NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7044 8.4093 118.2165 52.5040 38.6432 173.3237 4 E 4.7612 7.8404 117.9778 55.8441 30.9582 174.6338 5 D 4.5323 9.3540 121.6845 54.0358 42.1198 177.7812 6 L 4.1754 8.2381 123.2918 54.5075 42.1517 176.5394 7 F 5.1655 7.3651 117.1589 55.8955 42.6769 174.7551 8 I 3.9068 8.8476 127.1485 63.1980 37.3704 175.6803 9 C 4.6966 7.2186 113.3759 57.8000 30.8958 172.3912 10 I 4.2099 8.0740 121.2491 61.0445 37.3880 175.7776 11 D 4.7197 9.4545 126.9563 57.2662 42.0661 175.4425 12 H 5.3549 7.9112 111.3723 54.7523 32.0817 172.1963 13 V 4.7813 8.6705 119.5568 61.1087 33.6401 174.2917 14 A 4.7923 8.9555 131.3684 51.5828 20.0617 175.1008 15 Y 5.1286 9.5766 125.1198 55.7639 41.3502 174.1537 16 A 4.8408 8.2681 129.2022 50.7946 21.2459 175.4943 17 C 4.8797 8.6097 115.9596 56.3512 33.0251 173.4604 18 P 4.2447 0.0000 0.0000 64.8221 31.4059 176.4609 19 D 4.4963 7.7424 117.3458 51.6035 43.6094 175.0839 20 A 4.0230 8.5493 130.2192 55.0941 18.4741 178.6215 21 D 4.2913 8.1353 116.9927 57.5568 41.0848 178.3427 22 E 3.9436 8.8070 119.7473 59.3545 29.5779 178.7843 23 A 4.1823 7.9235 120.4634 55.2765 18.5243 179.5325 24 S 4.1178 8.4337 111.9376 61.6125 62.4045 176.6157 25 K 4.1310 8.4448 121.1648 59.2134 31.6354 178.8794 26 Y 3.9238 8.0203 120.1297 60.8325 38.6956 177.1552 27 Y 3.8756 8.7143 118.1440 61.0152 38.0438 178.8345 28 Q 4.3394 8.2429 120.1749 58.4049 28.8250 178.3614 29 E 3.8849 8.1062 118.2419 59.6946 29.6296 179.3106 30 T 3.7888 7.2415 114.0837 65.9965 68.7526 176.1901 31 F 4.7139 7.4287 116.2899 57.3618 39.6405 176.4541 32 G 3.9213 7.9272 107.8618 46.1840 0.0000 173.8913 33 W 4.5574 8.7066 119.9549 56.4007 31.1201 174.8093 34 H 5.1259 9.4512 118.6041 54.0832 30.9397 173.4595 35 E 4.7191 8.9814 124.6015 55.9971 29.4343 175.7391 36 L 4.5802 8.9675 127.6147 55.9932 43.2905 176.4294 37 H 4.6371 7.6671 115.5710 55.2362 33.1171 172.4483 38 R 5.0753 8.2532 123.9429 54.7005 33.0673 173.9909 39 E 4.7761 9.6723 124.5603 54.5851 34.3256 173.9194 40 E 4.6779 8.8062 123.3802 54.5591 32.5196 174.9212 41 N 4.7948 9.0555 126.5056 50.6620 39.1829 172.5699 42 P 4.2135 0.0000 0.0000 65.3250 31.9690 177.4557 43 E 4.0695 8.3499 116.7828 59.5323 28.9902 178.0249 44 Q 4.0559 8.1341 116.1015 56.5130 29.2033 177.0396 45 G 3.8959 8.2383 106.7423 46.2124 0.0000 173.1080 46 V 4.9982 7.2276 115.1990 59.3012 34.8948 174.4736 47 V 4.7800 8.7631 123.2560 60.0405 33.9326 174.3617 48 E 5.2492 9.7154 123.9048 54.5597 33.5230 174.8282 49 I 4.9887 8.7613 123.6541 59.8560 41.3536 174.1358 50 M 4.9260 9.2085 127.1227 54.3453 33.7460 175.1329 51 M 5.5493 9.4410 123.2017 53.6684 36.0765 174.6865 52 A 4.9574 9.1475 122.5407 49.5593 22.8483 175.5078 53 P 2.9700 0.0000 0.0000 63.5563 31.7692 176.1462 54 A 4.5981 7.0913 120.1904 49.8412 22.1603 175.7692 55 A 3.8871 8.2170 122.3318 53.8625 18.7201 178.3754 56 K 4.5301 7.5400 114.7601 54.2051 34.3535 176.1408 57 L 4.1068 8.4796 124.3843 54.9032 42.4373 176.7135 58 T 4.4747 8.0210 111.6862 59.5871 71.1476 175.0754 59 E 3.7670 8.8083 122.5537 59.7343 29.2522 177.6304 60 H 4.7131 7.9605 111.3355 55.4156 29.0479 174.3616 61 M 4.0966 7.7384 120.9207 55.9224 32.1469 175.9482 62 T 4.6013 8.4388 123.3930 63.6080 69.8088 174.1678 63 Q 4.9169 8.8258 123.7499 54.3591 32.8228 174.2129 64 V 4.8672 9.2786 120.3583 61.3687 34.0823 173.9740 65 Q 4.9913 9.0851 129.5883 54.4327 30.9871 174.1980 66 V 4.6194 8.7744 128.1677 62.4035 33.0804 174.5322 67 M 5.2676 9.2885 127.1888 53.5660 35.4103 174.5819 68 A 5.5571 8.8460 123.2992 48.9902 23.2104 173.7648 69 P 4.8583 0.0000 0.0000 63.0064 32.0453 176.1396 70 L 4.7409 8.9972 121.2101 55.0791 43.3181 176.2664 71 N 4.7360 7.5934 114.2461 51.8757 39.4231 174.9055 72 D 4.5023 8.7839 117.7395 55.6944 40.5945 176.8184 73 E 4.4600 8.6079 120.1175 56.9576 30.7706 177.4906 74 S 4.3070 8.0213 114.5170 58.3887 64.8654 175.2977 75 T 3.8851 8.4319 120.2677 67.0409 68.2090 176.8639 76 V 3.5458 7.8316 119.2451 65.9672 31.4506 177.6909 77 A 4.0193 7.9449 120.0653 55.2954 18.2734 179.8331 78 K 4.0207 7.9271 116.6629 58.7825 31.8382 179.6401 79 W 4.0157 7.9577 128.4375 60.4908 30.9335 177.7059 80 L 4.2455 8.6400 119.0926 57.7629 40.5116 179.4255 81 A 4.0027 8.2295 120.7803 55.0197 18.1513 179.0974 82 K 4.2888 7.6160 113.2104 56.9717 33.0394 177.0082 83 H 4.5377 7.2243 115.6345 55.3130 29.3754 173.9314 84 N 3.8705 8.7106 111.1847 53.4331 36.3434 175.1204 85 G 4.0363 8.2785 104.4504 46.0419 0.0000 173.8264 86 R 4.5377 7.5868 114.5176 53.5791 31.2361 176.2927 87 A 4.2963 8.5007 123.1156 53.1307 19.2277 176.7358 88 G 4.4865 8.5726 105.6554 45.2528 0.0000 172.9063 89 L 4.5418 8.9580 121.3218 55.6972 41.5809 176.4073 90 H 4.2805 9.5131 125.6248 57.7615 30.7643 174.2691 91 H 4.6581 7.5538 110.8313 55.4415 31.6216 171.8791 92 M 5.1278 8.2230 117.7821 53.5114 34.6650 175.1309 93 A 4.9710 8.7489 123.9387 49.8643 22.3197 174.9396 94 W 5.2725 8.9877 122.5074 54.8152 32.1318 175.2552 95 R 4.8869 8.9853 125.3484 56.1814 30.4343 175.5435 96 V 4.7806 8.8064 118.9563 59.6958 34.9492 176.2969 97 D 4.3327 8.7592 122.0072 56.4812 41.6700 176.6932 98 D 4.6374 7.5920 117.8148 51.8436 42.5069 174.6007 99 I 3.7317 8.9642 127.3825 63.9825 38.0371 176.9484 100 D 4.3156 8.1602 119.1473 57.0030 40.8147 177.8861 101 A 3.9691 9.7106 121.9163 55.7426 18.3527 180.0503 102 V 3.5409 8.1727 116.4722 66.0036 31.4202 178.3727 103 S 4.1537 8.2316 114.9642 60.9605 62.5215 176.4888 104 A 3.9562 8.0685 123.8563 55.4401 18.2461 179.7010 105 T 3.7923 7.8095 114.2158 66.8001 68.4894 176.7931 106 L 4.0215 8.1717 121.0276 57.8968 41.5893 179.7810 107 R 4.0570 8.2273 118.1279 59.4442 29.8532 178.7418 108 E 3.9660 8.3431 117.8277 58.7583 29.4889 177.9227 109 R 4.5665 7.4810 116.0566 55.4584 30.5138 176.4898 110 G 3.8635 8.0706 106.0892 46.4468 0.0000 174.1855 111 V 3.9786 7.8684 119.6389 61.9566 32.7855 174.9530 112 Q 4.4903 8.5972 128.5954 54.6880 30.7669 174.9088 113 L 4.7250 8.3249 126.2985 52.9065 43.6777 176.1156 114 L 4.2320 8.5000 120.3541 56.6829 42.6522 175.9943 115 Y 5.1060 7.5592 114.4911 56.1129 39.9341 175.7730 116 D 4.5964 8.8913 122.8488 56.7141 41.3117 176.7523 117 E 4.8394 7.8125 115.8703 53.3709 33.2960 173.5373 118 P 4.7401 0.0000 0.0000 63.1337 32.0204 175.7840 119 K 4.6934 9.3405 121.8507 54.3268 35.6667 175.6750 120 L 4.3946 8.4770 122.4683 54.4806 42.1369 177.1044 121 G 4.0489 8.9195 114.1585 44.5887 0.0000 173.1008 122 T 3.8098 8.6595 119.9216 64.7006 69.3749 175.4591 123 G 3.9715 8.0345 113.2018 45.9114 0.0000 174.4016 124 G 3.9675 8.5089 113.9681 45.6119 0.0000 173.3636 125 N 4.5927 7.8324 117.7743 54.0020 39.9689 174.1234 126 R 5.0326 8.9508 122.4565 54.7575 32.1061 175.5304 127 I 5.0318 9.0963 118.2166 59.3038 41.5515 173.4303 128 N 4.9726 8.0353 118.3074 53.6682 42.6951 172.8744 129 F 5.0888 7.9329 119.7404 55.2309 42.9875 173.8369 130 M 5.0324 8.5759 117.2287 54.4576 36.2536 175.1849 131 H 4.3820 8.3864 117.9589 55.2683 29.6136 175.1929 132 P 4.2726 0.0000 0.0000 65.2709 31.0265 178.8241 133 K 4.0142 7.9334 118.1696 59.1413 32.2483 178.2535 134 S 4.5395 7.9899 112.9520 59.7101 62.8192 174.8714 135 G 4.5157 7.4515 110.0798 43.7971 0.0000 173.4302 136 K 3.8975 9.1370 116.7918 57.2116 30.1867 175.5945 137 G 4.0621 8.4980 107.1915 45.0220 0.0000 174.2260 138 V 4.2725 8.2124 119.9285 60.7654 33.0448 173.9663 139 L 4.6370 8.3377 128.8915 54.5311 43.0596 174.9815 140 I 4.5748 8.2265 126.7335 59.3968 40.1086 174.1018 141 E 4.0608 9.0852 128.5393 54.6907 31.7738 174.4607 142 L 5.1434 8.6714 126.3154 53.5658 44.4579 175.6034 143 T 5.0331 8.8223 117.1620 60.8847 71.4017 171.8573 144 Q 5.2124 8.8706 129.9387 53.3653 31.5295 174.3794 145 Y 5.6293 9.1751 124.2176 56.8408 38.7463 174.2090 146 P 4.1876 0.0000 0.0000 64.2869 31.9291 176.0847 147 K 4.1840 8.6630 121.6183 57.0369 32.9543 175.4315 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 3 N 8.41 4.70 0.00 2.84 2.89 0.00 0.00 5.95 6.77 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 4 E 7.84 4.76 0.00 2.14 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 1.99 2.34 0.00 5 D 9.35 4.53 0.00 2.65 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 6 L 8.24 4.18 0.00 0.65 0.95 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.37 5.17 0.00 2.90 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 8 I 8.85 3.91 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.45 0.86 0.00 0.00 9 C 7.22 4.70 0.00 3.09 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 10 I 8.07 4.21 1.89 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 1.05 0.32 1.12 0.00 0.00 11 D 9.45 4.72 0.00 2.98 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 H 7.91 5.35 0.00 3.37 3.42 0.00 5.46 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 13 V 8.67 4.78 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.02 0.00 0.00 14 A 8.96 4.79 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 15 Y 9.58 5.13 0.00 2.89 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 16 A 8.27 4.84 0.64 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 17 C 8.61 4.88 0.00 2.78 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 0.00 0.00 0.00 0.00 18 P 0.00 4.24 0.00 2.19 2.22 0.00 3.67 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 19 D 7.74 4.50 0.00 2.66 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 20 A 8.55 4.02 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 21 D 8.14 4.29 0.00 2.83 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 22 E 8.81 3.94 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 23 A 7.92 4.18 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 0.00 0.00 0.00 0.00 0.00 24 S 8.43 4.12 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 25 K 8.44 4.13 0.00 2.04 2.15 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.58 7.81 26 Y 8.02 3.92 0.00 3.19 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 27 Y 8.71 3.88 0.00 3.33 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 28 Q 8.24 4.34 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.68 2.71 0.00 29 E 8.11 3.88 0.00 1.87 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 0.00 2.32 2.40 0.00 30 T 7.24 3.79 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 0.56 0.00 0.00 31 F 7.43 4.71 0.00 3.10 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 32 G 7.93 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 0.00 0.00 0.00 33 W 8.71 4.56 0.00 3.70 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 34 H 9.45 5.13 0.00 3.12 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.98 4.72 0.00 2.06 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 2.31 2.38 0.00 36 L 8.97 4.58 0.00 1.57 1.73 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 37 H 7.67 4.64 0.00 3.20 3.08 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.25 5.08 0.00 1.92 1.66 0.00 3.23 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 39 E 9.67 4.78 0.00 1.87 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 2.24 2.33 0.00 40 E 8.81 4.68 0.00 1.91 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 0.00 2.16 2.25 0.00 41 N 9.06 4.79 0.00 2.80 2.76 0.00 0.00 6.74 8.01 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 42 P 0.00 4.21 0.00 2.07 2.13 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 43 E 8.35 4.07 0.00 1.92 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 2.29 2.34 0.00 44 Q 8.13 4.06 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.03 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 45 G 8.24 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 46 V 7.23 5.00 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 0.79 0.00 0.00 0.95 0.00 0.00 47 V 8.76 4.78 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 0.78 0.00 0.00 1.01 0.00 0.00 48 E 9.72 5.25 0.00 1.86 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 0.00 2.19 2.23 0.00 49 I 8.76 4.99 1.86 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 1.22 0.79 0.92 0.00 0.00 50 M 9.21 4.93 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.68 0.00 51 M 9.44 5.55 0.00 2.21 2.03 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.52 0.00 52 A 9.15 4.96 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 53 P 0.00 2.97 0.00 1.71 1.11 0.00 3.31 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 54 A 7.09 4.60 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 55 A 8.22 3.89 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 56 K 7.54 4.53 0.00 1.67 1.69 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.36 7.81 57 L 8.48 4.11 0.00 1.65 1.61 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.02 4.47 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 1.19 0.00 0.00 59 E 8.81 3.77 0.00 1.90 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 2.01 2.26 0.00 60 H 7.96 4.71 0.00 3.11 3.28 0.00 5.95 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 7.74 4.10 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 62 T 8.44 4.60 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 1.35 0.00 0.00 63 Q 8.83 4.92 0.00 2.15 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 64 V 9.28 4.87 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 0.71 0.00 0.00 1.04 0.00 0.00 65 Q 9.09 4.99 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 66 V 8.77 4.62 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 1.00 0.00 0.00 0.80 0.00 0.00 67 M 9.29 5.27 0.00 1.78 1.68 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 68 A 8.85 5.56 1.18 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 0.00 0.00 69 P 0.00 4.86 0.00 2.09 2.14 0.00 3.79 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 1.97 2.00 0.00 70 L 9.00 4.74 0.00 1.50 1.73 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.59 4.74 0.00 2.89 2.85 0.00 0.00 6.28 8.07 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 72 D 8.78 4.50 0.00 2.67 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 73 E 8.61 4.46 0.00 2.09 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 2.26 2.36 0.00 74 S 8.02 4.31 0.00 4.15 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 75 T 8.43 3.89 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 76 V 7.83 3.55 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 1.05 0.00 0.00 0.79 0.00 0.00 77 A 7.94 4.02 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 78 K 7.93 4.02 0.00 1.85 1.90 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.46 7.81 79 W 7.96 4.02 0.00 3.39 3.39 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 80 L 8.64 4.25 0.00 1.99 1.78 0.98 1.53 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 81 A 8.23 4.00 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 82 K 7.62 4.29 0.00 1.71 1.67 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.70 7.81 83 H 7.22 4.54 0.00 2.50 2.76 0.00 5.96 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 84 N 8.71 3.87 0.00 2.83 2.88 0.00 0.00 7.22 7.65 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 85 G 8.28 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 0.00 0.00 0.00 86 R 7.59 4.54 0.00 1.98 1.94 0.00 3.13 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 87 A 8.50 4.30 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 88 G 8.57 4.49 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 0.00 0.00 0.00 89 L 8.96 4.54 0.00 1.68 1.73 0.99 1.12 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 90 H 9.51 4.28 0.00 2.37 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 7.55 4.66 0.00 3.38 3.25 0.00 5.47 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 M 8.22 5.13 0.00 2.16 1.89 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 93 A 8.75 4.97 0.98 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 94 W 8.99 5.27 0.00 2.96 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 95 R 8.99 4.89 0.00 1.90 1.76 0.00 2.69 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.29 0.00 96 V 8.81 4.78 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 0.99 0.00 0.00 1.01 0.00 0.00 97 D 8.76 4.33 0.00 2.59 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 98 D 7.59 4.64 0.00 2.68 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 99 I 8.96 3.73 1.91 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 1.56 1.23 1.02 0.00 0.00 100 D 8.16 4.32 0.00 2.88 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 0.00 101 A 9.71 3.97 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 0.00 102 V 8.17 3.54 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 0.91 0.00 0.00 0.88 0.00 0.00 103 S 8.23 4.15 0.00 4.07 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 0.00 104 A 8.07 3.96 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 0.00 105 T 7.81 3.79 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 1.19 0.00 0.00 106 L 8.17 4.02 0.00 1.75 1.76 1.06 1.19 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 0.00 107 R 8.23 4.06 0.00 2.05 1.99 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 108 E 8.34 3.97 0.00 1.94 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 0.00 2.33 2.36 0.00 109 R 7.48 4.57 0.00 1.99 1.94 0.00 3.34 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 110 G 8.07 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 0.00 111 V 7.87 3.98 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 0.76 0.00 0.00 0.99 0.00 0.00 112 Q 8.60 4.49 0.00 2.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.49 0.00 0.00 0.00 0.00 0.00 2.05 2.27 0.00 113 L 8.32 4.72 0.00 1.57 1.76 0.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.50 4.23 0.00 1.40 1.04 0.33 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 7.56 5.11 0.00 3.24 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 0.00 116 D 8.89 4.60 0.00 2.72 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 0.00 117 E 7.81 4.84 0.00 1.91 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 0.00 2.23 2.25 0.00 118 P 0.00 4.74 0.00 1.97 2.05 0.00 3.66 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 2.21 2.19 0.00 119 K 9.34 4.69 0.00 1.51 1.47 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.54 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.03 0.21 7.81 120 L 8.48 4.39 0.00 1.52 1.59 0.91 0.87 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 0.00 121 G 8.92 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 0.00 0.00 0.00 122 T 8.66 3.81 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 123 G 8.03 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 0.00 124 G 8.51 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 0.00 125 N 7.83 4.59 0.00 2.81 2.83 0.00 0.00 6.92 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 0.00 126 R 8.95 5.03 0.00 1.81 1.89 0.00 3.08 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 127 I 9.10 5.03 1.94 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 1.44 1.19 0.98 0.00 0.00 128 N 8.04 4.97 0.00 2.87 2.66 0.00 0.00 7.41 7.34 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 0.00 129 F 7.93 5.09 0.00 2.72 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 0.00 130 M 8.58 5.03 0.00 1.78 1.94 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 131 H 8.39 4.38 0.00 3.18 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 4.27 0.00 2.14 2.12 0.00 3.51 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 2.07 2.11 0.00 133 K 7.93 4.01 0.00 1.80 1.81 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.48 7.81 134 S 7.99 4.54 0.00 4.13 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 0.00 135 G 7.45 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 0.00 0.00 0.00 0.00 136 K 9.14 3.90 0.00 1.83 1.85 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.42 7.81 137 G 8.50 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.21 4.27 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 0.95 0.00 0.00 0.96 0.00 0.00 139 L 8.34 4.64 0.00 1.79 1.49 0.89 0.77 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 0.00 140 I 8.23 4.57 1.42 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.85 -0.43 0.00 0.00 141 E 9.09 4.06 0.00 1.16 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 1.92 1.60 0.00 142 L 8.67 5.14 0.00 1.60 1.61 0.91 -0.23 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 0.00 143 T 8.82 5.03 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 1.37 0.00 0.00 144 Q 8.87 5.21 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 145 Y 9.18 5.63 0.00 2.81 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 0.00 146 P 0.00 4.19 0.00 2.07 2.10 0.00 3.82 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 2.00 1.93 0.00 147 K 8.66 4.18 0.00 1.93 1.89 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.43 7.81