NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1719 8.1727 122.0519 56.2928 34.1224 174.0630 2 V 4.5620 8.1808 127.0632 60.7284 32.2875 174.4996 3 F 4.4113 10.0318 128.9693 57.5451 40.2077 174.9402 4 E 4.2689 8.8623 120.5418 55.5159 31.0809 176.7283 5 R 3.3168 8.9661 120.6099 60.8243 29.9427 179.4726 6 C 4.3105 8.0047 115.3931 59.5942 35.0375 175.7781 7 E 3.9092 8.0956 120.8035 59.2428 29.2569 178.4697 8 L 3.6389 8.0651 120.1382 57.8647 42.1917 178.5822 9 A 3.9296 7.9669 120.7576 55.4447 18.3051 179.9181 10 R 3.9178 8.0751 116.4059 59.4731 30.1052 179.4850 11 T 3.8320 7.7975 115.3072 66.6935 68.4951 176.6933 12 L 3.8540 8.0104 121.1094 57.5757 41.5618 179.5763 13 K 3.9125 7.8979 119.2060 59.5299 31.9558 178.9548 14 R 3.9879 7.8160 117.8251 58.7856 30.0266 177.4295 15 L 4.3774 7.4836 116.7158 53.9506 41.7706 176.6965 16 G 3.8496 7.7536 106.8298 47.0679 0.0000 175.1816 17 M 3.9083 7.7788 121.0415 56.2346 32.4624 175.8429 18 D 4.5660 8.0095 118.0188 55.8439 41.2159 175.8519 19 G 3.9550 9.3610 115.5694 45.4704 0.0000 171.5318 20 Y 4.1888 8.3195 122.1514 58.7221 38.9645 176.3250 21 R 3.6300 8.9825 126.6403 57.2876 27.8345 177.1473 22 G 3.7980 8.1104 102.9025 45.7855 0.0000 174.0060 23 I 4.1308 7.5994 121.8540 58.8586 38.2018 175.8414 24 S 4.6257 8.3384 120.4060 57.7896 63.8937 174.9135 25 L 4.1994 9.0159 123.6731 58.6862 41.7429 179.4174 26 A 4.1471 8.1840 119.9729 55.2882 18.2879 179.2482 27 N 4.4308 8.2302 115.0656 56.2549 38.5732 177.7091 28 W 4.2172 8.0179 119.9572 59.9130 29.2026 178.3562 29 M 4.1677 8.4649 118.8369 58.5769 31.5701 177.9236 30 C 3.1811 8.0807 118.6198 59.0909 44.5351 175.3560 31 L 3.9719 8.0755 121.5998 58.2740 41.7646 178.7764 32 A 4.1693 8.3291 120.7803 54.9418 18.2953 179.3922 33 K 2.8387 8.0991 118.0124 59.3993 32.0487 179.1276 34 W 4.2781 7.5774 116.8303 59.0446 29.0507 178.4152 35 E 4.3395 8.2135 118.5937 58.6365 29.0346 177.7126 36 S 4.5363 7.8889 109.5459 56.6011 64.5167 174.4372 37 G 3.2146 8.0873 108.8801 46.9649 0.0000 173.2858 38 Y 3.6329 7.6981 113.4399 58.6741 35.1395 168.7652 39 N 5.3018 7.5396 118.1957 51.9155 39.9682 175.5876 40 T 3.9825 9.0446 117.8302 63.9423 69.1350 175.9141 41 R 4.4743 7.9559 116.4295 55.6444 30.1804 176.2501 42 A 4.3166 7.6739 122.4060 52.8486 19.3237 176.9948 43 T 5.0185 8.3782 111.2756 59.9843 72.4367 172.9817 44 N 4.8871 8.8453 122.1316 52.1608 41.8402 172.2846 45 Y 4.6462 8.7010 127.9861 57.1688 40.8293 173.9054 46 N 4.5574 8.4460 124.9040 51.1908 38.5739 175.3320 47 A 3.7120 8.1904 128.0759 54.7555 18.9159 180.1149 48 G 3.6488 7.9985 104.1128 48.0256 0.0000 173.6838 49 D 4.6994 6.9737 112.3911 52.0027 40.3542 175.7748 50 R 4.0409 8.1680 116.6952 57.2171 28.0873 175.7672 51 S 4.9996 7.7790 111.7371 56.9776 66.5103 172.7479 52 T 5.0967 8.8014 116.0016 61.9624 72.7591 172.7579 53 D 5.3859 9.0065 125.3676 53.2572 43.1422 175.0596 54 Y 4.9743 9.2550 121.1006 57.4927 41.5566 177.2286 55 G 4.3116 9.0190 111.8867 46.2235 0.0000 173.4076 56 I 3.9658 8.1871 116.7634 62.9128 37.8941 177.2765 57 F 4.7683 7.9668 115.5638 56.4130 39.9254 175.2003 58 Q 3.6267 7.9342 119.2278 57.0620 26.5490 174.1910 59 L 4.5518 8.3294 118.2141 54.6128 43.6530 177.9631 60 N 5.3457 9.3774 123.3036 53.4160 39.8432 175.6775 61 S 4.7078 9.1546 120.7950 60.1496 63.1857 175.3566 62 R 3.7601 8.7828 122.2829 58.5388 30.4321 177.6536 63 Y 4.2008 7.6262 114.5208 57.9613 40.8123 177.1584 64 W 4.7779 8.1515 118.9695 57.7572 30.2779 173.6624 65 C 5.5499 7.8742 110.5744 53.5819 45.7964 171.7930 66 N 4.9961 8.8834 119.6117 52.1009 39.7291 174.8082 67 D 4.8135 8.5641 123.0070 52.3165 40.4616 178.0396 68 G 4.0602 8.5479 108.9442 45.9085 0.0000 174.7018 69 K 4.4074 7.8550 116.1230 56.7018 33.2079 175.9904 70 T 4.4207 7.4196 116.7506 61.6534 68.7539 173.1272 71 P 4.2939 0.0000 0.0000 63.5833 31.9661 176.4196 72 G 4.0703 8.5683 108.1803 46.4060 0.0000 173.1510 73 A 4.4583 7.1634 120.2805 51.0662 19.6329 178.2238 74 V 4.3174 8.4531 113.5956 59.2394 35.2540 175.6315 75 N 4.9412 8.0714 118.4197 51.6858 37.6462 174.3544 76 A 3.8996 8.7535 124.9755 55.1249 19.0959 178.5392 77 C 4.4762 8.2552 110.3553 57.3241 41.1299 173.0767 78 H 4.1606 7.9190 116.6975 56.6527 26.3716 174.2856 79 L 4.8319 8.4345 117.9855 52.8317 46.4378 176.8538 80 S 4.6186 8.3718 115.7423 58.0121 63.3251 175.9880 81 C 4.1274 8.6296 123.8372 59.6130 40.8161 176.4153 82 S 3.9210 7.8077 114.5276 61.2147 61.6636 175.9311 83 A 4.0840 7.8414 122.6263 54.4762 17.8731 177.9620 84 L 4.4276 7.7745 116.2189 55.1505 41.7546 177.6837 85 L 5.0145 7.7782 117.3250 54.5004 42.4284 176.7126 86 Q 4.3590 7.8099 117.8913 55.4408 29.4997 175.9117 87 D 4.4413 8.4896 119.3261 56.9318 41.1876 176.8276 88 N 4.5942 8.0511 118.2371 53.1634 39.3299 174.6933 89 I 4.2554 8.4339 118.6520 60.9856 38.0183 176.9880 90 A 3.9470 8.5160 125.1090 56.0024 18.1850 180.0699 91 D 4.2768 8.0802 116.4553 57.3991 40.9533 178.6746 92 A 4.1272 7.9867 120.9090 55.1140 18.4445 179.7639 93 V 3.4140 8.2685 117.0211 66.0393 31.4967 178.1430 94 A 3.8697 8.0976 120.6468 55.2176 18.1611 178.8205 95 C 4.2120 8.3483 116.8673 59.6140 37.8888 175.6175 96 A 3.8674 8.0876 122.5274 54.9474 17.5812 179.7443 97 K 3.7766 7.5331 116.3500 59.4297 32.2921 179.1973 98 R 4.0631 7.5645 119.0935 59.3234 30.1642 178.5039 99 V 2.6899 7.3555 117.9652 65.9368 31.1657 177.9610 100 V 3.9252 7.4129 108.0461 62.5660 31.6510 177.6360 101 R 4.1408 7.7574 118.2821 57.2254 30.5453 175.9100 102 D 4.7435 7.4077 118.5155 52.9354 41.9816 175.2408 103 P 4.2303 0.0000 0.0000 66.3525 31.0755 177.9458 104 Q 4.0151 8.1724 117.3338 56.3954 30.0581 177.3525 105 G 3.6285 7.8334 107.0223 46.2150 0.0000 176.4873 106 I 3.5149 7.7791 120.7228 63.4542 37.9255 177.8865 107 R 4.2289 7.2977 117.6958 57.9912 29.9666 177.5469 108 A 3.9328 7.6930 120.7716 54.0690 18.6623 177.5547 109 W 4.7655 8.1492 116.9729 55.3620 30.2072 177.5627 110 V 3.7485 8.7262 123.5346 65.9492 30.9030 177.6170 111 A 4.0483 8.2998 120.2597 54.8354 18.1207 179.1908 112 W 3.9383 8.3071 126.4646 60.6729 30.5725 178.4444 113 R 3.6794 8.1281 116.4231 59.2469 29.6509 178.4076 114 N 4.3390 7.8383 114.9274 55.7532 38.7355 176.9334 115 R 4.0264 7.6963 116.2952 55.9392 31.3391 176.0725 116 C 4.5214 7.6772 115.1920 57.9584 42.5419 174.3210 117 Q 3.2674 6.4541 118.3427 57.5762 28.5580 175.7947 118 N 4.1806 8.6961 119.8614 54.0605 36.1968 173.7771 119 R 4.4434 7.4475 116.6762 54.1394 32.6388 175.5815 120 D 4.5706 8.4235 118.8490 54.0380 40.5811 175.9228 121 V 4.5620 8.2329 119.3161 61.1424 32.4889 178.1713 122 R 4.0263 8.1572 121.9675 59.4161 30.4955 178.7211 123 Q 3.9836 8.2383 115.2112 59.4206 28.3644 178.5610 124 Y 4.3085 7.8103 115.1907 60.0807 38.2732 177.0079 125 V 4.3864 7.8788 110.8065 60.6091 33.0497 175.4476 126 Q 4.1688 7.5701 119.4999 57.4072 28.6930 177.0785 127 G 3.9410 8.9249 110.4137 46.0853 0.0000 174.5238 128 C 4.4154 8.0818 115.8125 56.8526 40.5402 173.9633 129 G 3.8514 8.1374 107.2584 46.8144 0.0000 174.1634 130 V 4.0100 7.8762 118.0388 61.0892 32.1275 175.8407 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 K 8.17 4.17 0.00 2.04 1.65 0.00 1.29 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.15 7.81 2 V 8.18 4.56 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 10.03 4.41 0.00 2.86 2.85 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 0.00 0.00 0.00 0.00 4 E 8.86 4.27 0.00 1.95 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 2.31 2.24 0.00 5 R 8.97 3.32 0.00 1.93 1.89 0.00 3.40 0.00 0.00 3.45 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 6 C 8.00 4.31 0.00 3.00 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 7 E 8.10 3.91 0.00 2.06 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 0.00 2.62 2.42 0.00 8 L 8.07 3.64 0.00 1.42 1.40 -0.19 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.97 3.93 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 10 R 8.08 3.92 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.80 3.83 4.27 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 1.20 0.00 0.00 12 L 8.01 3.85 0.00 1.73 1.58 0.93 0.76 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 13 K 7.90 3.91 0.00 1.96 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.82 3.99 0.00 2.01 2.03 0.00 3.30 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.48 4.38 0.00 1.68 1.54 0.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.75 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.78 3.91 0.00 1.21 1.90 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.19 0.00 18 D 8.01 4.57 0.00 2.67 2.67 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 19 G 9.36 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 0.00 0.00 0.00 0.00 20 Y 8.32 4.19 0.00 3.37 3.16 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 0.00 0.00 0.00 21 R 8.98 3.63 0.00 1.91 1.85 0.00 3.26 0.00 0.00 3.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.39 0.00 22 G 8.11 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 23 I 7.60 4.13 1.78 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.74 -0.18 0.00 0.00 24 S 8.34 4.63 0.00 4.06 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 25 L 9.02 4.20 0.00 2.09 1.81 0.98 1.14 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 26 A 8.18 4.15 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 27 N 8.23 4.43 0.00 2.83 2.72 0.00 0.00 6.92 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 28 W 8.02 4.22 0.00 3.54 3.13 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 29 M 8.46 4.17 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.08 3.18 0.00 2.45 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 31 L 8.08 3.97 0.00 1.84 1.83 0.51 -0.49 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 32 A 8.33 4.17 1.47 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 0.00 0.00 33 K 8.10 2.84 0.00 1.50 1.78 0.00 0.68 0.00 0.00 1.02 0.00 0.00 2.55 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.06 0.21 7.81 34 W 7.58 4.28 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 35 E 8.21 4.34 0.00 2.04 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 0.00 2.59 2.46 0.00 36 S 7.89 4.54 0.00 4.09 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.09 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 0.00 0.00 0.00 38 Y 7.70 3.63 0.00 3.21 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 39 N 7.54 5.30 0.00 2.85 2.83 0.00 0.00 7.01 7.10 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 40 T 9.04 3.98 4.45 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 1.47 0.00 0.00 41 R 7.96 4.47 0.00 2.02 2.10 0.00 3.09 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 42 A 7.67 4.32 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 43 T 8.38 5.02 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 1.35 0.00 0.00 44 N 8.85 4.89 0.00 2.94 2.67 0.00 0.00 6.72 6.84 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 45 Y 8.70 4.65 0.00 3.07 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 46 N 8.45 4.56 0.00 2.64 2.59 0.00 0.00 6.57 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 47 A 8.19 3.71 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 48 G 8.00 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 49 D 6.97 4.70 0.00 2.75 2.67 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 50 R 8.17 4.04 0.00 2.05 2.20 0.00 3.11 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 51 S 7.78 5.00 0.00 4.00 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 52 T 8.80 5.10 4.10 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 0.61 0.00 0.00 53 D 9.01 5.39 0.00 2.67 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 54 Y 9.26 4.97 0.00 3.00 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 55 G 9.02 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.19 3.97 1.68 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.86 0.09 0.00 0.00 57 F 7.97 4.77 0.00 3.26 3.16 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 0.00 0.00 0.00 58 Q 7.93 3.63 0.00 2.55 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.83 0.00 0.00 0.00 0.00 0.00 2.53 2.70 0.00 59 L 8.33 4.55 0.00 1.90 1.87 1.12 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 60 N 9.38 5.35 0.00 3.11 3.05 0.00 0.00 6.97 7.63 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 61 S 9.15 4.71 0.00 4.07 4.42 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 62 R 8.78 3.76 0.00 1.60 1.30 0.00 2.62 0.00 0.00 2.87 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 63 Y 7.63 4.20 0.00 1.43 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 0.00 0.00 0.00 0.00 64 W 8.15 4.78 0.00 3.56 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 65 C 7.87 5.55 0.00 3.15 3.20 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 66 N 8.88 5.00 0.00 2.79 2.70 0.00 0.00 7.08 8.72 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 67 D 8.56 4.81 0.00 2.97 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 68 G 8.55 4.06 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 0.00 0.00 0.00 69 K 7.86 4.41 0.00 1.86 1.93 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.46 7.81 70 T 7.42 4.42 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 1.17 0.00 0.00 71 P 0.00 4.29 0.00 2.15 1.95 0.00 3.73 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 72 G 8.57 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 73 A 7.16 4.46 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 74 V 8.45 4.32 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 0.62 0.00 0.00 0.83 0.00 0.00 75 N 8.07 4.94 0.00 2.78 2.65 0.00 0.00 6.75 7.71 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 76 A 8.75 3.90 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 77 C 8.26 4.48 0.00 3.33 3.22 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 78 H 7.92 4.16 0.00 3.27 3.34 0.00 5.79 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 79 L 8.43 4.83 0.00 1.66 1.50 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.37 4.62 0.00 3.83 3.69 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 81 C 8.63 4.13 0.00 2.30 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 82 S 7.81 3.92 0.00 3.87 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 83 A 7.84 4.08 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 84 L 7.77 4.43 0.00 1.95 1.82 1.07 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.78 5.01 0.00 1.79 1.72 1.09 0.99 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 86 Q 7.81 4.36 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 87 D 8.49 4.44 0.00 2.65 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 88 N 8.05 4.59 0.00 2.70 2.75 0.00 0.00 6.94 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.43 4.26 1.78 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.99 0.97 0.00 0.00 90 A 8.52 3.95 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 91 D 8.08 4.28 0.00 2.72 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 92 A 7.99 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 93 V 8.27 3.41 2.18 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 0.71 0.00 0.00 0.88 0.00 0.00 94 A 8.10 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 95 C 8.35 4.21 0.00 3.16 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 96 A 8.09 3.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.53 3.78 0.00 1.66 1.46 0.00 1.28 0.00 0.00 0.75 0.00 0.00 2.21 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.30 0.98 7.81 98 R 7.56 4.06 0.00 1.92 2.12 0.00 3.27 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.92 0.00 99 V 7.36 2.69 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 -0.86 0.00 0.00 100 V 7.41 3.93 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 1.06 0.00 0.00 1.41 0.00 0.00 101 R 7.76 4.14 0.00 2.18 2.01 0.00 3.33 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 102 D 7.41 4.74 0.00 3.12 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 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.78 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 1.98 2.01 0.00 104 Q 8.17 4.02 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.90 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 105 G 7.83 3.63 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 0.00 0.00 0.00 106 I 7.78 3.51 0.98 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.30 -0.67 0.00 0.00 107 R 7.30 4.23 0.00 2.03 2.04 0.00 3.23 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.60 0.00 108 A 7.69 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.15 4.77 0.00 3.45 3.22 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 0.00 110 V 8.73 3.75 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.05 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 0.00 112 W 8.31 3.94 0.00 3.44 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 0.00 113 R 8.13 3.68 0.00 2.06 1.98 0.00 3.60 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.10 0.00 114 N 7.84 4.34 0.00 2.56 2.70 0.00 0.00 6.97 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 0.00 115 R 7.70 4.03 0.00 0.92 0.68 0.00 2.81 0.00 0.00 2.86 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.95 0.00 116 C 7.68 4.52 0.00 1.65 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 0.00 117 Q 6.45 3.27 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.69 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 118 N 8.70 4.18 0.00 2.80 2.83 0.00 0.00 6.93 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 0.00 119 R 7.45 4.44 0.00 1.87 1.83 0.00 3.25 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 120 D 8.42 4.57 0.00 2.64 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 0.00 121 V 8.23 4.56 2.35 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 0.97 0.00 0.00 1.04 0.00 0.00 122 R 8.16 4.03 0.00 1.91 2.03 0.00 3.27 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 123 Q 8.24 3.98 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.90 0.00 0.00 0.00 0.00 0.00 2.10 1.47 0.00 124 Y 7.81 4.31 0.00 3.24 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.88 4.39 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 1.03 0.00 0.00 1.05 0.00 0.00 126 Q 7.57 4.17 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 127 G 8.92 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 0.00 128 C 8.08 4.42 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 0.00 129 G 8.14 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.88 4.01 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 0.81 0.00 0.00 0.96 0.00 0.00