NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3280 8.0176 115.2435 61.9121 68.7368 174.5428 6 T 4.0976 8.1169 116.4702 63.5226 68.6725 175.3777 7 L 3.9605 8.6850 122.8007 57.6435 42.2726 180.5286 8 K 3.9618 8.0141 117.8447 59.6134 31.5280 179.0847 9 E 4.0081 8.2260 118.7951 59.4323 29.3654 179.3595 10 Q 4.0271 8.6019 118.5017 58.9129 28.7757 179.0044 11 V 3.6600 8.1100 119.4642 66.1867 31.6140 178.0221 12 L 4.0321 7.8445 118.2400 58.1155 41.5476 179.6588 13 T 3.8947 8.0523 115.8980 66.8337 68.3819 176.6998 14 T 3.9227 8.0660 111.6570 64.9211 68.6783 176.4918 15 L 4.2803 8.0360 123.2054 56.8050 41.5557 179.6393 16 K 3.9775 8.0628 118.3912 59.4370 31.9523 179.3486 17 R 3.9017 7.8887 118.5026 59.5614 30.0682 178.3924 18 E 3.9931 8.6706 118.8161 59.3938 29.4571 179.1658 19 Q 3.9893 8.6691 119.8024 59.1808 29.1528 178.1019 20 A 4.3257 8.3445 121.9235 55.4326 18.3922 179.2714 21 N 4.2819 8.6429 115.0953 56.4510 38.5107 177.4982 22 A 4.0725 8.0917 122.1554 54.9965 18.4397 179.8670 23 V 3.4327 7.7427 116.7492 66.1864 31.5525 178.4664 24 V 3.5260 7.8663 118.0155 66.1798 31.3555 177.5957 25 M 3.9405 8.4705 118.4153 58.6248 32.0620 177.5427 26 Y 4.2132 8.3443 119.8695 60.8754 39.0638 178.1161 27 L 3.5971 8.0231 119.8591 57.5260 41.6541 179.1760 28 N 3.7199 8.1634 116.8108 56.4534 38.4386 176.9292 29 Y 3.8240 7.4722 117.7848 60.8678 37.7864 179.0200 30 K 3.0249 7.2735 119.2717 58.6516 31.8250 179.0218 31 K 3.7900 7.1896 119.7937 59.8795 32.0278 178.3556 32 Y 3.9685 6.8726 116.5742 61.0693 37.3468 177.6915 33 H 4.2345 8.0199 118.4819 59.5406 29.9299 176.9173 34 W 4.7194 8.0498 119.1953 58.9980 29.1230 177.7253 35 L 4.7057 8.1513 116.1906 53.9918 42.1256 176.9138 36 T 4.2359 7.5477 114.3280 62.6547 68.1155 172.1698 37 Y 4.8181 8.1763 122.7730 56.6333 40.8406 174.0815 38 G 4.1476 8.9202 106.2476 44.0431 0.0000 172.4210 39 P 4.3863 0.0000 0.0000 64.8169 31.3995 177.4433 40 L 4.5641 7.8082 117.3587 54.6073 42.1390 177.6854 41 F 4.1304 8.3230 123.0171 61.6627 39.1290 177.2345 42 R 3.5884 8.0419 117.3124 59.3295 29.9271 177.5676 43 D 4.2823 8.0385 117.2253 57.6247 41.1353 178.2608 44 L 3.3824 7.9178 119.3673 57.5101 41.6350 178.6362 45 H 3.9919 8.2430 118.6127 59.3626 29.5589 177.2982 46 L 3.8706 7.8614 120.4578 57.5375 41.4066 178.8404 47 L 3.7470 7.7393 120.4984 58.4974 41.8440 179.2282 48 F 4.4600 7.8755 117.6416 60.4812 38.7127 177.3976 49 E 3.6706 8.0189 118.5698 59.0528 29.4214 178.7506 50 E 3.8117 8.3333 118.9686 59.6409 29.4407 179.4723 51 Q 3.6718 7.9948 118.4312 58.4396 28.6096 178.7575 52 G 3.5552 7.3245 107.1059 47.9084 0.0000 175.8564 53 S 4.3267 8.2782 116.9964 61.1084 62.7443 176.5090 54 E 3.9906 7.7856 121.1350 59.1344 29.5387 179.0463 55 V 3.7904 8.0043 118.3876 65.8476 31.6120 177.5866 56 F 3.7312 8.7858 120.6860 61.4301 38.6508 177.0017 57 A 3.9306 8.0368 119.5822 55.3744 17.9888 179.4088 58 M 3.7585 8.0214 116.9894 57.8823 31.9496 178.7939 59 I 3.5656 7.3269 120.5732 64.5533 37.2042 177.8461 60 D 4.2407 7.6397 118.0800 57.1419 41.1807 177.8732 61 E 3.8952 7.5992 118.8688 59.5332 29.2889 179.4271 62 L 3.9942 7.9403 117.5789 57.4252 41.7770 179.2037 63 A 4.1356 8.0994 120.8339 55.3591 18.4461 179.6382 64 E 3.9443 8.4793 117.0672 58.9313 29.2193 179.4012 65 R 3.8424 7.8471 119.1709 59.4817 29.9765 178.5247 66 S 4.1381 7.7775 114.8208 61.7299 62.8701 176.7621 67 L 4.2354 7.7405 122.3313 57.5775 41.2430 179.2336 68 M 4.2483 8.1136 117.1362 57.1361 31.8246 177.6372 69 L 4.5503 7.0831 117.6716 53.8583 42.1894 176.0312 70 D 4.4723 7.9474 116.8342 55.2432 38.5354 173.9467 71 G 4.3775 7.9986 110.7231 43.8520 0.0000 172.7745 72 Q 4.5842 8.2591 116.9902 53.2470 31.9721 173.7165 73 P 4.5828 0.0000 0.0000 61.4316 32.7143 175.9442 74 V 3.5844 8.0439 118.0806 63.2096 31.8769 174.8884 75 A 4.5279 8.0432 125.3527 53.4625 23.3671 176.5957 76 D 4.4381 7.8459 116.6128 53.6197 41.0378 175.3652 77 P 4.4856 0.0000 0.0000 65.8829 31.1138 178.3133 78 A 4.1411 7.9383 117.5957 54.4908 18.6485 178.5420 79 D 4.4357 8.1656 117.6308 56.5238 40.8939 178.3275 80 Y 4.2005 7.4530 117.3177 61.2508 37.7644 178.5933 81 L 4.1549 7.9632 116.9534 56.9271 41.9084 179.0005 82 K 4.1752 7.7515 117.8591 58.4352 32.1062 178.0660 83 V 4.1675 7.6309 109.9745 61.6670 33.4333 176.3048 84 A 4.1994 8.1166 122.8857 52.5216 18.6010 177.1948 85 T 4.4509 8.2206 110.0086 61.8728 70.5628 175.7305 86 V 3.7331 7.5722 115.2408 61.4409 32.1345 175.6665 87 T 4.1562 8.2729 120.4633 62.2343 68.7559 173.0360 88 P 4.3313 0.0000 0.0000 62.1384 32.0995 176.2523 89 S 4.4086 8.4642 117.2221 58.3150 62.9770 173.3275 90 S 4.4920 8.1828 120.7420 57.5246 65.5409 174.7820 91 G 3.8973 8.7948 111.2740 44.6012 0.0000 172.4490 92 Q 4.2222 8.3552 117.7183 55.5829 29.1484 176.0728 93 L 5.0466 8.2518 122.0586 52.4663 45.3905 177.0524 94 T 5.0852 8.7346 113.9849 60.7199 71.0275 176.1438 95 V 3.4403 7.9843 120.7217 65.9398 31.4386 177.7071 96 K 3.8199 8.0374 118.8174 59.9433 31.8738 178.4791 97 Q 4.1885 7.9855 119.3024 58.5398 28.4840 178.6012 98 M 3.4824 8.0261 119.7923 58.3474 31.8605 178.9305 99 I 3.5906 7.5697 119.6592 64.2889 36.9261 178.3198 100 E 3.9292 8.2714 119.5862 59.3568 29.2738 179.0665 101 E 3.9322 8.3106 119.1933 59.1546 29.7087 178.6209 102 A 3.9049 7.9482 120.9493 55.2037 18.3670 179.5729 103 I 3.7144 7.9940 118.1407 64.5500 37.2520 178.3530 104 A 4.0196 8.0420 121.4157 55.4002 18.1302 179.4653 105 N 4.2814 8.3076 114.8111 56.8104 38.6346 177.3105 106 H 4.2395 8.6461 117.9812 59.0954 28.8151 177.7056 107 E 4.0809 8.6921 120.7151 59.1474 29.1648 179.1662 108 L 3.9356 8.0179 120.3522 58.2732 42.2204 179.0824 109 I 3.6344 7.9098 119.7970 64.3839 37.0406 178.4197 110 I 3.7145 8.2118 120.9331 64.7330 36.9960 178.5444 111 T 3.8468 8.0079 116.3733 66.8058 68.2732 176.5175 112 E 3.9210 8.3865 120.5993 59.7121 29.3865 179.3799 113 M 3.6615 8.5447 118.9757 58.4951 32.0756 178.6051 114 H 4.1180 8.1841 116.3210 58.8597 28.8934 177.8574 115 Q 3.9900 8.0744 119.7922 59.2291 28.5107 178.7486 116 D 4.2972 8.6152 119.9809 57.0580 40.6215 178.6593 117 A 4.2104 8.2664 121.9143 55.1050 18.2806 179.2932 118 E 3.8802 8.1293 117.4426 59.4167 29.7567 179.0563 119 I 3.6793 7.8361 119.6080 64.3939 37.1284 178.1826 120 A 4.0590 8.3055 121.6376 55.5416 18.2067 179.7744 121 T 3.8179 8.1925 114.2958 66.9740 68.3404 176.7162 122 E 3.9860 8.2898 119.1400 59.2379 29.5781 178.6997 123 A 4.2606 7.9202 118.6030 52.4210 18.6133 178.3333 124 G 3.8360 7.8824 105.2813 46.2728 0.0000 175.2110 125 D 4.6266 8.0538 121.8555 52.6598 39.0362 176.4696 126 I 3.8621 7.8681 118.7208 63.2128 37.9396 178.4847 127 G 3.5353 7.9550 106.9986 48.0531 0.0000 175.7263 128 T 3.6213 8.2290 118.5553 65.8764 68.3941 176.5591 129 A 4.1000 8.0111 122.7648 55.4277 18.2962 179.2355 130 D 4.2387 8.2149 116.3761 57.1575 41.1963 177.9754 131 L 3.8576 7.9455 121.0009 58.6048 42.0922 178.6387 132 Y 4.4017 7.7004 116.3707 61.5151 37.5548 178.8483 133 T 3.9937 7.8946 115.8001 66.4856 68.6925 176.5114 134 R 4.0331 8.3457 120.8575 59.5912 30.2650 178.6175 135 L 4.0548 8.2605 119.3035 57.6878 41.5104 179.8926 136 V 3.7842 8.1278 119.2963 64.9330 31.2102 178.5327 137 Q 4.3295 7.8401 120.1912 58.5161 28.4083 178.8114 138 T 3.8011 7.8286 116.4060 66.8972 68.5039 176.2326 139 H 4.0977 8.0151 117.6484 59.0714 28.5534 177.9118 140 Q 4.1084 8.4549 119.9942 58.6482 28.4985 178.7728 141 K 4.3250 8.2666 120.7519 59.9436 32.3050 178.4942 142 H 4.4852 8.2272 117.9879 58.3551 28.5416 177.6732 143 R 3.9946 8.4158 120.7434 59.1287 29.9346 178.2466 144 W 4.4115 8.4086 128.0583 60.6772 30.5568 177.6186 145 F 3.4036 8.2841 116.1535 60.6035 38.5731 177.4484 146 L 4.3121 8.3002 118.2325 57.9236 41.4616 179.7209 147 K 4.0482 8.5187 118.6472 59.6389 32.0311 179.1621 148 E 3.9572 8.3067 118.7887 59.4354 29.0929 179.3896 149 F 3.9806 7.9425 116.8359 59.7395 39.0006 176.6887 150 L 4.3974 7.6879 116.4218 54.2737 42.2405 176.9223 151 A 4.1960 7.1447 122.3465 51.6966 18.8930 176.3783 152 K 4.9443 7.5224 118.0997 54.7574 35.6749 175.8348 153 G 3.8572 8.6346 104.3327 46.5710 0.0000 174.7121 154 D 4.2941 8.1241 120.7524 54.2382 39.6821 177.3605 155 G 3.9679 8.1943 107.6916 45.3142 0.0000 173.4088 156 L 4.5444 8.0825 117.0923 55.9656 43.3444 177.7317 157 V 4.5000 8.5734 106.7911 60.5345 34.2290 175.8864 158 S 4.1619 7.9636 120.1827 58.5667 62.8027 173.7444 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 5 T 8.02 4.33 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 6 T 8.12 4.10 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 7 L 8.69 3.96 0.00 1.72 1.77 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.01 3.96 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.54 7.81 9 E 8.23 4.01 0.00 2.19 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 2.33 2.50 0.00 10 Q 8.60 4.03 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 11 V 8.11 3.66 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.05 0.00 0.00 12 L 7.84 4.03 0.00 1.95 1.71 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.05 3.89 4.42 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 1.22 0.00 0.00 14 T 8.07 3.92 4.55 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 1.34 0.00 0.00 15 L 8.04 4.28 0.00 1.93 1.79 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.06 3.98 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.61 7.81 17 R 7.89 3.90 0.00 1.93 2.09 0.00 3.39 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 18 E 8.67 3.99 0.00 2.21 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 2.44 2.49 0.00 19 Q 8.67 3.99 0.00 2.20 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 20 A 8.34 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.64 4.28 0.00 3.02 2.90 0.00 0.00 6.93 8.05 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 22 A 8.09 4.07 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 23 V 7.74 3.43 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 0.41 0.00 0.00 0.61 0.00 0.00 24 V 7.87 3.53 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 0.98 0.00 0.00 0.96 0.00 0.00 25 M 8.47 3.94 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.68 0.00 26 Y 8.34 4.21 0.00 3.24 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 27 L 8.02 3.60 0.00 1.75 1.58 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.16 3.72 0.00 2.56 2.17 0.00 0.00 7.00 7.02 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 29 Y 7.47 3.82 0.00 3.04 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.27 3.02 0.00 0.98 0.74 0.00 1.06 0.00 0.00 1.18 0.00 0.00 2.71 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.30 0.85 7.81 31 K 7.19 3.79 0.00 1.61 1.44 0.00 1.60 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.53 7.81 32 Y 6.87 3.97 0.00 1.85 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.02 4.23 0.00 2.98 3.10 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 W 8.05 4.72 0.00 3.50 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 35 L 8.15 4.71 0.00 1.82 1.87 1.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.55 4.24 4.71 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 1.50 0.00 0.00 37 Y 8.18 4.82 0.00 3.24 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 38 G 8.92 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 39 P 0.00 4.39 0.00 2.08 2.17 0.00 3.70 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 2.06 2.16 0.00 40 L 7.81 4.56 0.00 1.71 1.70 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.32 4.13 0.00 3.36 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.04 3.59 0.00 2.01 1.93 0.00 3.29 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 43 D 8.04 4.28 0.00 2.83 2.78 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 44 L 7.92 3.38 0.00 1.65 1.30 0.73 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 45 H 8.24 3.99 0.00 2.13 3.01 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.86 3.87 0.00 1.87 1.63 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.74 3.75 0.00 1.54 1.10 1.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.88 4.46 0.00 3.14 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.02 3.67 0.00 1.87 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 2.17 2.25 0.00 50 E 8.33 3.81 0.00 1.98 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 2.25 2.38 0.00 51 Q 7.99 3.67 0.00 1.25 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 1.96 2.27 0.00 52 G 7.32 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 53 S 8.28 4.33 0.00 4.00 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 54 E 7.79 3.99 0.00 2.14 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 2.45 0.00 55 V 8.00 3.79 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 1.22 0.00 0.00 1.21 0.00 0.00 56 F 8.79 3.73 0.00 2.45 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 57 A 8.04 3.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 M 8.02 3.76 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.59 0.00 59 I 7.33 3.57 1.44 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.59 0.75 0.00 0.00 60 D 7.64 4.24 0.00 2.51 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 61 E 7.60 3.90 0.00 2.08 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 2.28 2.47 0.00 62 L 7.94 3.99 0.00 1.67 1.76 1.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.10 4.14 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 64 E 8.48 3.94 0.00 2.04 1.98 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 2.30 2.49 0.00 65 R 7.85 3.84 0.00 2.03 2.01 0.00 3.08 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 66 S 7.78 4.14 0.00 4.07 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 67 L 7.74 4.24 0.00 1.86 1.70 0.97 1.19 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 68 M 8.11 4.25 0.00 1.97 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 69 L 7.08 4.55 0.00 1.71 1.65 0.96 1.01 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 70 D 7.95 4.47 0.00 2.85 2.78 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 71 G 8.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.26 4.58 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 73 P 0.00 4.58 0.00 2.19 2.28 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 74 V 8.04 3.58 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 0.22 0.00 0.00 0.93 0.00 0.00 75 A 8.04 4.53 1.20 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 76 D 7.85 4.44 0.00 2.84 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.49 0.00 2.23 2.26 0.00 3.62 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 78 A 7.94 4.14 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 79 D 8.17 4.44 0.00 2.60 2.56 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 80 Y 7.45 4.20 0.00 3.07 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 81 L 7.96 4.15 0.00 1.65 1.77 0.96 0.93 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 82 K 7.75 4.18 0.00 1.92 1.86 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.64 7.81 83 V 7.63 4.17 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 0.70 0.00 0.00 1.04 0.00 0.00 84 A 8.12 4.20 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 85 T 8.22 4.45 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 86 V 7.57 3.73 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 0.72 0.00 0.00 0.98 0.00 0.00 87 T 8.27 4.16 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 88 P 0.00 4.33 0.00 2.16 2.05 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 89 S 8.46 4.41 0.00 3.80 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 90 S 8.18 4.49 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 8.79 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 92 Q 8.36 4.22 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 93 L 8.25 5.05 0.00 1.63 1.56 0.99 1.04 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 94 T 8.73 5.09 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 1.31 0.00 0.00 95 V 7.98 3.44 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 0.97 0.00 0.00 0.40 0.00 0.00 96 K 8.04 3.82 0.00 1.85 1.80 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.55 7.81 97 Q 7.99 4.19 0.00 2.39 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 98 M 8.03 3.48 0.00 0.82 1.90 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.48 0.00 99 I 7.57 3.59 1.96 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.73 0.95 0.00 0.00 100 E 8.27 3.93 0.00 2.12 1.98 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 2.33 2.42 0.00 101 E 8.31 3.93 0.00 2.06 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 2.35 2.33 0.00 102 A 7.95 3.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.99 3.71 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.85 0.98 0.00 0.00 104 A 8.04 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.31 4.28 0.00 2.95 2.82 0.00 0.00 7.08 7.70 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 0.00 106 H 8.65 4.24 0.00 3.52 3.46 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.69 4.08 0.00 2.17 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 0.00 2.39 2.54 0.00 108 L 8.02 3.94 0.00 1.87 1.86 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.91 3.63 1.88 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 1.48 0.59 0.63 0.00 0.00 110 I 8.21 3.71 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.03 0.99 0.00 0.00 111 T 8.01 3.85 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 1.20 0.00 0.00 112 E 8.39 3.92 0.00 2.11 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 2.29 2.47 0.00 113 M 8.54 3.66 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 114 H 8.18 4.12 0.00 3.38 3.35 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Q 8.07 3.99 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 116 D 8.62 4.30 0.00 1.76 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 0.00 117 A 8.27 4.21 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 0.00 118 E 8.13 3.88 0.00 2.10 2.17 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 2.39 2.36 0.00 119 I 7.84 3.68 2.05 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 1.47 0.93 0.94 0.00 0.00 120 A 8.31 4.06 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 0.00 121 T 8.19 3.82 4.41 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 1.23 0.00 0.00 122 E 8.29 3.99 0.00 2.09 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 0.00 2.36 2.53 0.00 123 A 7.92 4.26 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.88 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 0.00 0.00 0.00 125 D 8.05 4.63 0.00 2.71 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 7.87 3.86 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 1.56 0.62 0.96 0.00 0.00 127 G 7.95 3.54 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 0.00 0.00 0.00 128 T 8.23 3.62 4.22 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 0.87 0.00 0.00 129 A 8.01 4.10 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 8.21 4.24 0.00 2.87 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 0.00 131 L 7.95 3.86 0.00 1.71 1.50 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 7.70 4.40 0.00 3.23 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 0.00 133 T 7.89 3.99 4.41 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 1.22 0.00 0.00 134 R 8.35 4.03 0.00 1.86 2.06 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 135 L 8.26 4.05 0.00 1.84 1.81 0.98 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.13 3.78 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 0.82 0.00 0.00 0.96 0.00 0.00 137 Q 7.84 4.33 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 138 T 7.83 3.80 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 0.98 0.00 0.00 139 H 8.02 4.10 0.00 3.47 3.47 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.45 4.11 0.00 2.31 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 141 K 8.27 4.32 0.00 1.93 1.94 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.27 1.83 7.81 142 H 8.23 4.49 0.00 3.14 3.27 0.00 5.71 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.42 3.99 0.00 1.96 2.21 0.00 3.19 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 144 W 8.41 4.41 0.00 3.51 3.67 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 0.00 145 F 8.28 3.40 0.00 3.11 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 0.00 146 L 8.30 4.31 0.00 2.06 1.83 1.03 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.52 4.05 0.00 2.16 1.97 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.70 7.81 148 E 8.31 3.96 0.00 1.78 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 2.31 2.14 0.00 149 F 7.94 3.98 0.00 3.10 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 0.00 150 L 7.69 4.40 0.00 1.87 1.74 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 151 A 7.14 4.20 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 0.00 152 K 7.52 4.94 0.00 1.82 1.79 0.00 1.25 0.00 0.00 2.37 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.35 7.81 153 G 8.63 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 0.00 154 D 8.12 4.29 0.00 2.73 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 0.00 155 G 8.19 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 0.00 156 L 8.08 4.54 0.00 1.72 1.67 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.57 4.50 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 0.72 0.00 0.00 1.01 0.00 0.00 158 S 7.96 4.16 0.00 3.93 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