NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3453 8.3044 118.1920 53.8343 32.4421 176.3875 2 K 3.8266 7.4019 115.1898 55.0537 34.6630 172.5346 3 K 4.1422 8.7309 129.2196 56.7562 34.1196 175.1436 4 V 4.3956 8.5365 127.7690 62.4410 32.2088 175.5013 5 V 4.4581 8.4964 125.9080 62.3468 33.0276 174.9813 6 A 4.3253 7.3625 118.5235 51.7809 22.4287 175.7358 7 V 4.5852 8.5320 123.2791 59.8106 32.4527 174.5021 8 V 4.0511 8.7770 128.2828 60.8722 32.9159 175.1901 9 K 4.9322 8.4125 125.1914 54.8984 33.8671 176.0026 10 L 4.3284 8.2357 123.7507 54.2927 46.1714 173.3117 11 Q 5.0830 8.7298 125.3826 54.2778 30.7257 174.9905 12 L 4.7952 8.8482 123.2246 52.3444 46.6862 173.9105 13 P 4.9371 0.0000 0.0000 61.5452 32.8789 175.5218 14 A 4.0228 8.7549 127.6591 53.9488 18.4435 177.3400 15 G 4.0372 9.0756 111.0509 46.3717 0.0000 173.4305 16 K 4.6093 8.2143 118.7222 55.3970 32.6554 176.0083 17 A 4.4275 8.3032 120.3381 51.0549 19.9795 177.3447 18 T 4.7723 7.8651 110.2571 58.7692 72.5762 172.0769 19 P 4.2388 0.0000 0.0000 65.5912 31.1674 176.5595 20 A 4.2101 7.8918 119.8420 51.1436 18.8248 175.1777 21 P 4.4000 0.0000 0.0000 62.2304 32.0850 176.0789 22 P 4.3169 0.0000 0.0000 65.3224 31.2262 178.9585 23 V 3.4568 7.7492 118.3921 66.2225 31.4131 177.3486 24 G 3.7130 7.8011 104.4808 47.9158 0.0000 173.6131 25 P 4.2059 0.0000 0.0000 64.7650 31.3440 178.7280 26 A 3.9093 7.8825 118.4247 54.5948 18.5102 178.7936 27 L 4.3134 7.9951 116.8184 56.3349 42.6957 179.2395 28 G 3.6358 8.4398 106.2181 47.5773 0.0000 175.2263 29 Q 3.8984 7.5198 121.4235 59.2824 28.9944 177.3394 30 H 4.6905 8.2011 111.3473 54.9802 28.8434 174.8531 31 G 3.9637 7.7748 105.7576 46.4067 0.0000 174.4262 32 A 4.4799 7.7384 121.4874 51.0162 19.4663 178.5759 33 N 4.5542 8.9160 119.5990 53.5812 39.7227 176.0258 34 I 3.6819 8.3411 129.4484 64.6583 37.5966 177.6024 35 M 3.9685 8.1577 118.4478 58.8828 31.9197 177.5785 36 E 4.0722 8.5196 119.0620 59.4759 29.7587 178.6531 37 F 4.2312 8.3555 120.4805 61.2289 39.4260 176.9039 38 V 3.5486 8.0417 118.0920 66.1087 31.1336 177.9472 39 K 3.9497 8.2100 118.8220 59.3789 32.0567 178.6733 40 A 4.1027 8.1785 121.1240 54.8887 18.5823 179.1035 41 F 3.4749 8.4521 120.3806 61.5725 39.0460 177.2263 42 N 4.2858 7.9401 114.1463 56.2378 38.2830 177.0564 43 A 4.0806 7.8438 122.1072 54.9824 18.2265 179.5410 44 A 4.0560 7.8219 118.8098 54.6147 18.4292 178.9607 45 T 4.2708 6.9822 105.2928 61.6347 69.4126 175.7655 46 A 4.1446 7.4297 124.6780 54.5623 18.8546 179.3927 47 N 4.5152 8.0113 112.9675 55.2259 38.1976 175.7476 48 M 4.3278 7.7661 114.8586 55.8399 33.1800 174.7374 49 G 3.7870 8.6531 102.0699 46.7234 0.0000 174.1423 50 D 4.6452 9.3087 123.6816 54.1867 41.0312 173.7771 51 A 4.1518 7.3780 120.4005 51.8361 19.4717 177.0646 52 I 4.0810 7.0321 122.8608 61.1453 38.2661 176.1124 53 V 4.3670 9.0162 125.7527 59.2076 34.1903 173.1919 54 P 4.9849 0.0000 0.0000 62.4333 32.2202 175.9669 55 V 5.1149 9.0727 122.9970 60.3362 35.3688 173.4983 56 E 5.1470 9.4380 123.5711 54.8055 32.0916 174.7747 57 I 4.8479 8.8170 126.4407 60.1201 39.4772 174.8422 58 T 4.7681 9.0869 125.0757 62.2237 70.0587 173.6960 59 I 4.7240 8.4922 128.4922 59.9105 39.7272 175.3543 60 Y 5.0916 8.6948 124.1195 56.1363 40.4477 176.7235 61 A 4.1101 9.0246 123.5101 55.2688 18.4367 178.4866 62 D 4.5153 8.1077 112.7607 53.9587 39.7859 177.3217 63 R 4.1375 8.0873 118.3212 56.3498 28.5237 176.2451 64 S 4.6359 8.3498 115.3175 59.1853 64.1439 173.1245 65 F 5.6279 8.2258 114.9478 55.9652 40.9098 173.1849 66 T 5.1050 9.3443 110.4498 60.1929 72.5306 172.2757 67 F 5.6450 8.2730 115.1105 55.7166 41.1196 173.6770 68 V 4.4888 9.0963 120.9673 61.4871 34.0189 174.1248 69 T 4.7605 8.7039 122.3637 61.4117 68.5840 173.9205 70 K 4.9339 8.6886 128.9198 55.3449 34.6924 175.4811 71 T 4.2550 8.7417 109.7015 63.5124 70.1932 172.8897 72 P 5.0011 0.0000 0.0000 60.9359 32.1388 172.8208 73 P 4.2944 0.0000 0.0000 62.5369 32.0859 176.7177 74 A 4.0776 9.0245 125.0441 55.7153 17.9732 180.0280 75 S 4.1554 8.0873 112.0370 61.5291 63.3219 175.9739 76 Y 4.0721 8.0047 123.1534 60.6977 38.5387 178.1425 77 L 3.9709 8.0410 119.1957 57.5119 41.7370 179.1604 78 I 3.8492 7.8001 120.5531 64.2188 36.8396 178.0927 79 R 4.3303 7.4246 112.9384 56.8752 29.2636 177.6130 80 K 4.0690 7.1829 115.6473 57.3355 32.1613 177.1365 81 A 4.3462 7.8820 122.6356 53.5622 20.2271 178.1395 82 A 4.5991 7.4258 116.2587 50.8694 19.5447 176.9431 83 G 3.7495 7.7271 115.8401 43.3571 0.0000 172.4852 84 L 4.2420 7.4592 119.3286 54.0116 42.9964 176.3265 85 E 3.7330 8.6069 129.3470 55.4122 29.3566 173.4492 86 K 4.1885 8.4754 117.6700 56.4038 33.1951 179.3164 87 G 3.9113 8.2496 113.2434 45.2499 0.0000 172.2094 88 A 4.3743 8.2780 124.4549 52.0985 20.1546 174.6469 89 H 5.2173 8.3265 112.1415 54.2789 32.3894 173.1094 90 K 4.1705 8.7393 118.1283 60.1881 32.8637 176.6830 91 P 4.2734 0.0000 0.0000 65.2855 31.5177 176.9444 92 G 4.3062 8.6040 107.3885 46.1496 0.0000 173.9321 93 R 4.6502 7.5316 129.6044 54.7421 30.5939 174.3750 94 E 4.6564 7.8532 117.5848 54.5189 33.2905 173.5783 95 K 4.7403 8.4306 124.0321 55.0630 34.4495 175.8156 96 V 4.4169 8.0750 119.1309 62.2395 34.4691 174.9938 97 G 4.0314 6.8355 110.9634 45.0006 0.0000 172.0608 98 R 4.5990 8.4613 121.7745 56.3538 31.4856 173.8873 99 I 4.4275 8.2807 112.3005 60.8392 40.6171 172.9408 100 T 4.7102 8.3128 114.7763 61.0483 70.4322 175.1716 101 W 4.8253 9.0878 116.0984 56.9365 27.3433 175.6996 102 E 4.4040 8.1882 118.5169 56.6021 29.8402 176.3317 103 Q 4.2944 8.1425 119.3633 57.2094 30.4837 177.4672 104 V 3.6694 7.7661 117.1406 65.9648 31.6221 177.3745 105 L 4.5475 7.6301 118.6522 54.1980 40.0365 176.2246 106 E 4.7958 8.7404 121.2145 56.1349 37.4300 176.4451 107 I 4.1370 7.5999 116.9007 62.0537 38.0458 176.8542 108 A 4.2135 7.8931 119.8404 54.3206 18.6642 178.6617 109 K 4.0931 7.9676 117.1978 59.0866 32.4346 178.6421 110 Q 4.1800 7.3738 115.3153 58.4369 28.9569 177.4862 111 K 4.4421 7.7624 117.5723 57.1390 32.7357 178.5614 112 M 4.2188 8.0243 119.1644 58.0090 32.7105 177.3785 113 P 4.8435 0.0000 0.0000 62.8165 31.4651 177.0396 114 D 4.3946 8.0294 117.8510 55.0284 41.7580 177.1711 115 L 4.0986 8.2774 130.0163 54.5061 42.7236 175.8954 116 N 4.3472 8.6381 125.9130 53.9934 39.1487 174.5986 117 T 4.4539 8.1371 122.7981 62.8449 71.2346 173.7293 118 T 4.0384 8.6021 124.7013 66.2407 68.7522 175.3722 119 D 4.7275 7.7997 120.3742 53.3537 41.6586 177.3802 120 L 3.8945 8.3720 121.6829 56.9655 42.4944 179.0350 121 E 3.8520 7.8762 119.5714 59.4688 29.6359 178.6894 122 A 4.1346 8.0028 119.7802 54.6665 17.7170 178.9481 123 A 3.9802 7.6402 119.2509 55.3532 18.2961 179.7770 124 A 3.9644 7.6507 118.0726 55.5401 18.7108 179.9472 125 R 3.9907 7.9057 116.2947 59.2747 29.5835 178.5826 126 M 4.1228 7.9538 118.5074 58.3024 32.1606 178.4978 127 I 3.8052 7.3727 120.2331 64.2696 37.1099 178.2482 128 A 4.1980 7.9137 120.7150 54.7660 18.2145 178.8880 129 G 3.9666 7.6517 101.3258 45.2431 0.0000 174.8741 130 S 4.6450 7.5894 117.3865 58.9034 65.4341 174.7653 131 A 4.6225 7.8227 124.0600 51.2988 14.2375 176.3067 132 R 4.6473 7.3204 122.2262 57.3899 37.2066 178.2229 133 S 4.2446 7.7063 110.2679 60.1736 63.1293 174.7350 134 M 4.3368 7.7836 118.8678 55.9574 33.4140 175.9971 135 G 4.2793 7.0878 108.2266 46.9436 0.0000 173.0809 136 V 4.7378 7.6608 117.1625 60.8517 34.7929 174.5221 137 E 4.9156 8.5645 122.6882 54.5840 33.9858 174.9216 138 V 4.8247 8.2604 120.8489 61.2521 34.5681 175.5822 139 V 4.0095 8.3559 126.1920 62.0923 31.2290 174.4626 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 M 8.30 4.35 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 2 K 7.40 3.83 0.00 1.53 1.26 0.00 1.33 0.00 0.00 0.94 0.00 0.00 2.92 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.09 1.34 7.81 3 K 8.73 4.14 0.00 1.93 1.75 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.56 1.48 7.81 4 V 8.54 4.40 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 1.03 0.00 0.00 5 V 8.50 4.46 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 0.86 0.00 0.00 0.97 0.00 0.00 6 A 7.36 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.53 4.59 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 0.76 0.00 0.00 0.91 0.00 0.00 8 V 8.78 4.05 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 0.67 0.00 0.00 0.79 0.00 0.00 9 K 8.41 4.93 0.00 1.63 1.76 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.40 7.81 10 L 8.24 4.33 0.00 1.66 1.38 0.80 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.73 5.08 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.51 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 12 L 8.85 4.80 0.00 1.34 1.21 0.11 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.94 0.00 2.09 1.96 0.00 3.60 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 2.09 2.07 0.00 14 A 8.75 4.02 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 15 G 9.08 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 16 K 8.21 4.61 0.00 1.68 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.41 7.81 17 A 8.30 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.87 4.77 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 19 P 0.00 4.24 0.00 2.23 2.37 0.00 3.73 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 2.07 1.98 0.00 20 A 7.89 4.21 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 21 P 0.00 4.40 0.00 2.01 1.97 0.00 3.65 0.00 0.00 3.68 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 22 P 0.00 4.32 0.00 2.16 2.23 0.00 3.63 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 1.96 1.93 0.00 23 V 7.75 3.46 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 1.11 0.00 0.00 0.86 0.00 0.00 24 G 7.80 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 0.00 0.00 0.00 25 P 0.00 4.21 0.00 2.11 2.06 0.00 3.67 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 2.11 0.00 26 A 7.88 3.91 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 27 L 8.00 4.31 0.00 1.49 1.49 0.11 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.44 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 29 Q 7.52 3.90 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.27 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 30 H 8.20 4.69 0.00 3.11 3.28 0.00 6.10 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.77 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 0.00 0.00 0.00 32 A 7.74 4.48 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 33 N 8.92 4.55 0.00 2.95 3.04 0.00 0.00 7.14 7.94 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 34 I 8.34 3.68 1.89 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 1.46 0.62 0.91 0.00 0.00 35 M 8.16 3.97 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 36 E 8.52 4.07 0.00 2.55 2.55 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 2.60 2.49 0.00 37 F 8.36 4.23 0.00 2.51 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 38 V 8.04 3.55 2.23 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 0.96 0.00 0.00 1.01 0.00 0.00 39 K 8.21 3.95 0.00 2.11 1.85 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.53 7.81 40 A 8.18 4.10 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.45 3.47 0.00 1.51 2.41 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 42 N 7.94 4.29 0.00 2.88 2.87 0.00 0.00 7.09 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 43 A 7.84 4.08 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 44 A 7.82 4.06 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 45 T 6.98 4.27 3.99 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 0.00 0.00 0.48 0.00 0.00 46 A 7.43 4.14 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 47 N 8.01 4.52 0.00 2.83 2.93 0.00 0.00 6.08 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 48 M 7.77 4.33 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 49 G 8.65 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 50 D 9.31 4.65 0.00 2.87 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 51 A 7.38 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.03 4.08 1.63 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 1.27 0.01 0.85 0.00 0.00 53 V 9.02 4.37 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 0.88 0.00 0.00 1.04 0.00 0.00 54 P 0.00 4.98 0.00 2.14 2.03 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 55 V 9.07 5.11 2.42 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 0.90 0.00 0.00 1.30 0.00 0.00 56 E 9.44 5.15 0.00 2.00 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 2.24 2.29 0.00 57 I 8.82 4.85 1.66 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.31 0.82 0.00 0.00 58 T 9.09 4.77 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 0.80 0.00 0.00 59 I 8.49 4.72 1.73 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 1.15 0.81 0.98 0.00 0.00 60 Y 8.69 5.09 0.00 3.12 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 9.02 4.11 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 62 D 8.11 4.52 0.00 2.83 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 63 R 8.09 4.14 0.00 2.11 2.43 0.00 3.34 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.64 0.00 64 S 8.35 4.64 0.00 4.38 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 65 F 8.23 5.63 0.00 3.05 2.99 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 0.00 0.00 0.00 66 T 9.34 5.11 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 1.29 0.00 0.00 67 F 8.27 5.64 0.00 3.35 3.30 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 68 V 9.10 4.49 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 1.07 0.00 0.00 0.96 0.00 0.00 69 T 8.70 4.76 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 1.24 0.00 0.00 70 K 8.69 4.93 0.00 1.85 1.77 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.15 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.43 7.81 71 T 8.74 4.25 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 1.36 0.00 0.00 72 P 0.00 5.00 0.00 2.00 2.02 0.00 3.63 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 1.84 1.99 0.00 73 P 0.00 4.29 0.00 2.29 2.07 0.00 3.56 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 2.11 2.10 0.00 74 A 9.02 4.08 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 75 S 8.09 4.16 0.00 4.10 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.00 4.07 0.00 3.12 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 77 L 8.04 3.97 0.00 1.92 1.72 1.00 1.02 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 78 I 7.80 3.85 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.83 0.91 0.00 0.00 79 R 7.42 4.33 0.00 1.88 2.00 0.00 3.11 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.60 0.00 80 K 7.18 4.07 0.00 1.86 1.75 0.00 1.38 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.09 0.90 7.81 81 A 7.88 4.35 1.27 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 82 A 7.43 4.60 1.19 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 0.00 0.00 0.00 83 G 7.73 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 84 L 7.46 4.24 0.00 1.58 1.60 0.92 1.00 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 85 E 8.61 3.73 0.00 2.11 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 2.19 2.35 0.00 86 K 8.48 4.19 0.00 1.78 1.72 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.46 7.81 87 G 8.25 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 88 A 8.28 4.37 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 89 H 8.33 5.22 0.00 3.05 3.23 0.00 5.90 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.74 4.17 0.00 1.87 1.94 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.47 7.81 91 P 0.00 4.27 0.00 2.08 2.15 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 92 G 8.60 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 0.00 0.00 0.00 0.00 93 R 7.53 4.65 0.00 1.73 1.81 0.00 3.20 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 94 E 7.85 4.66 0.00 1.93 1.66 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 0.00 2.20 2.33 0.00 95 K 8.43 4.74 0.00 1.74 1.69 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.45 7.81 96 V 8.07 4.42 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 0.85 0.00 0.00 0.99 0.00 0.00 97 G 6.84 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 98 R 8.46 4.60 0.00 1.78 1.89 0.00 3.03 0.00 0.00 3.44 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.48 0.00 99 I 8.28 4.43 1.88 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 1.12 0.76 0.91 0.00 0.00 100 T 8.31 4.71 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 101 W 9.09 4.83 0.00 3.60 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 0.00 102 E 8.19 4.40 0.00 1.44 1.70 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 1.99 1.83 0.00 103 Q 8.14 4.29 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 104 V 7.77 3.67 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 1.00 0.00 0.00 0.98 0.00 0.00 105 L 7.63 4.55 0.00 1.54 1.57 0.61 0.73 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 0.00 106 E 8.74 4.80 0.00 1.84 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 2.18 2.34 0.00 107 I 7.60 4.14 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 1.48 1.25 0.92 0.00 0.00 108 A 7.89 4.21 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 0.00 109 K 7.97 4.09 0.00 1.77 1.84 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.53 7.81 110 Q 7.37 4.18 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.38 0.00 0.00 0.00 0.00 0.00 2.61 2.55 0.00 111 K 7.76 4.44 0.00 1.92 1.85 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.40 7.81 112 M 8.02 4.22 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 113 P 0.00 4.84 0.00 2.10 2.06 0.00 3.72 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 2.11 0.00 114 D 8.03 4.39 0.00 2.62 2.49 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 0.00 115 L 8.28 4.10 0.00 1.62 1.62 0.93 0.93 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 0.00 116 N 8.64 4.35 0.00 2.73 2.74 0.00 0.00 7.03 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 0.00 117 T 8.14 4.45 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 1.31 0.00 0.00 118 T 8.60 4.04 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 1.22 0.00 0.00 119 D 7.80 4.73 0.00 2.79 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 0.00 120 L 8.37 3.89 0.00 1.69 1.73 0.93 0.82 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 0.00 121 E 7.88 3.85 0.00 2.12 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 2.32 2.40 0.00 122 A 8.00 4.13 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 0.00 123 A 7.64 3.98 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 0.00 124 A 7.65 3.96 1.49 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 0.00 125 R 7.91 3.99 0.00 1.97 1.95 0.00 3.15 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 126 M 7.95 4.12 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.70 0.00 127 I 7.37 3.81 1.90 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 1.69 1.18 0.93 0.00 0.00 128 A 7.91 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 0.00 129 G 7.65 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 0.00 130 S 7.59 4.64 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 0.00 131 A 7.82 4.62 1.29 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 0.00 132 R 7.32 4.65 0.00 1.84 1.90 0.00 3.13 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 133 S 7.71 4.24 0.00 3.96 3.93 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 0.00 134 M 7.78 4.34 0.00 1.98 2.10 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 2.54 2.59 0.00 135 G 7.09 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 0.00 0.00 0.00 0.00 136 V 7.66 4.74 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 0.86 0.00 0.00 0.94 0.00 0.00 137 E 8.56 4.92 0.00 1.92 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 2.28 2.27 0.00 138 V 8.26 4.82 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 0.95 0.00 0.00 0.98 0.00 0.00 139 V 8.36 4.01 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 0.77 0.00 0.00 0.92 0.00 0.00