NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2614 8.2644 123.5797 52.2113 20.0098 177.0789 3 R 4.1872 8.1335 119.7607 55.9026 31.6468 174.2327 4 R 4.2114 8.7284 112.6687 57.2207 31.7049 176.9714 5 R 4.0562 8.5422 113.6900 55.6007 31.5595 177.3338 6 R 3.9419 8.6031 118.8109 55.6806 29.7017 175.2077 7 A 3.4964 7.8158 117.2924 52.6114 17.8246 177.3384 8 E 4.0788 8.4932 121.2931 55.3698 30.3271 176.4237 9 V 3.4422 8.3127 122.6620 62.8406 31.0029 175.2915 10 R 3.8275 8.5046 127.5803 56.9538 30.0356 175.7578 11 Q 4.4990 8.4641 124.1914 54.6095 30.3118 174.9648 12 L 4.6714 8.0594 120.1282 52.7946 44.6609 176.0937 13 Q 4.2977 8.3668 119.3176 54.0916 28.6937 174.6554 14 P 4.3392 0.0000 0.0000 62.3886 32.0798 175.6226 15 D 4.4763 8.2801 119.2160 54.7002 41.6880 177.4648 16 L 4.1120 8.8482 125.2565 57.5773 41.9522 177.6204 17 V 4.0617 8.8780 114.2449 64.5804 33.0208 176.0021 18 Y 4.2078 12.0000 113.8017 57.5889 38.1593 175.9482 19 G 3.9307 8.4310 107.4631 46.1856 0.0000 172.8433 20 D 4.9680 7.8703 117.5005 51.6611 43.8627 176.9116 21 V 3.6607 8.4394 119.5627 64.3318 31.4776 178.5834 22 L 4.1317 7.9353 117.6594 56.8643 42.2862 178.7103 23 V 3.1756 7.3622 118.0293 66.5272 31.6945 177.5455 24 T 3.7562 7.8430 114.7037 66.5564 67.8903 175.7817 25 A 3.9428 7.5561 121.4553 55.5837 18.2399 179.5822 26 F 4.0291 8.2467 118.5290 61.1185 39.3234 177.4658 27 I 3.7705 8.0266 119.9983 64.3945 36.9365 177.7451 28 N 4.2864 8.1445 115.2608 56.5631 38.3769 176.9941 29 K 3.9667 7.4454 118.4032 59.3163 32.0777 179.2396 30 I 3.7071 7.0171 119.4232 63.4399 37.4632 176.3358 31 M 3.8219 7.1428 117.3355 56.3825 32.4273 175.7495 32 R 4.5643 8.3904 123.3201 54.6242 33.1028 174.9761 33 D 4.4499 9.6163 115.1070 54.8815 38.5945 174.4207 34 G 3.9613 7.6310 107.0667 46.3126 0.0000 174.4822 35 K 4.6812 7.4842 126.6470 53.9473 33.6360 177.4905 36 K 3.8716 8.1914 121.3606 60.3330 32.2915 177.9757 37 N 4.3885 8.4353 116.7113 56.0481 38.9899 176.6595 38 L 3.8473 7.6685 120.6000 58.5272 42.6978 178.7733 39 A 4.0938 7.9625 120.8170 54.4965 18.1691 179.0547 40 A 3.9330 8.5103 119.2445 56.1809 18.8746 179.1595 41 R 3.7112 8.2080 114.2193 60.0115 29.8117 178.1852 42 I 3.6874 7.9791 121.5774 64.6848 37.7452 177.7338 43 F 4.4673 8.5534 121.3576 61.5314 39.2625 176.9004 44 Y 4.0112 8.7957 117.2050 60.9835 37.7016 177.4886 45 D 4.4455 8.4088 119.2684 57.8168 40.5449 179.0657 46 A 4.1344 7.6984 120.1507 54.6558 18.1208 179.4421 47 C 4.0079 7.4857 115.1680 62.6681 28.1861 175.5954 48 K 4.0855 7.8770 120.9670 59.5579 31.7603 178.2060 49 I 3.9684 8.3012 117.5490 62.3913 37.0342 177.1382 50 I 4.0662 7.1265 119.0352 61.9237 38.1329 176.0483 51 Q 4.1723 9.5212 119.7764 58.9051 29.0937 175.8696 52 E 4.0677 7.4967 118.3277 58.5072 29.8002 177.6276 53 K 4.3297 7.9998 121.7020 57.9577 32.7672 177.1259 54 T 4.7219 7.5821 108.2899 59.8947 71.7684 174.4113 55 G 3.6408 8.7386 112.7861 48.0568 0.0000 173.8978 56 Q 4.4260 7.6279 116.8749 54.1402 29.4280 174.7766 57 E 4.1191 8.5512 116.8088 56.1759 30.1570 176.4149 58 P 4.2463 0.0000 0.0000 66.9547 31.2815 177.6472 59 L 3.6096 8.2623 118.7169 58.4400 41.1831 177.8383 60 K 4.0824 7.9485 119.2358 58.7716 32.1791 178.7641 61 V 3.7211 7.5573 117.4301 65.7545 31.4925 177.2444 62 F 3.7654 8.1986 120.0996 61.4417 39.5072 177.7972 63 K 4.0849 8.4264 117.6618 59.8922 31.7837 179.2388 64 Q 3.9978 7.6561 116.9019 58.8703 29.2253 177.6720 65 A 4.0824 9.1305 122.8539 55.1996 18.4292 179.2994 66 V 3.5139 8.1959 116.6760 66.4220 31.3405 177.5776 67 E 4.2865 7.8747 113.6230 57.4521 29.2301 177.0593 68 N 4.6960 7.8784 115.9151 55.0909 39.6366 176.3102 69 V 3.8100 7.8896 118.6583 64.3016 31.9841 175.0152 70 K 3.9278 8.2216 118.5018 56.2599 31.4709 174.4160 71 P 4.9040 0.0000 0.0000 62.2375 32.9373 176.3183 72 R 4.3235 8.5473 118.1567 57.7584 31.0114 175.9591 73 M 5.3714 7.3624 114.4977 53.8906 36.3907 174.0436 74 E 4.8350 8.4800 115.2337 56.0659 33.2468 175.5352 75 V 4.6100 8.4805 113.7876 61.4928 32.9308 176.7926 76 R 4.5685 9.1026 123.4396 55.0924 33.2424 175.1092 77 S 4.4732 9.0036 120.4439 59.0453 64.0229 174.3487 78 R 4.5042 9.1350 122.1280 54.5333 33.4007 173.9960 79 R 4.5600 8.6526 126.9575 55.5594 30.5915 175.6548 80 V 4.1735 7.7253 124.9226 62.2739 34.1456 174.2083 81 G 4.2048 10.5471 122.5733 44.8208 0.0000 173.3605 82 G 4.0746 7.2392 105.5807 44.8644 0.0000 172.0036 83 A 4.5525 7.2928 121.4060 50.0804 21.9034 174.3770 84 N 4.9774 8.1620 116.2931 52.3040 38.5912 174.2284 85 Y 4.3697 8.6454 122.5651 57.7979 39.2056 175.3440 86 Q 4.6763 8.6916 124.5547 54.9502 27.9952 174.8330 87 V 4.1287 8.0408 123.5030 61.4025 33.6669 172.2335 88 P 5.8500 0.0000 0.0000 60.9609 32.7023 174.4108 89 M 4.9350 8.5536 121.3598 52.5755 34.8882 174.5138 90 E 4.2179 8.8808 120.6094 57.2356 30.0897 176.6042 91 V 4.2447 8.3737 126.7486 62.1840 33.1334 175.2824 92 S 4.8195 8.2627 119.3482 56.0455 65.2634 173.3610 93 P 4.0835 0.0000 0.0000 65.9523 31.6601 178.2049 94 R 4.0601 7.9934 117.1149 59.1368 30.2917 178.0116 95 R 3.8449 8.0777 117.9808 60.2237 29.6721 176.8689 96 Q 4.0824 8.6361 118.3531 57.2865 28.2844 178.9371 97 Q 3.4052 7.8565 118.1628 58.0748 30.8090 179.8605 98 S 3.9956 8.4860 115.9215 61.5646 63.2192 177.2458 99 L 3.2773 7.5758 121.0844 57.3570 41.5007 179.1491 100 A 4.1335 8.1423 121.2762 55.3037 18.0649 179.4494 101 L 3.9213 8.6019 117.7211 58.1425 41.6519 179.6303 102 R 3.8054 7.6474 118.3705 59.5747 29.9514 178.3795 103 W 4.4824 8.0630 118.4369 59.6915 28.7637 178.1753 104 L 4.0293 7.9064 118.5120 58.2632 41.2631 179.6459 105 V 3.4323 7.3425 116.2168 66.1962 30.9884 178.2502 106 Q 3.9441 7.9782 117.1107 59.0810 28.4724 178.6959 107 A 4.0339 8.5477 120.1270 54.3893 18.2345 178.8842 108 A 3.9897 9.4168 119.6023 55.0784 17.7847 178.7205 109 N 4.6115 6.3376 111.2237 53.0783 39.1969 176.0079 110 Q 4.3196 7.5627 121.7666 56.5334 29.6092 176.1756 111 R 3.9582 8.2151 119.1743 55.6452 30.8914 174.3246 112 P 4.6591 0.0000 0.0000 62.6461 30.9941 175.8969 113 E 4.0037 7.9933 120.0853 56.8673 29.8199 178.2926 114 R 4.1836 8.6570 122.2828 58.1108 30.2682 176.7967 115 R 4.5022 7.2929 117.6035 53.8413 31.6092 175.2584 116 A 3.7921 8.1082 123.6590 56.1435 18.0476 179.3152 117 A 3.9863 8.0692 116.0585 54.9553 18.6537 179.6960 118 V 3.5436 7.4216 115.2632 66.6546 31.5391 177.9782 119 R 4.0670 7.9029 116.9671 59.5043 29.9506 178.7693 120 I 3.7798 7.9027 118.3074 64.7910 37.2504 177.9715 121 A 3.9775 8.3494 121.4868 55.6852 18.4158 178.8531 122 H 3.9586 9.2030 115.1948 59.2139 28.8796 177.1939 123 E 3.9353 8.8898 120.8214 59.9889 29.5387 178.9173 124 L 3.9356 8.4079 119.1708 58.1740 41.5824 179.3056 125 M 4.0535 8.3172 116.4338 58.7105 31.0445 178.1270 126 D 4.3473 8.7104 120.0548 57.7874 41.0141 177.7614 127 A 3.9821 8.3055 119.5916 55.2808 17.9205 179.0082 128 A 4.0678 8.0500 120.1221 55.2044 18.7823 179.6507 129 E 4.1379 7.7305 116.1618 60.0846 29.6555 177.0501 130 G 3.5387 7.3511 106.0243 44.7083 0.0000 172.7202 131 K 4.5226 7.8853 119.5578 54.3731 35.7026 176.0925 132 G 3.9091 9.1588 105.6377 45.8641 0.0000 174.6740 133 G 3.8002 9.3328 112.7740 49.5819 0.0000 175.7089 134 A 3.3552 7.1127 116.7149 54.1392 18.8713 179.1390 135 V 3.5750 8.6713 117.9579 64.5559 32.0846 178.3432 136 K 3.7429 7.7387 119.8163 59.6556 31.8059 178.2595 137 K 3.5030 7.2740 118.8110 59.4302 32.0123 178.2186 138 K 3.9303 7.4239 119.6410 59.2662 32.0585 177.9413 139 E 4.3426 8.1320 115.0927 57.4948 29.2208 177.8178 140 D 4.6635 7.5984 119.9002 54.7319 42.1612 178.1779 141 V 4.0035 7.6224 118.6389 65.2541 31.9409 177.3723 142 E 3.8536 8.2569 116.3369 59.6884 29.2969 178.8431 143 R 4.0101 8.0662 116.9560 60.1306 30.2433 177.8963 144 M 4.1582 8.7059 117.9719 57.5008 32.3672 177.0491 145 A 4.2063 7.3736 121.2648 53.2348 19.1208 178.3127 146 E 3.7677 8.7766 118.3598 56.6778 29.3266 174.7845 147 A 4.5517 7.8111 118.8233 52.8334 20.3939 177.0070 148 N 4.8208 7.9048 113.5993 52.8658 39.3497 176.0454 149 R 3.9743 8.0219 116.1565 57.6209 30.0592 177.0351 150 A 3.9666 7.4056 119.6794 55.1405 18.7849 177.9731 151 Y 4.3995 7.5157 111.8395 58.3427 39.0598 176.1961 152 A 4.5099 7.7313 124.5333 52.6152 17.4015 177.1427 153 H 5.0399 8.7433 115.1581 55.5472 30.5280 175.1085 154 Y 3.8875 8.4667 118.0713 59.7813 37.3219 174.7111 155 R 4.0203 8.3862 119.4076 54.0329 29.9686 175.6192 156 W 4.0399 7.9538 122.2321 56.9701 28.4311 174.4238 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 2 A 8.26 4.26 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 3 R 8.13 4.19 0.00 1.85 1.94 0.00 3.20 0.00 0.00 3.26 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 4 R 8.73 4.21 0.00 1.92 1.74 0.00 3.08 0.00 0.00 3.22 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 5 R 8.54 4.06 0.00 1.89 1.88 0.00 3.12 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 6 R 8.60 3.94 0.00 1.75 1.90 0.00 3.37 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 7 A 7.82 3.50 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 8 E 8.49 4.08 0.00 1.94 1.88 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 2.30 2.34 0.00 9 V 8.31 3.44 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 0.73 0.00 0.00 0.91 0.00 0.00 10 R 8.50 3.83 0.00 1.79 1.85 0.00 3.26 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 11 Q 8.46 4.50 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 12 L 8.06 4.67 0.00 1.57 1.56 0.90 0.91 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 13 Q 8.37 4.30 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 14 P 0.00 4.34 0.00 2.18 2.07 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 15 D 8.28 4.48 0.00 2.86 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 16 L 8.85 4.11 0.00 1.86 1.80 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.88 4.06 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 0.17 0.00 0.00 0.53 0.00 0.00 18 Y 12.00 4.21 0.00 3.09 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 19 G 8.43 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 20 D 7.87 4.97 0.00 2.65 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.44 3.66 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 0.86 0.00 0.00 0.92 0.00 0.00 22 L 7.94 4.13 0.00 1.62 1.61 0.97 1.08 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 23 V 7.36 3.18 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 0.50 0.00 0.00 0.48 0.00 0.00 24 T 7.84 3.76 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 1.21 0.00 0.00 25 A 7.56 3.94 1.40 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 26 F 8.25 4.03 0.00 3.31 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 27 I 8.03 3.77 1.88 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.63 0.86 0.00 0.00 28 N 8.14 4.29 0.00 2.64 2.88 0.00 0.00 6.91 7.61 0.00 0.00 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 7.45 3.97 0.00 1.68 1.60 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.50 7.81 30 I 7.02 3.71 2.01 0.00 0.00 0.68 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 0.13 0.92 0.00 0.00 31 M 7.14 3.82 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.54 0.00 32 R 8.39 4.56 0.00 1.88 1.79 0.00 3.32 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.60 0.00 33 D 9.62 4.45 0.00 2.74 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.63 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 35 K 7.48 4.68 0.00 2.00 1.71 0.00 1.71 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.45 7.81 36 K 8.19 3.87 0.00 1.81 1.92 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.54 7.81 37 N 8.44 4.39 0.00 2.82 2.78 0.00 0.00 6.82 6.66 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 38 L 7.67 3.85 0.00 1.83 1.86 0.95 1.24 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 39 A 7.96 4.09 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 40 A 8.51 3.93 1.51 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 41 R 8.21 3.71 0.00 2.05 2.20 0.00 3.20 0.00 0.00 3.22 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.82 0.00 42 I 7.98 3.69 2.13 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 1.47 1.04 1.00 0.00 0.00 43 F 8.55 4.47 0.00 3.20 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 44 Y 8.80 4.01 0.00 3.32 2.90 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 45 D 8.41 4.45 0.00 2.87 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 46 A 7.70 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.49 4.01 0.00 3.13 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 48 K 7.88 4.09 0.00 1.83 1.88 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.53 7.81 49 I 8.30 3.97 1.89 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 1.65 0.94 0.94 0.00 0.00 50 I 7.13 4.07 2.11 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 1.40 0.65 0.97 0.00 0.00 51 Q 9.52 4.17 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 52 E 7.50 4.07 0.00 2.12 1.80 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 2.40 2.39 0.00 53 K 8.00 4.33 0.00 1.69 1.82 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.48 7.81 54 T 7.58 4.72 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 55 G 8.74 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 56 Q 7.63 4.43 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 57 E 8.55 4.12 0.00 2.10 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 2.44 2.34 0.00 58 P 0.00 4.25 0.00 2.19 2.53 0.00 3.83 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 2.36 2.26 0.00 59 L 8.26 3.61 0.00 1.79 1.61 0.40 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.95 4.08 0.00 1.88 1.81 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.53 7.81 61 V 7.56 3.72 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 0.94 0.00 0.00 1.06 0.00 0.00 62 F 8.20 3.77 0.00 3.12 3.07 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 63 K 8.43 4.08 0.00 1.91 1.91 0.00 1.74 0.00 0.00 1.55 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.46 7.81 64 Q 7.66 4.00 0.00 2.09 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 65 A 9.13 4.08 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 66 V 8.20 3.51 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.89 0.00 0.00 67 E 7.87 4.29 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 2.34 2.42 0.00 68 N 7.88 4.70 0.00 2.96 2.86 0.00 0.00 6.83 7.67 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 69 V 7.89 3.81 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 0.87 0.00 0.00 1.06 0.00 0.00 70 K 8.22 3.93 0.00 1.83 1.86 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.49 7.81 71 P 0.00 4.90 0.00 2.36 2.35 0.00 3.81 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.44 0.00 72 R 8.55 4.32 0.00 1.91 2.02 0.00 3.08 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 73 M 7.36 5.37 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 74 E 8.48 4.83 0.00 2.11 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 0.00 2.18 2.28 0.00 75 V 8.48 4.61 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 0.76 0.00 0.00 0.99 0.00 0.00 76 R 9.10 4.57 0.00 1.88 2.05 0.00 3.29 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 77 S 9.00 4.47 0.00 3.83 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 78 R 9.14 4.50 0.00 1.41 1.57 0.00 2.21 0.00 0.00 2.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.14 0.00 79 R 8.65 4.56 0.00 1.84 1.79 0.00 3.29 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.53 0.00 80 V 7.73 4.17 2.14 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 0.76 0.00 0.00 0.86 0.00 0.00 81 G 10.55 4.20 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 0.00 82 G 7.24 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 0.00 0.00 0.00 83 A 7.29 4.55 1.03 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 84 N 8.16 4.98 0.00 2.59 2.80 0.00 0.00 6.88 7.46 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 85 Y 8.65 4.37 0.00 2.76 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 0.00 0.00 0.00 0.00 86 Q 8.69 4.68 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.91 0.00 0.00 0.00 0.00 0.00 2.55 2.36 0.00 87 V 8.04 4.13 2.14 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 1.15 0.00 0.00 0.83 0.00 0.00 88 P 0.00 5.85 0.00 2.13 2.08 0.00 3.16 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 89 M 8.55 4.94 0.00 2.25 2.27 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 2.62 2.69 0.00 90 E 8.88 4.22 0.00 2.04 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 2.32 2.36 0.00 91 V 8.37 4.24 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 0.85 0.00 0.00 0.97 0.00 0.00 92 S 8.26 4.82 0.00 3.99 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 93 P 0.00 4.08 0.00 2.07 2.15 0.00 3.91 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 94 R 7.99 4.06 0.00 1.89 1.87 0.00 3.22 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 95 R 8.08 3.84 0.00 1.89 2.03 0.00 3.19 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 96 Q 8.64 4.08 0.00 2.43 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.23 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 97 Q 7.86 3.41 0.00 2.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 98 S 8.49 4.00 0.00 4.01 3.74 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 99 L 7.58 3.28 0.00 1.47 0.25 0.75 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.14 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.60 3.92 0.00 1.79 1.68 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.65 3.81 0.00 1.83 1.81 0.00 2.92 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 103 W 8.06 4.48 0.00 3.69 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 0.00 104 L 7.91 4.03 0.00 1.88 1.88 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.34 3.43 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 0.92 0.00 0.00 0.41 0.00 0.00 106 Q 7.98 3.94 0.00 2.35 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 107 A 8.55 4.03 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 0.00 108 A 9.42 3.99 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 0.00 109 N 6.34 4.61 0.00 2.75 2.85 0.00 0.00 7.11 7.41 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 0.00 110 Q 7.56 4.32 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 111 R 8.22 3.96 0.00 1.90 1.92 0.00 3.49 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.78 0.00 112 P 0.00 4.66 0.00 2.14 2.15 0.00 3.51 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.08 0.00 113 E 7.99 4.00 0.00 1.98 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 2.37 2.21 0.00 114 R 8.66 4.18 0.00 1.80 1.99 0.00 3.33 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 115 R 7.29 4.50 0.00 1.92 1.75 0.00 3.15 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 116 A 8.11 3.79 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 0.00 117 A 8.07 3.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.42 3.54 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 0.90 0.00 0.00 0.95 0.00 0.00 119 R 7.90 4.07 0.00 2.05 1.98 0.00 3.38 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 120 I 7.90 3.78 2.15 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.55 1.30 0.00 0.00 121 A 8.35 3.98 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.20 3.96 0.00 3.23 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.89 3.94 0.00 2.08 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 2.38 2.48 0.00 124 L 8.41 3.94 0.00 1.99 1.63 0.96 0.44 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 0.00 125 M 8.32 4.05 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.94 0.00 126 D 8.71 4.35 0.00 2.92 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 0.00 127 A 8.31 3.98 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 0.00 128 A 8.05 4.07 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 0.00 129 E 7.73 4.14 0.00 2.03 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 2.34 2.31 0.00 130 G 7.35 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.52 0.00 1.76 1.78 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.33 7.81 132 G 9.16 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 0.00 133 G 9.33 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 0.00 134 A 7.11 3.36 1.40 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 0.00 135 V 8.67 3.58 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 0.98 0.00 0.00 1.04 0.00 0.00 136 K 7.74 3.74 0.00 1.82 1.75 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.39 7.81 137 K 7.27 3.50 0.00 1.26 0.74 0.00 1.03 0.00 0.00 1.43 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.97 1.15 7.81 138 K 7.42 3.93 0.00 1.77 1.90 0.00 1.78 0.00 0.00 2.13 0.00 0.00 3.34 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.58 7.81 139 E 8.13 4.34 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.62 0.00 140 D 7.60 4.66 0.00 2.62 2.59 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 0.00 0.00 0.00 141 V 7.62 4.00 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 1.18 0.00 0.00 1.02 0.00 0.00 142 E 8.26 3.85 0.00 2.12 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 2.35 2.44 0.00 143 R 8.07 4.01 0.00 1.90 2.05 0.00 3.22 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 144 M 8.71 4.16 0.00 2.05 2.20 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.77 0.00 145 A 7.37 4.21 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 0.00 146 E 8.78 3.77 0.00 2.11 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 2.16 2.23 0.00 147 A 7.81 4.55 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 0.00 148 N 7.90 4.82 0.00 2.90 2.77 0.00 0.00 6.46 7.74 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 0.00 149 R 8.02 3.97 0.00 1.72 1.87 0.00 3.20 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 150 A 7.41 3.97 0.73 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 0.00 151 Y 7.52 4.40 0.00 2.79 2.14 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 0.00 152 A 7.73 4.51 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.74 5.04 0.00 3.27 3.43 0.00 5.57 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 0.00 154 Y 8.47 3.89 0.00 2.77 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 0.00 155 R 8.39 4.02 0.00 2.01 2.03 0.00 3.36 0.00 0.00 3.32 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.83 0.00 156 W 7.95 4.04 0.00 3.64 3.29 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