NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3978 8.3001 118.1956 55.2986 31.4821 174.6193 2 A 3.6366 8.0347 130.3744 54.9232 19.2556 177.9030 3 A 4.1285 8.9215 119.4295 55.5541 19.3591 177.1915 4 N 4.7024 7.9105 110.5108 53.8398 39.2683 175.3689 5 C 4.5146 7.8384 119.6720 57.6863 32.8860 173.0260 6 I 3.6675 8.0982 123.6310 64.0744 36.8769 177.9774 7 F 4.6149 7.7542 119.1760 60.5599 38.8748 177.2755 8 C 4.2391 8.2225 116.0311 62.6873 27.8914 176.1336 9 K 3.9702 8.0260 120.1249 59.4677 31.7605 179.3740 10 I 3.9058 7.6865 121.2878 63.9866 36.8053 178.5851 11 I 3.7651 7.8738 119.5593 64.1625 37.0706 178.0439 12 K 4.2988 8.1108 116.8029 56.8396 32.1901 177.9563 13 G 3.9579 7.6650 107.1852 45.5059 0.0000 174.3743 14 D 4.5025 8.1012 120.6512 55.7300 41.0457 176.8610 15 I 4.5561 7.4237 119.7462 58.4549 40.2898 173.0839 16 P 4.3953 0.0000 0.0000 62.7682 32.2410 175.2627 17 C 4.3910 7.8978 115.5922 58.2908 34.2309 173.3382 18 A 3.9725 8.7042 130.6362 52.0399 18.2813 176.5963 19 K 4.3075 8.5397 125.3023 55.7482 32.5162 176.7613 20 V 3.7758 8.8664 127.6068 65.3831 31.9874 175.6091 21 A 4.4777 7.4986 119.2144 51.6392 21.5408 174.3960 22 E 4.9459 8.5473 120.0268 55.0368 32.6496 174.3858 23 T 4.7890 8.3633 116.0570 59.3350 71.9268 173.6444 24 S 4.2418 8.8274 114.9723 61.0491 62.8524 175.2170 25 K 4.4601 8.3772 117.5266 55.6877 33.1527 175.0450 26 A 5.1946 7.6670 119.0155 50.4234 23.2146 174.9034 27 L 5.2136 9.1866 120.3230 53.3012 46.2289 175.0945 28 A 5.1541 8.8988 125.7223 50.3430 22.5431 175.0281 29 F 5.0708 7.7594 114.5285 56.0923 41.9523 173.1993 30 M 4.6164 8.7678 118.5151 55.0374 32.8656 175.8882 31 D 4.7230 8.5982 122.1665 53.4345 41.8534 176.5680 32 I 4.1228 8.4613 119.2112 61.8594 38.7985 175.5061 33 N 5.0807 8.3895 118.2986 51.4024 38.4746 172.3981 34 P 4.5309 0.0000 0.0000 62.5294 33.0625 177.4014 35 L 4.3531 8.7354 119.0229 56.4451 42.3631 176.6702 36 S 4.8059 7.5053 111.4450 56.6233 65.4429 173.6144 37 R 3.8567 8.3897 122.3102 57.9655 30.0435 176.7781 38 G 3.9283 8.9897 113.4138 44.9941 0.0000 172.4779 39 H 4.5637 8.0160 121.4556 56.8824 30.8376 174.0972 40 M 5.3218 9.1812 122.0620 53.5556 35.5633 173.8705 41 L 5.1567 8.6476 118.0668 52.7691 45.8958 176.0932 42 V 4.6614 8.6892 122.5925 60.9731 34.2530 174.2969 43 I 5.0362 8.6477 121.5017 58.1269 40.9051 173.2183 44 P 4.8199 0.0000 0.0000 62.8021 31.6063 176.5250 45 K 4.2412 8.8986 122.1941 59.4399 32.6061 177.9246 46 E 4.0093 8.1574 120.0691 56.3480 30.0605 176.6807 47 H 4.1728 8.6625 125.6714 55.2646 28.4082 172.2549 48 A 4.5781 7.6139 126.6991 49.7537 20.6811 178.2511 49 S 4.3542 8.6201 117.6394 60.0522 63.0680 173.6157 50 C 5.0112 7.7311 115.6588 57.2198 32.0511 174.6841 51 L 3.9707 8.9727 123.7078 58.3976 41.7149 178.6470 52 H 4.4628 8.0882 112.0041 57.1261 28.6805 175.4350 53 E 4.3268 7.7536 118.9131 56.3482 29.9664 176.0432 54 L 4.1991 7.5428 122.0537 54.1529 42.9558 177.3621 55 G 3.8239 8.3511 111.1324 44.7429 0.0000 174.8433 56 M 4.0781 8.5262 121.8833 58.3395 32.2021 179.0980 57 E 4.0085 8.1154 118.2365 59.5228 29.6915 178.9950 58 D 4.3945 8.0992 118.2747 57.0723 40.8249 178.5237 59 A 3.9806 8.2428 121.5696 54.8996 18.3764 179.4991 60 A 3.8804 8.0153 119.3449 55.4207 18.4638 179.4195 61 D 4.2257 7.9623 116.2423 57.4223 41.2502 178.6374 62 V 3.5906 8.0429 119.0630 65.7404 31.5031 178.1592 63 G 3.5066 8.2058 105.8078 47.7232 0.0000 175.8527 64 V 3.5000 7.6589 120.6424 65.6835 31.5428 177.9092 65 L 3.9079 7.9754 120.1783 57.8821 41.7594 178.6075 66 L 3.7649 8.1914 120.5848 58.0499 41.8572 178.8781 67 A 3.9467 7.8589 120.6517 55.0047 18.3998 179.8103 68 K 3.8644 8.0940 116.7531 59.5325 32.0742 179.3732 69 A 3.9403 8.2284 121.6513 55.2066 18.1838 179.7358 70 S 3.6036 8.2537 112.9429 61.6274 62.6165 177.0943 71 R 3.8421 7.4369 120.7558 58.7374 29.9295 178.4759 72 A 4.0703 7.6644 120.2186 55.2893 18.2055 179.9631 73 V 3.4189 7.6581 115.4149 65.7664 31.8163 177.8514 74 A 4.3570 8.0482 120.8354 52.8790 18.2145 177.9142 75 G 4.1373 7.7499 103.7516 44.0490 0.0000 172.5651 76 P 4.2341 0.0000 0.0000 64.8504 31.2145 177.3737 77 D 4.6644 8.0870 114.2768 52.4777 39.8912 176.7131 78 G 3.9127 7.8989 107.6255 46.5800 0.0000 174.7214 79 S 4.4496 8.1688 112.9321 58.4697 63.7138 173.7028 80 M 4.3679 7.9851 122.8122 55.4404 32.5666 175.9254 81 Q 4.5710 8.7452 125.0204 55.9795 30.8691 174.0656 82 Y 5.1569 7.4696 116.6403 56.6598 40.6527 172.9400 83 N 5.0757 9.1235 118.1284 51.5227 41.9544 173.6743 84 V 4.9831 8.4396 122.3868 61.2482 33.5558 174.5845 85 L 4.8662 8.9780 129.1812 53.4438 45.6501 174.7145 86 Q 4.6176 8.5940 126.1765 54.5278 31.6804 173.4777 87 N 4.9140 8.6741 123.5433 51.6470 40.6861 174.6678 88 N 4.8426 8.6260 118.8395 53.6313 40.3184 174.0446 89 G 4.1386 9.3974 111.7890 44.6272 0.0000 173.4209 90 S 4.5108 8.6395 115.4584 60.0841 63.5278 176.3320 91 L 3.8600 7.9341 121.9481 57.4635 41.9882 176.8441 92 A 4.4560 7.7841 119.4484 52.2107 18.6245 176.7690 93 H 4.1336 7.8543 112.5055 57.4717 26.6933 174.6261 94 Q 4.2191 8.1837 121.9856 55.8261 29.3410 174.8708 95 E 4.3071 8.7071 125.2572 57.7855 31.1993 175.6802 96 V 3.7690 7.5485 117.8566 61.8039 32.6475 174.9662 97 P 4.6997 0.0000 0.0000 62.0468 30.7030 175.5884 98 H 5.0193 7.7813 116.0234 54.9705 33.3507 172.4493 99 V 3.8288 8.5205 127.6750 63.9340 31.8272 175.0062 100 H 4.9999 8.3609 122.4737 54.2282 31.5406 172.5345 101 F 4.5546 9.2856 122.4595 56.6311 40.4692 174.7528 102 H 4.9423 9.4064 122.4931 55.4580 30.4249 174.6146 103 I 4.8623 9.0549 124.2305 59.8638 39.5215 174.8288 104 I 4.6208 8.8649 129.7332 58.4848 39.3099 173.8454 105 P 4.6869 0.0000 0.0000 62.9523 31.9775 176.7517 106 K 4.4125 8.9525 126.3338 55.1282 31.6420 175.2573 107 T 4.2032 8.4161 120.3484 63.2390 67.7993 174.0954 108 D 4.7391 7.5099 118.8804 52.7165 44.1687 175.5122 109 E 3.9671 9.0008 127.0188 59.9108 29.5813 178.9765 110 K 4.2916 8.1645 117.9756 55.2027 32.1554 178.2895 111 T 4.6839 7.0887 105.6881 61.3060 72.1181 173.9962 112 G 3.7996 8.1867 108.7961 44.6546 0.0000 172.4537 113 L 4.1032 8.3933 121.1182 54.6865 42.6868 177.1934 114 K 4.6165 8.5797 124.9620 54.5656 34.2481 175.4502 115 I 4.5476 8.4055 124.2263 59.2872 39.9457 175.0060 116 G 4.0881 8.7085 113.6252 43.9550 0.0000 173.8897 117 W 4.3327 8.6542 135.0000 55.1469 30.2352 172.6846 118 D 4.7937 7.7122 118.5744 52.0825 41.4809 176.7370 119 T 4.1212 8.2057 114.4812 61.0902 69.9389 174.2016 120 V 4.4443 7.8914 117.0506 59.7804 34.9831 176.2507 121 K 4.2854 8.3891 123.3425 54.0581 32.3893 177.7444 122 V 4.4311 8.0775 122.4163 59.6675 34.5400 175.5293 123 A 4.4080 8.4816 127.5992 51.1414 20.7135 179.0451 124 S 4.0694 8.5170 116.8548 61.6997 63.0399 176.5042 125 D 4.3373 8.0819 122.4920 56.2997 38.9738 178.3788 126 E 3.9431 8.0739 119.4549 58.9824 29.5453 179.1033 127 L 3.9219 8.0137 118.9179 57.6228 41.5612 179.4873 128 A 3.9568 7.9736 120.8426 54.8647 18.3510 179.1580 129 E 3.7984 8.0072 117.7562 59.7317 29.6801 178.8953 130 D 3.9735 8.0854 118.5568 57.1139 40.7752 178.7142 131 A 3.9351 7.9851 121.3407 54.7769 18.3702 179.6495 132 K 3.8571 8.2050 118.3283 59.5865 32.3135 178.9704 133 R 3.8967 7.9118 118.8529 59.7333 29.9550 177.9723 134 Y 4.3661 8.1271 116.8041 61.3080 37.8805 178.9660 135 S 4.1836 8.3689 115.1571 61.4801 62.7321 176.3529 136 E 3.9807 8.4256 122.0208 59.0373 28.9755 179.0911 137 A 4.0843 8.0267 119.8974 55.3560 18.8502 179.5043 138 I 3.8301 8.1774 118.3354 64.3420 36.9724 178.4250 139 A 4.1032 8.3487 121.5190 54.3873 18.1888 178.7292 140 K 4.3727 7.3380 113.5009 57.0488 33.0857 176.8940 141 I 3.9821 7.4970 126.0452 61.9405 37.1425 175.5636 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 4.40 0.00 2.14 2.17 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 2.48 2.56 0.00 2 A 8.03 3.64 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 3 A 8.92 4.13 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 4 N 7.91 4.70 0.00 2.70 2.81 0.00 0.00 6.71 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 5 C 7.84 4.51 0.00 3.23 3.01 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 6 I 8.10 3.67 1.71 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.20 0.79 0.00 0.00 7 F 7.75 4.61 0.00 2.93 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 8 C 8.22 4.24 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.03 3.97 0.00 1.99 1.83 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.63 7.81 10 I 7.69 3.91 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.70 0.55 0.00 0.00 11 I 7.87 3.77 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.63 0.96 0.00 0.00 12 K 8.11 4.30 0.00 2.08 1.86 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.32 7.81 13 G 7.67 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 14 D 8.10 4.50 0.00 2.76 2.72 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 15 I 7.42 4.56 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.92 0.85 0.00 0.00 16 P 0.00 4.40 0.00 2.14 2.01 0.00 3.76 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 17 C 7.90 4.39 0.00 2.68 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 18 A 8.70 3.97 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 19 K 8.54 4.31 0.00 1.75 1.76 0.00 2.02 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 20 V 8.87 3.78 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 0.78 0.00 0.00 0.97 0.00 0.00 21 A 7.50 4.48 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 22 E 8.55 4.95 0.00 1.90 1.79 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 2.20 2.31 0.00 23 T 8.36 4.79 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 1.19 0.00 0.00 24 S 8.83 4.24 0.00 4.00 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 8.38 4.46 0.00 2.00 1.84 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.49 7.81 26 A 7.67 5.19 1.21 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 0.00 0.00 0.00 27 L 9.19 5.21 0.00 1.76 1.56 0.97 1.26 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 28 A 8.90 5.15 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 29 F 7.76 5.07 0.00 3.21 3.21 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 0.00 30 M 8.77 4.62 0.00 1.98 2.12 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 2.64 2.54 0.00 31 D 8.60 4.72 0.00 2.52 2.40 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 32 I 8.46 4.12 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.76 0.96 0.00 0.00 33 N 8.39 5.08 0.00 2.71 2.80 0.00 0.00 6.96 8.88 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 34 P 0.00 4.53 0.00 2.46 2.08 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 35 L 8.74 4.35 0.00 1.77 1.77 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.51 4.81 0.00 3.98 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 37 R 8.39 3.86 0.00 1.79 1.91 0.00 3.30 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 38 G 8.99 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 0.00 0.00 0.00 39 H 8.02 4.56 0.00 3.34 3.21 0.00 5.55 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 40 M 9.18 5.32 0.00 2.07 2.15 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 2.40 2.44 0.00 41 L 8.65 5.16 0.00 0.56 0.97 1.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.69 4.66 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 0.98 0.00 0.00 0.81 0.00 0.00 43 I 8.65 5.04 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.18 0.33 0.00 0.00 44 P 0.00 4.82 0.00 2.14 2.14 0.00 4.09 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 2.16 2.05 0.00 45 K 8.90 4.24 0.00 1.76 1.96 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.43 7.81 46 E 8.16 4.01 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 47 H 8.66 4.17 0.00 3.17 3.25 0.00 5.95 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 48 A 7.61 4.58 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 49 S 8.62 4.35 0.00 3.82 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 50 C 7.73 5.01 0.00 2.71 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 51 L 8.97 3.97 0.00 1.81 1.67 1.09 1.55 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 52 H 8.09 4.46 0.00 3.26 3.39 0.00 5.76 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 7.75 4.33 0.00 2.05 1.97 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 2.23 1.97 0.00 54 L 7.54 4.20 0.00 1.71 1.65 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.35 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 0.00 0.00 0.00 0.00 56 M 8.53 4.08 0.00 2.12 2.13 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 2.69 2.70 0.00 57 E 8.12 4.01 0.00 2.05 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 2.40 2.46 0.00 58 D 8.10 4.39 0.00 2.94 2.73 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 59 A 8.24 3.98 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 60 A 8.02 3.88 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 61 D 7.96 4.23 0.00 2.94 2.66 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 0.00 0.00 0.00 62 V 8.04 3.59 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 0.96 0.00 0.00 63 G 8.21 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.66 3.50 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 0.95 0.00 0.00 0.94 0.00 0.00 65 L 7.98 3.91 0.00 1.82 1.55 0.87 0.35 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 66 L 8.19 3.76 0.00 1.57 1.61 0.78 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.86 3.95 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 68 K 8.09 3.86 0.00 1.92 1.82 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.61 7.81 69 A 8.23 3.94 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 70 S 8.25 3.60 0.00 3.95 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.44 3.84 0.00 1.90 2.00 0.00 3.25 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 72 A 7.66 4.07 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 73 V 7.66 3.42 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 0.57 0.00 0.00 0.78 0.00 0.00 74 A 8.05 4.36 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 7.75 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 0.00 0.00 0.00 76 P 0.00 4.23 0.00 2.05 2.13 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 77 D 8.09 4.66 0.00 2.76 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 78 G 7.90 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 79 S 8.17 4.45 0.00 4.02 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 80 M 7.99 4.37 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.68 0.00 81 Q 8.75 4.57 0.00 2.21 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 82 Y 7.47 5.16 0.00 2.96 2.84 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 83 N 9.12 5.08 0.00 2.72 2.74 0.00 0.00 6.81 8.36 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 84 V 8.44 4.98 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 1.04 0.00 0.00 1.11 0.00 0.00 85 L 8.98 4.87 0.00 1.79 1.46 0.97 0.17 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 86 Q 8.59 4.62 0.00 1.08 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.50 0.00 0.00 0.00 0.00 0.00 1.74 1.16 0.00 87 N 8.67 4.91 0.00 2.70 2.83 0.00 0.00 6.91 8.00 0.00 0.00 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 N 8.63 4.84 0.00 2.63 2.72 0.00 0.00 7.23 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 89 G 9.40 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 0.00 0.00 0.00 90 S 8.64 4.51 0.00 4.01 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 91 L 7.93 3.86 0.00 1.59 1.72 0.89 0.98 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 92 A 7.78 4.46 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 93 H 7.85 4.13 0.00 3.37 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Q 8.18 4.22 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.61 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 95 E 8.71 4.31 0.00 2.00 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 0.00 2.20 2.28 0.00 96 V 7.55 3.77 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 0.52 0.00 0.00 0.58 0.00 0.00 97 P 0.00 4.70 0.00 2.31 2.25 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.97 0.00 98 H 7.78 5.02 0.00 3.21 3.44 0.00 5.77 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.52 3.83 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 0.80 0.00 0.00 0.92 0.00 0.00 100 H 8.36 5.00 0.00 2.91 2.90 0.00 5.57 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.29 4.55 0.00 3.04 3.03 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 0.00 102 H 9.41 4.94 0.00 3.14 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 9.05 4.86 1.82 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 1.17 0.96 0.79 0.00 0.00 104 I 8.86 4.62 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.73 0.83 0.00 0.00 105 P 0.00 4.69 0.00 1.96 2.03 0.00 3.65 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 2.20 2.09 0.00 106 K 8.95 4.41 0.00 1.68 1.71 0.00 1.78 0.00 0.00 1.63 0.00 0.00 3.21 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.32 1.38 7.81 107 T 8.42 4.20 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 108 D 7.51 4.74 0.00 2.67 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 0.00 109 E 9.00 3.97 0.00 2.00 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 2.31 2.31 0.00 110 K 8.16 4.29 0.00 1.80 1.70 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.24 7.81 111 T 7.09 4.68 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 1.22 0.00 0.00 112 G 8.19 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.39 4.10 0.00 1.59 1.74 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.58 4.62 0.00 1.76 1.70 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.61 7.81 115 I 8.41 4.55 1.94 0.00 0.00 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 1.44 0.66 1.21 0.00 0.00 116 G 8.71 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.65 4.33 0.00 3.40 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 7.71 4.79 0.00 2.62 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 0.00 119 T 8.21 4.12 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 1.25 0.00 0.00 120 V 7.89 4.44 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.88 0.00 0.00 121 K 8.39 4.29 0.00 1.77 1.60 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.35 0.99 7.81 122 V 8.08 4.43 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 0.91 0.00 0.00 123 A 8.48 4.41 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 0.00 124 S 8.52 4.07 0.00 4.05 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 0.00 125 D 8.08 4.34 0.00 2.87 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 0.00 126 E 8.07 3.94 0.00 2.15 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 2.37 2.37 0.00 127 L 8.01 3.92 0.00 1.87 1.69 0.92 0.62 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 0.00 128 A 7.97 3.96 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 E 8.01 3.80 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 130 D 8.09 3.97 0.00 2.45 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 0.00 0.00 0.00 131 A 7.99 3.94 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 0.00 132 K 8.20 3.86 0.00 1.88 1.94 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 133 R 7.91 3.90 0.00 1.90 1.95 0.00 3.20 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 1.77 1.74 0.00 134 Y 8.13 4.37 0.00 3.09 2.91 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 0.00 135 S 8.37 4.18 0.00 4.09 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 0.00 136 E 8.43 3.98 0.00 2.15 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 2.34 2.45 0.00 137 A 8.03 4.08 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 0.00 138 I 8.18 3.83 1.89 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 1.43 0.97 0.92 0.00 0.00 139 A 8.35 4.10 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 0.00 140 K 7.34 4.37 0.00 1.97 1.92 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.69 1.47 7.81 141 I 7.50 3.98 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.74 0.92 0.00 0.00