NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.5461 8.0333 117.3276 63.6156 70.5196 172.4268 3 V 4.6906 8.2903 117.7910 58.5934 36.7662 172.6413 4 L 5.1184 9.4813 125.5594 53.6047 45.1672 174.7168 5 I 4.8230 8.7827 128.3045 59.8298 39.5261 174.8497 6 I 4.5206 9.3976 129.7504 62.3192 38.5943 176.0776 7 G 3.8324 8.9691 113.8496 44.5519 0.0000 171.1476 *9 G 3.9797 8.0398 104.4089 45.3264 0.0000 172.5007 10 N 4.2569 8.9644 115.2345 56.9723 38.4448 177.1356 11 I 3.8938 7.7690 120.4180 64.0164 37.3552 178.5287 12 G 3.7948 7.8906 107.4008 47.4460 0.0000 175.7755 13 K 4.0267 8.1335 121.6751 58.7733 32.0000 179.4553 14 K 3.9490 7.8079 119.5968 59.3932 32.0319 178.9539 15 L 4.0043 8.1035 119.4326 57.7321 41.2903 179.6601 16 V 3.7084 7.7100 117.7241 65.8899 31.5424 177.5968 17 E 4.1277 8.0260 116.4765 58.9380 29.7426 178.3214 18 L 4.3728 7.8202 118.5671 55.1828 42.4254 177.6696 19 G 3.2718 7.5608 107.0814 45.3075 0.0000 173.0451 20 N 4.5905 7.3051 117.5622 51.0639 39.2318 174.1699 21 F 5.1818 8.0499 120.9988 55.2650 42.9630 175.3657 22 E 4.1452 9.1869 123.4219 58.7575 30.0030 177.0571 23 K 4.6076 7.7278 119.4400 54.1811 36.4213 174.8465 24 I 4.7958 7.9724 125.6263 59.8375 40.8948 173.6463 25 Y 4.9503 8.9990 125.1949 56.4649 40.2402 174.7765 26 A 5.6006 8.5022 122.6295 49.4240 23.1670 174.2473 27 Y 5.0126 8.5257 121.8907 55.7948 42.2209 173.8860 28 D 4.3683 8.2219 125.8730 53.6871 43.2684 175.1761 29 R 3.7966 8.4671 126.3935 59.2512 30.8497 177.6433 30 I 4.1531 7.6544 112.3587 61.5487 38.6298 177.6839 31 S 4.4854 8.4332 118.2758 58.9384 64.6003 174.5155 32 K 3.8347 8.2327 121.1869 56.4041 32.2635 175.7925 33 D 4.3576 8.6753 123.2802 54.8954 40.9927 176.3614 34 I 4.2990 8.1808 118.2996 59.0134 40.2553 171.3587 35 P 4.0982 0.0000 0.0000 64.5292 29.8738 176.7947 36 G 4.0877 8.9186 103.2707 45.6323 0.0000 173.9026 37 V 4.5058 7.4649 110.6819 59.1781 35.5633 177.1403 38 V 4.0146 8.5731 124.4023 60.6872 30.1053 172.3604 39 R 4.1357 8.2402 121.2944 56.4794 30.5675 175.7310 40 L 4.4146 8.8933 126.8419 54.7993 42.2636 176.8083 41 D 4.9473 8.7914 118.9250 54.6651 43.1758 176.7314 42 E 4.6070 7.8317 117.7585 53.7427 31.5637 175.5684 43 F 3.0038 8.1996 126.0580 58.0044 39.8153 173.8108 44 Q 4.0601 5.7400 122.6502 56.0499 29.8699 173.8785 45 V 3.7675 7.6700 118.7962 59.4615 31.5787 172.7121 46 P 3.9735 0.0000 0.0000 62.2686 31.6922 177.7698 47 S 4.0827 8.4887 115.9287 60.7224 62.4285 174.4176 48 D 4.6410 7.8414 117.3235 53.0847 39.7651 176.2306 49 V 3.9839 7.5181 121.5290 63.0171 31.9342 175.5929 50 S 4.6442 8.8747 122.1604 59.7026 64.8995 174.1428 51 T 5.1073 7.6611 116.6640 61.9614 73.0321 172.7863 52 V 4.7885 8.9629 125.6953 61.1084 34.7331 174.4874 53 V 4.9305 8.9872 126.4380 61.2475 33.0557 173.5143 54 E 4.9926 9.3464 130.1707 54.4885 31.2614 176.1351 55 C 4.7680 8.2901 119.7395 58.2967 29.0353 172.1212 56 A 4.6073 9.2829 121.1023 52.1768 22.3865 177.3578 57 S 4.6048 7.3512 105.7234 55.6819 66.7958 175.1102 58 P 4.2301 0.0000 0.0000 65.8546 30.9940 178.7631 59 E 3.7880 8.1577 116.6198 59.3042 29.3097 179.2171 60 A 3.7873 7.7463 120.3991 54.9922 18.5708 179.7324 61 V 3.7467 7.5986 116.4445 66.2984 31.3457 178.4942 62 K 3.6110 7.4797 117.1098 59.0701 31.8466 179.0066 63 E 3.7651 7.7532 118.2881 58.8372 29.5840 178.0807 64 Y 4.5158 7.2901 114.4391 57.9052 38.9820 177.8458 65 S 4.6190 8.2876 118.4407 60.8745 62.8671 176.4052 66 L 4.7342 7.9683 121.4905 58.4946 40.3282 178.7321 67 Q 4.0927 8.0641 120.3701 58.6083 29.1808 177.6425 68 I 3.5733 8.1232 121.2863 64.7310 36.9548 178.3554 69 L 4.0406 7.6750 117.4999 57.4278 41.3725 179.4652 70 K 4.0640 7.7063 118.1912 58.4434 32.3588 177.5407 71 N 4.5590 7.3704 115.6106 52.3670 39.6362 174.0811 72 P 4.7352 0.0000 0.0000 61.9843 30.4477 174.5950 73 V 4.7256 7.0823 114.5655 59.9597 37.0501 175.5482 74 N 5.1949 8.7383 119.4965 53.1801 40.0746 173.9540 75 Y 5.2920 9.8778 126.9509 56.2260 40.8516 174.2858 76 I 4.4306 8.8198 129.2301 60.2264 38.7376 175.0955 77 I 4.8173 8.0028 128.5192 59.4582 38.8719 175.5850 78 I 4.4350 8.2325 118.3658 61.1602 40.1516 176.9742 79 S 4.6018 8.3584 120.7597 58.0374 61.6585 175.7576 80 T 4.2801 7.9272 112.6496 64.5458 68.7577 175.4600 81 S 4.5857 8.7051 118.2066 60.8501 62.0542 176.1961 82 A 4.0369 8.0973 123.5015 54.5141 17.8343 178.6595 83 F 4.4309 9.0254 114.7596 58.5358 39.3282 176.3208 84 A 3.7907 7.9073 121.5033 53.4154 18.6414 177.5810 85 D 4.5693 7.6832 115.7825 52.7264 41.7054 176.1369 86 E 3.8404 8.6915 127.6995 59.7284 29.6859 179.5646 87 V 3.5627 7.6714 117.3031 66.1414 31.5217 177.8739 88 F 4.2114 8.4814 119.8497 61.0906 39.2034 176.8812 89 R 3.7278 8.1131 118.5125 59.2156 29.9779 178.0830 90 E 3.9729 8.1479 119.0990 59.3027 29.6758 178.6425 91 R 3.9403 7.7259 118.2010 59.5242 30.1169 177.7714 92 F 3.6599 7.9361 120.4382 61.5380 39.1112 176.8646 93 F 4.3247 8.2002 115.2259 59.2267 39.0685 177.6663 94 S 4.3021 7.6130 114.7155 61.7504 62.8648 176.1718 95 E 3.9190 7.9811 121.1143 59.3890 28.8899 179.3539 96 L 3.8811 7.3332 119.6440 57.7635 42.1527 178.2692 97 K 4.1594 7.7900 117.4267 59.0305 32.1733 177.8336 98 N 4.5532 7.9259 114.5995 54.6747 39.1640 175.6519 99 S 4.2187 7.5743 113.0215 57.7566 62.8174 171.8759 100 P 4.6828 0.0000 0.0000 63.3127 32.0529 175.4243 101 A 4.6189 8.2147 123.4901 51.5334 20.3357 176.6384 102 R 4.5018 8.7312 117.9975 54.9692 33.4018 173.9494 103 V 4.7841 8.3627 126.0182 61.3805 33.5284 174.6320 104 F 4.6215 9.1249 126.0145 55.7995 42.0360 174.4511 105 F 5.3002 8.7688 123.0851 54.3526 38.5436 173.3861 106 P 4.4941 0.0000 0.0000 62.4197 31.9616 178.6491 107 S 3.9667 8.7862 115.8284 59.8097 64.0697 175.9922 108 G 3.8835 7.0994 107.5665 46.8728 0.0000 176.5913 109 A 4.1465 8.8530 128.2514 52.9380 18.4901 176.8076 110 I 4.5614 7.1352 108.7098 58.8967 40.2302 174.1440 111 G 3.9128 8.1420 107.9545 44.7422 0.0000 172.8119 112 G 2.5182 8.3298 106.0176 44.6162 0.0000 175.1995 113 L 4.1364 7.4328 119.5574 56.1821 41.7063 178.6752 114 D 4.2925 7.7541 120.0848 56.5339 39.5698 178.8207 115 V 3.5549 7.5455 120.9460 64.0325 31.2582 177.8213 116 L 3.8934 7.7919 120.6840 57.7406 41.5858 178.9477 117 S 3.9818 7.7422 112.3046 61.1351 62.4230 175.9674 118 S 4.3553 7.7446 116.8571 60.9096 62.8731 175.8979 119 I 4.6146 7.6820 114.1922 60.5637 37.6290 177.2490 120 K 3.8778 7.5904 122.8108 60.8438 32.2292 178.7702 121 D 4.2073 8.0736 117.6118 56.3822 41.1170 176.8903 122 F 4.5241 8.2746 116.4665 57.3941 39.5631 175.8233 123 V 4.1870 7.3975 122.2040 63.0800 31.7857 175.6306 124 K 4.4267 9.0954 127.8834 58.8165 32.9194 176.7849 125 N 4.8093 7.5730 113.8201 52.1465 40.3420 173.5998 126 V 4.9389 8.7856 120.2173 61.2898 35.0656 174.1898 127 R 5.0100 9.0505 127.0446 54.4126 32.8152 174.6531 128 I 4.9309 8.7492 124.7451 59.2390 40.5861 173.4646 129 E 5.2538 9.2504 131.2009 54.7152 32.2880 174.4587 130 T 4.8893 9.0585 123.4631 61.8395 71.5642 173.0886 131 I 4.7143 8.5470 127.7324 59.8064 39.2083 175.0481 132 K 4.9533 8.6953 127.0193 53.0886 35.2861 174.7312 133 P 4.9020 0.0000 0.0000 61.6174 32.3167 175.8546 134 P 4.2418 0.0000 0.0000 65.7540 31.7587 178.3577 135 K 3.8017 8.4073 118.9227 59.6677 31.9047 178.1353 136 S 4.4695 7.8555 108.4643 59.5246 62.5769 174.2006 137 L 4.7164 7.8583 119.2292 53.7058 43.1527 176.4222 138 G 4.0262 8.3656 106.4386 46.9395 0.0000 173.9425 139 L 4.8704 7.8435 116.3385 52.3222 45.5448 176.2065 140 D 4.8884 8.6089 120.0429 51.5984 41.2339 175.1118 141 L 4.9021 8.3291 122.5425 52.9638 45.6172 176.3814 142 K 4.4527 8.5089 117.7139 56.5207 33.3815 176.1152 143 G 4.1555 7.4937 105.9358 43.8509 0.0000 172.7805 144 K 4.4118 8.3434 118.8177 57.1965 32.8955 177.1719 145 T 4.6668 8.7112 119.1082 62.1222 73.2913 173.1479 146 V 4.1849 8.5184 126.5802 62.9004 31.7824 175.9453 147 V 4.3327 8.5775 120.9073 61.8866 32.7886 175.9011 148 F 4.6263 7.9474 119.8681 57.7141 42.6576 172.5143 149 E 5.3011 6.0280 124.2489 54.6512 32.9513 175.2247 150 G 3.8624 7.8357 113.0958 45.5182 0.0000 171.4958 151 S 4.8666 7.6339 116.1326 57.8018 65.5649 175.4085 152 V 3.7312 8.3755 120.8435 65.9101 30.8286 177.3012 153 E 3.9776 8.3718 118.7279 59.5914 29.4297 178.6628 154 E 4.0721 8.3202 117.8594 59.3030 29.4775 179.0741 155 A 3.2461 8.1664 120.8721 55.0408 18.1314 179.6801 156 S 4.0653 7.8639 110.6499 61.3979 62.5406 176.2213 157 K 4.0762 7.5813 119.9030 58.8517 31.8300 178.4744 158 L 4.2919 7.4480 117.1541 54.3779 43.7086 176.9140 159 F 4.8489 7.8388 117.8263 54.6790 38.7902 173.9268 160 P 4.4887 0.0000 0.0000 63.3961 32.9404 177.0589 161 R 3.9437 8.4280 117.2537 58.0715 27.5446 178.7301 162 N 4.9024 8.7707 123.2891 52.3866 38.7051 174.9760 163 I 3.4341 8.7966 116.2867 62.4389 35.1986 174.6193 164 N 4.5837 7.8069 120.3413 55.3693 38.8637 177.4800 165 V 3.5130 7.8423 118.9200 66.1217 31.7410 177.8038 166 A 3.9968 7.9782 119.8520 55.1664 18.2813 179.6973 167 S 4.0706 7.5522 113.6233 62.1145 62.8449 176.8830 168 T 3.5621 7.8840 118.3658 66.5560 68.1609 176.6880 169 I 3.6645 7.6227 121.6898 64.3112 37.1406 178.6427 170 G 2.6417 7.9426 106.7232 47.4777 0.0000 175.6587 171 L 4.1014 7.5766 120.3559 57.0182 41.5011 179.4621 172 I 3.8557 6.8577 119.2046 63.8934 37.5243 177.9616 173 V 4.0441 7.2524 110.2538 59.7489 32.5783 176.5575 174 G 4.1523 7.7725 108.5763 44.5339 0.0000 175.1273 175 F 3.9401 9.3999 122.3017 60.1636 39.2511 177.4359 176 E 4.0578 8.4055 117.4459 59.0076 29.3811 177.6927 177 K 4.2858 7.9747 117.3700 56.4549 32.4883 175.6523 178 V 4.8632 7.7097 119.9863 60.8447 33.4359 174.6374 179 K 4.6858 9.0773 129.0389 54.5811 35.0816 174.5211 180 V 4.9898 8.9136 127.2669 61.5556 34.3291 174.3620 181 T 5.2441 8.9274 123.3579 61.9547 72.3998 172.7349 182 I 4.8272 9.0473 127.7577 59.7233 39.3676 174.6993 183 V 4.7928 9.2509 127.9273 60.9029 34.4992 174.1397 184 A 5.0462 8.9951 129.7153 50.4565 20.8493 175.0752 185 D 5.1858 8.6055 123.1985 51.9784 42.5414 174.5277 186 P 4.2667 0.0000 0.0000 65.2813 31.9718 176.9570 187 A 4.2125 8.1451 124.7280 50.9500 16.9922 176.0908 *189 D 4.6582 7.8147 122.1538 53.0168 43.4544 174.1462 190 H 5.1285 7.5128 111.0996 53.3556 32.1815 172.8065 191 N 4.8525 8.5861 115.0992 53.4472 39.9409 174.6741 192 I 4.9188 8.2042 121.1976 60.0787 42.2867 173.8157 193 H 5.4099 9.2644 122.1300 54.0822 32.2292 172.6823 194 I 4.9026 8.8942 123.6321 59.5220 40.5393 174.5487 195 V 4.6917 9.1074 128.2055 61.3971 33.5624 174.3717 196 R 4.9642 9.1667 128.5542 54.6117 32.2596 175.4062 197 I 4.8889 9.0905 125.4576 59.5012 40.2374 174.4111 198 S 5.0953 8.7958 122.3453 56.6033 64.8903 173.0293 199 S 5.0746 8.4012 119.8538 57.3832 66.3701 174.9641 200 A 4.1979 8.7577 122.3574 54.3806 18.2713 178.8397 201 I 3.9076 7.7145 115.7185 61.0720 37.6524 176.0355 202 G 3.7924 6.1918 107.0518 45.5160 0.0000 170.0992 203 N 4.9410 7.4988 115.6743 51.3559 41.4694 174.2013 204 Y 4.5823 8.6766 119.6406 56.0672 42.2573 174.3201 205 E 4.8428 8.2572 121.0600 54.5206 33.1009 175.0542 206 F 5.0371 9.0246 122.9760 55.6317 42.2683 173.8203 207 K 5.0309 8.9526 125.3832 54.6658 34.0978 175.1330 208 I 4.4425 9.3424 128.3919 59.8534 39.9339 174.4303 209 E 4.9287 8.7693 127.5633 54.2897 29.4642 174.5769 210 N 4.5571 8.3677 119.9422 52.9588 39.5406 175.8209 211 I 3.7330 8.1848 122.6298 63.1366 37.3846 175.3232 *220 S 4.1207 7.6400 114.5113 57.9788 63.5316 173.4078 *222 L 4.3912 8.2149 121.3098 55.4533 43.5098 178.7269 223 T 3.9285 7.9092 114.6846 66.4833 68.2314 176.4840 224 V 3.5113 7.4951 119.0945 66.4648 31.5790 177.8697 225 Y 3.9603 7.9083 115.5223 60.6460 37.5464 178.4711 226 S 4.1476 8.2241 114.7045 61.2441 62.4356 176.2157 227 I 3.7264 7.8565 122.5275 64.4506 36.9483 178.2170 228 L 3.9597 8.0436 119.9771 58.0776 41.4228 179.7543 229 R 4.0980 8.2825 118.4519 59.5953 29.7343 178.7944 230 T 3.8567 7.4091 115.1781 66.3603 68.7869 176.5113 231 L 4.0709 8.0878 121.0163 57.9521 41.5880 179.7037 232 R 3.9511 8.5148 118.2739 59.4651 30.0867 178.9008 233 N 4.3697 8.4093 116.2723 56.1473 38.2383 177.2310 234 L 4.0343 7.4079 119.3229 57.0063 41.7284 178.0697 235 E 4.6578 7.7010 116.4012 56.0278 29.9984 175.5057 236 S 4.8274 7.6281 112.0767 56.5455 64.9305 173.8998 237 K 4.2030 8.4870 122.6894 56.6971 32.6759 176.7073 238 I 4.1282 7.6648 119.5698 59.4744 37.7757 174.7310 239 I 4.3803 7.8656 126.2124 59.2320 39.1536 175.4987 240 F 4.7962 8.6965 123.5191 56.2738 41.4904 175.9039 241 G 4.4007 8.8816 110.8738 46.3134 0.0000 173.2929 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 T 8.03 4.55 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 3 V 8.29 4.69 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 0.26 0.00 0.00 -0.03 0.00 0.00 4 L 9.48 5.12 0.00 1.63 1.41 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.78 4.82 1.88 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 1.13 1.25 0.99 0.00 0.00 6 I 9.40 4.52 2.12 0.00 0.00 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 1.36 1.04 1.13 0.00 0.00 7 G 8.97 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 0.00 0.00 0.00 *9 G 8.04 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 0.00 0.00 0.00 10 N 8.96 4.26 0.00 2.75 2.92 0.00 0.00 6.89 7.32 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 11 I 7.77 3.89 1.89 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 1.58 0.66 0.92 0.00 0.00 12 G 7.89 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 0.00 0.00 0.00 13 K 8.13 4.03 0.00 1.83 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 14 K 7.81 3.95 0.00 2.12 1.85 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.41 7.81 15 L 8.10 4.00 0.00 1.96 1.82 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 V 7.71 3.71 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 0.88 0.00 0.00 1.01 0.00 0.00 17 E 8.03 4.13 0.00 2.18 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 2.59 2.41 0.00 18 L 7.82 4.37 0.00 1.52 1.66 0.70 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.56 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.31 4.59 0.00 2.42 2.61 0.00 0.00 6.71 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 21 F 8.05 5.18 0.00 2.99 2.74 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 0.00 0.00 0.00 22 E 9.19 4.15 0.00 2.08 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 2.34 2.31 0.00 23 K 7.73 4.61 0.00 1.68 1.46 0.00 1.20 0.00 0.00 0.85 0.00 0.00 2.66 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.89 1.16 7.81 24 I 7.97 4.80 1.81 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.57 0.85 0.00 0.00 25 Y 9.00 4.95 0.00 2.77 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 26 A 8.50 5.60 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 27 Y 8.53 5.01 0.00 2.94 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 28 D 8.22 4.37 0.00 2.59 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.47 3.80 0.00 1.77 1.96 0.00 3.33 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 30 I 7.65 4.15 1.85 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 1.62 0.48 0.91 0.00 0.00 31 S 8.43 4.49 0.00 3.83 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.23 3.83 0.00 1.70 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.49 7.81 33 D 8.68 4.36 0.00 2.70 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 34 I 8.18 4.30 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.44 0.95 0.00 0.00 35 P 0.00 4.10 0.00 2.20 1.93 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 36 G 8.92 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 37 V 7.46 4.51 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 0.72 0.00 0.00 0.96 0.00 0.00 38 V 8.57 4.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.72 0.00 0.00 39 R 8.24 4.14 0.00 1.86 1.92 0.00 3.35 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 40 L 8.89 4.41 0.00 1.65 1.55 1.18 0.96 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 41 D 8.79 4.95 0.00 2.65 2.74 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 0.00 0.00 0.00 42 E 7.83 4.61 0.00 1.85 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 2.20 2.19 0.00 43 F 8.20 3.00 0.00 1.82 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 44 Q 5.74 4.06 0.00 1.88 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 1.98 1.71 0.00 45 V 7.67 3.77 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 0.69 0.00 0.00 0.75 0.00 0.00 46 P 0.00 3.97 0.00 1.21 1.28 0.00 3.04 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.58 0.00 47 S 8.49 4.08 0.00 3.76 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 48 D 7.84 4.64 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 49 V 7.52 3.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.86 0.00 0.00 50 S 8.87 4.64 0.00 3.95 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 0.00 51 T 7.66 5.11 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 52 V 8.96 4.79 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 1.00 0.00 0.00 0.82 0.00 0.00 53 V 8.99 4.93 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 0.94 0.00 0.00 0.94 0.00 0.00 54 E 9.35 4.99 0.00 2.37 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 55 C 8.29 4.77 0.00 3.03 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 56 A 9.28 4.61 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 57 S 7.35 4.60 0.00 4.00 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 58 P 0.00 4.23 0.00 2.11 2.18 0.00 3.59 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 59 E 8.16 3.79 0.00 1.98 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 2.34 0.00 60 A 7.75 3.79 1.52 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 0.00 0.00 61 V 7.60 3.75 2.21 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 1.23 0.00 0.00 1.13 0.00 0.00 62 K 7.48 3.61 0.00 1.54 1.39 0.00 1.37 0.00 0.00 1.24 0.00 0.00 2.50 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.81 7.81 63 E 7.75 3.77 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 2.02 2.30 0.00 64 Y 7.29 4.52 0.00 2.89 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 65 S 8.29 4.62 0.00 4.31 4.44 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 66 L 7.97 4.73 0.00 1.79 2.06 1.02 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 8.06 4.09 0.00 2.24 2.44 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 2.50 2.51 0.00 68 I 8.12 3.57 1.52 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.55 0.01 0.00 0.00 69 L 7.67 4.04 0.00 1.67 1.63 0.39 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.71 4.06 0.00 1.80 1.84 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.74 1.61 7.81 71 N 7.37 4.56 0.00 2.77 2.68 0.00 0.00 7.06 8.04 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 72 P 0.00 4.74 0.00 2.17 2.08 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 73 V 7.08 4.73 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 0.82 0.00 0.00 0.88 0.00 0.00 74 N 8.74 5.19 0.00 2.75 2.90 0.00 0.00 6.88 7.30 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 75 Y 9.88 5.29 0.00 2.97 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 76 I 8.82 4.43 2.05 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.94 0.00 0.00 77 I 8.00 4.82 1.42 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 0.81 -0.26 1.09 0.00 0.00 78 I 8.23 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 1.60 0.73 1.02 0.00 0.00 79 S 8.36 4.60 0.00 4.20 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 80 T 7.93 4.28 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 1.28 0.00 0.00 81 S 8.71 4.59 0.00 4.12 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.10 4.04 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 83 F 9.03 4.43 0.00 3.25 3.33 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 84 A 7.91 3.79 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 85 D 7.68 4.57 0.00 2.76 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 86 E 8.69 3.84 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 87 V 7.67 3.56 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 1.02 0.00 0.00 0.93 0.00 0.00 88 F 8.48 4.21 0.00 3.16 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 89 R 8.11 3.73 0.00 2.16 2.09 0.00 3.33 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.14 0.00 90 E 8.15 3.97 0.00 2.18 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 2.34 2.48 0.00 91 R 7.73 3.94 0.00 2.02 1.96 0.00 3.18 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.62 0.00 92 F 7.94 3.66 0.00 2.21 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 93 F 8.20 4.32 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 7.61 4.30 0.00 4.09 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 95 E 7.98 3.92 0.00 1.87 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 2.26 2.42 0.00 96 L 7.33 3.88 0.00 1.27 1.77 0.85 0.79 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 97 K 7.79 4.16 0.00 1.97 1.87 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.65 7.81 98 N 7.93 4.55 0.00 2.67 2.85 0.00 0.00 6.85 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 99 S 7.57 4.22 0.00 3.86 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 0.00 100 P 0.00 4.68 0.00 2.10 2.13 0.00 4.12 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 101 A 8.21 4.62 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.73 4.50 0.00 1.91 1.85 0.00 3.11 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.41 0.00 103 V 8.36 4.78 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 0.18 0.00 0.00 1.08 0.00 0.00 104 F 9.12 4.62 0.00 2.92 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 0.00 105 F 8.77 5.30 0.00 2.90 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 0.00 106 P 0.00 4.49 0.00 2.26 2.24 0.00 4.00 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 2.13 2.04 0.00 107 S 8.79 3.97 0.00 3.89 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.10 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.85 4.15 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 0.00 110 I 7.14 4.56 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 1.17 0.84 0.82 0.00 0.00 111 G 8.14 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.33 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 0.00 0.00 0.00 113 L 7.43 4.14 0.00 1.63 1.67 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 114 D 7.75 4.29 0.00 2.93 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 0.00 115 V 7.55 3.55 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.28 0.00 0.00 116 L 7.79 3.89 0.00 1.94 1.68 0.95 0.69 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 0.00 117 S 7.74 3.98 0.00 3.98 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 0.00 118 S 7.74 4.36 0.00 4.02 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 7.68 4.61 2.00 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 1.45 1.03 0.90 0.00 0.00 120 K 7.59 3.88 0.00 2.06 2.33 0.00 1.46 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.41 7.81 121 D 8.07 4.21 0.00 2.24 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 0.00 0.00 0.00 0.00 122 F 8.27 4.52 0.00 3.32 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 V 7.40 4.19 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 0.83 0.00 0.00 1.08 0.00 0.00 124 K 9.10 4.43 0.00 1.77 1.86 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.44 7.81 125 N 7.57 4.81 0.00 2.79 2.86 0.00 0.00 5.62 7.68 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 0.00 126 V 8.79 4.94 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 1.09 0.00 0.00 0.95 0.00 0.00 127 R 9.05 5.01 0.00 1.78 1.82 0.00 3.12 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 128 I 8.75 4.93 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.42 0.98 0.00 0.00 129 E 9.25 5.25 0.00 2.07 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 130 T 9.06 4.89 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 1.12 0.00 0.00 131 I 8.55 4.71 1.82 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 1.21 1.45 0.88 0.00 0.00 132 K 8.70 4.95 0.00 1.64 1.67 0.00 1.54 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.63 1.14 7.81 133 P 0.00 4.90 0.00 2.18 1.95 0.00 3.61 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.07 0.00 134 P 0.00 4.24 0.00 2.18 2.13 0.00 3.62 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.10 0.00 135 K 8.41 3.80 0.00 1.79 1.83 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.47 7.81 136 S 7.86 4.47 0.00 4.07 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 0.00 137 L 7.86 4.72 0.00 1.75 1.72 0.96 1.13 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 0.00 138 G 8.37 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 0.00 0.00 0.00 139 L 7.84 4.87 0.00 1.61 1.55 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 140 D 8.61 4.89 0.00 2.72 2.63 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 0.00 141 L 8.33 4.90 0.00 1.60 1.67 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 142 K 8.51 4.45 0.00 1.72 1.82 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.34 7.81 143 G 7.49 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 0.00 144 K 8.34 4.41 0.00 1.66 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.74 1.48 7.81 145 T 8.71 4.67 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 1.23 0.00 0.00 146 V 8.52 4.18 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 0.81 0.00 0.00 0.94 0.00 0.00 147 V 8.58 4.33 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 0.77 0.00 0.00 1.17 0.00 0.00 148 F 7.95 4.63 0.00 3.36 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 6.03 5.30 0.00 1.78 1.53 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 2.08 2.31 0.00 150 G 7.84 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 0.00 151 S 7.63 4.87 0.00 4.22 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 0.00 152 V 8.38 3.73 2.43 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 1.22 0.00 0.00 1.01 0.00 0.00 153 E 8.37 3.98 0.00 2.11 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 2.41 2.42 0.00 154 E 8.32 4.07 0.00 2.45 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 2.42 2.45 0.00 155 A 8.17 3.25 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 0.00 156 S 7.86 4.07 0.00 3.96 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.58 4.08 0.00 1.94 1.84 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.64 7.81 158 L 7.45 4.29 0.00 1.09 1.01 1.00 1.26 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 0.00 159 F 7.84 4.85 0.00 3.10 2.81 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 0.00 160 P 0.00 4.49 0.00 2.04 2.09 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 161 R 8.43 3.94 0.00 1.97 1.83 0.00 2.98 0.00 0.00 3.14 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 162 N 8.77 4.90 0.00 2.72 2.19 0.00 0.00 6.95 7.82 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 0.00 163 I 8.80 3.43 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.42 0.97 0.00 0.00 164 N 7.81 4.58 0.00 2.92 2.88 0.00 0.00 6.66 7.56 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 0.00 165 V 7.84 3.51 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 0.99 0.00 0.00 0.87 0.00 0.00 166 A 7.98 4.00 1.34 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 0.00 0.00 167 S 7.55 4.07 0.00 4.03 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 0.00 168 T 7.88 3.56 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 1.10 0.00 0.00 169 I 7.62 3.66 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.96 0.83 0.00 0.00 170 G 7.94 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 0.00 0.00 0.00 171 L 7.58 4.10 0.00 1.43 1.32 -0.40 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 172 I 6.86 3.86 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.54 0.85 0.00 0.00 173 V 7.25 4.04 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 0.70 0.00 0.00 0.84 0.00 0.00 174 G 7.77 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 0.00 0.00 0.00 175 F 9.40 3.94 0.00 3.18 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 E 8.41 4.06 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 177 K 7.97 4.29 0.00 1.91 1.86 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.37 7.81 178 V 7.71 4.86 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 0.72 0.00 0.00 0.81 0.00 0.00 179 K 9.08 4.69 0.00 1.85 1.63 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.36 7.81 180 V 8.91 4.99 2.39 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 1.05 0.00 0.00 1.03 0.00 0.00 181 T 8.93 5.24 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 1.24 0.00 0.00 182 I 9.05 4.83 1.94 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 1.31 0.40 0.61 0.00 0.00 183 V 9.25 4.79 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 1.08 0.00 0.00 1.01 0.00 0.00 184 A 9.00 5.05 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 0.00 185 D 8.61 5.19 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 0.00 186 P 0.00 4.27 0.00 2.22 2.29 0.00 3.81 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 1.99 1.97 0.00 187 A 8.15 4.21 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 *189 D 7.81 4.66 0.00 2.73 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 0.00 190 H 7.51 5.13 0.00 3.16 3.24 0.00 5.58 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 0.00 191 N 8.59 4.85 0.00 2.67 2.70 0.00 0.00 6.55 7.32 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 0.00 192 I 8.20 4.92 1.82 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 1.19 0.97 0.91 0.00 0.00 193 H 9.26 5.41 0.00 3.06 3.18 0.00 5.55 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.89 4.90 1.90 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 1.14 0.87 0.93 0.00 0.00 195 V 9.11 4.69 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.02 0.00 0.00 196 R 9.17 4.96 0.00 1.74 1.80 0.00 3.11 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 197 I 9.09 4.89 2.10 0.00 0.00 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 1.22 0.96 1.10 0.00 0.00 198 S 8.80 5.10 0.00 3.89 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 0.00 199 S 8.40 5.07 0.00 4.13 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 0.00 200 A 8.76 4.20 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 I 7.71 3.91 1.94 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.52 0.88 0.00 0.00 202 G 6.19 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 0.00 0.00 0.00 203 N 7.50 4.94 0.00 2.32 2.49 0.00 0.00 6.60 7.46 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 0.00 204 Y 8.68 4.58 0.00 2.55 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 E 8.26 4.84 0.00 1.64 1.71 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 2.12 2.22 0.00 206 F 9.02 5.04 0.00 2.99 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 0.00 207 K 8.95 5.03 0.00 1.79 1.73 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.47 7.81 208 I 9.34 4.44 1.96 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 1.31 0.91 0.99 0.00 0.00 209 E 8.77 4.93 0.00 1.85 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 2.26 2.34 0.00 210 N 8.37 4.56 0.00 2.76 2.79 0.00 0.00 7.26 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 0.00 211 I 8.18 3.73 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.44 0.89 0.00 0.00 *220 S 7.64 4.12 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *222 L 8.21 4.39 0.00 1.83 1.73 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 223 T 7.91 3.93 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 1.24 0.00 0.00 224 V 7.50 3.51 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 0.82 0.00 0.00 0.97 0.00 0.00 225 Y 7.91 3.96 0.00 3.07 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 0.00 226 S 8.22 4.15 0.00 4.04 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 0.00 227 I 7.86 3.73 1.99 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 1.77 0.71 0.94 0.00 0.00 228 L 8.04 3.96 0.00 1.81 1.71 0.60 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 229 R 8.28 4.10 0.00 2.04 2.16 0.00 3.22 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 230 T 7.41 3.86 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 0.93 0.00 0.00 231 L 8.09 4.07 0.00 1.87 1.82 1.17 0.89 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 0.00 232 R 8.51 3.95 0.00 1.90 1.99 0.00 3.26 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 233 N 8.41 4.37 0.00 2.94 2.87 0.00 0.00 6.99 6.27 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 0.00 234 L 7.41 4.03 0.00 1.69 1.71 0.79 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 235 E 7.70 4.66 0.00 1.88 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 2.26 2.37 0.00 236 S 7.63 4.83 0.00 3.92 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 0.00 237 K 8.49 4.20 0.00 1.76 1.81 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.44 7.81 238 I 7.66 4.13 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.89 0.65 0.00 0.00 239 I 7.87 4.38 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.45 0.92 0.00 0.00 240 F 8.70 4.80 0.00 3.04 2.93 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 0.00 241 G 8.88 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.