NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 5.0387 8.2348 114.6950 59.4511 63.8324 173.3774 -1 N 4.2101 9.3762 124.1088 53.4688 37.1951 174.3332 0 A 4.3074 8.4331 124.9562 52.4153 19.0772 179.2039 0 Y 4.5374 8.3131 121.4562 57.8153 37.7772 177.3039 3 K 4.8189 9.1017 121.2164 54.5197 36.4092 175.2384 4 E 4.5729 8.8938 122.4215 55.7117 30.0196 176.8553 5 G 4.2928 9.1155 112.6980 45.6711 0.0000 174.1785 6 A 4.3341 8.7304 126.3069 52.2154 19.7807 176.0395 7 C 4.2941 8.6485 121.6071 59.2107 31.6795 173.1930 8 L 4.5864 8.7475 126.5178 56.5117 42.8570 176.3851 9 Y 4.7904 7.6615 116.7857 56.7878 42.2328 173.3254 10 R 4.7791 7.7020 125.4889 55.0377 33.4700 173.3102 11 N 4.8196 9.5289 125.2623 51.2178 41.3154 173.0129 12 P 4.3690 0.0000 0.0000 62.8656 32.6643 176.7363 13 L 3.6728 8.1915 118.6816 56.1948 39.4727 175.9017 14 R 4.7845 8.8932 117.0918 55.9946 32.0454 176.7658 15 S 3.9097 7.4705 110.7164 55.8513 66.4462 174.7319 16 K 3.3491 7.7948 120.0090 59.4447 31.8831 179.7260 17 S 4.1587 7.7385 112.6287 61.0428 63.0506 176.0535 18 D 4.3768 7.8402 120.5610 56.4301 40.8087 177.3465 19 V 3.7156 7.4331 111.8417 60.5294 32.1803 177.5653 20 K 3.8186 7.6183 122.5319 59.8889 31.8429 177.2563 21 D 4.9254 8.1268 114.6314 53.9253 41.0191 176.6685 22 W 4.3686 8.2074 119.5072 57.0567 30.0626 176.0523 23 R 4.6815 8.4382 121.5354 54.5443 33.6317 174.6450 *25 E 4.4522 8.6209 118.4202 60.9395 30.7850 174.9848 26 G 4.1394 9.0525 109.8144 43.6242 0.0000 172.3369 27 G 3.9659 8.7004 105.2956 45.9702 0.0000 174.1595 28 G 3.5494 7.6799 105.7022 45.4428 0.0000 173.4953 29 Q 4.5836 8.6459 123.2370 53.9344 31.7460 174.1372 30 I 4.6603 8.0817 126.6815 59.7218 39.3281 174.8785 31 S 4.6215 8.2952 119.5691 56.4012 66.7977 173.6307 32 F 5.6755 8.3616 121.0944 55.7426 39.8460 174.7685 33 D 4.4566 7.6023 119.0579 55.9099 41.4490 175.7264 34 D 4.2932 8.5784 122.9402 55.5169 39.3139 173.5403 35 H 4.4055 8.1253 111.8585 55.1246 27.0757 174.4403 36 S 5.1522 7.7105 109.9927 56.6170 67.2681 174.0917 37 L 3.6107 8.4867 124.8988 55.4988 43.0799 175.1317 38 H 5.1748 9.0455 124.7800 54.0994 31.2285 173.7296 39 L 5.1300 8.9950 124.1518 53.1833 44.3884 175.9653 40 S 5.1294 8.6961 118.3297 57.4205 66.6704 172.1914 41 H 5.4519 8.7181 114.6802 54.6340 31.6216 174.6728 42 V 3.9181 8.6032 114.7382 63.8482 32.2319 176.3292 43 Q 4.6366 7.8740 117.6119 53.9586 32.7957 175.2990 44 D 4.4745 8.7580 119.0688 56.9551 40.9003 177.4299 45 E 4.4608 7.9373 116.5903 55.9482 30.9654 176.8864 46 A 4.3847 7.6492 122.7586 51.4165 17.0677 178.0582 47 H 4.7958 7.4455 119.0320 55.5366 30.5846 175.7231 48 F 5.2177 8.1800 114.8509 56.1237 42.0148 173.0099 49 V 4.6946 8.9028 118.5096 61.1932 34.1751 174.1452 50 F 5.3492 9.5880 131.1918 56.6794 41.1142 174.0376 51 W 5.1404 9.3501 127.5375 55.5471 30.9764 175.6138 52 C 2.5175 8.1412 124.8817 57.6784 31.1793 172.1016 53 P 4.5265 0.0000 0.0000 64.5845 31.6137 176.5280 54 E 3.7992 7.5320 119.0819 56.2616 29.8887 175.9572 55 T 4.1478 7.9187 119.9389 62.7657 69.4247 174.2442 56 F 4.9476 8.8469 125.9616 55.3048 41.6031 174.1996 57 P 5.0681 0.0000 0.0000 62.1741 33.1981 174.7910 58 D 4.5019 8.6863 119.6039 53.8364 42.8970 174.7071 59 G 4.0769 8.6261 107.4008 45.9716 0.0000 172.0786 60 I 5.3088 8.4688 112.7870 59.4224 42.6356 175.9975 61 I 4.8541 8.9484 123.5484 59.6323 40.2085 174.6958 62 V 4.9417 9.2990 128.3711 61.4397 33.4847 174.6501 63 T 5.3417 9.0227 117.6441 60.1307 72.3312 172.6687 64 W 5.6725 8.3108 117.1202 57.0733 30.9052 172.9843 65 D 5.1012 9.3907 122.1310 53.2953 42.3664 175.3682 66 F 5.3358 9.1390 124.8022 56.5361 43.0663 173.7785 67 S 4.5990 7.8857 121.1175 55.7775 66.2587 171.4141 68 P 3.8345 0.0000 0.0000 62.4748 31.0919 175.8335 69 I 4.1557 8.1930 125.8137 62.4215 38.6437 176.3257 70 E 4.6329 7.8369 120.3122 54.6306 32.4369 173.4885 71 Q 4.8394 8.3437 122.4356 53.1529 31.7962 172.9242 72 P 4.5487 0.0000 0.0000 62.2064 32.3518 176.2483 73 G 4.1329 7.2459 109.2093 46.7173 0.0000 170.8025 74 L 5.8601 7.4274 119.8031 54.0272 45.8825 174.1086 75 C 5.3632 8.1459 121.0928 56.5734 32.4277 172.1479 *77 L 4.0642 8.1693 119.8964 55.3164 42.9618 175.4056 78 F 5.2447 8.8294 125.3524 56.1810 41.3446 174.8643 79 F 5.4905 9.0971 116.4799 55.5497 41.8793 173.4972 80 A 4.0801 8.8604 118.7608 53.2111 16.1182 176.9934 81 A 4.8830 7.8810 120.9931 52.5622 20.6591 177.6871 82 A 4.4894 8.5085 122.9031 50.5354 23.5667 175.8142 83 G 3.8732 8.8496 106.9614 46.2594 0.0000 175.4233 84 I 3.7931 8.3481 122.0800 63.5891 37.2281 177.6228 85 R 4.3700 8.4216 117.8607 55.7947 29.9462 177.0458 86 G 3.9043 8.3295 106.0939 45.3666 0.0000 174.3078 87 E 4.0804 7.6574 118.9514 55.4600 30.3520 175.8546 88 D 4.4471 8.3624 120.9846 54.0369 41.7684 177.1064 89 L 3.4737 8.0479 127.6840 57.3527 41.8773 177.5041 90 F 4.8617 7.5750 114.9700 56.9206 39.4156 175.0734 91 D 4.4439 8.1439 122.9427 53.3981 41.3435 175.6137 92 P 4.3825 0.0000 0.0000 65.3340 31.3129 177.5659 93 S 4.2306 8.6982 113.4427 60.1314 63.2391 174.5215 94 L 4.4502 7.4247 121.3068 53.5064 42.3262 176.9305 95 R 4.0196 8.7549 121.5948 56.0229 30.6002 177.2784 96 K 4.1528 8.4286 120.5889 56.6651 32.7388 176.7018 97 R 4.7732 8.3580 120.4762 54.8869 33.1319 175.5325 98 T 4.6670 10.1237 110.7893 61.3771 69.5102 175.5678 99 G 4.1718 8.9441 108.9827 46.2431 0.0000 174.0538 100 T 4.3946 8.1942 117.5290 62.9101 69.2061 174.5268 101 Y 4.8812 9.1654 128.2336 60.9300 38.8232 176.6209 102 P 3.7342 0.0000 0.0000 65.2516 31.1097 178.2427 103 E 3.8634 8.3531 116.7493 58.5882 29.2831 177.8664 104 Y 4.3354 8.0770 116.4081 59.4592 39.0983 176.7537 105 H 4.8312 7.7550 114.1256 56.0265 29.5430 175.3747 106 S 4.9955 8.1440 118.2555 58.4583 64.7929 174.5961 107 G 4.1261 7.9016 111.9435 46.1466 0.0000 174.2315 108 D 5.1116 8.5545 121.4995 52.8699 40.4189 175.6461 109 I 5.0958 7.7398 110.6623 60.1503 41.2271 173.6727 110 N 5.3267 8.8071 119.4080 51.5139 42.2075 173.6804 111 A 4.7756 8.3673 121.8583 51.9290 23.6161 175.2118 112 L 4.9374 7.7572 119.9292 53.3513 44.1731 175.6892 113 H 4.9482 8.7577 117.8982 53.7240 31.8567 171.7242 114 L 5.0487 8.8071 125.7823 53.1444 43.7727 175.5484 115 S 4.8769 8.9209 122.5767 57.5474 65.2792 172.8472 116 Y 4.9750 8.2124 119.6774 55.1607 42.0169 173.9599 117 F 4.0092 8.9665 120.0336 59.4574 38.0858 177.1764 118 R 4.4988 7.4075 118.8303 55.5195 29.0520 176.8932 119 R 4.5078 8.4001 124.5758 55.5102 31.7571 178.3615 120 K 3.7423 8.4009 120.9253 58.7241 32.6300 176.8348 121 Y 4.9104 7.7224 115.0990 55.5108 41.9169 176.4569 122 A 4.0181 8.6629 123.8085 55.7931 18.2536 180.0314 123 E 3.9849 8.2392 115.0964 59.6603 29.6786 179.1157 124 E 4.1784 8.0771 118.1041 59.5042 29.5242 179.3830 125 R 3.8963 8.0737 116.5952 58.6917 30.1433 178.5050 126 A 4.4969 7.9738 119.6653 53.2651 18.6516 177.3235 127 F 4.4213 7.6909 119.3986 57.2443 40.6303 173.5139 128 R 4.3360 8.1057 128.6422 55.5819 30.8532 175.8694 129 T 5.1502 8.2588 113.1416 60.2283 72.6480 172.5615 130 C 5.0667 9.1692 119.3734 58.0203 30.7861 173.6563 131 N 5.1345 8.7982 119.9189 51.2488 42.0248 172.9953 132 L 4.8951 8.6541 125.0006 53.3440 44.4152 175.3864 133 R 4.7472 8.6079 124.6089 53.9638 34.6703 174.2211 134 K 4.8041 8.4451 121.8479 54.8634 35.1036 175.2406 135 S 5.1504 9.0999 122.4930 56.0263 67.4860 173.2748 136 R 4.2641 9.0879 122.5164 57.1214 29.7164 175.3460 137 G 3.1386 10.1314 117.1257 44.1969 0.0000 173.4199 138 F 3.7034 7.6281 121.2955 59.1990 38.5018 174.5052 139 H 4.0247 7.5538 115.9475 54.6740 29.5357 174.7454 140 L 3.9099 8.1374 126.0198 55.0001 41.7942 175.7355 141 A 4.1605 8.2841 128.7707 53.5683 20.3882 176.0807 142 A 4.0935 6.9907 115.4659 51.5811 22.0916 174.6856 *144 G 4.3037 8.4532 103.0420 45.9403 0.0000 172.7016 145 A 4.4267 8.5040 121.9021 51.9135 19.3791 176.6220 146 D 4.8423 8.4464 121.4268 51.9891 41.8276 174.8640 147 P 4.3898 0.0000 0.0000 63.9948 32.0280 176.7420 148 L 3.6844 8.0268 120.9220 54.2963 41.8157 175.4552 149 P 4.6650 0.0000 0.0000 61.2567 33.4593 175.4436 150 S 4.6413 8.2552 112.3009 57.2012 64.1453 173.1529 151 P 4.3024 0.0000 0.0000 65.7916 31.2576 178.5502 152 D 4.3880 8.2703 116.3895 55.9221 39.1596 176.7703 153 D 4.7781 7.7876 115.8862 53.5202 41.2672 176.4074 154 A 4.3537 7.6430 122.7615 52.5323 19.3490 177.6910 155 D 4.8322 8.6227 118.4238 52.8433 41.0426 175.6786 156 S 4.1001 7.5534 116.7381 57.7113 64.3756 173.7249 157 P 4.6790 0.0000 0.0000 62.4521 33.2522 174.2900 158 Y 4.6416 8.8580 117.6919 56.4240 40.5686 176.3526 159 R 4.3676 9.2308 122.7335 55.0307 32.9283 175.1894 *161 K 4.4882 8.2638 120.1488 56.3853 33.6834 173.8871 162 L 5.3588 9.3341 129.1008 53.3671 45.3828 174.7607 163 I 4.7697 8.8975 127.0753 59.3943 39.9866 174.5816 164 K 4.7971 9.0500 127.5328 54.9603 35.3673 174.9080 165 D 4.9075 9.2351 128.0825 53.4255 43.2016 176.5162 166 K 4.1869 8.6708 129.4348 56.4094 31.6594 179.5600 167 G 3.5570 8.9260 117.8838 48.2342 0.0000 172.3852 168 Y 4.6998 8.1012 122.6378 56.7658 39.8504 174.0489 169 V 5.2981 8.1468 126.0885 60.3387 35.3995 173.5171 170 H 5.2170 8.4259 125.7970 54.4270 33.7944 171.3694 171 F 5.6808 8.9759 126.8391 56.5564 42.4924 173.5943 172 S 4.7771 8.4449 119.2157 56.6041 66.6039 173.3123 173 I 4.2253 7.7581 120.9212 59.9464 40.5199 175.5558 174 N 4.1826 10.1154 125.2739 54.2244 36.6037 175.7948 175 G 3.8653 8.3292 105.8664 45.2307 0.0000 173.9858 176 L 4.2213 7.7231 123.2457 53.1797 42.5488 174.1993 177 P 4.5981 0.0000 0.0000 63.0989 32.0988 175.4869 178 I 4.3785 8.8571 123.6893 62.5567 39.2808 175.4963 179 L 4.7611 7.5554 119.5320 55.0924 43.7101 173.4086 180 E 5.1229 8.5537 116.3170 55.6332 33.1904 174.1419 181 W 5.2227 8.8616 129.9079 56.9914 34.5566 171.9931 *183 D 3.5811 8.6453 117.3038 54.0031 41.1548 176.0891 184 D 4.3179 8.5326 125.2773 53.6765 40.0992 177.3538 185 G 3.9722 8.9139 108.5002 46.3832 0.0000 174.1166 186 S 4.6612 9.2314 111.0963 58.1404 64.3920 174.2061 187 T 4.2464 8.1983 116.4926 65.4327 70.0702 175.7350 188 Y 4.8255 7.5676 116.3566 57.3844 38.3234 176.2053 189 G 4.0203 8.1367 106.4422 44.0726 0.0000 171.2612 190 P 4.3215 0.0000 0.0000 62.2361 31.7667 176.9676 191 V 3.9115 8.1297 120.7473 63.0120 32.0676 175.8934 192 L 4.4581 8.4018 126.7335 54.4143 43.0369 174.8649 193 T 4.4583 8.4309 109.0796 61.4248 70.5369 175.6870 194 K 4.4980 9.1247 119.5493 54.2257 35.3966 176.7695 195 G 3.9997 7.6719 106.6813 44.9943 0.0000 171.7886 196 K 4.9210 8.0107 119.2599 55.8906 34.0865 176.4008 197 I 5.1942 8.6993 121.9639 59.8102 40.3425 175.0561 198 G 3.7777 8.9512 112.5581 44.2690 0.0000 171.2536 199 F 4.8124 8.9807 120.3196 55.5107 40.8136 174.7902 200 R 5.0040 8.2633 123.9405 54.1353 32.8318 174.5933 201 Q 5.2012 7.1265 122.9704 54.0204 33.2280 173.7413 *203 A 3.6908 8.6338 125.8239 52.1606 19.7688 174.0908 204 P 4.4913 0.0000 0.0000 61.3121 32.9382 175.5102 *206 K 4.4307 8.4328 120.4975 56.3521 33.6160 174.6207 207 A 4.8391 8.7378 125.2000 50.3695 23.5230 174.5282 208 V 4.7070 8.0987 118.8058 61.2386 34.4928 174.1577 209 Y 5.5118 9.1022 124.5069 56.6858 41.7584 174.7678 210 R 4.5788 9.2579 119.8159 55.0934 35.4047 174.1675 211 D 4.3318 8.5259 118.0530 55.5648 38.7664 172.8020 212 F 5.5409 9.0882 122.3554 57.7975 41.0454 174.8690 213 A 5.1118 9.6230 127.5453 50.1982 23.2949 174.6034 214 V 4.6647 8.8696 119.1707 61.5207 34.6179 174.3660 215 H 5.4658 9.0980 124.2783 53.6341 32.9336 173.3582 216 Q 4.5229 9.0039 119.4531 56.1233 29.8837 175.3400 217 A 4.7880 8.7464 125.8111 51.1079 20.1539 176.8575 218 V 4.2487 9.0006 124.0158 61.1532 33.3851 174.5923 219 R 3.5977 8.5125 129.3314 55.4445 30.8375 176.4273 220 R 4.1018 8.0122 124.1149 56.3499 30.3158 176.1441 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -2 S 8.23 5.04 0.00 3.91 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 -1 N 9.38 4.21 0.00 2.97 2.93 0.00 0.00 6.95 6.47 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 A 8.43 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 Y 8.31 4.54 0.00 2.63 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 0.00 0.00 0.00 0.00 3 K 9.10 4.82 0.00 1.62 1.68 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.53 7.81 4 E 8.89 4.57 0.00 1.81 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 0.00 2.31 2.32 0.00 5 G 9.12 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 0.00 0.00 0.00 6 A 8.73 4.33 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 7 C 8.65 4.29 0.00 2.98 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 8 L 8.75 4.59 0.00 1.81 1.87 1.04 0.97 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 9 Y 7.66 4.79 0.00 3.28 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 10 R 7.70 4.78 0.00 1.72 1.62 0.00 3.22 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 11 N 9.53 4.82 0.00 2.79 3.04 0.00 0.00 6.79 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.37 0.00 2.14 2.12 0.00 3.81 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 2.13 0.00 13 L 8.19 3.67 0.00 1.99 1.81 0.94 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.89 4.78 0.00 1.86 2.02 0.00 3.14 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 15 S 7.47 3.91 0.00 3.66 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.79 3.35 0.00 1.65 1.81 0.00 1.61 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.20 7.81 17 S 7.74 4.16 0.00 3.95 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 18 D 7.84 4.38 0.00 2.75 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 19 V 7.43 3.72 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 -0.04 0.00 0.00 1.19 0.00 0.00 20 K 7.62 3.82 0.00 1.82 1.96 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.49 7.81 21 D 8.13 4.93 0.00 2.82 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 22 W 8.21 4.37 0.00 3.17 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 23 R 8.44 4.68 0.00 1.71 1.90 0.00 2.21 0.00 0.00 2.89 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 0.00 *25 E 8.62 4.45 0.00 2.44 2.29 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 2.58 2.77 0.00 26 G 9.05 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.70 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 28 G 7.68 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.65 4.58 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 30 I 8.08 4.66 1.71 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.20 0.74 0.00 0.00 31 S 8.30 4.62 0.00 3.78 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 32 F 8.36 5.68 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 33 D 7.60 4.46 0.00 2.52 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 8.58 4.29 0.00 2.95 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 35 H 8.13 4.41 0.00 3.39 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.71 5.15 0.00 3.90 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 37 L 8.49 3.61 0.00 1.61 1.75 0.33 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 38 H 9.05 5.17 0.00 2.99 3.11 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 9.00 5.13 0.00 1.85 1.76 0.85 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.70 5.13 0.00 3.87 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 41 H 8.72 5.45 0.00 3.05 3.36 0.00 5.70 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 42 V 8.60 3.92 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 0.61 0.00 0.00 1.00 0.00 0.00 43 Q 7.87 4.64 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 44 D 8.76 4.47 0.00 2.66 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 45 E 7.94 4.46 0.00 1.86 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 0.00 2.19 2.22 0.00 46 A 7.65 4.38 1.44 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 0.00 0.00 47 H 7.45 4.80 0.00 3.21 3.13 0.00 5.71 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.18 5.22 0.00 3.29 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 49 V 8.90 4.69 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 -0.60 0.00 0.00 -0.00 0.00 0.00 50 F 9.59 5.35 0.00 3.03 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 51 W 9.35 5.14 0.00 3.45 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 52 C 8.14 2.52 0.00 1.98 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 53 P 0.00 4.53 0.00 2.15 2.18 0.00 3.35 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.00 0.00 54 E 7.53 3.80 0.00 1.16 1.12 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 2.07 1.88 0.00 55 T 7.92 4.15 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 1.14 0.00 0.00 56 F 8.85 4.95 0.00 3.11 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 5.07 0.00 2.15 2.14 0.00 4.02 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 2.10 2.06 0.00 58 D 8.69 4.50 0.00 2.82 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 59 G 8.63 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 60 I 8.47 5.31 1.94 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 1.30 0.84 1.07 0.00 0.00 61 I 8.95 4.85 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 1.09 0.76 0.94 0.00 0.00 62 V 9.30 4.94 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.85 0.00 0.00 63 T 9.02 5.34 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 1.27 0.00 0.00 64 W 8.31 5.67 0.00 3.61 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 65 D 9.39 5.10 0.00 2.98 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 66 F 9.14 5.34 0.00 3.27 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.89 4.60 0.00 3.43 3.47 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 0.00 0.00 0.00 68 P 0.00 3.83 0.00 1.27 1.06 0.00 3.57 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 69 I 8.19 4.16 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.75 0.87 0.00 0.00 70 E 7.84 4.63 0.00 1.86 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 71 Q 8.34 4.84 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 72 P 0.00 4.55 0.00 1.89 2.03 0.00 3.82 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 2.00 2.08 0.00 73 G 7.25 4.13 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 0.00 74 L 7.43 5.86 0.00 1.54 1.27 0.81 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 75 C 8.15 5.36 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *77 L 8.17 4.06 0.00 1.60 1.45 -0.68 0.42 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 78 F 8.83 5.24 0.00 2.56 3.08 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 79 F 9.10 5.49 0.00 3.18 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 80 A 8.86 4.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.88 4.88 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 82 A 8.51 4.49 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 83 G 8.85 3.87 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 0.00 84 I 8.35 3.79 1.84 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 1.44 0.70 0.90 0.00 0.00 85 R 8.42 4.37 0.00 2.11 1.90 0.00 3.15 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 86 G 8.33 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 87 E 7.66 4.08 0.00 1.99 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 0.00 2.35 2.31 0.00 88 D 8.36 4.45 0.00 2.67 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.05 3.47 0.00 0.85 0.13 0.42 -1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 90 F 7.57 4.86 0.00 3.13 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 91 D 8.14 4.44 0.00 2.66 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 0.00 0.00 0.00 92 P 0.00 4.38 0.00 2.21 2.18 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 93 S 8.70 4.23 0.00 3.92 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 94 L 7.42 4.45 0.00 1.59 1.52 0.82 0.97 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 95 R 8.75 4.02 0.00 1.68 1.81 0.00 3.12 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 96 K 8.43 4.15 0.00 1.74 1.76 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.46 7.81 97 R 8.36 4.77 0.00 1.90 1.66 0.00 2.42 0.00 0.00 2.95 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.57 0.00 98 T 10.12 4.67 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 1.26 0.00 0.00 99 G 8.94 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.19 4.39 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 101 Y 9.17 4.88 0.00 3.02 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 0.00 102 P 0.00 3.73 0.00 2.13 1.97 0.00 3.67 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 103 E 8.35 3.86 0.00 1.46 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 104 Y 8.08 4.34 0.00 3.25 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 0.00 105 H 7.76 4.83 0.00 3.41 3.45 0.00 5.59 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 8.14 5.00 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 0.00 107 G 7.90 4.13 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 0.00 108 D 8.55 5.11 0.00 2.72 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 0.00 109 I 7.74 5.10 1.87 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 1.25 0.73 0.72 0.00 0.00 110 N 8.81 5.33 0.00 2.59 2.73 0.00 0.00 7.14 7.43 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 0.00 111 A 8.37 4.78 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.76 4.94 0.00 0.27 0.64 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.76 4.95 0.00 2.41 1.88 0.00 5.23 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.81 5.05 0.00 1.67 1.42 0.27 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.92 4.88 0.00 3.78 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 0.00 116 Y 8.21 4.97 0.00 3.12 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 0.00 117 F 8.97 4.01 0.00 3.45 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 0.00 118 R 7.41 4.50 0.00 1.77 1.83 0.00 3.17 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 119 R 8.40 4.51 0.00 1.51 1.53 0.00 2.89 0.00 0.00 2.76 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 120 K 8.40 3.74 0.00 1.36 1.57 0.00 1.23 0.00 0.00 1.51 0.00 0.00 2.67 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.55 0.21 7.81 121 Y 7.72 4.91 0.00 3.04 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.66 4.02 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 0.00 123 E 8.24 3.98 0.00 1.99 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 2.32 2.41 0.00 124 E 8.08 4.18 0.00 2.16 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 2.47 2.54 0.00 125 R 8.07 3.90 0.00 1.88 1.95 0.00 3.10 0.00 0.00 3.27 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 126 A 7.97 4.50 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 F 7.69 4.42 0.00 2.83 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 0.00 128 R 8.11 4.34 0.00 1.64 1.72 0.00 3.02 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 129 T 8.26 5.15 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 130 C 9.17 5.07 0.00 2.90 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 0.00 131 N 8.80 5.13 0.00 2.59 2.51 0.00 0.00 6.22 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.65 4.90 0.00 1.58 1.24 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.61 4.75 0.00 1.08 1.23 0.00 2.53 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.10 0.00 134 K 8.45 4.80 0.00 1.61 1.49 0.00 2.05 0.00 0.00 2.02 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.46 7.81 135 S 9.10 5.15 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 0.00 136 R 9.09 4.26 0.00 1.98 1.86 0.00 3.29 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 137 G 10.13 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 0.00 0.00 0.00 138 F 7.63 3.70 0.00 2.80 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 7.55 4.02 0.00 2.42 1.41 0.00 5.67 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 0.00 140 L 8.14 3.91 0.00 1.34 1.41 0.75 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.28 4.16 -0.36 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 0.00 142 A 6.99 4.09 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 *144 G 8.45 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 0.00 0.00 0.00 0.00 145 A 8.50 4.43 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.45 4.84 0.00 2.53 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 0.00 147 P 0.00 4.39 0.00 2.17 2.10 0.00 3.76 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 1.87 1.88 0.00 148 L 8.03 3.68 0.00 1.85 1.77 1.21 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 4.67 0.00 2.23 2.12 0.00 3.46 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 2.04 2.08 0.00 150 S 8.26 4.64 0.00 4.09 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 0.00 151 P 0.00 4.30 0.00 2.23 2.28 0.00 3.73 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 152 D 8.27 4.39 0.00 2.80 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 0.00 153 D 7.79 4.78 0.00 2.73 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 0.00 154 A 7.64 4.35 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 0.00 155 D 8.62 4.83 0.00 2.54 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 S 7.55 4.10 0.00 3.69 3.65 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 0.00 157 P 0.00 4.68 0.00 2.04 1.99 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.94 0.00 158 Y 8.86 4.64 0.00 2.97 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 R 9.23 4.37 0.00 1.61 1.77 0.00 3.29 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 *161 K 8.26 4.49 0.00 1.77 1.62 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.46 7.81 162 L 9.33 5.36 0.00 1.88 1.53 0.74 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 163 I 8.90 4.77 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.51 0.33 0.00 0.00 164 K 9.05 4.80 0.00 1.93 1.69 0.00 1.67 0.00 0.00 1.98 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.58 1.72 7.81 165 D 9.24 4.91 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 0.00 166 K 8.67 4.19 0.00 1.98 1.00 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.39 7.81 167 G 8.93 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Y 8.10 4.70 0.00 3.06 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 0.00 169 V 8.15 5.30 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.26 0.00 0.00 170 H 8.43 5.22 0.00 2.87 2.93 0.00 5.66 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 0.00 171 F 8.98 5.68 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 0.00 172 S 8.44 4.78 0.00 3.73 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 0.00 173 I 7.76 4.23 1.62 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 0.67 -0.11 0.81 0.00 0.00 174 N 10.12 4.18 0.00 2.79 2.87 0.00 0.00 7.18 7.54 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 0.00 175 G 8.33 3.87 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 0.00 176 L 7.72 4.22 0.00 1.68 1.63 0.90 1.17 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 0.00 177 P 0.00 4.60 0.00 2.10 2.20 0.00 3.69 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 2.17 0.00 178 I 8.86 4.38 1.91 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.94 1.06 0.00 0.00 179 L 7.56 4.76 0.00 1.76 1.76 0.96 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 180 E 8.55 5.12 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 181 W 8.86 5.22 0.00 3.27 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 *183 D 8.65 3.58 0.00 1.58 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 0.00 0.00 0.00 184 D 8.53 4.32 0.00 2.74 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 0.00 185 G 8.91 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 0.00 186 S 9.23 4.66 0.00 3.85 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 0.00 187 T 8.20 4.25 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 0.35 0.00 0.00 188 Y 7.57 4.83 0.00 3.06 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 0.00 189 G 8.14 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 0.00 0.00 0.00 190 P 0.00 4.32 0.00 2.08 2.03 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 191 V 8.13 3.91 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 0.83 0.00 0.00 0.93 0.00 0.00 192 L 8.40 4.46 0.00 1.73 1.61 0.95 0.86 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 0.00 193 T 8.43 4.46 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 1.28 0.00 0.00 194 K 9.12 4.50 0.00 2.10 1.91 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.42 7.81 195 G 7.67 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 0.00 196 K 8.01 4.92 0.00 1.50 1.79 0.00 1.55 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.20 0.78 7.81 197 I 8.70 5.19 2.15 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 1.45 1.29 0.68 0.00 0.00 198 G 8.95 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 0.00 0.00 0.00 199 F 8.98 4.81 0.00 2.92 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 0.00 200 R 8.26 5.00 0.00 1.79 1.64 0.00 3.15 0.00 0.00 3.12 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.44 0.00 201 Q 7.13 5.20 0.00 1.06 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.39 0.00 0.00 0.00 0.00 0.00 2.39 2.16 0.00 *203 A 8.63 3.69 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 0.00 204 P 0.00 4.49 0.00 2.19 2.05 0.00 3.84 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 2.10 1.95 0.00 *206 K 8.43 4.43 0.00 1.76 1.83 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.47 1.66 7.81 207 A 8.74 4.84 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 0.00 208 V 8.10 4.71 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.52 0.00 0.00 209 Y 9.10 5.51 0.00 2.84 2.87 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 0.00 210 R 9.26 4.58 0.00 1.81 1.87 0.00 3.51 0.00 0.00 3.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 211 D 8.53 4.33 0.00 2.96 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 0.00 212 F 9.09 5.54 0.00 3.33 3.40 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 0.00 213 A 9.62 5.11 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 0.00 214 V 8.87 4.66 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 0.86 0.00 0.00 0.01 0.00 0.00 215 H 9.10 5.47 0.00 3.10 3.19 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 Q 9.00 4.52 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 217 A 8.75 4.79 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 0.00 218 V 9.00 4.25 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 0.94 0.00 0.00 0.99 0.00 0.00 219 R 8.51 3.60 0.00 1.55 1.64 0.00 3.08 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.88 0.00 220 R 8.01 4.10 0.00 1.70 1.73 0.00 3.41 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 * Residues marked with a * may have inaccurate shift predictions.