NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5635 8.2649 122.4712 52.1119 20.0671 176.1705 2 T 4.2231 8.6423 119.7165 62.5709 70.1556 172.4825 3 K 5.3489 8.9840 125.1757 54.9109 37.2435 174.5779 4 A 5.3536 9.0993 123.5267 50.9562 23.4021 175.1889 5 V 5.0187 8.8362 117.4583 60.9028 35.4485 173.3250 6 C 4.9698 9.1494 121.7995 58.0088 35.5028 172.5891 7 V 4.5871 8.4551 125.8827 61.4548 33.2350 174.1126 8 L 4.9001 8.9950 129.1820 53.8243 43.2025 176.1427 9 K 4.8739 9.0653 121.9308 55.5207 37.1514 176.2502 10 G 4.3941 7.9540 108.0983 45.6620 0.0000 172.0674 11 D 4.5421 8.8005 117.9697 55.6215 41.8707 176.9880 12 G 4.2226 7.6527 109.2045 44.2450 0.0000 171.8613 13 P 4.5334 0.0000 0.0000 62.8815 32.0229 175.9599 14 V 4.1894 7.5458 120.6364 63.1110 32.0525 174.9778 15 Q 4.8196 8.4951 124.7518 55.4372 32.5086 173.4649 16 G 4.2194 8.0332 106.5092 46.3168 0.0000 171.8685 17 I 5.1479 7.8674 119.7747 59.3700 40.5940 175.1350 18 I 4.5519 8.7386 127.6316 59.4739 40.2202 174.4708 19 N 4.9106 8.4476 124.2073 51.5157 41.0563 173.9892 20 F 5.3476 8.9144 119.8833 55.8003 43.1692 173.7774 21 E 5.2346 9.7044 123.1104 54.7372 33.6260 173.7956 22 Q 4.8669 9.4030 127.5690 54.3198 31.2505 175.7756 23 K 4.0779 9.0554 127.1624 58.7363 32.6963 177.6357 24 E 4.8332 7.7991 116.5742 54.0253 33.0223 176.9269 25 S 4.2387 8.7751 116.1241 60.8977 63.2577 174.6039 26 N 4.8587 8.1390 117.2895 52.8243 38.5422 174.0006 27 G 4.2855 7.7054 107.1617 42.7525 0.0000 171.1856 28 P 4.6515 0.0000 0.0000 62.5781 32.3562 176.4161 29 V 4.5901 8.9191 122.8840 61.4060 33.5533 174.8559 30 K 4.8852 9.2798 128.3648 55.8614 33.8057 175.9707 31 V 4.8615 9.2356 124.9261 60.8562 34.2391 174.2369 32 W 5.4666 8.2966 123.9469 55.0451 31.9674 175.4844 33 G 3.9077 7.0484 106.2697 45.7614 0.0000 170.9249 34 S 5.1335 7.8258 114.2254 56.7698 67.3208 173.3004 35 I 4.9241 8.7854 124.4771 59.3292 40.4308 174.9763 36 K 4.7440 9.2447 125.8551 55.5674 36.0330 176.8605 37 G 3.6865 8.7737 105.8368 45.8635 0.0000 173.2188 38 L 4.5984 7.6080 119.5457 52.6039 43.4399 176.5032 39 T 4.3289 8.1550 111.6054 61.0395 69.5803 174.0587 40 E 4.0483 8.5380 124.5121 57.4357 30.4943 175.1271 41 G 3.7602 8.4022 110.2286 43.9168 0.0000 172.4257 42 L 4.8017 8.2053 118.9136 54.8257 42.8397 176.6158 43 H 4.9996 9.2550 119.4939 53.6935 32.8985 173.3356 44 G 4.0478 9.1688 111.2339 46.9012 0.0000 172.4175 45 F 5.4109 9.1467 124.7860 57.0176 42.4410 172.9795 46 H 5.0779 8.9070 122.5826 54.1293 33.9593 172.6976 47 V 4.4695 8.5059 121.2039 62.4413 32.7374 175.1651 48 H 5.0115 9.3693 125.5633 54.5934 30.5111 176.0646 49 E 3.6998 8.9667 122.3247 58.7502 29.8914 177.0688 50 F 4.9629 8.1152 118.2282 54.8199 41.6296 176.9609 51 G 4.3125 8.3135 112.5974 44.2988 0.0000 174.4259 52 D 4.7390 7.8656 117.2363 52.7343 42.6488 174.1292 53 N 5.1183 8.5387 125.1409 53.4741 39.2387 175.8062 54 T 3.9744 8.5278 109.9076 63.2888 68.9792 174.4394 55 A 4.6898 7.7710 124.9252 51.3687 20.0755 177.4282 56 G 3.8257 8.0137 110.7459 47.5252 0.0000 175.3694 57 C 4.2042 8.5006 115.6124 62.6721 27.8864 175.7374 58 T 3.9852 7.9169 117.7403 66.2272 67.8518 175.5253 59 S 4.5851 7.6179 113.3210 59.0210 63.6011 175.3501 60 A 4.5554 7.5144 126.1813 53.8184 18.3402 178.7752 61 G 4.1589 7.9469 104.9802 43.9973 0.0000 170.6584 62 P 4.7266 0.0000 0.0000 61.9217 34.0297 175.0717 63 H 4.5098 8.3958 116.2639 55.7190 29.6109 175.6240 64 F 4.3004 9.1844 125.3471 58.0114 40.2122 175.4086 65 N 5.1083 7.8942 125.8793 51.8546 39.0227 173.1335 66 P 4.2363 0.0000 0.0000 64.8799 32.1121 177.7431 67 L 4.3769 7.6393 117.3000 53.6084 42.1400 176.2739 68 S 3.5946 7.5189 113.9138 59.6234 60.7464 171.7064 69 R 4.4535 8.0926 117.7658 54.6165 31.8690 176.7234 70 K 4.4178 8.8373 118.8780 55.8591 33.7043 176.4976 71 H 3.9737 8.6453 122.7065 56.8311 30.4955 174.7747 72 G 4.1419 7.4611 109.7385 45.4369 0.0000 172.0842 73 G 4.1448 9.1319 109.4932 43.3240 0.0000 173.3636 74 P 4.4104 0.0000 0.0000 65.1824 31.3072 177.7971 75 K 4.1816 7.9167 116.7650 57.8689 32.4751 176.8076 76 D 4.6454 7.7328 119.1243 53.4007 41.6813 176.3003 77 E 3.8993 8.7467 123.6352 59.1067 29.6658 176.8024 78 E 4.2386 7.9648 122.5160 55.3103 28.5053 174.8052 79 R 4.7365 7.5582 119.6889 55.4101 32.4862 174.8020 80 H 4.6024 9.0803 116.6188 55.2879 29.4270 177.0888 81 V 3.4424 8.2112 122.2612 66.3185 31.3983 177.1760 82 G 3.8895 8.2196 104.5120 47.1102 0.0000 173.4526 83 D 4.9990 8.1839 121.4762 53.4985 40.1606 175.8169 84 L 4.4897 8.4503 121.1277 53.3022 42.4465 178.6777 85 G 4.0065 8.4274 107.9413 46.6227 0.0000 173.4701 86 N 5.5896 8.6876 121.0373 51.4671 41.6720 173.9529 87 V 4.4373 8.5993 113.8827 59.8884 35.5753 174.7478 88 T 4.9896 8.2437 118.6999 61.8578 71.0980 173.1268 89 A 4.7573 8.9759 129.4548 50.8931 20.9437 177.1875 90 D 5.0748 8.8859 122.4700 51.8080 41.3614 177.2476 91 K 4.1616 8.4725 117.2486 59.5057 32.5107 177.1696 92 D 4.5511 8.0930 118.0587 54.1314 41.2023 176.8971 93 G 4.3639 8.4716 108.2281 44.4909 0.0000 172.7067 94 V 4.8563 7.8685 119.4334 60.6771 34.2240 174.2817 95 A 5.0835 8.9701 130.1597 50.0774 20.4545 175.8030 96 D 4.9249 8.5764 123.5716 53.4832 40.5598 175.9344 97 V 3.6596 8.6602 124.1915 62.7019 33.0191 175.0054 98 S 4.6535 8.3833 122.6780 57.7520 64.2484 172.8956 99 I 4.8570 9.2306 128.2221 59.4402 41.6658 174.1595 100 E 5.2320 8.8245 124.9445 54.5742 32.5134 174.3811 101 D 4.9489 9.2788 125.5622 52.6021 44.9628 175.5158 102 S 4.7136 8.9149 118.1978 58.1952 63.7684 174.4737 103 V 4.0831 7.9887 121.1731 64.7479 32.2705 176.3694 104 I 4.0558 7.9417 111.6149 61.1761 38.2060 174.4934 105 S 4.6408 8.4093 114.6328 57.6673 65.4602 174.1332 106 L 4.4826 8.8898 122.0129 54.1872 41.5561 176.2924 107 S 4.4871 7.8716 112.4433 57.9676 66.4615 175.1641 108 G 3.8996 8.5003 108.6024 45.1349 0.0000 173.7443 109 D 4.5171 8.6888 117.3404 57.0882 41.1302 176.7471 110 H 4.9882 8.1481 115.4661 55.5190 28.9126 174.1316 111 C 4.3068 8.0073 121.4453 59.7966 31.7733 173.5273 112 I 3.8815 8.2232 119.3158 61.0128 38.2307 175.9106 113 T 3.8842 7.4301 118.7466 65.0522 68.7538 174.5771 114 G 3.8234 9.3865 114.1567 45.3624 0.0000 172.9552 115 R 4.8753 7.4429 119.1566 54.7075 33.7903 174.4465 116 T 4.9890 7.9689 115.0835 62.1187 71.5047 173.5343 117 L 4.7573 8.6480 128.5905 54.0598 44.0447 175.3546 118 V 4.9743 8.8176 125.9004 60.9931 35.0345 174.2017 119 V 5.0989 8.5777 127.0196 60.5430 33.7133 174.7792 120 H 5.2502 8.8863 120.9501 54.0513 30.8792 174.6234 121 E 4.1954 9.2164 121.6056 58.9896 30.0321 176.4087 122 K 4.8008 8.5084 117.2830 53.7598 36.1216 175.4568 123 A 4.5146 8.3483 122.0132 52.2604 19.6609 176.1399 124 D 5.0475 9.4015 121.5435 53.5164 41.7496 176.0733 125 D 4.6146 9.3638 125.1076 53.0007 39.4963 176.7670 126 L 3.4530 9.7816 119.3874 56.2049 39.5779 175.9512 127 G 4.0416 8.6546 104.6786 46.0025 0.0000 174.8230 128 K 4.5207 8.0475 116.7930 55.9847 32.2623 177.5313 129 G 3.7541 7.8549 108.7109 45.2719 0.0000 175.5270 130 G 4.1547 8.5575 108.2140 45.1673 0.0000 172.4328 131 N 5.0999 7.4713 115.0916 51.1642 40.2546 172.8777 132 E 4.0085 8.9909 113.9890 60.2141 29.7615 178.2585 133 E 3.8155 8.4883 119.3961 59.6191 29.3100 178.6558 134 S 4.0220 10.4949 112.8043 61.8644 62.3522 176.0406 135 T 4.1476 7.9517 110.5312 62.9708 68.4370 175.7281 136 K 4.2642 7.6184 119.7608 57.7547 34.2620 176.8071 137 T 4.0810 8.0614 105.9873 60.0233 70.1242 175.1561 138 G 3.7508 8.1260 110.7696 45.6606 0.0000 173.6845 139 N 4.3083 7.8428 114.4852 54.1959 36.5774 175.4543 140 A 4.3025 7.0958 117.8982 51.3303 19.3774 180.1105 141 G 3.6871 7.3948 105.5696 44.9345 0.0000 173.7724 142 S 4.4034 8.5172 114.4354 58.5155 64.7580 174.1836 143 R 4.3768 8.3513 119.9805 55.2681 29.6664 176.4913 144 L 4.3065 8.8167 125.9284 57.4552 43.0534 177.1240 145 A 4.9289 7.7309 117.7873 51.5156 22.8072 174.7689 146 C 5.3856 8.4416 113.4170 58.7897 33.6565 172.7918 147 G 4.6650 8.0687 104.1111 46.1316 0.0000 172.4811 148 V 4.3998 8.2541 121.2074 62.2512 32.7575 175.5180 149 I 4.1420 8.8606 129.6967 60.9932 38.0681 175.3062 150 G 4.4213 8.9612 114.4134 43.8919 0.0000 172.3084 151 I 4.2725 8.3408 121.9125 61.1581 37.5826 175.4478 152 A 4.8351 8.4980 127.9726 49.6961 22.1543 176.0345 153 Q 4.0702 8.5485 119.0298 56.4191 29.2182 176.0109 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 A 8.26 4.56 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 2 T 8.64 4.22 4.29 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 1.23 0.00 0.00 3 K 8.98 5.35 0.00 1.88 1.72 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 9.10 5.35 1.16 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 0.00 0.00 5 V 8.84 5.02 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 0.81 0.00 0.00 0.93 0.00 0.00 6 C 9.15 4.97 0.00 3.14 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 7 V 8.46 4.59 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 9.00 4.90 0.00 1.69 1.58 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.07 4.87 0.00 1.65 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 7.95 4.39 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 11 D 8.80 4.54 0.00 2.68 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 12 G 7.65 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.53 0.00 2.18 2.16 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 14 V 7.55 4.19 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.50 4.82 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.46 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 16 G 8.03 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 7.87 5.15 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.51 0.81 0.00 0.00 18 I 8.74 4.55 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.19 0.44 0.00 0.00 19 N 8.45 4.91 0.00 1.44 1.47 0.00 0.00 6.41 8.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.91 5.35 0.00 2.87 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 21 E 9.70 5.23 0.00 2.45 2.06 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 2.31 2.39 0.00 22 Q 9.40 4.87 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 23 K 9.06 4.08 0.00 1.81 1.88 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.27 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.42 7.81 24 E 7.80 4.83 0.00 1.95 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 2.30 2.21 0.00 25 S 8.78 4.24 0.00 3.99 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 26 N 8.14 4.86 0.00 2.73 2.86 0.00 0.00 6.63 7.65 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 27 G 7.71 4.29 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 0.00 28 P 0.00 4.65 0.00 1.99 2.04 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.92 4.59 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.09 0.00 0.00 30 K 9.28 4.89 0.00 1.89 1.78 0.00 1.50 0.00 0.00 1.43 0.00 0.00 2.74 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.45 1.42 7.81 31 V 9.24 4.86 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.12 0.00 0.00 32 W 8.30 5.47 0.00 3.50 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 33 G 7.05 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 34 S 7.83 5.13 0.00 3.71 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 35 I 8.79 4.92 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.60 0.95 0.00 0.00 36 K 9.24 4.74 0.00 1.73 1.89 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.34 7.81 37 G 8.77 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 0.00 0.00 0.00 38 L 7.61 4.60 0.00 1.81 1.43 0.82 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.15 4.33 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 1.24 0.00 0.00 40 E 8.54 4.05 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 41 G 8.40 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.21 4.80 0.00 1.51 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.26 5.00 0.00 3.02 3.32 0.00 5.63 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 44 G 9.17 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 45 F 9.15 5.41 0.00 2.96 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 46 H 8.91 5.08 0.00 3.08 2.99 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.51 4.47 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 0.79 0.00 0.00 0.88 0.00 0.00 48 H 9.37 5.01 0.00 3.05 3.42 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.97 3.70 0.00 1.61 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 2.05 0.00 50 F 8.12 4.96 0.00 3.05 2.87 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 51 G 8.31 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 52 D 7.87 4.74 0.00 2.63 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 53 N 8.54 5.12 0.00 2.70 2.74 0.00 0.00 7.25 7.70 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 54 T 8.53 3.97 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 1.24 0.00 0.00 55 A 7.77 4.69 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 56 G 8.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.50 4.20 0.00 2.96 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 58 T 7.92 3.99 4.39 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 1.23 0.00 0.00 59 S 7.62 4.59 0.00 4.10 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 60 A 7.51 4.56 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 61 G 7.95 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 0.00 0.00 0.00 0.00 62 P 0.00 4.73 0.00 2.04 2.20 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 63 H 8.40 4.51 0.00 2.79 3.16 0.00 5.72 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 64 F 9.18 4.30 0.00 2.88 2.93 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 65 N 7.89 5.11 0.00 2.61 2.45 0.00 0.00 6.94 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 66 P 0.00 4.24 0.00 2.10 2.00 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.20 0.00 67 L 7.64 4.38 0.00 1.56 1.67 0.92 0.93 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 68 S 7.52 3.59 0.00 3.95 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 69 R 8.09 4.45 0.00 1.86 1.99 0.00 3.46 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.80 0.00 70 K 8.84 4.42 0.00 1.66 1.69 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.65 3.97 0.00 3.22 3.28 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.46 4.14 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 0.00 0.00 0.00 73 G 9.13 4.14 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 0.00 0.00 0.00 74 P 0.00 4.41 0.00 2.23 2.39 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 75 K 7.92 4.18 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.73 4.65 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.75 3.90 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 78 E 7.96 4.24 0.00 2.06 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 2.32 2.30 0.00 79 R 7.56 4.74 0.00 1.96 1.87 0.00 2.85 0.00 0.00 2.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 80 H 9.08 4.60 0.00 3.48 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.21 3.44 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 0.72 0.00 0.00 0.35 0.00 0.00 82 G 8.22 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 0.00 0.00 0.00 83 D 8.18 5.00 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.45 4.49 0.00 1.90 1.94 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.43 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.69 5.59 0.00 2.60 2.72 0.00 0.00 6.56 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 87 V 8.60 4.44 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 -0.06 0.00 0.00 0.73 0.00 0.00 88 T 8.24 4.99 4.21 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 1.20 0.00 0.00 89 A 8.98 4.76 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.89 5.07 0.00 2.88 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 91 K 8.47 4.16 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.09 4.55 0.00 2.68 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 93 G 8.47 4.36 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 0.00 94 V 7.87 4.86 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 1.01 0.00 0.00 0.92 0.00 0.00 95 A 8.97 5.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.58 4.92 0.00 2.56 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.66 3.66 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 0.67 0.00 0.00 0.58 0.00 0.00 98 S 8.38 4.65 0.00 3.90 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 99 I 9.23 4.86 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.50 1.03 0.00 0.00 100 E 8.82 5.23 0.00 1.96 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 2.22 2.31 0.00 101 D 9.28 4.95 0.00 2.88 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.91 4.71 0.00 4.02 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 0.00 103 V 7.99 4.08 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 0.95 0.00 0.00 104 I 7.94 4.06 1.94 0.00 0.00 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 1.51 0.82 1.05 0.00 0.00 105 S 8.41 4.64 0.00 3.85 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 0.00 106 L 8.89 4.48 0.00 1.78 1.63 1.04 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.87 4.49 0.00 3.93 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 0.00 108 G 8.50 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 0.00 109 D 8.69 4.52 0.00 2.69 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 0.00 110 H 8.15 4.99 0.00 3.23 3.43 0.00 5.64 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.01 4.31 0.00 3.09 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 0.00 112 I 8.22 3.88 1.63 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.20 1.02 0.00 0.00 113 T 7.43 3.88 4.14 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 1.12 0.00 0.00 114 G 9.39 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 0.00 115 R 7.44 4.88 0.00 1.61 1.82 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.20 0.00 116 T 7.97 4.99 4.26 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 1.19 0.00 0.00 117 L 8.65 4.76 0.00 1.76 1.51 0.40 0.67 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 0.00 118 V 8.82 4.97 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 0.72 0.00 0.00 0.74 0.00 0.00 119 V 8.58 5.10 2.31 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 0.74 0.00 0.00 1.01 0.00 0.00 120 H 8.89 5.25 0.00 3.31 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.22 4.20 0.00 2.13 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 0.00 2.37 2.34 0.00 122 K 8.51 4.80 0.00 1.78 1.69 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.38 7.81 123 A 8.35 4.51 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 0.00 124 D 9.40 5.05 0.00 2.75 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 0.00 125 D 9.36 4.61 0.00 2.92 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 0.00 126 L 9.78 3.45 0.00 1.86 1.79 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.65 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 0.00 128 K 8.05 4.52 0.00 1.89 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.53 7.81 129 G 7.85 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 0.00 0.00 0.00 130 G 8.56 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 0.00 0.00 0.00 131 N 7.47 5.10 0.00 2.76 2.80 0.00 0.00 6.03 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 0.00 132 E 8.99 4.01 0.00 2.20 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 133 E 8.49 3.82 0.00 2.08 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 2.57 2.43 0.00 134 S 10.49 4.02 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 0.00 135 T 7.95 4.15 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 1.25 0.00 0.00 136 K 7.62 4.26 0.00 1.74 1.80 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.67 7.81 137 T 8.06 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 138 G 8.13 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 0.00 0.00 0.00 139 N 7.84 4.31 0.00 2.95 2.90 0.00 0.00 6.90 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 0.00 140 A 7.10 4.30 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 0.00 141 G 7.39 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 0.00 0.00 0.00 142 S 8.52 4.40 0.00 3.95 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 0.00 143 R 8.35 4.38 0.00 1.68 1.85 0.00 3.24 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 144 L 8.82 4.31 0.00 1.71 1.70 0.97 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.73 4.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 C 8.44 5.39 0.00 3.01 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 0.00 147 G 8.07 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.25 4.40 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 0.76 0.00 0.00 0.97 0.00 0.00 149 I 8.86 4.14 1.78 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.35 0.39 0.00 0.00 150 G 8.96 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 0.00 151 I 8.34 4.27 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.50 4.84 1.21 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 0.00 153 Q 8.55 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00