NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3762 8.2893 120.3493 55.4584 32.1108 173.7210 2 N 4.4826 8.0315 120.2475 50.3050 38.0216 171.4055 3 E 3.9659 9.3649 125.3545 56.9429 29.3823 178.4650 4 L 4.4201 8.1555 124.8210 53.3382 40.6421 176.0023 5 E 4.5257 8.0105 123.2583 53.5448 32.0770 175.7979 6 G 3.7802 8.1455 112.4770 45.2523 0.0000 172.1974 7 Y 4.7532 9.0057 117.4988 56.0925 40.1394 176.8413 8 V 4.0728 8.5789 123.7935 63.5103 32.5482 177.5867 9 T 4.2112 8.1735 117.2970 66.1341 68.8052 174.9998 10 K 4.3928 7.9526 119.9454 56.6658 32.4639 177.3172 11 A 4.3326 8.1270 123.8790 53.6918 19.1259 182.1002 12 Q 3.5758 7.6334 111.3528 58.1320 31.4359 180.1519 13 S 4.0869 7.9994 110.9630 59.9653 63.1768 174.3212 14 F 4.2599 8.5514 119.7708 56.5008 39.9164 174.5092 15 R 4.5705 8.3685 121.8273 54.7124 32.1238 174.3829 16 F 5.7965 8.9735 122.8852 54.7269 43.8961 173.5376 17 A 4.7233 8.3254 120.1359 50.5054 22.4871 175.0009 18 I 4.8283 8.8743 122.7287 59.4371 40.4131 174.9771 19 V 4.5819 8.6288 125.6689 61.1864 34.3238 174.6078 20 V 5.2817 8.7486 120.6358 58.3579 35.3105 174.6483 21 A 5.7032 8.4198 125.3859 50.5296 19.7146 177.8202 22 R 4.2770 8.9515 121.5081 58.8338 30.7257 176.6884 23 F 4.1082 8.3040 119.9126 59.7695 39.8535 174.1698 24 N 4.3285 8.4547 123.1517 54.3602 36.2972 176.0708 25 E 4.5116 8.0467 121.4939 59.3259 29.4018 177.6281 26 F 4.0006 8.3503 118.6633 60.9618 39.4376 176.3942 27 V 4.1339 8.4534 117.1338 65.0277 32.0890 177.5149 28 T 3.8537 8.0171 109.0879 65.1501 68.2569 175.2923 29 R 4.0595 8.5073 122.1259 59.3313 29.9629 178.1682 30 R 3.8185 7.9617 116.7441 59.2856 30.1418 178.2142 31 L 3.8496 8.2414 120.1863 58.6057 41.9717 178.7078 32 M 3.8536 8.6451 117.9521 58.8378 32.1572 177.6511 33 E 4.0891 8.6911 119.1637 59.6125 29.5530 179.8891 34 G 3.4933 8.4070 105.4763 47.6975 0.0000 175.3184 35 A 3.6601 7.7701 124.0444 54.8644 18.4815 178.8305 36 L 4.0639 8.3040 118.6853 58.6467 41.9622 178.3093 37 D 4.4115 8.5595 117.6318 58.1262 41.1286 178.8421 38 T 3.8710 7.9936 115.9260 66.9042 68.1977 176.0924 39 F 4.3325 7.5911 118.0499 60.7633 39.2417 177.4499 40 K 4.1805 8.1646 117.2025 59.6896 31.7612 179.0961 41 K 3.8257 8.5918 118.6249 59.1953 32.6372 176.8974 42 Y 4.3435 8.6563 117.7503 58.4220 38.3871 176.0699 43 S 3.7904 8.2387 111.2342 58.8324 63.5009 172.8443 44 V 3.9748 7.8270 120.2209 62.0794 31.7253 175.7780 45 N 4.7196 8.2991 120.8141 53.6905 40.5503 174.0372 46 E 4.5023 9.0442 126.0975 56.5191 30.7869 174.6557 47 D 4.2871 8.8971 114.0462 59.6898 40.1090 173.9556 48 I 3.5744 6.4981 109.4907 58.5032 39.4217 174.5407 49 D 4.6424 8.7757 124.5619 54.0482 42.2156 175.4215 50 V 4.6460 8.3726 116.4143 59.5789 33.9604 175.0427 51 V 4.2843 8.8518 126.7616 60.9404 33.3485 174.4097 52 W 5.1672 8.8482 128.0896 55.8884 30.3531 176.1733 53 V 4.7098 9.1489 117.9916 58.8736 34.8477 174.8217 54 P 4.3539 0.0000 0.0000 65.5198 31.9999 176.3888 55 G 4.5213 8.2027 108.6201 42.3875 0.0000 173.1298 56 A 3.9431 8.6580 122.9068 55.3921 18.3933 179.4269 57 Y 3.9180 8.3480 116.0205 61.1978 38.6512 178.1659 58 E 4.1303 8.6872 119.2257 59.4869 29.5267 179.4037 59 L 3.9603 7.8141 119.2377 58.6776 41.7321 179.0349 60 G 3.6688 7.8495 101.1739 49.3522 0.0000 175.5992 61 V 3.6619 7.7231 111.9821 63.8987 32.1448 178.5675 62 T 3.8364 7.7464 114.7194 66.6804 68.2910 176.2870 63 A 3.8839 8.5934 122.5992 55.6520 18.4110 179.3915 64 Q 3.8110 8.4502 118.1442 60.0274 29.2437 178.7482 65 A 4.0075 8.8769 122.0715 54.6397 18.0648 179.1178 66 L 4.1383 8.2217 117.9329 57.8015 42.3760 180.2308 67 G 3.8160 8.8719 105.5854 47.9804 0.0000 176.0617 68 K 4.1686 8.1333 120.2582 58.3355 32.3815 179.0016 69 S 4.3465 8.3750 114.2299 58.7388 62.6521 175.1846 70 G 3.9444 7.9319 109.4834 46.2907 0.0000 174.7224 71 K 3.8133 7.8042 119.3783 58.0869 32.2310 176.9152 72 Y 4.7875 7.3997 114.2230 56.5507 40.3714 174.9659 73 H 4.8063 9.0499 118.5663 57.5730 29.9974 175.7538 74 A 4.9495 7.8659 118.0798 50.7232 22.6675 175.0986 75 I 4.8816 8.8450 115.6020 58.9326 40.7368 174.6506 76 V 4.6260 8.8419 125.7137 60.1161 33.8739 174.1281 77 C 5.0734 9.1300 122.8921 57.9067 30.6044 172.8122 78 L 5.5353 8.0694 123.5447 52.0972 44.9140 175.8129 79 G 4.3303 8.0631 107.3325 46.4101 0.0000 171.8931 80 A 5.1715 8.5321 121.3448 50.5860 22.1646 176.2677 81 V 4.2781 9.2094 123.1834 59.9254 33.6362 175.2079 82 V 4.2972 8.4655 119.4528 60.5393 32.6355 177.6712 83 K 3.5993 8.4874 127.2296 56.7250 29.2114 177.0108 84 G 3.7950 8.5640 113.3270 47.3100 0.0000 171.5795 85 D 4.6348 7.9024 116.8376 54.5917 43.2610 177.6924 86 T 4.2673 8.5627 115.7102 61.3570 70.7635 176.0499 87 S 4.9317 8.5421 116.9017 60.0811 62.6073 175.2095 88 H 3.8917 7.9671 122.9883 60.1756 29.4231 175.2919 89 Y 4.1598 8.2044 120.4046 61.4600 38.5472 177.6968 90 D 4.1864 8.5044 118.0984 57.9864 41.0461 178.7540 91 A 3.8683 8.3317 120.2396 55.8609 18.3366 179.4778 92 V 3.6164 8.3231 115.7829 66.0210 31.6074 178.2707 93 V 3.4908 8.0431 117.9940 66.4761 31.1946 177.7405 94 N 4.2478 8.8291 116.3255 56.2619 38.3362 177.1989 95 S 3.9794 8.2277 116.1056 62.1784 63.0164 176.3787 96 A 3.9411 8.6513 123.7555 55.4163 17.9742 179.1196 97 S 4.2167 8.7667 110.3059 61.7609 62.5201 176.5653 98 S 4.1099 8.9195 116.2581 61.6135 62.0973 176.1862 99 G 3.6526 8.5475 108.5596 48.1997 0.0000 175.3707 100 V 3.6648 7.9061 121.1406 65.8449 31.4488 177.3587 101 L 3.9379 8.1967 119.9762 57.5935 41.7731 178.7714 102 S 4.0738 8.7939 114.8131 61.9973 63.0777 176.5627 103 A 4.1464 8.6160 123.3090 55.3618 18.0315 179.5154 104 G 4.2933 8.2754 103.0955 47.8319 0.0000 175.4971 105 L 4.0270 7.8355 120.1194 57.6067 41.8062 179.0408 106 N 4.5030 8.6795 115.7612 56.4383 38.6148 177.3836 107 S 4.3869 8.6586 114.6924 58.9983 63.3500 175.3922 108 G 3.9754 8.0522 109.2438 45.6505 0.0000 172.8048 109 V 4.5560 7.7997 119.9619 59.8213 34.3918 173.1909 110 P 4.5448 0.0000 0.0000 63.2756 32.3126 174.7787 111 C 5.2233 8.5872 122.3236 57.8056 30.6418 173.8150 112 V 3.7415 8.8208 125.9134 62.5552 32.3350 175.3700 113 F 4.5177 8.9942 131.5324 56.4358 37.9190 175.5194 114 G 4.1808 8.7411 118.5371 44.0699 0.0000 170.6913 115 V 4.8183 6.3669 116.9558 59.5905 34.4323 177.3258 116 L 4.4127 8.8487 125.8309 54.1587 42.8956 177.1894 117 T 5.3188 7.9375 112.3580 60.3411 68.2243 173.1323 118 C 4.3021 8.1597 119.2498 60.4237 30.2253 174.6721 119 D 4.4995 9.0025 120.0832 56.0356 39.6300 176.7108 120 N 4.7312 9.5972 116.4137 51.8632 39.4550 175.7767 121 M 3.9675 8.8336 119.7517 59.2174 32.1797 177.8198 122 D 4.3643 8.2265 117.2558 57.7799 41.0204 178.1390 123 Q 3.9950 8.7333 116.8403 59.0063 29.0365 178.6237 124 A 4.1603 7.7284 120.7507 55.5469 18.3526 179.4499 125 I 3.7680 8.0715 118.2091 65.1705 37.2115 178.2884 126 N 4.4230 8.1493 116.7329 56.1607 38.3977 177.5316 127 R 4.0409 8.7177 119.2174 57.5740 30.8686 176.8307 128 A 4.4597 7.5597 123.7014 51.4871 18.3010 177.4949 129 G 3.9204 9.0078 105.9836 45.8537 0.0000 173.9584 130 G 4.2278 7.8069 111.0968 44.0330 0.0000 175.4044 131 K 4.1517 8.2819 120.0001 58.2281 32.5609 177.2450 132 A 4.4667 7.9816 121.5728 51.7930 20.0441 178.5412 133 G 3.7315 8.7398 105.0620 45.3162 0.0000 172.8917 134 N 5.7905 8.0285 119.2554 49.9800 41.4841 175.5446 135 K 4.1350 8.1784 131.2531 58.9566 32.3200 177.9832 136 G 3.7238 8.2314 104.9475 48.0961 0.0000 174.8391 137 A 3.7690 8.4373 123.4921 54.5900 17.9867 179.2559 138 E 3.7355 8.0459 116.7940 59.8674 29.0805 179.8578 139 S 4.0187 8.5250 114.8388 61.5223 62.8231 176.5208 140 A 3.3902 7.5505 123.0989 54.8463 17.9319 179.0269 141 L 3.3582 7.4567 118.5162 58.6843 42.0261 179.4657 142 T 3.6730 8.0210 115.3314 66.4282 68.2809 176.0805 143 A 3.8987 8.0279 123.0331 55.8418 18.2334 179.1532 144 I 3.6337 7.5785 117.7384 64.6587 37.1562 177.7646 145 E 3.8287 8.4035 119.4634 59.9399 29.4285 179.3993 146 M 3.8223 8.4405 118.2805 58.3745 31.7937 178.1579 147 A 3.8486 7.8322 119.6146 55.3095 18.7988 178.9139 148 S 4.2175 7.9142 110.9190 61.6025 62.3486 176.1893 149 L 4.0058 8.4129 122.9324 58.6749 41.7778 179.0109 150 F 4.4202 8.8768 117.4467 59.2600 39.8639 174.7814 151 E 5.1827 7.9826 118.1874 52.7917 28.6870 173.9415 152 H 4.9336 7.8234 129.5371 56.8700 32.1420 174.6740 153 H 4.4720 9.0269 113.8500 57.1934 28.9564 175.0149 154 L 3.9610 7.2277 120.3092 52.9986 42.0702 173.9601 155 K 4.1207 7.5138 121.1111 56.8147 32.7357 176.0538 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 8.29 4.38 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 N 8.03 4.48 0.00 2.90 2.78 0.00 0.00 6.34 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 3 E 9.36 3.97 0.00 1.97 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 2.31 2.33 0.00 4 L 8.16 4.42 0.00 1.68 1.83 0.96 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 5 E 8.01 4.53 0.00 1.79 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 6 G 8.15 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 9.01 4.75 0.00 2.99 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 V 8.58 4.07 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 0.97 0.00 0.00 0.89 0.00 0.00 9 T 8.17 4.21 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 1.25 0.00 0.00 10 K 7.95 4.39 0.00 1.95 1.89 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.35 0.00 0.00 3.59 0.00 0.00 0.00 0.00 1.61 1.85 7.81 11 A 8.13 4.33 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 7.63 3.58 0.00 2.31 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 13 S 8.00 4.09 0.00 3.61 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 14 F 8.55 4.26 0.00 2.67 2.30 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 15 R 8.37 4.57 0.00 1.82 1.63 0.00 3.10 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.75 0.00 16 F 8.97 5.80 0.00 2.48 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 17 A 8.33 4.72 0.14 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 18 I 8.87 4.83 1.75 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 1.18 0.88 0.74 0.00 0.00 19 V 8.63 4.58 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 0.96 0.00 0.00 0.81 0.00 0.00 20 V 8.75 5.28 1.72 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 0.61 0.00 0.00 -0.62 0.00 0.00 21 A 8.42 5.70 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 22 R 8.95 4.28 0.00 2.01 2.15 0.00 3.14 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.40 0.00 23 F 8.30 4.11 0.00 3.31 2.97 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 24 N 8.45 4.33 0.00 3.25 3.06 0.00 0.00 6.72 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 25 E 8.05 4.51 0.00 2.30 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 0.00 2.36 2.28 0.00 26 F 8.35 4.00 0.00 3.10 3.14 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 27 V 8.45 4.13 2.29 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 0.95 0.00 0.00 1.16 0.00 0.00 28 T 8.02 3.85 4.35 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 1.34 0.00 0.00 29 R 8.51 4.06 0.00 2.18 1.99 0.00 3.33 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 30 R 7.96 3.82 0.00 2.06 1.93 0.00 3.25 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 31 L 8.24 3.85 0.00 1.87 1.71 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 M 8.65 3.85 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.61 0.00 33 E 8.69 4.09 0.00 2.15 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 2.36 2.59 0.00 34 G 8.41 3.49 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 35 A 7.77 3.66 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 36 L 8.30 4.06 0.00 1.99 1.71 1.02 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.56 4.41 0.00 2.80 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 38 T 7.99 3.87 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 0.81 0.00 0.00 39 F 7.59 4.33 0.00 3.35 3.06 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 40 K 8.16 4.18 0.00 2.01 1.94 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.68 7.81 41 K 8.59 3.83 0.00 2.06 2.30 0.00 1.96 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.49 7.81 42 Y 8.66 4.34 0.00 3.30 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 43 S 8.24 3.79 0.00 4.13 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 44 V 7.83 3.97 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 0.88 0.00 0.00 1.29 0.00 0.00 45 N 8.30 4.72 0.00 2.75 2.75 0.00 0.00 6.94 7.53 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 46 E 9.04 4.50 0.00 1.92 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 47 D 8.90 4.29 0.00 2.78 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 6.50 3.57 1.72 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 1.41 1.55 0.51 0.00 0.00 49 D 8.78 4.64 0.00 2.62 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 50 V 8.37 4.65 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 0.61 0.00 0.00 0.92 0.00 0.00 51 V 8.85 4.28 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 1.07 0.00 0.00 0.86 0.00 0.00 52 W 8.85 5.17 0.00 3.24 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 9.15 4.71 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 0.78 0.00 0.00 1.11 0.00 0.00 54 P 0.00 4.35 0.00 2.21 2.38 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 55 G 8.20 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 56 A 8.66 3.94 1.26 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 0.00 0.00 57 Y 8.35 3.92 0.00 3.01 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 58 E 8.69 4.13 0.00 2.41 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 0.00 2.42 2.50 0.00 59 L 7.81 3.96 0.00 1.75 1.68 0.83 0.76 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 60 G 7.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.72 3.66 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 0.85 0.00 0.00 0.99 0.00 0.00 62 T 7.75 3.84 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 63 A 8.59 3.88 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 64 Q 8.45 3.81 0.00 2.20 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 65 A 8.88 4.01 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 66 L 8.22 4.14 0.00 1.74 1.69 0.70 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.87 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 68 K 8.13 4.17 0.00 1.96 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.48 7.81 69 S 8.38 4.35 0.00 4.08 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 70 G 7.93 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 71 K 7.80 3.81 0.00 0.79 1.21 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.38 7.81 72 Y 7.40 4.79 0.00 2.93 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 H 9.05 4.81 0.00 2.83 3.45 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.87 4.95 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 75 I 8.84 4.88 1.78 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 1.52 0.77 0.00 0.00 76 V 8.84 4.63 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 0.91 0.00 0.00 0.83 0.00 0.00 77 C 9.13 5.07 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.07 5.54 0.00 1.39 1.40 0.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.06 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 0.00 0.00 0.00 0.00 80 A 8.53 5.17 1.26 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 0.00 0.00 81 V 9.21 4.28 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 0.87 0.00 0.00 0.87 0.00 0.00 82 V 8.47 4.30 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 0.76 0.00 0.00 1.06 0.00 0.00 83 K 8.49 3.60 0.00 0.79 1.33 0.00 0.87 0.00 0.00 1.52 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.08 0.64 7.81 84 G 8.56 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 85 D 7.90 4.63 0.00 2.63 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 86 T 8.56 4.27 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 1.24 0.00 0.00 87 S 8.54 4.93 0.00 4.29 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 0.00 88 H 7.97 3.89 0.00 3.25 3.43 0.00 5.62 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 89 Y 8.20 4.16 0.00 3.12 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 90 D 8.50 4.19 0.00 2.91 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 91 A 8.33 3.87 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 92 V 8.32 3.62 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 0.94 0.00 0.00 1.03 0.00 0.00 93 V 8.04 3.49 1.89 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 0.90 0.00 0.00 0.16 0.00 0.00 94 N 8.83 4.25 0.00 2.85 2.78 0.00 0.00 7.06 7.22 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 95 S 8.23 3.98 0.00 3.73 3.06 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 96 A 8.65 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 97 S 8.77 4.22 0.00 3.72 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 98 S 8.92 4.11 0.00 3.81 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 99 G 8.55 3.65 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 0.00 0.00 0.00 100 V 7.91 3.66 2.45 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 1.09 0.00 0.00 1.03 0.00 0.00 101 L 8.20 3.94 0.00 1.84 1.71 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.79 4.07 0.00 3.99 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 0.00 103 A 8.62 4.15 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 0.00 104 G 8.28 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 0.00 105 L 7.84 4.03 0.00 1.81 1.76 0.94 1.00 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 0.00 106 N 8.68 4.50 0.00 2.70 2.90 0.00 0.00 7.19 7.79 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 0.00 107 S 8.66 4.39 0.00 4.02 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 0.00 108 G 8.05 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 0.00 109 V 7.80 4.56 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 1.08 0.00 0.00 1.09 0.00 0.00 110 P 0.00 4.54 0.00 1.94 1.73 0.00 3.71 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 1.31 1.37 0.00 111 C 8.59 5.22 0.00 2.94 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 0.00 112 V 8.82 3.74 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 0.75 0.00 0.00 0.88 0.00 0.00 113 F 8.99 4.52 0.00 3.04 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 0.00 114 G 8.74 4.18 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 0.00 115 V 6.37 4.82 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 -0.90 0.00 0.00 0.73 0.00 0.00 116 L 8.85 4.41 0.00 1.64 1.66 0.94 0.46 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 0.00 117 T 7.94 5.32 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 1.27 0.00 0.00 118 C 8.16 4.30 0.00 2.97 3.10 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 0.00 119 D 9.00 4.50 0.00 2.68 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 0.00 120 N 9.60 4.73 0.00 2.89 2.91 0.00 0.00 6.76 8.32 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 0.00 121 M 8.83 3.97 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 122 D 8.23 4.36 0.00 2.74 2.89 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 0.00 123 Q 8.73 4.00 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 124 A 7.73 4.16 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 0.00 125 I 8.07 3.77 2.04 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.35 1.02 0.00 0.00 126 N 8.15 4.42 0.00 3.01 2.87 0.00 0.00 7.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.72 4.04 0.00 1.91 1.98 0.00 3.28 0.00 0.00 3.18 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 128 A 7.56 4.46 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 0.00 129 G 9.01 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 0.00 130 G 7.81 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 0.00 0.00 0.00 0.00 131 K 8.28 4.15 0.00 1.83 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.39 7.81 132 A 7.98 4.47 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 0.00 133 G 8.74 3.73 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 0.00 134 N 8.03 5.79 0.00 2.73 2.60 0.00 0.00 6.78 6.63 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 0.00 135 K 8.18 4.13 0.00 1.83 1.75 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.36 7.81 136 G 8.23 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 0.00 137 A 8.44 3.77 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 0.00 138 E 8.05 3.74 0.00 2.11 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 2.27 2.43 0.00 139 S 8.52 4.02 0.00 3.83 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 0.00 140 A 7.55 3.39 0.24 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 0.00 141 L 7.46 3.36 0.00 1.44 1.65 0.71 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 T 8.02 3.67 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 1.12 0.00 0.00 143 A 8.03 3.90 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 0.00 144 I 7.58 3.63 1.94 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 1.33 0.52 0.92 0.00 0.00 145 E 8.40 3.83 0.00 1.93 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 2.24 2.31 0.00 146 M 8.44 3.82 0.00 1.64 2.04 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 147 A 7.83 3.85 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 0.00 148 S 7.91 4.22 0.00 3.83 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 0.00 149 L 8.41 4.01 0.00 1.85 2.03 0.99 1.17 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 0.00 150 F 8.88 4.42 0.00 3.43 3.14 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 0.00 151 E 7.98 5.18 0.00 2.25 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 0.00 2.41 2.37 0.00 152 H 7.82 4.93 0.00 3.38 3.68 0.00 5.71 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 0.00 153 H 9.03 4.47 0.00 3.32 3.72 0.00 5.96 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.23 3.96 0.00 1.74 1.60 0.85 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.51 4.12 0.00 1.83 1.69 0.00 1.53 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.41 7.81