NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8149 8.3393 109.7274 45.1337 0.0000 172.5524 2 I 3.8791 8.0120 113.8051 59.9315 38.6818 173.4472 3 S 4.4997 8.6447 115.6765 56.7103 67.5199 175.0732 4 Y 4.1740 8.6214 120.9435 59.0361 37.7678 176.8846 5 S 4.5106 9.1044 118.9044 58.5476 63.7560 174.1257 6 V 4.4622 7.2943 119.6638 61.0162 34.4710 174.2392 7 E 4.2472 8.6430 124.1948 55.6125 30.2397 176.0439 8 A 4.5593 8.1969 125.5683 50.0161 21.9124 174.9321 9 D 4.5164 8.5836 122.9777 52.7907 41.4244 174.9654 10 P 4.3271 0.0000 0.0000 65.9831 31.2883 177.4815 11 D 4.6136 8.3831 118.4652 56.7230 40.8729 176.6616 12 T 5.2679 8.0640 108.5643 60.2704 69.9283 173.8041 13 T 4.8464 8.1771 116.5780 62.8685 72.6564 173.1290 14 A 4.7799 8.7591 127.1190 50.0629 22.1702 175.2795 15 K 5.1644 8.1108 118.1435 54.8886 36.5694 175.3605 16 A 4.6104 8.5855 119.5844 51.8995 22.8763 175.4947 17 M 5.2729 8.6938 118.9529 53.7363 36.8395 174.3712 18 L 4.7686 8.6152 120.4875 53.0307 44.9235 175.6687 19 R 4.9881 8.4556 121.5134 55.1265 32.5357 175.8610 20 E 3.7598 9.7483 124.8884 57.1315 28.0414 175.7133 21 R 4.0572 8.5597 118.1137 56.4910 31.6336 177.2813 22 Q 5.1714 8.9021 123.1980 54.9503 28.5827 174.5403 23 M 4.5819 8.1711 119.5935 53.9338 34.2860 174.5123 24 S 4.0002 8.5927 114.0163 58.9389 62.6847 174.8111 25 F 4.5010 8.8036 129.2130 60.6643 38.9406 177.2425 26 K 3.6055 7.7269 117.9819 59.3141 31.9502 178.7905 27 H 3.9704 8.1186 116.6865 58.6760 28.5929 177.7931 28 S 3.9944 7.7185 117.0853 61.6352 62.6909 176.5982 29 K 3.6409 7.3229 120.5888 59.6108 31.8097 178.9502 30 A 3.7954 7.2733 120.0421 55.1335 18.2685 179.6453 31 I 3.4218 7.9223 118.2863 64.7798 36.9987 177.8978 32 A 4.0333 8.4356 121.4801 55.4103 17.8768 179.4780 33 R 3.6710 8.1632 116.7489 59.5003 30.4298 177.9710 34 E 3.9373 8.2772 118.2098 59.0480 30.0413 178.2613 35 I 3.8534 7.7891 111.4980 60.8484 38.2082 175.7478 36 K 4.0699 7.1161 122.7478 57.9940 32.4423 176.6478 37 G 3.9609 8.8743 114.5700 45.3462 0.0000 173.8670 38 K 4.3905 7.6182 119.1852 55.9859 33.2626 175.7065 39 T 4.7438 9.9785 117.4752 62.4838 70.4365 175.9686 40 A 4.0789 9.0554 128.2420 55.5773 18.3368 180.4955 41 G 3.5305 8.1163 103.6977 48.0183 0.0000 175.5895 42 E 3.9736 8.2145 121.0963 58.9897 29.4589 178.9193 43 A 4.0606 8.6052 120.8874 55.4386 18.4243 179.5173 44 V 3.5857 7.8692 116.1601 66.4652 31.6595 177.5971 45 D 4.4174 8.0769 118.3199 58.0154 40.6972 178.0803 46 Y 4.0474 8.4573 119.8373 61.0734 38.7869 178.1859 47 L 3.8919 8.7466 120.0799 57.8983 41.7911 179.5422 48 E 4.0393 8.2240 118.2373 58.8447 29.4018 178.9962 49 A 3.9311 7.7118 121.0060 54.8332 18.3213 179.6729 50 V 4.2571 7.6362 118.4309 65.9663 31.4222 178.1883 51 I 3.6299 7.5372 118.1884 64.5724 36.9763 177.6598 52 E 4.0884 7.8020 119.4023 57.2378 29.4901 177.5282 53 G 3.3908 8.0540 106.0635 45.1478 0.0000 173.4987 54 D 4.6180 7.8745 119.3260 54.0111 42.2560 176.4402 55 Q 4.5982 7.8605 120.4091 53.3638 31.4849 171.7681 56 P 4.8594 0.0000 0.0000 61.4292 33.7062 175.2851 57 V 4.4606 8.5933 123.4810 60.5793 32.5376 173.5040 58 P 4.7677 0.0000 0.0000 63.3260 31.9157 175.9902 59 F 4.8085 9.0220 123.7691 56.3328 39.2632 175.4389 60 K 3.7908 8.5272 123.3885 56.3290 33.6032 177.4283 61 Q 4.2179 7.8925 117.8255 57.4114 30.5261 175.8079 62 H 4.7964 7.5780 115.1069 54.3327 27.5162 174.0602 63 N 5.0652 7.8214 115.4082 51.9777 38.4640 175.5220 64 S 4.2192 8.1774 114.4270 60.2709 62.9607 174.6892 65 G 3.8954 8.9311 112.5012 45.5253 0.0000 173.3169 66 V 3.8721 8.0039 120.0558 62.1716 31.8468 175.7332 67 G 3.9690 8.3136 113.2683 45.6142 0.0000 172.7975 68 H 4.7602 8.7365 119.8648 55.8782 29.9123 174.8437 69 K 4.6387 9.1078 120.9782 54.5013 34.5013 177.4886 70 S 4.1184 9.0604 120.1117 61.4259 63.0150 176.0284 71 K 4.0892 7.9765 118.6586 58.1167 32.0559 177.3369 72 V 3.7742 7.4600 119.3678 62.4562 31.8834 174.3726 73 D 4.7891 8.8087 126.6566 53.6910 42.5625 176.3699 74 G 4.0395 9.8751 114.4635 45.3637 0.0000 171.9269 75 W 5.1971 7.5425 127.2054 56.3336 34.2435 172.4695 76 D 4.3733 6.9607 113.9640 54.6963 40.6503 175.6252 77 A 4.4684 7.3351 121.8322 51.1607 19.8586 176.2669 78 G 3.9223 7.3313 106.0959 46.2887 0.0000 172.8844 79 R 3.8605 6.6972 118.2227 54.5508 34.8007 173.7733 80 Y 4.7638 7.7992 113.5317 56.1990 37.4844 175.1088 81 P 4.6016 0.0000 0.0000 62.0912 29.9058 177.0160 82 E 3.9906 8.4590 121.9629 58.9543 29.8789 178.9193 83 K 3.9274 8.0868 119.8875 59.3330 32.5974 178.2959 84 A 4.1626 8.1384 120.4324 55.5340 18.3204 179.5343 85 S 4.1421 8.3760 113.5727 61.8008 62.7793 177.1451 86 K 4.0657 8.4172 120.9953 59.4389 31.9268 179.2874 87 A 4.1005 8.2488 120.8407 54.8065 18.2304 179.6238 88 F 3.8783 8.3514 116.4325 60.3165 39.0658 177.7726 89 L 4.2820 8.2191 118.1942 57.0751 41.4349 178.9046 90 D 4.4416 7.7745 119.5294 56.6643 41.0344 178.4247 91 L 3.9119 7.6661 120.6063 58.0327 42.0264 179.1069 92 L 3.9922 8.5050 119.3383 57.7416 41.5978 178.7934 93 E 3.9449 8.1652 119.3432 59.4706 29.3799 178.5916 94 N 4.2686 8.1671 116.4158 56.5880 39.0386 176.8049 95 A 3.9607 8.0931 122.2335 55.2850 18.5420 179.8402 96 V 3.7029 8.3777 117.0272 65.4097 31.4930 178.6727 97 G 3.5422 7.9684 105.9606 48.0402 0.0000 175.5436 98 N 4.4179 8.4390 119.7968 55.7699 38.5270 177.4245 99 A 4.2780 8.2907 122.3175 55.1524 18.3422 179.5518 100 D 4.6239 8.0337 118.2982 57.2965 40.8999 178.1666 101 H 4.2299 8.0653 115.6816 57.8927 29.9011 175.6970 102 Q 4.5685 7.6159 117.3057 55.9948 29.6066 176.0837 103 G 3.7236 8.9888 109.7885 45.2592 0.0000 173.6050 104 F 4.6257 8.1573 119.3404 56.2727 41.0848 174.8781 105 D 4.9267 8.4098 121.1725 52.1142 39.4108 176.4332 106 G 3.8442 8.5778 110.7868 48.5789 0.0000 172.9704 107 E 3.9446 8.4287 118.4105 58.7786 29.8302 179.3706 108 A 4.2547 7.7887 118.8473 53.8103 19.0557 177.4915 109 M 4.4156 8.3300 117.4056 55.4362 33.3332 176.0611 110 T 4.5339 8.6011 119.8176 63.3837 70.4626 174.5784 111 I 4.2833 8.8748 127.5758 60.6419 36.3193 176.3767 112 K 4.0600 8.7486 129.6861 59.3050 33.0789 176.5690 113 H 5.0428 8.0264 118.3254 54.9618 33.4625 173.0243 114 V 5.4333 8.2319 123.6214 61.2916 34.0897 173.0458 115 A 4.7950 8.5909 125.5164 50.3631 22.7182 174.3083 116 A 5.3885 8.6512 122.0569 50.8008 21.8573 176.0399 117 H 4.8047 9.1391 116.6753 53.8790 33.4741 172.8150 118 K 3.9920 7.7363 124.4482 55.6533 31.5961 176.4610 119 V 3.7358 8.6689 128.7196 63.1563 32.3039 176.2970 120 G 3.9011 6.7624 105.6188 46.3020 0.0000 170.1285 121 E 5.0010 8.0419 117.7807 54.6809 33.8190 175.1865 122 Q 4.2650 9.2784 126.2750 55.3805 29.9988 174.9803 123 Q 4.6997 8.7716 126.5031 55.9855 29.6750 175.8803 124 G 4.8686 10.0877 109.5864 43.3896 0.0000 171.2049 125 R 5.1560 8.5885 120.1822 54.1645 33.1164 174.0669 126 K 4.3081 9.2537 128.1445 53.7431 34.1080 173.6496 127 P 4.7015 0.0000 0.0000 62.9637 32.0779 175.5340 128 R 4.7820 8.7628 121.3693 53.8294 34.0653 175.0454 129 A 4.0883 8.3188 122.1760 53.8105 18.9230 177.7605 130 M 3.3642 8.9334 117.1910 56.0066 28.9585 177.9482 131 G 3.8622 8.3032 104.4517 45.9552 0.0000 173.5891 132 R 4.7896 7.3934 119.0003 54.1945 33.0855 174.5474 133 A 5.3646 8.4546 123.6137 50.2501 22.5532 175.1499 134 S 4.8283 8.8644 112.7794 56.1304 67.2076 173.3073 135 A 4.5373 8.6353 122.1221 52.2452 19.0254 178.1252 136 W 5.1152 9.0587 129.8194 56.4637 31.3028 173.1953 137 N 5.3313 7.9534 120.5875 51.9714 41.1785 175.0804 138 S 4.6868 8.4660 115.1423 56.1893 66.5385 172.7375 139 P 4.6414 0.0000 0.0000 62.5825 32.9117 175.2004 140 Q 4.9259 8.8931 121.6108 54.2692 31.4817 174.7841 141 V 4.7902 9.3485 125.3386 61.1987 34.5602 174.0905 142 D 5.6058 8.7757 125.4161 52.7520 44.9100 175.4255 143 V 4.9560 8.3020 119.7509 60.6275 35.1788 172.7460 144 E 4.9598 8.9906 122.8543 54.6801 32.4641 174.6504 145 L 5.2512 8.8116 123.0532 53.7453 46.2891 174.7315 146 I 4.8260 9.1695 126.6143 59.6264 40.4156 174.4463 147 L 4.8757 9.2359 128.7067 53.6768 43.6310 175.6479 148 E 5.1387 8.7793 122.8390 52.8690 33.4217 174.5311 149 E 4.3381 8.7360 125.8551 55.6310 30.8429 175.4571 150 P 4.3848 0.0000 0.0000 63.1929 31.4227 175.9528 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 G 8.34 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.01 3.88 1.64 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.50 0.73 0.00 0.00 3 S 8.64 4.50 0.00 3.80 3.75 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 4 Y 8.62 4.17 0.00 2.95 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 9.10 4.51 0.00 4.00 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 6 V 7.29 4.46 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 0.81 0.00 0.00 0.60 0.00 0.00 7 E 8.64 4.25 0.00 1.98 1.85 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 2.29 2.29 0.00 8 A 8.20 4.56 1.08 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 0.00 0.00 9 D 8.58 4.52 0.00 2.69 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 10 P 0.00 4.33 0.00 2.23 2.18 0.00 3.82 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 2.00 2.00 0.00 11 D 8.38 4.61 0.00 2.97 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 12 T 8.06 5.27 4.30 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 1.35 0.00 0.00 13 T 8.18 4.85 4.49 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 1.09 0.00 0.00 14 A 8.76 4.78 0.99 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 0.00 0.00 15 K 8.11 5.16 0.00 1.43 1.53 0.00 1.15 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.84 1.09 7.81 16 A 8.59 4.61 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 17 M 8.69 5.27 0.00 1.71 1.84 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 18 L 8.62 4.77 0.00 1.44 1.45 0.78 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.46 4.99 0.00 1.62 1.78 0.00 3.46 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 20 E 9.75 3.76 0.00 1.96 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 2.23 2.22 0.00 21 R 8.56 4.06 0.00 1.71 1.88 0.00 3.29 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 22 Q 8.90 5.17 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 23 M 8.17 4.58 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.72 0.00 24 S 8.59 4.00 0.00 3.61 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 25 F 8.80 4.50 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.73 3.61 0.00 1.58 1.49 0.00 1.54 0.00 0.00 1.47 0.00 0.00 2.59 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.94 1.30 7.81 27 H 8.12 3.97 0.00 3.28 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.72 3.99 0.00 4.04 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 29 K 7.32 3.64 0.00 1.56 1.62 0.00 1.36 0.00 0.00 1.35 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 0.80 7.81 30 A 7.27 3.80 1.10 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 0.00 0.00 31 I 7.92 3.42 1.17 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.65 -0.14 0.00 0.00 32 A 8.44 4.03 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 33 R 8.16 3.67 0.00 1.78 2.10 0.00 3.09 0.00 0.00 2.97 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 34 E 8.28 3.94 0.00 1.91 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 2.11 1.82 0.00 35 I 7.79 3.85 1.88 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.51 0.89 0.00 0.00 36 K 7.12 4.07 0.00 1.68 1.72 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.44 1.39 7.81 37 G 8.87 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 38 K 7.62 4.39 0.00 2.05 1.73 0.00 1.46 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.38 1.36 7.81 39 T 9.98 4.74 4.48 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 1.33 0.00 0.00 40 A 9.06 4.08 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 41 G 8.12 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.21 3.97 0.00 2.14 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 2.42 2.41 0.00 43 A 8.61 4.06 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 44 V 7.87 3.59 2.25 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 1.06 0.00 0.00 1.02 0.00 0.00 45 D 8.08 4.42 0.00 3.00 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 Y 8.46 4.05 0.00 3.08 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 47 L 8.75 3.89 0.00 1.77 1.77 1.10 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.22 4.04 0.00 2.17 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 2.34 2.66 0.00 49 A 7.71 3.93 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 50 V 7.64 4.26 2.08 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 1.14 0.00 0.00 0.24 0.00 0.00 51 I 7.54 3.63 2.02 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 1.41 0.91 0.90 0.00 0.00 52 E 7.80 4.09 0.00 2.12 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 2.29 2.37 0.00 53 G 8.05 3.39 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 0.00 54 D 7.87 4.62 0.00 2.63 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 55 Q 7.86 4.60 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 56 P 0.00 4.86 0.00 1.82 1.74 0.00 3.90 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 57 V 8.59 4.46 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 1.45 0.00 0.00 1.02 0.00 0.00 58 P 0.00 4.77 0.00 1.95 2.04 0.00 3.76 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 59 F 9.02 4.81 0.00 2.87 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.53 3.79 0.00 1.23 0.79 0.00 1.32 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.92 7.81 61 Q 7.89 4.22 0.00 1.75 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.36 0.00 0.00 0.00 0.00 0.00 1.72 2.15 0.00 62 H 7.58 4.80 0.00 2.96 3.14 0.00 5.71 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.82 5.07 0.00 3.05 3.50 0.00 0.00 5.84 7.64 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 64 S 8.18 4.22 0.00 4.03 3.99 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 65 G 8.93 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 66 V 8.00 3.87 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 0.70 0.00 0.00 1.08 0.00 0.00 67 G 8.31 3.97 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 0.00 0.00 0.00 68 H 8.74 4.76 0.00 2.99 3.15 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 9.11 4.64 0.00 1.52 1.64 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.67 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.22 7.81 70 S 9.06 4.12 0.00 3.98 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 71 K 7.98 4.09 0.00 1.82 1.97 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.47 7.81 72 V 7.46 3.77 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 0.92 0.00 0.00 0.96 0.00 0.00 73 D 8.81 4.79 0.00 2.66 2.56 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 74 G 9.88 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 0.00 0.00 0.00 0.00 75 W 7.54 5.20 0.00 3.26 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 76 D 6.96 4.37 0.00 2.09 2.32 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 77 A 7.34 4.47 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 78 G 7.33 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 79 R 6.70 3.86 0.00 0.67 1.37 0.00 2.85 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.05 0.00 80 Y 7.80 4.76 0.00 2.75 2.95 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 81 P 0.00 4.60 0.00 2.19 1.93 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 82 E 8.46 3.99 0.00 2.21 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 2.39 2.40 0.00 83 K 8.09 3.93 0.00 1.90 1.92 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.55 7.81 84 A 8.14 4.16 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 85 S 8.38 4.14 0.00 4.10 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 86 K 8.42 4.07 0.00 2.03 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.83 7.81 87 A 8.25 4.10 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 88 F 8.35 3.88 0.00 3.40 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 89 L 8.22 4.28 0.00 1.93 1.77 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.77 4.44 0.00 2.94 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 91 L 7.67 3.91 0.00 1.58 1.71 0.82 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.50 3.99 0.00 1.80 1.74 1.04 0.97 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 93 E 8.17 3.94 0.00 2.22 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 0.00 2.33 2.35 0.00 94 N 8.17 4.27 0.00 3.01 2.96 0.00 0.00 7.11 7.69 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 95 A 8.09 3.96 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 96 V 8.38 3.70 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 1.07 0.00 0.00 0.95 0.00 0.00 97 G 7.97 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 98 N 8.44 4.42 0.00 2.92 2.92 0.00 0.00 7.00 7.91 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 99 A 8.29 4.28 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 0.00 100 D 8.03 4.62 0.00 2.89 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 0.00 101 H 8.07 4.23 0.00 3.15 3.39 0.00 5.90 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.62 4.57 0.00 2.53 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.46 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 103 G 8.99 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 0.00 104 F 8.16 4.63 0.00 3.24 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 0.00 105 D 8.41 4.93 0.00 2.79 2.61 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 0.00 0.00 0.00 0.00 106 G 8.58 3.84 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 0.00 0.00 0.00 107 E 8.43 3.94 0.00 2.06 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 2.44 2.37 0.00 108 A 7.79 4.25 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 0.00 109 M 8.33 4.42 0.00 1.84 2.13 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 110 T 8.60 4.53 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 1.20 0.00 0.00 111 I 8.87 4.28 1.87 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 1.12 0.82 0.93 0.00 0.00 112 K 8.75 4.06 0.00 1.78 1.99 0.00 1.95 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.39 7.81 113 H 8.03 5.04 0.00 3.21 3.11 0.00 5.74 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.23 5.43 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 0.86 0.00 0.00 1.12 0.00 0.00 115 A 8.59 4.79 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 0.00 116 A 8.65 5.39 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 0.00 117 H 9.14 4.80 0.00 3.03 3.09 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.74 3.99 0.00 0.79 1.12 0.00 1.60 0.00 0.00 1.44 0.00 0.00 2.59 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.11 1.02 7.81 119 V 8.67 3.74 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 0.72 0.00 0.00 0.94 0.00 0.00 120 G 6.76 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 0.00 121 E 8.04 5.00 0.00 1.77 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 0.00 2.16 2.24 0.00 122 Q 9.28 4.27 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 123 Q 8.77 4.70 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 124 G 10.09 4.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.59 5.16 0.00 1.79 1.78 0.00 3.30 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 126 K 9.25 4.31 0.00 1.27 1.71 0.00 1.09 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 0.43 1.08 7.81 127 P 0.00 4.70 0.00 1.88 1.91 0.00 3.47 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.05 0.00 128 R 8.76 4.78 0.00 1.77 1.81 0.00 3.32 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 129 A 8.32 4.09 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 0.00 130 M 8.93 3.36 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 131 G 8.30 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.39 4.79 0.00 1.92 1.76 0.00 3.04 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 133 A 8.45 5.36 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.86 4.83 0.00 3.93 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 0.00 135 A 8.64 4.54 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 0.00 136 W 9.06 5.12 0.00 3.35 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 0.00 137 N 7.95 5.33 0.00 2.61 2.84 0.00 0.00 7.01 7.57 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 0.00 138 S 8.47 4.69 0.00 3.74 3.70 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 0.00 139 P 0.00 4.64 0.00 2.28 1.96 0.00 3.51 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 2.09 2.08 0.00 140 Q 8.89 4.93 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 141 V 9.35 4.79 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 1.19 0.00 0.00 1.10 0.00 0.00 142 D 8.78 5.61 0.00 2.74 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 0.00 143 V 8.30 4.96 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 0.43 0.00 0.00 0.74 0.00 0.00 144 E 8.99 4.96 0.00 2.03 1.77 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 2.28 2.25 0.00 145 L 8.81 5.25 0.00 1.73 1.62 1.04 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.17 4.83 1.93 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 1.28 0.86 0.87 0.00 0.00 147 L 9.24 4.88 0.00 1.39 1.43 0.92 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.78 5.14 0.00 1.93 1.68 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 2.16 2.20 0.00 149 E 8.74 4.34 0.00 2.02 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 2.64 2.42 0.00 150 P 0.00 4.38 0.00 2.05 2.02 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.21 0.00