.0638 122 K 4.7170 7.8759 113.8527 55.8985 33.9155 175.3147 123 Q 4.6565 7.8811 118.2018 54.4903 33.9734 173.4346 124 I 4.5832 8.6679 121.5544 60.0239 39.6078 174.7941 125 M 4.8563 9.1637 126.7898 53.6675 34.4076 174.7664 126 I 4.7500 9.0020 125.5504 59.6187 39.9726 174.2995 127 D 4.8345 8.7194 127.4349 52.6190 43.1561 175.6423 128 I 3.8634 8.0989 125.3664 59.4437 38.5019 174.5215 129 F 4.9914 8.4315 126.8387 56.8217 40.1677 175.5091 130 H 4.9806 8.4498 120.0670 54.7223 29.5765 173.6197 131 P 4.5730 0.0000 0.0000 63.1850 31.9581 177.3869 132 S 4.1432 9.0804 117.6275 61.6578 62.8547 176.9850 133 V 3.4632 7.5901 112.8360 63.7794 31.1813 176.6973 134 F 4.8095 7.8099 116.0498 57.8150 39.4968 176.3614 135 V 4.3017 7.7126 121.5768 60.1652 30.6271 172.5963 *146 P 4.1366 0.0000 0.0000 63.4974 32.6066 177.4646 147 E 4.1626 9.1185 118.8458 56.3141 27.4463 175.1130 148 T 4.5331 7.4449 112.0286 60.8643 68.8021 174.2170 149 T 4.4830 8.3393 113.9668 62.4381 69.3996 176.3250 150 C 4.5526 8.2538 124.3708 55.4980 43.3484 171.5089 151 Y 4.4553 6.9120 121.6968 54.2873 41.0710 174.7745 152 I 4.0135 7.5960 121.5797 61.5342 37.2486 176.0509 153 R 4.3734 9.2519 128.7786 58.2426 31.3170 176.4378 154 V 4.9027 7.3304 116.4694 60.1458 35.0255 173.4727 155 Y 5.0762 8.9888 120.5100 56.5326 40.5252 174.5320 156 N 4.8092 9.0716 122.6684 52.2437 40.1013 174.1987 157 V 4.5618 8.6050 125.4876 61.3869 33.8671 173.9693 158 Y 4.8579 9.0627 126.5279 56.4993 39.7900 174.7335 159 V 5.0183 8.7324 124.9242 61.0620 34.7594 174.3100 160 R 5.1561 9.3069 126.9547 54.4523 33.2120 174.4969 161 M 4.6717 9.1115 121.9005 52.9162 33.5270 176.3865 162 N 3.8808 8.4711 123.7808 54.6275 38.6635 175.3604 163 G 4.0613 8.8320 113.4875 46.2824 0.0000 172.7038 164 S 4.8195 8.2896 116.2015 56.2641 65.2730 172.9579 165 E 5.2214 8.4140 122.4721 54.8404 32.3613 175.2960 166 I 4.3809 8.7885 122.5732 59.8053 42.0239 172.8505 167 Q 4.7209 8.3908 130.0310 54.7257 30.4948 173.9909 168 Y 5.0111 8.7378 123.4453 56.0251 42.0151 174.5243 169 K 4.9288 8.6805 122.1115 54.9411 34.7270 175.0544 170 I 4.3963 8.8479 129.4368 59.7816 39.1876 174.5216 171 L 4.8555 8.4272 129.6703 53.7527 42.2493 176.3744 172 T 4.0333 8.6732 118.0345 64.3259 68.8812 175.5302 173 Q 4.3781 8.1242 119.4746 57.4290 30.0911 176.5685 174 K 4.4013 7.7387 115.2012 56.4449 32.5473 176.6276 175 E 4.7658 7.4955 113.6513 56.3371 32.9449 176.6095 176 D 4.8318 8.8624 122.1109 54.9558 40.7317 177.3221 177 D 4.4682 7.9668 121.9963 55.9887 41.1188 175.2881 178 C 5.3628 7.9719 118.1992 54.6665 46.5501 172.8744 179 D 5.1160 8.6806 126.8755 53.6202 42.7109 176.0573 180 E 4.1751 9.0496 119.4686 60.1941 30.1120 177.8318 181 I 4.3056 7.8451 118.6163 62.8598 38.4467 174.7933 182 Q 4.9729 7.6202 116.1374 55.5315 32.1907 173.8270 183 C 5.5005 8.6924 115.4374 55.2302 44.3705 173.3098 184 Q 4.9597 8.3657 120.6527 54.4942 32.1130 174.1188 185 L 4.7011 8.8928 126.0962 53.3618 45.9857 174.3336 186 A 5.0585 8.5214 127.1077 50.1465 21.3302 175.3746 187 I 4.4543 8.9272 123.6000 58.5849 40.7085 173.0273 188 P 4.5806 0.0000 0.0000 62.2578 32.3993 176.6028 189 V 4.2390 8.2861 124.6668 61.6995 30.7513 174.6997 190 S 4.8526 8.0573 123.6659 58.2764 66.2631 174.7175 191 S 3.8254 9.8547 117.7673 59.7432 60.4238 172.1445 192 L 3.7615 7.9140 116.7344 55.9296 38.3954 174.3257 193 N 4.6542 8.2004 115.3673 53.2458 39.3832 175.3766 194 S 4.6996 8.9045 116.2701 58.3249 66.5101 173.5335 195 Q 4.8983 8.0032 121.1373 54.2716 31.4944 173.7492 196 Y 5.0768 9.1591 124.2276 56.3869 41.1921 173.9041 197 C 5.5304 9.5465 121.9396 55.1790 44.9133 173.3395 198 V 5.3122 9.0488 122.4600 61.4953 35.1543 174.0859 199 S 5.2035 9.1612 120.0563 57.5444 67.2619 172.1443 200 A 5.3484 8.7324 120.2197 51.3379 23.0113 175.1228 201 E 5.1480 9.1310 116.2811 54.7688 33.5413 175.0548 202 G 4.1980 9.1350 108.6764 45.1056 0.0000 172.6259 203 V 4.8190 8.3124 121.3551 60.6468 34.0818 175.1058 204 L 4.5235 8.8174 128.4849 54.6764 42.9140 176.3822 205 H 3.8487 8.1639 122.2442 57.1139 30.3175 172.9821 206 V 2.9183 7.8918 122.0189 62.1329 30.7479 172.0905 207 W 4.3999 7.8307 121.1553 56.0856 30.0152 176.8881 208 G 3.9669 8.0929 105.8983 45.4529 0.0000 173.8379 209 V 4.0398 7.7578 119.2066 62.5340 32.8548 174.8253 210 T 5.0774 8.3761 117.0499 60.6605 70.8021 174.5078 211 T 4.4628 8.4800 114.6565 60.9229 70.5235 173.8659 212 E 4.3328 8.9485 120.7483 56.2063 30.8301 176.4612 213 K 4.7382 8.5309 123.9179 55.7319 33.0063 176.8435 214 S 4.4944 8.7435 122.4029 58.1400 63.9779 174.1079 215 K 4.1955 8.4836 120.6271 55.7019 32.6296 176.7475 216 E 4.2788 8.7712 123.9438 57.3133 30.1244 176.3250 217 V 4.6269 8.8218 118.9307 59.8471 34.9064 174.0819 218 C 5.6682 8.7486 120.2004 55.3223 42.5873 173.0860 219 I 4.9012 8.7094 120.0348 59.5464 41.4898 173.7436 220 T 4.5376 8.4581 118.0342 60.3841 70.1699 172.8054 221 I 3.9521 9.0311 127.8975 59.0592 37.3167 176.0426 222 F 4.5875 7.9248 126.6482 58.3121 38.4331 175.1296 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 12 V 8.05 4.11 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 1.06 0.00 0.00 0.98 0.00 0.00 13 P 0.00 4.29 0.00 1.89 1.87 0.00 3.87 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.11 0.00 14 T 8.92 4.45 4.28 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 1.31 0.00 0.00 15 P 0.00 4.91 0.00 1.97 1.93 0.00 3.66 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 2.04 2.20 0.00 16 T 8.65 4.64 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 17 N 8.66 4.09 0.00 2.96 2.86 0.00 0.00 6.52 7.71 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 18 V 7.68 4.53 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 0.93 0.00 0.00 0.98 0.00 0.00 19 T 9.18 4.94 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 1.27 0.00 0.00 20 I 8.24 5.02 1.12 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 1.14 0.55 -0.22 0.00 0.00 21 E 9.06 4.94 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 22 S 8.73 4.91 0.00 4.06 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 23 Y 8.54 5.05 0.00 3.12 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 24 N 8.65 3.74 0.00 2.59 2.62 0.00 0.00 7.20 8.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 7.84 3.22 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 26 N 7.53 5.18 0.00 2.73 2.87 0.00 0.00 7.04 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 27 P 0.00 4.72 0.00 2.08 2.27 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 28 I 8.75 4.84 1.69 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 1.06 1.17 0.29 0.00 0.00 29 V 8.56 4.69 2.24 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 1.15 0.00 0.00 0.91 0.00 0.00 30 Y 9.22 5.32 0.00 2.88 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 31 W 7.82 5.74 0.00 3.33 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 32 E 9.56 4.88 0.00 1.93 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 2.16 2.22 0.00 33 Y 8.24 5.16 0.00 3.17 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 34 Q 7.82 4.31 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 1.76 2.22 0.00 35 I 7.98 4.11 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.58 0.94 0.00 0.00 36 M 8.29 4.96 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.83 0.00 37 P 0.00 4.38 0.00 2.18 2.19 0.00 3.77 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 2.00 2.00 0.00 38 Q 7.66 4.54 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.04 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 39 V 8.11 3.78 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 0.75 0.00 0.00 0.93 0.00 0.00 40 P 0.00 4.60 0.00 1.20 1.75 0.00 3.74 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 1.88 2.14 0.00 41 V 7.92 4.21 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 0.59 0.00 0.00 0.80 0.00 0.00 42 F 9.07 5.37 0.00 2.96 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 43 T 8.56 5.01 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 1.22 0.00 0.00 44 V 8.46 4.70 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.68 0.00 0.00 45 E 9.10 5.30 0.00 1.75 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 2.39 2.22 0.00 46 V 9.21 5.18 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 1.10 0.00 0.00 0.94 0.00 0.00 47 K 9.07 4.57 0.00 0.79 0.80 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.79 7.81 48 N 8.52 5.48 0.00 2.77 2.76 0.00 0.00 6.77 7.48 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 49 Y 9.07 4.20 0.00 3.15 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 50 G 7.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 6.77 3.66 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 0.56 0.00 0.00 0.87 0.00 0.00 52 K 8.80 4.12 0.00 1.73 1.89 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.44 7.81 53 N 8.05 4.86 0.00 2.63 2.02 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 54 S 9.02 4.62 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.14 4.40 0.00 1.95 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 2.30 2.31 0.00 56 W 8.70 4.73 0.00 3.12 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 57 I 8.71 4.60 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.00 1.01 0.00 0.00 58 D 8.87 4.84 0.00 2.60 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 9.30 4.48 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 C 7.74 4.87 0.00 2.98 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 61 I 7.98 4.73 1.88 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 1.42 0.55 0.90 0.00 0.00 62 N 8.61 4.07 0.00 2.77 2.78 0.00 0.00 6.91 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.46 4.43 1.58 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 1.53 1.02 0.93 0.00 0.00 64 S 8.41 4.62 0.00 3.96 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 65 H 7.73 4.56 0.00 3.12 3.28 0.00 5.48 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 H 7.97 3.42 0.00 2.64 2.11 0.00 5.82 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 6.52 4.53 0.00 2.49 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 68 C 8.84 4.60 0.00 3.24 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 9.07 4.80 0.00 2.85 2.77 0.00 0.00 7.08 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 70 I 8.54 4.55 1.91 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 1.34 0.76 0.98 0.00 0.00 71 S 8.53 4.10 0.00 3.95 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.09 4.66 0.00 2.64 2.62 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 0.00 73 H 8.30 4.90 0.00 3.12 3.30 0.00 5.65 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 74 V 8.01 3.90 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 0.84 0.00 0.00 1.09 0.00 0.00 75 G 7.76 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.65 4.56 0.00 2.75 2.62 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 0.00 77 P 0.00 4.41 0.00 2.32 2.35 0.00 3.81 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 78 S 8.65 4.59 0.00 4.12 4.11 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 79 N 7.85 4.78 0.00 2.98 2.87 0.00 0.00 7.00 7.64 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 80 S 8.36 4.57 0.00 3.49 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.23 5.23 0.00 1.89 1.74 0.97 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 82 W 9.54 5.38 0.00 3.22 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 83 V 8.91 5.40 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 1.11 0.00 0.00 0.99 0.00 0.00 84 R 8.82 5.09 0.00 1.50 1.51 0.00 2.21 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.64 0.00 85 V 8.89 4.83 1.58 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 -0.28 0.00 0.00 0.38 0.00 0.00 86 K 8.76 4.88 0.00 1.42 1.05 0.00 1.05 0.00 0.00 0.80 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.13 1.16 7.81 87 A 8.74 5.08 1.06 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 0.00 0.00 88 R 8.47 4.84 0.00 1.69 1.55 0.00 3.09 0.00 0.00 3.01 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 89 V 8.47 4.34 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 0.88 0.00 0.00 0.91 0.00 0.00 90 G 8.96 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 91 Q 8.90 4.41 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 92 K 7.81 4.46 0.00 1.94 1.68 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.37 7.81 93 E 8.38 5.15 0.00 1.70 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 94 S 8.60 4.65 0.00 3.95 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 95 A 8.22 4.25 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 96 Y 8.34 4.52 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 9.20 4.68 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 98 K 8.57 5.03 0.00 1.69 1.82 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.24 1.40 7.81 99 S 9.00 4.59 0.00 3.93 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 0.00 100 E 8.56 4.55 0.00 2.04 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 2.36 2.29 0.00 101 E 8.56 3.24 0.00 1.99 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.47 0.00 102 F 8.50 4.94 0.00 3.01 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 0.00 103 A 7.62 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.57 3.28 2.19 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 0.97 0.00 0.00 1.13 0.00 0.00 105 C 8.01 4.30 0.00 3.20 3.22 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 0.00 106 R 7.05 3.55 0.00 0.67 0.82 0.00 2.77 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.50 0.00 107 D 7.58 4.39 0.00 1.62 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 0.00 108 G 7.50 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 9.11 4.93 0.00 1.91 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.46 7.81 110 I 8.15 4.57 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.11 0.87 0.00 0.00 111 G 8.79 4.63 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 0.00 112 P 0.00 5.18 0.00 2.18 2.21 0.00 3.47 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.88 0.00 113 P 0.00 4.81 0.00 2.11 2.32 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 114 K 8.81 4.76 0.00 1.93 1.86 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.47 7.81 115 L 8.64 5.23 0.00 1.48 1.47 0.89 0.94 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 0.00 116 D 8.58 4.93 0.00 2.59 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 I 8.51 4.96 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 1.38 0.83 0.92 0.00 0.00 118 R 8.81 4.81 0.00 1.85 1.93 0.00 2.80 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 119 K 8.51 4.47 0.00 1.74 1.85 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.45 7.81 120 E 8.52 4.40 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 121 E 8.91 4.10 0.00 1.94 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 2.30 2.26 0.00 122 K 7.88 4.72 0.00 1.56 1.73 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.41 7.81 123 Q 7.88 4.66 0.00 1.86 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 124 I 8.67 4.58 1.53 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 0.85 0.50 0.82 0.00 0.00 125 M 9.16 4.86 0.00 1.78 1.89 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 126 I 9.00 4.75 1.77 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 0.65 0.81 0.00 0.00 127 D 8.72 4.83 0.00 2.11 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 0.00 0.00 0.00 128 I 8.10 3.86 1.35 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.74 0.04 0.00 0.00 129 F 8.43 4.99 0.00 2.99 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 0.00 130 H 8.45 4.98 0.00 3.29 3.54 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.57 0.00 2.21 2.22 0.00 4.13 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 132 S 9.08 4.14 0.00 3.97 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.59 3.46 1.61 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 0.48 0.00 0.00 -0.20 0.00 0.00 134 F 7.81 4.81 0.00 3.28 3.07 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 0.00 135 V 7.71 4.30 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 0.86 0.00 0.00 1.08 0.00 0.00 *146 P 0.00 4.14 0.00 2.25 2.08 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 147 E 9.12 4.16 0.00 2.09 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 148 T 7.44 4.53 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 1.35 0.00 0.00 149 T 8.34 4.48 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 150 C 8.25 4.55 0.00 3.05 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 0.00 151 Y 6.91 4.46 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 7.60 4.01 1.53 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.25 0.23 0.00 0.00 153 R 9.25 4.37 0.00 1.65 1.92 0.00 2.99 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 154 V 7.33 4.90 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 0.86 0.00 0.00 1.01 0.00 0.00 155 Y 8.99 5.08 0.00 2.91 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 N 9.07 4.81 0.00 2.64 2.54 0.00 0.00 6.11 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.61 4.56 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 1.12 0.00 0.00 0.94 0.00 0.00 158 Y 9.06 4.86 0.00 2.95 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 0.00 159 V 8.73 5.02 2.22 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 1.25 0.00 0.00 1.13 0.00 0.00 160 R 9.31 5.16 0.00 1.72 1.76 0.00 3.10 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 161 M 9.11 4.67 0.00 1.58 1.98 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 162 N 8.47 3.88 0.00 2.88 1.91 0.00 0.00 6.95 7.61 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 0.00 163 G 8.83 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.29 4.82 0.00 3.88 3.73 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 0.00 165 E 8.41 5.22 0.00 1.80 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 2.19 2.25 0.00 166 I 8.79 4.38 1.75 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.28 0.51 0.00 0.00 167 Q 8.39 4.72 0.00 2.01 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.56 0.00 0.00 0.00 0.00 0.00 1.96 1.82 0.00 168 Y 8.74 5.01 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 0.00 169 K 8.68 4.93 0.00 1.74 1.68 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.41 7.81 170 I 8.85 4.40 2.03 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 1.12 0.55 0.96 0.00 0.00 171 L 8.43 4.86 0.00 1.63 1.57 0.91 1.03 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 0.00 172 T 8.67 4.03 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 1.28 0.00 0.00 173 Q 8.12 4.38 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.79 0.00 0.00 0.00 0.00 0.00 2.17 2.38 0.00 174 K 7.74 4.40 0.00 1.74 1.81 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.44 7.81 175 E 7.50 4.77 0.00 2.14 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 2.16 2.17 0.00 176 D 8.86 4.83 0.00 2.65 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 D 7.97 4.47 0.00 2.65 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 0.00 178 C 7.97 5.36 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 D 8.68 5.12 0.00 2.66 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 E 9.05 4.18 0.00 2.00 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 2.32 2.34 0.00 181 I 7.85 4.31 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.17 1.05 0.00 0.00 182 Q 7.62 4.97 0.00 1.84 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 183 C 8.69 5.50 0.00 2.83 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 0.00 184 Q 8.37 4.96 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 185 L 8.89 4.70 0.00 1.64 1.31 0.73 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 186 A 8.52 5.06 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 0.00 187 I 8.93 4.45 1.72 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 0.99 0.67 0.88 0.00 0.00 188 P 0.00 4.58 0.00 2.08 2.03 0.00 3.76 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 189 V 8.29 4.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.78 0.00 0.00 190 S 8.06 4.85 0.00 3.94 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 0.00 191 S 9.85 3.83 0.00 4.00 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 0.00 192 L 7.91 3.76 0.00 1.84 1.84 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 193 N 8.20 4.65 0.00 2.72 2.33 0.00 0.00 6.65 7.11 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 0.00 194 S 8.90 4.70 0.00 3.53 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 Q 8.00 4.90 0.00 1.97 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 196 Y 9.16 5.08 0.00 2.95 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 0.00 197 C 9.55 5.53 0.00 2.80 3.07 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 0.00 198 V 9.05 5.31 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 1.13 0.00 0.00 1.01 0.00 0.00 199 S 9.16 5.20 0.00 4.08 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 A 8.73 5.35 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 0.00 201 E 9.13 5.15 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 202 G 9.14 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 0.00 0.00 0.00 203 V 8.31 4.82 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 0.75 0.00 0.00 0.93 0.00 0.00 204 L 8.82 4.52 0.00 1.63 1.52 1.00 1.05 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 0.00 205 H 8.16 3.85 0.00 2.26 2.73 0.00 6.03 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 V 7.89 2.92 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 0.51 0.00 0.00 207 W 7.83 4.40 0.00 3.42 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 0.00 208 G 8.09 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 0.00 0.00 0.00 209 V 7.76 4.04 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 1.09 0.00 0.00 0.94 0.00 0.00 210 T 8.38 5.08 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 1.25 0.00 0.00 211 T 8.48 4.46 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 1.39 0.00 0.00 212 E 8.95 4.33 0.00 2.16 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 2.44 2.61 0.00 213 K 8.53 4.74 0.00 1.81 1.73 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.36 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.39 1.51 7.81 214 S 8.74 4.49 0.00 3.98 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 K 8.48 4.20 0.00 1.80 1.80 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.45 7.81 216 E 8.77 4.28 0.00 1.99 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 2.33 2.41 0.00 217 V 8.82 4.63 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 0.77 0.00 0.00 1.02 0.00 0.00 218 C 8.75 5.67 0.00 2.80 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 0.00 219 I 8.71 4.90 1.89 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 1.28 1.62 0.97 0.00 0.00 220 T 8.46 4.54 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 1.08 0.00 0.00 221 I 9.03 3.95 1.94 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 1.24 0.60 0.97 0.00 0.00 222 F 7.92 4.59 0.00 3.22 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 * Residues marked with a * may have inaccurate shift predictions.