NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 4.5595 8.2548 109.1379 45.8429 0.0000 175.8848 4 L 4.3475 7.7681 120.2880 55.6098 41.4971 177.2070 5 D 4.4000 8.4794 119.4267 57.5480 40.8555 178.2972 6 K 3.6732 7.7942 118.4187 59.4803 32.1540 177.6286 7 Y 4.6004 7.7325 115.7587 58.6274 39.9525 175.8911 8 L 4.7522 7.4753 118.8328 51.5640 42.1022 172.5584 9 P 4.5481 0.0000 0.0000 63.0242 31.9477 176.6598 10 G 3.9368 8.3016 110.5309 46.2664 0.0000 172.7726 11 I 4.2736 7.5656 120.1933 60.0912 38.0512 175.4843 12 E 4.5912 8.7716 124.0682 56.7943 31.5630 175.9518 13 K 5.2263 8.0411 116.7018 54.4913 36.0941 175.7543 14 L 5.0053 8.9586 122.3708 52.7733 46.1142 176.2189 15 R 4.7546 8.9566 121.1935 56.4725 31.8371 176.0623 16 R 4.9667 9.1578 123.4468 54.9271 33.4862 175.8798 17 G 3.8267 9.0906 117.1454 47.1929 0.0000 174.6939 18 D 4.8726 9.1829 124.3890 53.8607 42.4680 176.5703 19 G 4.3999 8.0089 110.3620 44.7149 0.0000 171.4262 20 E 5.4320 8.6837 120.0271 54.7944 33.2964 175.7355 21 V 4.6922 8.8460 112.7655 59.4516 36.3326 175.2534 22 E 4.6493 8.6751 121.8026 56.1174 30.4858 178.4230 23 V 3.7114 8.9522 122.7896 65.7933 31.6798 178.4950 24 K 3.9468 8.3207 118.6913 60.1110 31.8386 178.4676 25 S 4.3949 7.9078 113.1575 59.9748 63.2383 175.2077 26 L 4.4119 8.0745 122.2545 53.5420 41.6409 175.9564 27 A 4.2434 7.1958 122.1933 54.1663 18.5250 178.5821 28 G 4.0124 9.6184 111.5358 45.2155 0.0000 173.7159 29 K 4.7734 7.7401 119.2995 55.1725 34.4836 175.6084 30 L 4.5836 8.4749 124.6090 54.7123 43.5740 175.5739 31 V 4.6100 8.6676 126.2125 61.1226 34.2370 173.9336 32 F 5.0496 9.1962 127.6142 56.0114 40.9232 174.9896 33 F 4.8703 9.0245 124.0910 56.9471 40.4285 174.1901 34 Y 5.1774 8.9334 126.4388 56.0738 40.4818 174.2781 35 F 4.9771 8.8547 127.1874 55.8986 40.4378 175.3602 36 S 4.5489 8.2462 116.7327 57.7740 66.2482 172.3307 37 A 4.9100 7.8095 121.9450 50.4176 21.5323 177.7381 38 S 3.3062 8.6916 115.8145 60.5601 63.0313 175.9104 39 W 4.3350 6.9584 116.9334 57.6667 28.0751 175.3178 40 C 4.5317 7.4517 120.9708 55.2868 37.3548 171.8550 41 P 4.3423 0.0000 0.0000 65.3278 30.5534 176.8800 42 P 4.4355 0.0000 0.0000 65.5110 31.2487 178.9246 43 C 4.5214 7.8989 115.8839 59.9356 39.7789 175.9815 44 R 4.0522 7.7710 118.8563 59.3886 30.3547 178.9904 45 G 3.7902 8.1161 104.5197 47.0037 0.0000 175.5134 46 F 4.1525 7.9123 122.2198 61.2264 39.4118 177.2220 47 T 3.8755 8.2465 115.9404 66.4688 68.3996 174.5893 48 P 4.1522 0.0000 0.0000 65.8136 31.2264 178.4420 49 Q 3.8918 7.2674 116.5424 58.6743 28.5229 178.3302 50 L 3.7499 7.2238 121.2863 58.0123 41.9315 179.0343 51 I 3.9784 8.0981 120.1411 64.3171 37.0100 177.9354 52 E 3.9011 8.2840 120.0789 59.3148 29.5407 178.5455 53 F 4.1457 8.3522 120.6326 61.5075 39.3757 176.3262 54 Y 4.4311 8.8527 119.4657 61.1440 38.4899 177.9330 55 D 4.3121 8.4559 118.7877 57.2674 40.9595 178.6641 56 K 3.7042 7.6300 118.1413 58.4135 32.1652 177.8559 57 F 4.8406 7.6461 114.4978 56.7378 41.1036 176.5859 58 H 2.5800 7.9118 117.6425 57.8363 28.4392 177.7952 59 E 3.6915 7.4483 119.3962 58.9360 29.6204 179.0691 60 S 4.1021 7.7831 111.4650 60.3851 63.3965 174.8149 61 K 4.1919 8.2168 118.3718 55.0517 32.8257 175.6487 62 N 4.1201 7.7198 117.6551 54.5785 37.3099 171.6970 63 F 5.6737 7.9473 112.4643 55.4223 42.4341 175.1143 64 E 5.1559 9.6806 118.9365 54.5892 33.7339 173.9333 65 V 4.8709 9.1917 124.0157 61.0249 34.4353 174.4023 66 V 4.8478 8.8718 127.8688 60.8248 33.9915 174.3071 67 F 4.9867 9.9186 132.5811 58.7936 40.6834 173.6875 68 C 4.7891 9.0843 124.8895 57.9024 29.4456 173.0979 69 T 4.1132 7.8447 118.5797 61.5144 67.7951 173.8310 70 W 5.0906 8.9405 126.6947 56.7211 30.0862 175.9822 71 D 5.0781 8.7030 120.7772 54.6612 40.8305 176.1886 72 E 4.8143 9.1611 120.6862 56.1515 30.6323 175.3298 73 E 4.6499 8.1701 120.1843 54.5274 31.0824 176.1432 74 E 2.5400 8.5035 125.0920 58.7516 29.5129 178.3953 75 D 4.0713 7.9925 116.7581 55.7021 39.6092 177.6764 76 G 3.9007 7.7102 106.2059 46.1124 0.0000 175.6233 77 F 4.3012 9.1501 124.3347 61.4390 39.3658 176.5544 78 A 4.3128 8.5656 120.0129 55.5905 17.8674 179.7386 79 G 3.5615 8.0616 101.9241 47.9650 0.0000 174.9337 80 Y 4.2796 8.2829 122.0267 60.5607 38.8846 177.5630 81 F 3.8460 8.3344 121.6271 61.0005 39.1577 176.7691 82 A 3.5901 7.9465 120.0499 54.4857 18.1474 178.7582 83 K 3.9328 7.1152 114.5366 56.2250 32.6930 176.5570 84 M 3.6856 6.6183 119.8002 52.5441 33.8328 174.2708 85 P 4.2471 0.0000 0.0000 62.7992 32.8118 176.1686 86 W 4.9880 6.2355 117.7695 56.1705 30.8636 175.0732 87 L 5.3553 8.9512 119.1496 54.2088 44.1489 175.4448 88 A 5.2702 8.6817 120.4936 50.2369 22.8527 175.9861 89 V 3.9423 8.3955 121.8118 62.1438 32.2014 174.5321 90 P 4.2759 0.0000 0.0000 62.4050 31.9973 176.8625 91 F 3.3175 8.2018 123.5485 61.2532 39.1028 176.8700 92 A 4.1660 7.8834 120.7548 53.7962 18.4920 177.4451 93 Q 4.5871 7.8888 115.4531 55.7026 29.4042 178.0793 94 S 3.9342 7.4927 118.0763 61.7282 62.6115 176.0988 95 E 4.0155 8.1273 120.4966 59.5199 29.1433 179.1295 96 A 3.9643 7.7499 120.5957 55.0550 18.3769 179.8176 97 V 3.5922 7.6114 116.2414 66.3184 31.6902 178.1257 98 Q 3.9897 8.3586 118.0559 59.0196 28.4946 179.0340 99 K 4.0357 8.2617 119.5648 59.1438 32.0201 179.2665 100 L 4.0468 8.2571 120.9732 58.2624 41.9667 179.1006 101 S 3.9685 8.7277 115.6402 61.4743 62.7518 176.7337 102 K 3.9296 8.1798 122.2895 59.6623 31.7586 178.2014 103 H 3.9943 8.3367 117.8595 59.1168 29.7692 176.2294 104 F 4.6287 8.0262 116.0993 56.0442 39.6579 175.0573 105 N 4.0188 8.0522 116.4864 54.3689 37.6557 175.1941 106 V 3.7868 8.1073 117.4631 62.7691 31.6788 174.8765 107 E 4.7503 8.8000 126.7955 56.6249 31.0740 176.1563 108 S 4.9004 7.7869 111.3841 56.3972 66.1821 172.9457 109 I 4.3049 7.7784 114.2172 57.9455 39.9174 173.4371 110 P 4.5972 0.0000 0.0000 63.2411 32.3224 175.5788 111 T 4.6500 8.5051 117.1094 61.8928 72.9723 172.8280 112 L 5.2714 8.4085 125.6031 53.7205 45.6318 174.7578 113 I 4.9123 9.1365 127.3637 59.4253 40.5432 174.6616 114 G 3.9305 9.2072 114.7345 44.4019 0.0000 172.8586 115 V 4.9790 8.2544 117.6590 59.1848 36.2780 174.2485 116 D 4.7381 9.0681 123.4202 53.8936 41.7592 176.9466 117 A 4.0333 8.9436 128.5646 55.5675 18.7114 179.5862 118 D 4.3023 8.3909 115.2585 57.3217 41.1683 178.5589 119 S 4.3084 8.5213 111.9953 58.3863 63.6460 175.5414 120 G 4.1664 8.5251 108.2448 45.3297 0.0000 173.4028 121 D 4.6444 8.1174 120.7225 54.1772 42.0931 176.0106 122 V 3.9901 8.5839 123.0368 63.5732 31.9058 175.2002 123 V 4.0900 9.0402 128.4643 64.7070 32.9840 175.3210 124 T 5.2677 7.5600 113.9038 60.7667 70.7624 173.5833 125 T 4.4567 9.3237 116.4922 61.6043 69.7006 174.6082 126 R 4.5155 7.7968 120.3539 55.8137 31.1887 177.4535 127 A 4.1886 7.7143 123.8545 54.2499 17.6044 180.5484 128 R 3.3801 7.6856 117.1235 59.2863 29.8737 178.4006 129 A 4.0395 7.4823 119.4055 55.1290 18.7476 179.2253 130 T 3.6618 7.4706 108.3318 64.3651 68.8501 176.8042 131 L 2.9870 7.0892 123.3458 57.7134 41.7862 179.4424 132 V 3.6881 6.9476 111.4747 63.5890 31.5301 177.7048 133 K 4.3782 7.4305 115.8468 56.2183 33.8487 176.2208 134 D 4.9276 7.7765 118.9176 52.0112 41.1167 174.0920 135 P 4.4797 0.0000 0.0000 65.5519 32.0039 177.7979 136 E 4.6890 8.5393 116.2441 55.6344 29.9577 175.9431 137 G 4.2157 8.8353 107.8984 46.7071 0.0000 176.3096 138 E 4.0259 8.9260 120.7724 58.3012 29.9103 178.1194 139 Q 4.5457 9.1843 116.4966 55.1450 29.3722 175.1014 140 F 2.5466 7.3056 120.5410 57.6384 39.5686 172.7554 141 P 2.9700 0.0000 0.0000 61.7720 31.6896 175.5125 142 W 3.5859 7.4150 115.0492 58.0947 26.6384 175.2957 143 K 4.2056 7.9543 116.1871 56.9559 32.2316 178.2692 144 D 4.6082 8.7098 124.1953 54.1380 41.8081 176.4550 145 A 4.2418 8.4215 121.3516 52.3729 18.1146 177.5779 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 G 8.25 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.77 4.35 0.00 1.93 1.98 1.04 1.03 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 5 D 8.48 4.40 0.00 2.75 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 6 K 7.79 3.67 0.00 1.41 1.00 0.00 1.48 0.00 0.00 0.92 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.81 1.23 7.81 7 Y 7.73 4.60 0.00 3.32 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 8 L 7.48 4.75 0.00 1.75 1.61 1.17 1.09 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 9 P 0.00 4.55 0.00 2.02 1.98 0.00 3.86 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 10 G 8.30 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 11 I 7.57 4.27 1.91 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 1.31 0.63 0.96 0.00 0.00 12 E 8.77 4.59 0.00 1.94 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 2.34 2.34 0.00 13 K 8.04 5.23 0.00 1.62 1.71 0.00 1.72 0.00 0.00 2.01 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.47 7.81 14 L 8.96 5.01 0.00 1.63 1.72 1.05 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.96 4.75 0.00 1.62 2.09 0.00 3.34 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 16 R 9.16 4.97 0.00 2.00 1.86 0.00 3.33 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 17 G 9.09 3.83 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 0.00 0.00 0.00 18 D 9.18 4.87 0.00 2.70 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 19 G 8.01 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 0.00 0.00 0.00 0.00 20 E 8.68 5.43 0.00 1.99 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 2.23 2.36 0.00 21 V 8.85 4.69 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 0.83 0.00 0.00 1.08 0.00 0.00 22 E 8.68 4.65 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 23 V 8.95 3.71 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 1.15 0.00 0.00 1.09 0.00 0.00 24 K 8.32 3.95 0.00 2.05 2.12 0.00 1.59 0.00 0.00 1.89 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.67 1.56 7.81 25 S 7.91 4.39 0.00 4.13 4.08 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 26 L 8.07 4.41 0.00 1.88 1.78 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.20 4.24 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 28 G 9.62 4.01 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 0.00 29 K 7.74 4.77 0.00 1.91 1.80 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.54 7.81 30 L 8.47 4.58 0.00 1.74 1.60 0.58 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.67 4.61 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 0.55 0.00 0.00 0.90 0.00 0.00 32 F 9.20 5.05 0.00 3.09 2.78 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 33 F 9.02 4.87 0.00 2.98 2.38 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 34 Y 8.93 5.18 0.00 2.75 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 35 F 8.85 4.98 0.00 2.72 2.34 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 36 S 8.25 4.55 0.00 2.72 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.81 4.91 0.27 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 38 S 8.69 3.31 0.00 3.70 3.24 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 39 W 6.96 4.33 0.00 3.68 3.25 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 40 C 7.45 4.53 0.00 1.94 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 41 P 0.00 4.34 0.00 2.26 2.15 0.00 3.81 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 42 P 0.00 4.44 0.00 2.25 2.32 0.00 3.66 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 2.17 2.06 0.00 43 C 7.90 4.52 0.00 3.17 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 44 R 7.77 4.05 0.00 1.97 2.05 0.00 3.20 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 45 G 8.12 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 46 F 7.91 4.15 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 47 T 8.25 3.88 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 1.26 0.00 0.00 48 P 0.00 4.15 0.00 2.20 2.25 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.03 0.00 49 Q 7.27 3.89 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 50 L 7.22 3.75 0.00 0.73 1.36 0.59 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.10 3.98 1.93 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.56 0.79 0.00 0.00 52 E 8.28 3.90 0.00 2.05 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 0.00 2.33 2.30 0.00 53 F 8.35 4.15 0.00 3.34 3.34 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 54 Y 8.85 4.43 0.00 3.62 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.46 4.31 0.00 2.64 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 56 K 7.63 3.70 0.00 0.79 0.74 0.00 1.40 0.00 0.00 1.22 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.03 1.28 7.81 57 F 7.65 4.84 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 H 7.91 2.58 0.00 2.34 2.15 0.00 5.26 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.45 3.69 0.00 1.80 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 2.10 1.60 0.00 60 S 7.78 4.10 0.00 3.95 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 61 K 8.22 4.19 0.00 1.80 1.29 0.00 0.66 0.00 0.00 0.63 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.06 7.81 62 N 7.72 4.12 0.00 2.85 2.83 0.00 0.00 6.67 8.85 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 63 F 7.95 5.67 0.00 3.37 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 9.68 5.16 0.00 2.20 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 65 V 9.19 4.87 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 -0.37 0.00 0.00 0.91 0.00 0.00 66 V 8.87 4.85 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 1.17 0.00 0.00 1.02 0.00 0.00 67 F 9.92 4.99 0.00 3.52 3.28 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 68 C 9.08 4.79 0.00 2.06 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 69 T 7.84 4.11 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 70 W 8.94 5.09 0.00 3.17 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 71 D 8.70 5.08 0.00 3.13 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 72 E 9.16 4.81 0.00 2.04 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 2.27 2.44 0.00 73 E 8.17 4.65 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 74 E 8.50 2.54 0.00 1.16 1.55 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 2.16 1.94 0.00 75 D 7.99 4.07 0.00 2.86 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 76 G 7.71 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 77 F 9.15 4.30 0.00 3.06 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 78 A 8.57 4.31 1.46 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 0.00 0.00 79 G 8.06 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 8.28 4.28 0.00 3.06 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 81 F 8.33 3.85 0.00 2.69 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 82 A 7.95 3.59 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.12 3.93 0.00 1.37 1.61 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.39 7.81 84 M 6.62 3.69 0.00 0.51 1.30 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 85 P 0.00 4.25 0.00 2.10 1.89 0.00 2.20 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.56 0.00 86 W 6.24 4.99 0.00 3.49 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 0.00 0.00 0.00 0.00 87 L 8.95 5.36 0.00 1.94 1.90 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.68 5.27 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.40 3.94 2.02 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 0.73 0.00 0.00 0.96 0.00 0.00 90 P 0.00 4.28 0.00 2.18 1.95 0.00 3.67 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 2.12 2.11 0.00 91 F 8.20 3.32 0.00 1.85 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 92 A 7.88 4.17 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 93 Q 7.89 4.59 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 94 S 7.49 3.93 0.00 3.40 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.13 4.02 0.00 1.95 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 2.33 2.31 0.00 96 A 7.75 3.96 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 97 V 7.61 3.59 2.24 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 1.41 0.00 0.00 0.88 0.00 0.00 98 Q 8.36 3.99 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.21 2.43 0.00 99 K 8.26 4.04 0.00 1.79 1.84 0.00 1.75 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.41 7.81 100 L 8.26 4.05 0.00 1.93 2.02 1.05 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.73 3.97 0.00 4.12 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 0.00 102 K 8.18 3.93 0.00 1.81 1.95 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.42 7.81 103 H 8.34 3.99 0.00 3.10 3.36 0.00 5.99 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 0.00 104 F 8.03 4.63 0.00 3.15 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 0.00 105 N 8.05 4.02 0.00 2.77 2.83 0.00 0.00 7.05 7.25 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 0.00 106 V 8.11 3.79 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 0.50 0.00 0.00 0.22 0.00 0.00 107 E 8.80 4.75 0.00 2.03 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 2.27 2.53 0.00 108 S 7.79 4.90 0.00 3.93 3.83 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 0.00 109 I 7.78 4.30 1.48 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.40 -0.52 0.00 0.00 110 P 0.00 4.60 0.00 1.99 2.19 0.00 3.58 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.95 0.00 111 T 8.51 4.65 4.12 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 1.15 0.00 0.00 112 L 8.41 5.27 0.00 1.75 1.48 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 113 I 9.14 4.91 1.87 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.53 -0.01 0.00 0.00 114 G 9.21 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 0.00 115 V 8.25 4.98 2.27 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 0.57 0.00 0.00 0.85 0.00 0.00 116 D 9.07 4.74 0.00 2.75 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 0.00 117 A 8.94 4.03 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 0.00 118 D 8.39 4.30 0.00 2.74 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.52 4.31 0.00 4.01 4.01 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 0.00 120 G 8.53 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 0.00 0.00 0.00 121 D 8.12 4.64 0.00 2.66 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 0.00 122 V 8.58 3.99 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.33 0.00 0.00 123 V 9.04 4.09 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 0.66 0.00 0.00 0.85 0.00 0.00 124 T 7.56 5.27 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 125 T 9.32 4.46 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 1.24 0.00 0.00 126 R 7.80 4.52 0.00 1.77 1.81 0.00 3.12 0.00 0.00 3.42 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 127 A 7.71 4.19 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 0.00 128 R 7.69 3.38 0.00 1.41 1.60 0.00 3.04 0.00 0.00 2.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 129 A 7.48 4.04 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 0.00 130 T 7.47 3.66 3.35 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 1.08 0.00 0.00 131 L 7.09 2.99 0.00 0.81 1.41 0.30 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 132 V 6.95 3.69 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 1.03 0.00 0.00 0.94 0.00 0.00 133 K 7.43 4.38 0.00 1.58 1.81 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.35 7.81 134 D 7.78 4.93 0.00 2.83 2.78 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 0.00 135 P 0.00 4.48 0.00 2.37 2.28 0.00 3.90 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 2.10 2.06 0.00 136 E 8.54 4.69 0.00 2.11 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 0.00 2.40 2.35 0.00 137 G 8.84 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 0.00 0.00 0.00 0.00 138 E 8.93 4.03 0.00 2.17 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 2.34 2.38 0.00 139 Q 9.18 4.55 0.00 2.49 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 140 F 7.31 2.55 0.00 2.27 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 0.00 141 P 0.00 2.97 0.00 1.49 0.50 0.00 3.67 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 142 W 7.41 3.59 0.00 3.59 3.11 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 0.00 0.00 0.00 0.00 143 K 7.95 4.21 0.00 1.61 1.74 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.37 7.81 144 D 8.71 4.61 0.00 2.59 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 0.00 145 A 8.42 4.24 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00