NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3688 8.1933 115.3714 57.6793 64.4934 175.5732 2 W 4.5663 7.9575 123.7479 59.4689 28.7674 176.3587 3 Q 4.2620 8.1576 119.8030 58.9498 28.9792 177.4334 4 T 3.9808 7.7888 110.6858 64.5199 68.9853 176.5425 5 Y 4.3177 7.9874 119.1205 60.5074 37.7908 178.4423 6 V 3.7060 7.5939 118.1038 66.0567 31.7363 177.9070 7 D 4.3406 8.4137 118.7172 57.1521 40.2519 178.2637 8 T 4.2053 8.1362 115.5161 65.8540 69.2761 177.0888 9 N 4.4848 8.1602 115.8584 55.8354 38.8204 174.9706 10 L 4.5094 7.9015 118.3898 55.9594 43.5457 178.4776 11 V 4.0199 7.8087 121.3612 65.7007 31.7607 178.8880 12 G 3.7193 7.9621 106.6426 47.2234 0.0000 175.4569 13 T 4.0246 7.4740 111.6345 63.4958 68.8981 175.5603 14 G 3.9697 8.0816 109.3472 45.1659 0.0000 174.7128 15 A 4.0861 7.3810 121.0037 53.6621 18.5761 177.8221 16 V 4.6674 7.3294 109.2258 59.9945 36.0847 175.6935 17 T 4.0780 8.7115 115.3352 64.2645 69.5006 174.9677 18 Q 4.6765 7.6265 119.5415 53.7668 33.2558 174.0089 19 A 4.6387 8.2427 121.2378 51.6851 23.4577 174.7198 20 A 4.9202 8.7269 119.7598 51.6530 23.8456 175.8737 21 I 4.6092 8.3773 118.7206 59.9576 40.5208 175.4398 22 I 4.2344 8.2311 128.3360 59.6827 39.7784 175.7712 23 G 3.6425 7.8963 111.0917 44.2216 0.0000 174.8464 24 H 4.4401 8.6643 117.1374 57.7522 28.7480 176.6600 25 D 4.4833 7.9502 118.9967 54.2460 39.9771 177.5478 26 G 3.8985 7.8022 107.1776 45.6789 0.0000 173.9362 27 N 4.5184 8.3393 118.7508 52.8784 39.0580 174.6031 28 T 4.2145 8.5077 120.6915 63.8876 69.2206 173.9455 29 W 4.8550 9.3361 126.7952 58.8242 30.2300 176.4377 30 A 4.9317 7.8326 118.8854 51.3724 22.5260 174.4137 31 T 5.1342 8.4235 111.6590 61.5403 71.2065 172.8458 32 S 4.6729 8.7820 118.9408 57.1374 65.1256 174.9875 33 A 3.8453 8.5416 122.6100 55.1815 18.6718 179.9169 34 G 4.2516 7.7822 103.4501 45.0277 0.0000 173.2625 35 F 4.9569 8.2850 120.3084 56.2101 42.7484 173.3330 36 A 4.4619 7.6804 128.3845 50.7419 21.9174 175.7647 37 V 4.2616 7.7993 121.0207 59.0413 34.1113 176.4798 38 S 4.3241 8.3272 118.4984 57.3763 65.0712 173.2952 39 P 4.1983 0.0000 0.0000 65.9334 31.0653 178.6722 40 A 3.9856 7.9918 118.7166 55.4938 18.4936 179.3241 41 N 4.4554 7.8271 114.6898 56.2912 38.5230 177.9241 42 G 3.6782 8.3331 107.0470 47.4733 0.0000 175.7098 43 A 4.0769 8.4024 122.6536 54.2377 18.1653 179.3762 44 A 4.1592 7.5230 118.6300 54.5159 18.6749 179.2950 45 L 3.8190 7.4309 117.8841 58.0919 42.1248 178.7793 46 A 4.1601 7.9700 119.0953 54.5309 18.4253 178.0560 47 N 4.6102 7.5926 115.0143 55.1137 39.3044 176.4019 48 A 4.2168 7.4298 123.1348 53.6113 18.1072 179.1072 49 F 4.3273 7.9124 115.6330 59.4096 39.5394 177.6597 50 K 4.1707 8.4436 119.8708 57.5111 32.0444 176.6017 51 D 4.4443 7.1249 116.0144 51.9936 42.1054 176.0199 52 A 4.3551 7.8954 126.8947 52.3048 19.4063 178.7362 53 T 3.7693 7.9510 118.5714 68.4201 68.4866 175.7083 54 A 4.0761 7.9650 121.8793 55.4406 18.4175 179.6353 55 I 4.5305 7.6084 112.2220 63.5119 37.6371 177.9847 56 R 3.8762 7.9626 120.1419 58.7683 29.8583 177.7666 57 S 4.5091 7.5499 111.1347 60.2170 64.0629 175.4995 58 N 4.6284 8.1463 118.7226 55.1182 39.5582 174.3779 59 G 3.9461 9.2606 105.4391 44.1348 0.0000 172.0303 60 F 5.2366 8.3906 111.5463 55.5047 40.9958 173.0372 61 E 5.2708 8.7429 120.8639 54.8860 32.0263 176.0154 62 L 4.4969 8.9326 121.3851 54.6786 45.7192 176.3163 63 A 3.7491 9.8273 128.1980 53.0955 16.0632 177.5298 64 G 3.9766 8.4201 108.6900 46.2634 0.0000 173.9535 65 T 4.2168 7.7368 117.2507 62.1308 70.3741 173.9169 66 R 4.5374 8.1442 126.6296 55.5370 31.0342 175.0386 67 Y 4.5122 8.9360 124.8920 56.3956 41.0732 174.6885 68 V 4.6256 8.3454 121.3460 61.1978 34.0104 174.9863 69 T 4.4012 8.7512 124.7484 64.6876 68.2960 173.3251 70 I 4.2769 8.8791 127.7411 62.5307 37.9915 175.9114 71 R 4.5958 7.4264 121.0431 54.7354 33.6201 173.9391 72 A 4.6217 7.9357 120.6531 51.8674 20.6515 176.2384 73 D 5.0835 9.3072 126.4068 53.1276 40.7559 177.9538 74 D 5.2383 8.6705 122.1021 52.6843 39.9174 176.5511 75 R 4.4988 7.8705 118.6923 56.9671 34.9667 174.6836 76 S 5.3143 8.6656 114.7282 56.6933 67.2198 173.3377 77 V 4.5764 8.9352 124.3653 61.2951 34.0821 173.7524 78 Y 5.6089 9.1270 125.8195 56.5244 41.4021 175.0255 79 G 5.2741 9.0141 108.6998 45.1405 0.0000 171.2228 80 K 5.0838 8.4913 117.4986 55.5798 36.6952 175.3288 81 K 4.4656 9.4653 123.1936 54.2193 33.9635 177.4931 82 G 3.9397 8.7239 120.1611 46.8102 0.0000 172.3417 83 S 4.7064 8.7604 118.6098 57.4303 63.1503 172.7831 84 A 4.3745 7.7982 123.1271 50.6268 22.2956 176.1885 85 G 3.7454 6.4807 105.2996 45.6578 0.0000 172.3573 86 V 4.7260 6.9584 117.0322 59.8841 35.2015 174.5185 87 I 4.6220 8.5681 124.0048 59.7382 39.5416 174.5965 88 T 5.1871 9.0070 117.2776 59.8510 71.8221 173.0743 89 V 4.9234 8.9688 125.5841 60.8211 34.6730 174.1374 90 K 4.2155 8.5707 130.5446 56.2012 32.7027 176.2019 91 T 4.7123 7.8190 118.1275 59.6223 71.3726 173.8966 92 S 4.3002 8.5665 114.7046 60.6703 63.2363 174.8414 93 K 4.3621 8.4493 117.5197 55.4967 34.3863 174.8200 94 A 4.1680 7.5424 120.3234 50.5497 22.8720 174.6190 95 I 4.3366 7.3055 116.5372 60.6954 41.3631 174.7813 96 L 4.6894 9.0610 128.5579 54.4168 43.5025 176.5359 97 I 5.0229 8.3421 122.3154 60.1415 41.9509 174.3190 98 G 4.2920 9.0392 113.9101 44.6403 0.0000 171.8646 99 V 4.8920 8.7747 118.4778 59.8791 34.6073 174.5120 100 Y 5.2374 8.5044 120.4999 55.6236 42.1054 174.1169 101 N 5.5802 8.4707 118.0229 51.0430 40.4040 174.5359 102 E 4.3120 8.8807 114.8096 59.0065 29.6303 177.8724 103 K 4.2660 8.1254 117.0299 57.1539 32.5241 176.7177 104 I 4.5793 7.6091 119.6879 59.1190 40.2053 175.5464 105 Q 4.3048 8.1491 122.5482 54.2709 31.1710 175.3698 106 P 3.3883 0.0000 0.0000 65.5865 31.3222 179.2185 107 G 3.6010 7.7779 103.7598 47.5550 0.0000 176.0330 108 T 3.7872 7.6158 117.2969 66.5035 68.6681 176.1707 109 A 3.9967 7.8091 122.4307 55.2175 18.4141 179.1979 110 A 3.7568 7.8589 118.5363 55.4561 18.3476 179.5098 111 N 4.2507 8.2907 115.3185 56.7057 39.0956 177.3737 112 V 3.5595 7.4718 119.7220 66.0004 31.5834 177.9646 113 V 3.5585 7.6626 117.6490 66.0679 31.5335 177.3731 114 E 4.0027 8.1887 118.2372 59.7497 29.5228 179.9380 115 K 4.0223 8.1853 117.9083 59.4981 32.1893 179.2220 116 L 4.0836 8.1194 120.3468 58.0110 41.8567 178.8513 117 A 4.0439 8.4011 121.1380 55.1608 18.2406 179.0728 118 D 4.3330 8.0287 117.0546 57.8285 40.4717 178.1924 119 Y 4.1650 7.9617 119.4445 61.1552 38.7191 178.4777 120 L 4.0895 8.2636 119.4410 57.9057 41.7688 179.6219 121 I 3.8123 8.1890 120.1129 64.3463 36.8140 178.7088 122 G 3.6173 8.2089 105.7751 47.3219 0.0000 174.9266 123 Q 4.2693 7.2664 117.6964 55.8574 29.1384 176.6295 124 G 3.8452 7.8132 108.4584 45.1418 0.0000 173.7302 125 F 4.6600 8.4942 124.5445 57.3948 39.7130 175.0044 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 1 S 8.19 4.37 0.00 3.74 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 2 W 7.96 4.57 0.00 3.67 3.45 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 3 Q 8.16 4.26 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.71 0.00 4 T 7.79 3.98 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 1.13 0.00 0.00 5 Y 7.99 4.32 0.00 3.40 3.16 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 6 V 7.59 3.71 2.33 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 1.19 0.00 0.00 1.15 0.00 0.00 7 D 8.41 4.34 0.00 2.73 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 8 T 8.14 4.21 4.32 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 1.16 0.00 0.00 9 N 8.16 4.48 0.00 2.98 2.99 0.00 0.00 6.75 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 7.90 4.51 0.00 1.87 1.52 0.98 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.81 4.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.95 0.00 0.00 12 G 7.96 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.47 4.02 4.23 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 1.30 0.00 0.00 14 G 8.08 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 15 A 7.38 4.09 1.24 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 0.00 0.00 16 V 7.33 4.67 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 0.73 0.00 0.00 0.94 0.00 0.00 17 T 8.71 4.08 4.23 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 1.23 0.00 0.00 18 Q 7.63 4.68 0.00 1.53 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 19 A 8.24 4.64 1.17 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 20 A 8.73 4.92 1.57 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 0.00 0.00 21 I 8.38 4.61 1.83 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 0.38 0.00 0.00 22 I 8.23 4.23 1.74 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 1.10 1.38 0.75 0.00 0.00 23 G 7.90 3.64 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 24 H 8.66 4.44 0.00 3.10 3.33 0.00 5.72 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 25 D 7.95 4.48 0.00 2.85 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 26 G 7.80 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 27 N 8.34 4.52 0.00 3.02 2.85 0.00 0.00 7.17 7.05 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 28 T 8.51 4.21 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 1.34 0.00 0.00 29 W 9.34 4.86 0.00 2.92 2.85 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 30 A 7.83 4.93 1.47 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 0.00 0.00 31 T 8.42 5.13 4.37 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 1.30 0.00 0.00 32 S 8.78 4.67 0.00 3.96 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 33 A 8.54 3.85 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 34 G 7.78 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.28 4.96 0.00 3.08 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 36 A 7.68 4.46 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 0.00 0.00 0.00 0.00 0.00 37 V 7.80 4.26 1.78 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 0.72 0.00 0.00 0.90 0.00 0.00 38 S 8.33 4.32 0.00 4.06 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 39 P 0.00 4.20 0.00 2.18 2.16 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 40 A 7.99 3.99 1.32 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 0.00 0.00 41 N 7.83 4.46 0.00 3.00 2.91 0.00 0.00 6.98 7.97 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 42 G 8.33 3.68 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 0.00 0.00 0.00 43 A 8.40 4.08 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 0.00 0.00 44 A 7.52 4.16 1.38 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 45 L 7.43 3.82 0.00 1.78 1.79 0.29 1.04 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 46 A 7.97 4.16 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 47 N 7.59 4.61 0.00 3.00 2.77 0.00 0.00 6.89 8.03 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 48 A 7.43 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.91 4.33 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.44 4.17 0.00 1.81 1.86 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.39 7.81 51 D 7.12 4.44 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 52 A 7.90 4.36 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 53 T 7.95 3.77 4.23 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 1.20 0.00 0.00 54 A 7.96 4.08 1.31 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 0.00 0.00 0.00 55 I 7.61 4.53 2.00 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 1.41 0.32 0.85 0.00 0.00 56 R 7.96 3.88 0.00 2.21 2.11 0.00 3.29 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 57 S 7.55 4.51 0.00 4.11 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 58 N 8.15 4.63 0.00 2.81 2.92 0.00 0.00 7.33 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 9.26 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 0.00 0.00 0.00 60 F 8.39 5.24 0.00 3.16 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.74 5.27 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 62 L 8.93 4.50 0.00 2.01 1.79 1.23 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.83 3.75 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 64 G 8.42 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 65 T 7.74 4.22 3.82 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 0.45 0.00 0.00 66 R 8.14 4.54 0.00 1.66 1.67 0.00 3.22 0.00 0.00 3.18 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 67 Y 8.94 4.51 0.00 1.86 2.31 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 0.00 68 V 8.35 4.63 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 1.08 0.00 0.00 0.92 0.00 0.00 69 T 8.75 4.40 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 70 I 8.88 4.28 2.05 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.64 1.02 0.00 0.00 71 R 7.43 4.60 0.00 1.71 1.40 0.00 2.21 0.00 0.00 2.76 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.37 0.00 72 A 7.94 4.62 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 0.00 0.00 0.00 0.00 0.00 73 D 9.31 5.08 0.00 2.71 2.58 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 74 D 8.67 5.24 0.00 2.83 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 75 R 7.87 4.50 0.00 1.80 1.86 0.00 3.08 0.00 0.00 3.32 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 76 S 8.67 5.31 0.00 3.81 3.36 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 77 V 8.94 4.58 1.63 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 0.68 0.00 0.00 -0.15 0.00 0.00 78 Y 9.13 5.61 0.00 2.92 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 79 G 9.01 5.27 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 80 K 8.49 5.08 0.00 1.97 1.96 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.48 7.81 81 K 9.47 4.47 0.00 1.63 1.55 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.64 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.13 0.96 7.81 82 G 8.72 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 0.00 0.00 0.00 83 S 8.76 4.71 0.00 4.06 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 84 A 7.80 4.37 1.17 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 85 G 6.48 3.75 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 0.00 0.00 0.00 86 V 6.96 4.73 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 0.29 0.00 0.00 0.86 0.00 0.00 87 I 8.57 4.62 1.77 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.74 0.64 0.00 0.00 88 T 9.01 5.19 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 1.26 0.00 0.00 89 V 8.97 4.92 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.09 0.00 0.00 90 K 8.57 4.22 0.00 0.79 0.85 0.00 0.91 0.00 0.00 1.32 0.00 0.00 2.61 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.13 1.01 7.81 91 T 7.82 4.71 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 92 S 8.57 4.30 0.00 4.00 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 93 K 8.45 4.36 0.00 2.06 2.24 0.00 2.01 0.00 0.00 2.09 0.00 0.00 3.03 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.42 7.81 94 A 7.54 4.17 0.53 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 0.00 0.00 95 I 7.31 4.34 1.73 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 1.02 0.63 0.96 0.00 0.00 96 L 9.06 4.69 0.00 1.56 1.57 0.96 0.47 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 97 I 8.34 5.02 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.72 1.08 0.00 0.00 98 G 9.04 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 99 V 8.77 4.89 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 0.55 0.00 0.00 0.83 0.00 0.00 100 Y 8.50 5.24 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.47 5.58 0.00 2.85 3.00 0.00 0.00 5.75 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.88 4.31 0.00 2.13 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 2.30 2.26 0.00 103 K 8.13 4.27 0.00 2.00 1.91 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.56 7.81 104 I 7.61 4.58 1.94 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 1.32 0.85 0.88 0.00 0.00 105 Q 8.15 4.30 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 106 P 0.00 3.39 0.00 2.05 2.04 0.00 3.47 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 2.12 2.17 0.00 107 G 7.78 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 0.00 0.00 0.00 108 T 7.62 3.79 4.23 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 1.16 0.00 0.00 109 A 7.81 4.00 1.08 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 0.00 110 A 7.86 3.76 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 0.00 111 N 8.29 4.25 0.00 3.19 2.80 0.00 0.00 6.80 7.23 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 0.00 112 V 7.47 3.56 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.00 0.00 0.00 113 V 7.66 3.56 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 0.96 0.00 0.00 114 E 8.19 4.00 0.00 2.30 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 0.00 2.58 2.65 0.00 115 K 8.19 4.02 0.00 1.98 1.90 0.00 1.61 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.53 7.81 116 L 8.12 4.08 0.00 1.84 1.87 1.11 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.40 4.04 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 0.00 118 D 8.03 4.33 0.00 3.04 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 0.00 119 Y 7.96 4.17 0.00 3.19 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 0.00 120 L 8.26 4.09 0.00 1.86 1.93 0.96 0.64 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 0.00 121 I 8.19 3.81 2.00 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 1.45 1.11 0.89 0.00 0.00 122 G 8.21 3.62 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 0.00 0.00 0.00 123 Q 7.27 4.27 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.09 0.00 0.00 0.00 0.00 0.00 1.92 1.97 0.00 124 G 7.81 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.49 4.66 0.00 3.28 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