NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4134 8.3049 120.3483 55.1555 33.3066 174.9746 2 L 4.1345 8.4044 126.4572 54.1213 42.4828 175.3503 3 K 4.4316 9.3213 121.8074 56.6616 33.4388 176.1593 4 Q 4.7367 7.5173 117.1083 53.9100 32.7270 174.9307 5 V 4.1269 9.3249 123.8131 62.5971 33.2543 174.4822 6 E 4.9056 8.7787 126.1868 54.5642 32.3768 174.9742 7 I 5.0848 8.0942 124.7486 59.4201 41.0562 174.5818 8 F 5.4322 9.2785 124.1570 55.9976 42.4949 174.2047 9 T 5.3534 8.5682 112.1944 60.7137 72.1618 172.3040 10 D 4.7181 8.9580 120.7824 53.9935 45.3683 174.0243 11 G 4.7735 8.5937 108.4849 45.2225 0.0000 171.7220 12 S 4.9181 9.0825 113.4651 57.2496 66.6461 172.8862 13 C 5.1403 8.4198 120.8771 57.9986 34.4331 173.3029 14 L 4.4532 9.0852 124.8714 54.6844 41.9664 176.4668 15 G 4.0196 7.4703 106.5977 46.0270 0.0000 173.4794 16 N 5.0618 8.2852 114.1441 52.1693 39.1263 172.3562 17 P 4.7122 0.0000 0.0000 61.9045 33.8247 175.9816 18 G 4.0466 8.4113 107.3695 44.8299 0.0000 170.4038 19 P 4.9780 0.0000 0.0000 63.4245 32.3625 176.3947 20 G 4.4189 9.1050 110.5717 45.2887 0.0000 170.5551 21 G 4.8284 8.9325 106.2512 46.1098 0.0000 171.7901 22 Y 5.5160 8.1995 116.8363 55.5976 42.1885 174.4485 23 G 4.6815 9.2830 106.3369 44.8539 0.0000 171.5869 24 A 5.4797 9.5184 125.2198 50.5062 23.3400 174.8711 25 I 5.0467 9.0674 122.1690 59.3967 40.6941 174.4352 26 L 5.1932 9.6971 128.9565 53.4397 45.4058 175.1345 27 R 4.9545 9.2488 126.3956 55.0732 31.8502 174.6207 28 Y 4.7333 8.9206 125.1018 57.4835 42.2794 173.0467 29 R 3.8541 9.3755 125.2123 55.5223 28.8281 176.8028 30 G 4.0646 7.1426 103.5048 46.0129 0.0000 172.6164 31 R 4.6211 8.3442 119.2801 53.8301 33.2341 174.1888 32 E 4.9994 8.6025 120.1952 54.6804 31.5104 174.9549 33 K 4.5146 9.5719 128.0310 54.9975 34.6402 175.6146 34 T 5.0449 8.0725 120.2713 61.7395 71.1088 173.4132 35 F 5.0416 9.3612 124.8427 55.9507 42.6671 174.4352 36 S 4.7093 8.7586 112.5077 58.3046 65.2937 174.2909 37 A 4.5580 7.0859 127.2870 50.3355 23.0238 174.6026 38 G 4.4171 8.4384 106.0978 44.5462 0.0000 171.4821 39 Y 5.8589 9.1731 121.2891 55.1588 40.3405 176.8990 40 T 3.8482 8.8758 114.5972 64.6182 69.5963 174.1385 41 R 4.2950 7.8557 122.0756 55.6879 32.2732 173.4416 42 T 4.1656 8.2992 122.0973 61.4284 71.1848 172.0616 43 T 4.8492 8.0335 109.3219 59.0198 72.1583 174.0187 44 N 4.2335 8.7296 120.6296 57.2072 38.7048 176.8854 45 N 4.3031 7.9128 117.1983 56.3140 38.5570 177.4873 46 R 3.8810 7.7559 119.0266 59.3034 30.1393 179.0164 47 M 4.1148 7.9712 118.6364 58.2244 31.4413 178.5738 48 E 4.0555 8.1398 118.7085 59.3754 29.5952 179.5040 49 L 3.8817 7.6783 118.8506 58.0639 41.7361 179.1549 50 M 3.7376 8.3357 118.2469 58.4861 31.4629 178.1035 51 A 3.4948 7.9455 120.7121 54.8370 18.5535 179.5392 52 A 3.9369 7.6469 118.2248 55.2414 18.4217 179.4708 53 I 3.5124 7.7402 118.4711 64.7932 36.9966 178.4078 54 V 3.2886 7.2355 117.3026 65.9997 31.6576 177.7121 55 A 3.5404 7.2236 119.1564 55.0237 18.2413 179.6402 56 L 3.7901 7.6765 117.4757 57.8694 41.5228 179.2879 57 E 4.1049 8.0954 116.2324 57.9189 29.4806 178.1390 58 A 4.3864 7.3215 119.4482 51.8023 18.9268 176.9278 59 L 4.0855 7.1855 118.7669 53.0584 42.2474 177.0573 60 K 4.1877 8.7924 124.0014 58.1414 33.2793 176.4230 61 E 4.7318 7.2627 113.3223 53.7994 32.3096 175.0398 62 H 4.6073 8.5394 116.8297 56.4414 29.2691 174.7839 63 C 4.9927 9.0124 119.1894 58.1331 33.4127 172.5402 64 E 4.9378 8.6394 119.1887 55.0814 30.9080 175.5193 65 V 4.5764 8.8552 124.9530 60.8234 35.5714 174.2275 66 I 4.6517 8.3465 124.9223 59.1332 40.9386 173.4960 67 L 4.7079 8.1823 132.4597 53.2632 43.9377 174.6936 68 S 5.1691 8.5818 121.6969 56.8803 64.7626 172.5899 69 T 4.9525 8.9093 120.3631 61.2909 71.0875 173.2438 70 D 5.3442 8.6979 123.6293 52.4006 40.1979 176.7686 71 S 4.2617 8.0305 116.0588 58.8121 63.2604 174.5840 72 Q 3.8672 8.7817 130.1843 58.9786 28.9433 177.2902 73 Y 4.1905 7.9691 120.3864 60.7207 39.0057 178.0172 74 V 3.6052 8.3893 119.5325 65.9813 31.7098 177.7646 75 R 2.5100 7.6177 118.3605 59.0929 29.5486 178.5245 76 Q 3.2693 8.0176 118.0619 58.2704 28.3888 178.8498 77 G 3.0156 7.2126 106.6130 47.5508 0.0000 175.5684 78 I 3.5237 7.5450 122.6518 64.0414 37.2653 178.2775 79 T 4.0213 7.1660 108.0277 63.2108 69.0092 175.4361 80 Q 4.2070 7.5304 117.9746 54.9113 31.4855 176.6583 81 W 3.8136 7.0693 116.4697 58.1776 29.8642 177.7549 82 I 3.4830 7.0289 118.4080 64.6036 37.1446 177.1833 83 H 3.9151 7.8976 118.0680 59.4542 29.6105 176.7880 84 N 4.2949 7.7987 117.4978 55.6953 38.3872 177.4209 85 W 4.2211 7.8986 120.7288 59.4775 29.1190 178.7256 86 K 3.2071 7.5912 118.5211 59.1321 31.2292 179.6238 87 K 3.9993 7.4422 117.6519 58.6740 31.7297 178.5607 88 R 4.4692 7.5945 116.5466 55.0188 30.0360 176.9153 89 G 4.0341 7.9772 106.3992 46.3325 0.0000 173.9028 90 W 3.4303 8.5976 116.3339 57.8005 26.9227 174.2722 91 K 4.8980 7.4083 116.0390 54.6127 35.0942 176.8777 92 T 4.3482 8.7619 112.2333 60.3210 70.1320 175.5336 93 A 3.9270 8.5796 124.2202 55.0716 18.2513 177.9633 94 D 4.7176 8.0255 112.9100 52.7574 39.6544 176.2447 95 K 3.8469 8.0494 117.0763 58.3265 30.0683 175.4862 96 K 4.6743 7.6512 116.2180 53.4990 35.1353 174.2686 97 P 4.7658 0.0000 0.0000 62.7038 31.8724 177.1164 98 V 3.6739 7.9893 116.4349 60.7897 32.7698 175.6468 99 K 3.8512 8.4026 124.8582 57.3701 32.9511 176.1652 100 N 4.4681 9.0031 123.0858 54.4507 36.0986 176.5614 101 V 3.6398 7.4900 121.9510 65.0996 30.8649 177.1131 102 D 4.2433 8.0417 118.9900 56.5579 39.0369 178.7444 103 L 3.9433 7.7382 120.1293 56.8175 41.7708 179.2387 104 W 4.5746 8.1603 118.9604 59.9866 29.0368 178.5888 105 Q 3.5562 8.2416 118.3239 58.7681 27.8559 178.8178 106 R 3.8527 7.3942 118.5703 59.2028 30.3680 178.0141 107 L 4.1332 8.5492 120.4197 58.2583 42.3178 178.0289 108 D 4.6351 8.8208 118.3423 57.9015 40.9309 178.5849 109 A 4.0826 7.9699 119.0434 55.1064 18.4344 179.0929 110 A 4.1747 8.2281 119.3655 54.8388 18.6552 179.7873 111 L 4.0003 8.0754 117.1242 58.1853 41.8478 179.4398 112 G 3.8208 7.9655 102.8771 47.0890 0.0000 173.5797 113 Q 4.5635 7.6914 117.8222 56.1587 29.9189 174.6398 114 H 5.0177 8.2313 115.0753 54.2255 33.9283 172.4999 115 Q 4.4638 9.4118 121.0759 55.0494 29.9088 174.1248 116 I 4.7183 8.2455 127.0805 59.1996 40.1513 175.1767 117 K 4.4241 8.3512 126.2188 54.4266 34.8448 174.6772 118 W 4.5049 8.6125 127.2285 55.0657 30.9300 175.5186 119 E 4.2039 8.6710 125.8891 54.1400 31.0023 174.9773 120 W 5.2652 8.3604 128.1264 56.2900 29.5210 176.6552 121 V 4.4459 8.5664 118.3828 59.6360 34.3774 175.4854 122 K 4.5472 8.4026 121.3726 55.0405 33.1890 178.2066 123 G 3.9107 9.0539 113.2817 49.1324 0.0000 174.1751 124 H 4.4389 8.1893 112.7400 56.8550 29.0420 175.5522 125 A 4.4970 8.1825 123.1645 49.7848 18.6747 174.6749 126 G 4.2268 7.8782 109.5425 43.0935 0.0000 170.0542 127 H 4.5740 8.6774 116.1513 54.3682 29.6715 175.1796 128 P 4.5374 0.0000 0.0000 65.3234 31.0646 178.8670 129 E 3.7633 7.8058 116.8149 59.1269 29.1952 178.8451 130 N 4.5092 8.2407 116.7856 56.4042 38.4678 177.3187 131 E 4.0179 8.0963 119.5588 59.4113 29.5936 179.2395 132 R 3.9053 8.1308 118.7908 59.4002 30.0171 178.2531 133 C 4.1562 8.0884 116.1089 62.7687 28.0872 175.9455 134 A 4.1020 7.9031 121.7769 55.1578 17.9085 179.3104 135 E 3.9047 7.8863 117.1538 59.7030 29.5709 179.5200 136 L 3.9471 8.0781 118.5169 57.8953 41.7289 179.5509 137 A 3.9994 8.2489 120.5954 55.1927 18.1084 179.9258 138 R 3.8107 8.1820 115.4763 59.2808 30.4909 178.7472 139 A 4.1016 8.2692 120.5632 55.2755 18.4166 179.2204 140 A 3.8676 8.0982 118.9631 55.6194 18.1711 179.7952 141 A 4.1931 7.8286 117.5283 55.0365 18.5046 178.8820 142 M 4.3123 7.7332 115.1581 55.7747 33.7024 175.9577 143 N 4.9930 7.7735 117.0715 51.2678 39.1158 172.3235 144 P 4.4110 0.0000 0.0000 63.2600 32.5160 177.0244 145 T 4.6033 8.4254 108.9160 61.0214 70.2761 173.2051 146 L 4.6683 7.2867 120.8605 53.2651 45.7739 174.3482 147 E 4.9303 8.5003 120.7838 54.8263 31.4186 176.2745 148 D 4.9028 8.5470 126.6090 52.8024 39.8196 176.3303 149 T 4.0001 8.2366 119.8043 65.9475 69.0478 176.1190 150 G 3.9503 8.1041 108.6385 47.3435 0.0000 173.3983 151 Y 4.0686 7.9171 121.3894 58.0752 38.9021 175.2825 152 Q 4.2678 7.8051 124.8214 53.8914 32.4495 175.2683 153 V 3.9581 7.4499 117.4378 62.6227 32.7059 176.8961 154 E 3.6900 7.7207 117.8805 58.4766 29.3441 176.9743 155 V 3.8258 7.8715 125.6749 63.3983 31.5999 175.7632 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.41 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 2 L 8.40 4.13 0.00 1.78 1.59 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 3 K 9.32 4.43 0.00 1.74 1.83 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.39 7.81 4 Q 7.52 4.74 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 5 V 9.32 4.13 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 0.92 0.00 0.00 1.01 0.00 0.00 6 E 8.78 4.91 0.00 2.02 1.70 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 2.09 2.21 0.00 7 I 8.09 5.08 1.63 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.53 0.85 0.00 0.00 8 F 9.28 5.43 0.00 3.03 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 9 T 8.57 5.35 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 10 D 8.96 4.72 0.00 2.92 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 11 G 8.59 4.77 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 0.00 0.00 0.00 12 S 9.08 4.92 0.00 3.88 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 13 C 8.42 5.14 0.00 2.94 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 14 L 9.09 4.45 0.00 1.58 1.67 0.92 0.81 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 15 G 7.47 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.29 5.06 0.00 2.67 2.67 0.00 0.00 6.84 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 17 P 0.00 4.71 0.00 1.80 1.54 0.00 3.88 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.06 0.00 18 G 8.41 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.98 0.00 2.08 2.05 0.00 3.52 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 2.11 2.22 0.00 20 G 9.10 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 0.00 0.00 0.00 21 G 8.93 4.83 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 22 Y 8.20 5.52 0.00 3.23 3.17 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 23 G 9.28 4.68 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 0.00 0.00 0.00 24 A 9.52 5.48 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 25 I 9.07 5.05 2.07 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.80 0.98 0.00 0.00 26 L 9.70 5.19 0.00 1.99 1.97 0.89 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 27 R 9.25 4.95 0.00 1.88 1.93 0.00 3.23 0.00 0.00 3.15 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 28 Y 8.92 4.73 0.00 2.96 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 29 R 9.38 3.85 0.00 1.73 1.71 0.00 2.77 0.00 0.00 2.25 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 30 G 7.14 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 31 R 8.34 4.62 0.00 1.90 1.80 0.00 3.05 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 32 E 8.60 5.00 0.00 1.95 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 2.19 2.34 0.00 33 K 9.57 4.51 0.00 1.58 1.09 0.00 1.79 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.48 7.81 34 T 8.07 5.04 4.16 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 1.28 0.00 0.00 35 F 9.36 5.04 0.00 3.21 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 36 S 8.76 4.71 0.00 3.79 3.61 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 37 A 7.09 4.56 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.44 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 0.00 0.00 0.00 39 Y 9.17 5.86 0.00 2.91 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.88 3.85 4.25 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 1.25 0.00 0.00 41 R 7.86 4.29 0.00 1.78 1.85 0.00 3.28 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 42 T 8.30 4.17 4.13 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 1.25 0.00 0.00 43 T 8.03 4.85 4.16 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 1.14 0.00 0.00 44 N 8.73 4.23 0.00 2.83 2.82 0.00 0.00 6.95 6.71 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 45 N 7.91 4.30 0.00 2.40 1.56 0.00 0.00 7.15 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 46 R 7.76 3.88 0.00 1.91 1.84 0.00 3.37 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 47 M 7.97 4.11 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.81 0.00 48 E 8.14 4.06 0.00 2.29 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 2.43 2.42 0.00 49 L 7.68 3.88 0.00 1.67 1.47 0.14 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 50 M 8.34 3.74 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.41 0.00 51 A 7.95 3.49 1.50 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 0.00 0.00 0.00 52 A 7.65 3.94 1.45 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 0.00 0.00 53 I 7.74 3.51 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.71 0.82 0.00 0.00 54 V 7.24 3.29 1.69 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 0.49 0.00 0.00 0.65 0.00 0.00 55 A 7.22 3.54 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 56 L 7.68 3.79 0.00 1.78 1.67 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.10 4.10 0.00 1.82 1.95 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 2.31 2.37 0.00 58 A 7.32 4.39 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 59 L 7.19 4.09 0.00 1.64 1.44 0.46 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.79 4.19 0.00 1.93 2.00 0.00 1.59 0.00 0.00 1.87 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.64 7.81 61 E 7.26 4.73 0.00 2.18 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 2.38 2.38 0.00 62 H 8.54 4.61 0.00 3.09 3.26 0.00 5.64 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 9.01 4.99 0.00 2.70 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 64 E 8.64 4.94 0.00 1.88 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 2.28 2.26 0.00 65 V 8.86 4.58 1.83 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 0.61 0.00 0.00 0.68 0.00 0.00 66 I 8.35 4.65 1.69 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.22 0.77 0.00 0.00 67 L 8.18 4.71 0.00 0.93 0.84 0.50 0.88 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 68 S 8.58 5.17 0.00 3.68 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 69 T 8.91 4.95 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 1.64 0.00 0.00 70 D 8.70 5.34 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.03 4.26 0.00 4.01 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 72 Q 8.78 3.87 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 73 Y 7.97 4.19 0.00 3.21 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 74 V 8.39 3.61 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 1.02 0.00 0.00 1.03 0.00 0.00 75 R 7.62 2.51 0.00 0.82 1.40 0.00 2.38 0.00 0.00 2.60 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 76 Q 8.02 3.27 0.00 1.43 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 77 G 7.21 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 0.00 0.00 0.00 78 I 7.54 3.52 1.45 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 -0.36 0.45 0.00 0.00 79 T 7.17 4.02 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 1.01 0.00 0.00 80 Q 7.53 4.21 0.00 1.41 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 81 W 7.07 3.81 0.00 2.08 1.74 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 82 I 7.03 3.48 1.77 0.00 0.00 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 1.47 1.44 0.85 0.00 0.00 83 H 7.90 3.92 0.00 3.19 3.16 0.00 5.91 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 84 N 7.80 4.29 0.00 2.56 2.73 0.00 0.00 7.12 7.68 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 85 W 7.90 4.22 0.00 2.98 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 86 K 7.59 3.21 0.00 1.55 1.68 0.00 1.65 0.00 0.00 1.56 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.96 0.94 7.81 87 K 7.44 4.00 0.00 1.79 1.82 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.53 7.81 88 R 7.59 4.47 0.00 1.82 1.94 0.00 3.22 0.00 0.00 3.16 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.78 0.00 89 G 7.98 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 0.00 0.00 0.00 90 W 8.60 3.43 0.00 3.42 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 91 K 7.41 4.90 0.00 2.00 1.67 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.54 7.81 92 T 8.76 4.35 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 1.21 0.00 0.00 93 A 8.58 3.93 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 94 D 8.03 4.72 0.00 2.76 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 95 K 8.05 3.85 0.00 1.91 1.95 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.53 7.81 96 K 7.65 4.67 0.00 1.77 1.64 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.35 7.81 97 P 0.00 4.77 0.00 1.87 1.92 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.08 0.00 98 V 7.99 3.67 1.13 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 -0.22 0.00 0.00 -0.09 0.00 0.00 99 K 8.40 3.85 0.00 1.78 1.83 0.00 1.94 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.53 7.81 100 N 9.00 4.47 0.00 3.23 2.93 0.00 0.00 6.87 7.68 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 0.00 101 V 7.49 3.64 2.12 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 0.89 0.00 0.00 0.65 0.00 0.00 102 D 8.04 4.24 0.00 2.82 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 0.00 103 L 7.74 3.94 0.00 1.68 1.54 0.78 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 104 W 8.16 4.57 0.00 3.41 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.24 3.56 0.00 1.81 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 106 R 7.39 3.85 0.00 1.85 2.05 0.00 3.24 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 1.61 0.00 107 L 8.55 4.13 0.00 1.88 2.06 1.08 1.39 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 0.00 108 D 8.82 4.64 0.00 3.38 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 0.00 109 A 7.97 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 0.00 110 A 8.23 4.17 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 0.00 111 L 8.08 4.00 0.00 2.05 1.92 1.29 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 112 G 7.97 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.69 4.56 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.64 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 114 H 8.23 5.02 0.00 2.93 3.26 0.00 5.82 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 0.00 115 Q 9.41 4.46 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 I 8.25 4.72 1.68 0.00 0.00 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 0.92 0.64 -0.23 0.00 0.00 117 K 8.35 4.42 0.00 1.63 1.42 0.00 1.50 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.22 1.44 7.81 118 W 8.61 4.50 0.00 2.48 1.74 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 E 8.67 4.20 0.00 1.86 1.67 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 2.22 2.25 0.00 120 W 8.36 5.27 0.00 3.26 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 0.00 121 V 8.57 4.45 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 1.09 0.00 0.00 1.08 0.00 0.00 122 K 8.40 4.55 0.00 1.65 1.68 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.37 7.81 123 G 9.05 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 0.00 124 H 8.19 4.44 0.00 3.31 3.46 0.00 5.48 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.18 4.50 1.07 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 0.00 126 G 7.88 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 8.68 4.57 0.00 3.19 3.27 0.00 5.65 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 0.00 128 P 0.00 4.54 0.00 2.07 2.09 0.00 3.87 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 129 E 7.81 3.76 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.98 0.00 130 N 8.24 4.51 0.00 3.05 2.98 0.00 0.00 6.98 7.21 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 0.00 131 E 8.10 4.02 0.00 2.12 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 2.42 2.58 0.00 132 R 8.13 3.91 0.00 2.02 2.03 0.00 3.08 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 133 C 8.09 4.16 0.00 3.35 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.90 4.10 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 E 7.89 3.90 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 136 L 8.08 3.95 0.00 1.96 1.74 0.97 0.56 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 0.00 137 A 8.25 4.00 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 0.00 138 R 8.18 3.81 0.00 1.92 2.01 0.00 3.19 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 139 A 8.27 4.10 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 0.00 140 A 8.10 3.87 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 0.00 141 A 7.83 4.19 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 M 7.73 4.31 0.00 2.01 2.11 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 2.60 2.88 0.00 143 N 7.77 4.99 0.00 2.61 2.63 0.00 0.00 7.16 7.78 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 0.00 144 P 0.00 4.41 0.00 2.24 2.11 0.00 3.75 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 1.98 1.95 0.00 145 T 8.43 4.60 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 146 L 7.29 4.67 0.00 1.13 0.90 0.57 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.50 4.93 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 148 D 8.55 4.90 0.00 2.77 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 0.00 149 T 8.24 4.00 4.28 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 1.23 0.00 0.00 150 G 8.10 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 0.00 0.00 0.00 151 Y 7.92 4.07 0.00 3.08 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.81 4.27 0.00 1.79 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.67 0.00 0.00 0.00 0.00 0.00 2.09 2.33 0.00 153 V 7.45 3.96 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 0.65 0.00 0.00 0.95 0.00 0.00 154 E 7.72 3.69 0.00 1.87 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 0.00 2.27 2.33 0.00 155 V 7.87 3.83 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 0.76 0.00 0.00 0.89 0.00 0.00