NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4279 8.3001 118.1956 55.5169 32.6320 175.1570 2 A 4.5324 8.2278 121.5067 51.4673 19.7100 171.3029 3 V 4.2789 8.5958 120.7546 64.3941 33.4504 173.6806 4 E 4.5429 9.2489 124.8839 56.2166 32.8058 175.3356 5 Y 5.3043 8.0671 115.8796 55.8839 42.1035 174.3448 6 L 5.0805 9.0399 125.1530 53.4582 44.5003 174.9777 7 V 4.6972 9.1053 127.6772 61.3965 32.9237 175.3299 8 D 4.2862 8.3486 127.7997 51.8032 41.5210 177.1878 9 A 3.9472 8.3019 119.8884 55.5726 18.1803 179.9277 10 S 4.0505 7.9220 111.8183 61.3046 63.1642 176.5167 11 A 3.9023 8.6855 124.8430 54.8188 18.1932 179.1403 12 L 3.6703 8.0806 119.3516 58.5553 41.8149 178.6252 13 Y 3.8232 7.8322 117.9830 60.6591 38.5854 177.6201 14 A 4.2300 7.9976 121.2711 55.0167 18.5146 179.6401 15 L 4.1702 8.4256 117.9221 57.6944 41.4026 179.1611 16 A 4.5554 7.9820 119.9964 54.6969 18.1340 178.4287 17 A 4.7035 7.3828 116.0140 52.0228 19.5099 176.7308 18 H 5.0424 9.0365 116.8872 56.5993 30.7425 175.4781 19 Y 3.5580 8.6779 121.3445 60.9960 38.3840 177.8702 20 D 4.1265 8.3190 118.6338 57.3526 40.9908 179.3191 21 K 4.1716 7.5768 117.0396 58.2129 32.3337 177.7395 22 W 4.8627 6.8556 114.1618 55.6599 29.5368 177.0491 23 I 3.0347 6.4003 119.3087 63.9885 36.6444 177.3760 24 K 3.9499 7.6638 118.8511 58.5827 32.4080 177.2996 25 H 4.9499 8.1386 116.0921 55.5758 29.0161 176.7594 26 R 3.9534 7.5735 121.2821 59.3760 28.7994 177.8173 27 E 4.2161 8.0988 113.7375 57.3280 29.6924 176.8538 28 K 5.0669 7.9901 118.3187 55.8408 34.4596 175.5119 29 L 5.3046 8.2089 121.6684 53.0574 43.7999 175.5516 30 A 5.6201 9.3263 124.6687 50.3540 23.3930 174.3539 31 I 4.8612 8.8600 112.0928 59.6904 42.1354 173.9242 32 L 4.8949 8.4329 121.4534 53.1204 44.0545 178.0848 33 H 4.1962 8.8147 117.2863 58.9725 29.2873 177.8132 34 L 4.1666 8.2641 120.5689 58.7063 41.7823 178.7937 35 T 4.0180 7.8885 115.3247 66.9229 68.4154 176.4302 36 I 3.6081 7.5967 120.9821 64.7023 37.0345 178.1832 37 Y 4.0918 7.7599 116.9726 60.9586 37.8952 178.0609 38 E 3.9218 8.4804 119.5094 59.2673 29.6578 179.2393 39 A 4.1984 8.2413 121.1165 54.9552 18.4228 179.9635 40 G 3.6020 8.0898 104.2765 48.0716 0.0000 175.5191 41 N 4.4405 8.6181 119.8682 56.2215 39.0423 176.8496 42 A 3.9726 7.9769 122.0633 55.0305 18.3792 179.4050 43 L 4.2295 8.0840 118.5029 57.8724 42.1102 178.8106 44 W 4.1179 8.5330 128.5464 60.5398 30.4330 178.1382 45 K 3.3532 8.3628 118.2310 59.1105 31.3723 179.1523 46 E 3.9537 7.7246 117.5372 58.9327 29.4642 178.9240 47 A 3.9395 7.9631 121.0052 55.2401 18.1635 179.8957 48 R 3.6280 7.5213 115.7400 58.5478 29.9529 178.1290 49 L 4.5518 7.0250 116.8445 54.3308 42.1561 177.0661 50 G 3.9029 7.7056 105.8353 45.5452 0.0000 173.8697 51 R 4.2055 7.6888 120.2543 55.3397 30.6504 176.6184 52 V 3.8706 8.6347 125.9104 66.1041 31.9538 177.2910 53 D 4.6945 7.8989 119.3264 53.6117 40.7111 178.4090 54 W 4.2703 8.1840 120.4528 60.6061 28.0199 176.9506 55 A 3.7231 6.8211 120.9947 54.7375 17.8464 179.2793 56 A 3.8583 7.6797 118.6045 55.1546 18.5119 179.4125 57 A 3.9722 8.1890 119.6712 55.4256 18.4882 179.7911 58 S 4.2291 8.2988 112.6751 61.9967 62.9146 177.1684 59 R 3.9471 7.7320 121.4140 59.1655 29.8422 178.4447 60 H 4.1181 8.2554 118.1583 59.1794 29.8822 177.1448 61 L 3.9228 8.4159 122.6686 57.9034 41.8344 178.8223 62 K 3.9998 8.2505 119.7521 59.0807 31.8286 178.8674 63 K 3.9400 7.5756 118.9765 59.4324 32.3670 178.6631 64 V 4.1036 7.7560 118.5616 66.2336 31.5612 178.0159 65 L 4.1593 8.2256 119.0272 57.6898 41.2706 179.3631 66 S 4.4154 7.9394 112.5286 60.7849 63.0528 176.1863 67 S 4.3715 8.1254 118.4194 59.8599 62.9226 173.9393 68 F 4.8677 7.6083 119.3458 55.9439 40.7032 176.0035 69 K 4.4506 8.6712 120.2719 56.0538 33.8178 176.1469 70 V 4.7543 8.1657 122.5554 61.1360 33.1320 175.4567 71 L 4.4369 8.5850 128.3334 54.0734 42.6220 176.8943 72 E 4.3096 8.5604 119.6917 56.0092 30.1689 176.9202 73 D 4.5214 8.4151 120.8600 53.8898 41.4360 175.1102 74 P 4.6860 0.0000 0.0000 61.1092 32.7436 174.7251 75 P 4.4144 0.0000 0.0000 62.2074 32.3945 177.4294 76 L 4.1952 8.7002 124.8363 58.3232 42.1248 178.7747 77 D 4.3566 7.9850 118.7011 56.4079 39.3376 178.3452 78 E 3.7060 7.8190 119.5311 58.9728 29.4999 179.2672 79 V 3.1935 7.1248 117.9377 65.6717 31.4052 177.8175 80 L 4.0676 7.8517 119.9708 57.9743 41.8633 178.7301 81 R 3.8288 7.7250 118.2280 59.5179 30.0030 178.4885 82 V 3.5500 7.4669 117.3098 66.0347 31.6026 177.6806 83 A 3.9833 7.9490 120.3392 55.1747 17.8218 179.8669 84 V 3.5119 7.9953 116.6896 66.3598 31.4866 178.2439 85 E 3.9327 8.4002 117.2766 58.6655 29.3922 178.5499 86 R 4.4862 8.3644 115.6805 54.8586 30.9725 176.2024 87 G 3.8245 7.7102 106.5142 46.9735 0.0000 173.5934 88 L 4.7975 7.5081 117.6531 52.1420 44.9655 177.2919 89 T 4.2553 8.0584 111.0435 61.3431 71.1444 175.3128 90 F 3.9834 8.4973 122.4642 61.2932 39.0418 176.7425 91 Y 4.4295 7.6742 116.1408 61.3814 37.9651 177.9623 92 D 4.6840 8.5139 119.6323 57.2948 40.9203 178.6615 93 A 4.0458 8.1535 121.3843 55.0463 18.3576 179.6760 94 S 3.8914 7.6395 113.3704 62.2129 62.9064 176.6629 95 Y 4.1015 7.6903 118.9310 60.6585 37.7003 178.1244 96 A 4.0291 8.0651 121.4817 55.2834 18.4762 179.0700 97 Y 3.9919 8.4917 118.5125 60.8280 38.8745 178.4367 98 V 3.2925 7.7857 118.7505 65.6750 31.5530 177.8252 99 A 3.9309 7.9580 120.5054 55.2734 18.2775 179.5711 100 E 3.8246 7.9561 116.8324 59.6399 29.3869 179.5037 101 S 3.9403 7.8192 112.1305 60.5039 62.2882 175.3643 102 S 4.6315 7.6146 114.9413 56.8695 63.3348 173.9400 103 G 3.8184 7.7398 109.5019 46.7272 0.0000 173.8668 104 L 4.5957 8.3767 119.4562 52.9254 44.5431 176.3466 105 V 4.2681 8.3904 120.4848 61.2044 33.4112 174.3605 106 L 4.6860 8.5534 130.4153 54.7888 43.6722 175.1488 107 V 4.7519 9.3080 127.3642 61.6827 33.2493 174.3089 108 T 4.9579 8.6968 121.9123 60.7867 71.0559 173.7885 109 Q 4.3546 8.6148 126.2273 55.9732 29.6958 175.4942 110 D 4.5669 8.2917 118.2242 54.1398 41.8292 176.5921 111 R 3.9015 8.6359 127.4417 59.2128 30.0647 178.6863 112 E 3.8845 8.8228 119.5709 59.3969 29.6185 178.9023 113 L 4.0488 8.0411 118.5320 57.5133 41.4655 179.2183 114 L 3.9466 7.9043 118.1696 58.0256 41.7491 179.3613 115 A 4.1677 7.8480 118.7536 54.1598 18.3473 178.7508 116 K 4.4652 7.7151 114.4543 55.4250 32.8534 176.2073 117 T 4.7388 7.2459 117.3125 61.0902 71.1518 173.3757 118 K 3.9565 8.9239 128.6048 57.5812 32.5208 177.2723 119 G 3.9355 8.9692 114.2522 45.1002 0.0000 173.3170 120 A 4.5369 7.3752 122.0536 52.2894 19.2105 176.7610 121 I 4.8081 8.8642 114.3230 59.4074 42.2644 173.8551 122 D 5.3293 8.2606 121.7997 51.3761 41.8922 177.7077 123 V 3.4628 8.4592 116.9107 66.1586 31.3402 177.1327 124 E 3.8815 8.2577 118.4435 59.8314 29.3239 178.8026 125 T 3.8238 9.1232 116.2617 66.5178 68.4857 176.1721 126 L 3.7836 7.9624 122.1822 58.2740 42.0393 179.0193 127 L 3.9484 8.1844 119.1012 58.0147 41.1159 180.0387 128 V 3.7280 7.8698 112.0855 64.1004 31.1759 178.9110 129 R 3.8057 7.6501 117.6316 59.1272 30.0096 178.6349 130 L 3.9938 7.9694 117.7325 57.0000 41.6224 178.8719 131 A 4.1691 7.6989 120.3214 54.9632 18.6226 180.6771 132 A 4.3367 7.4477 118.2803 51.7684 18.7676 177.5030 133 Q 4.2772 7.8791 125.2121 58.4685 28.0908 173.4605 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 4.43 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.63 0.00 2 A 8.23 4.53 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 3 V 8.60 4.28 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 0.96 0.00 0.00 0.98 0.00 0.00 4 E 9.25 4.54 0.00 1.60 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 2.08 2.35 0.00 5 Y 8.07 5.30 0.00 2.92 2.81 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 6 L 9.04 5.08 0.00 1.80 1.60 1.06 1.19 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 7 V 9.11 4.70 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.96 0.00 0.00 8 D 8.35 4.29 0.00 1.58 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 0.00 0.00 0.00 9 A 8.30 3.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 7.92 4.05 0.00 4.02 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 11 A 8.69 3.90 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 12 L 8.08 3.67 0.00 1.47 1.84 0.93 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.83 3.82 0.00 3.19 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 14 A 8.00 4.23 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 15 L 8.43 4.17 0.00 1.71 1.38 0.59 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.98 4.56 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 17 A 7.38 4.70 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 18 H 9.04 5.04 0.00 3.52 3.40 0.00 5.67 0.00 0.00 0.00 0.00 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.68 3.56 0.00 2.95 2.92 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 20 D 8.32 4.13 0.00 2.68 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 21 K 7.58 4.17 0.00 1.96 1.95 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.42 7.81 22 W 6.86 4.86 0.00 3.63 3.23 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 23 I 6.40 3.03 0.56 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.76 0.39 0.00 0.00 24 K 7.66 3.95 0.00 1.59 1.52 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.38 7.81 25 H 8.14 4.95 0.00 3.21 3.31 0.00 5.69 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 7.57 3.95 0.00 2.22 2.23 0.00 2.79 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 27 E 8.10 4.22 0.00 2.12 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 0.00 2.30 2.29 0.00 28 K 7.99 5.07 0.00 2.11 2.09 0.00 1.87 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.31 7.81 29 L 8.21 5.30 0.00 1.62 1.68 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.33 5.62 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 31 I 8.86 4.86 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.56 0.00 0.00 32 L 8.43 4.89 0.00 1.47 1.50 0.33 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.81 4.20 0.00 3.43 3.56 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.26 4.17 0.00 1.75 1.71 1.23 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.89 4.02 4.34 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 1.14 0.00 0.00 36 I 7.60 3.61 1.52 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 1.44 0.89 0.59 0.00 0.00 37 Y 7.76 4.09 0.00 3.14 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 38 E 8.48 3.92 0.00 2.04 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 2.15 2.36 0.00 39 A 8.24 4.20 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 40 G 8.09 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.62 4.44 0.00 2.87 2.86 0.00 0.00 7.14 8.19 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 42 A 7.98 3.97 1.11 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 0.00 0.00 43 L 8.08 4.23 0.00 1.98 1.85 1.11 1.02 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 44 W 8.53 4.12 0.00 3.45 3.40 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 45 K 8.36 3.35 0.00 2.00 1.72 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.39 1.89 7.81 46 E 7.72 3.95 0.00 2.30 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 0.00 2.35 2.49 0.00 47 A 7.96 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.52 3.63 0.00 1.30 1.56 0.00 3.03 0.00 0.00 2.97 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.50 0.00 49 L 7.03 4.55 0.00 1.50 1.60 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 50 G 7.71 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 51 R 7.69 4.21 0.00 1.90 1.99 0.00 3.34 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 52 V 8.63 3.87 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 0.87 0.00 0.00 0.96 0.00 0.00 53 D 7.90 4.69 0.00 2.94 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 54 W 8.18 4.27 0.00 3.61 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 55 A 6.82 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.68 3.86 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 57 A 8.19 3.97 1.48 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 0.00 0.00 0.00 58 S 8.30 4.23 0.00 4.23 4.56 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 59 R 7.73 3.95 0.00 2.03 2.01 0.00 3.10 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 60 H 8.26 4.12 0.00 3.20 3.44 0.00 5.78 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.42 3.92 0.00 1.93 1.81 1.08 0.34 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 62 K 8.25 4.00 0.00 2.00 2.00 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 63 K 7.58 3.94 0.00 1.87 1.89 0.00 1.48 0.00 0.00 1.42 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.40 7.81 64 V 7.76 4.10 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 1.49 0.00 0.00 0.89 0.00 0.00 65 L 8.23 4.16 0.00 1.95 1.74 0.91 0.37 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 66 S 7.94 4.42 0.00 4.07 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 67 S 8.13 4.37 0.00 4.27 4.11 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 68 F 7.61 4.87 0.00 2.92 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.67 4.45 0.00 1.84 1.77 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.44 7.81 70 V 8.17 4.75 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 0.55 0.00 0.00 0.95 0.00 0.00 71 L 8.58 4.44 0.00 1.58 1.61 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.56 4.31 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 73 D 8.42 4.52 0.00 2.71 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 74 P 0.00 4.69 0.00 2.09 2.27 0.00 3.72 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 2.02 2.14 0.00 75 P 0.00 4.41 0.00 2.09 1.99 0.00 3.64 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 2.19 2.19 0.00 76 L 8.70 4.20 0.00 1.77 1.69 0.75 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 77 D 7.99 4.36 0.00 2.88 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 78 E 7.82 3.71 0.00 1.24 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 2.25 2.19 0.00 79 V 7.12 3.19 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 -0.10 0.00 0.00 0.71 0.00 0.00 80 L 7.85 4.07 0.00 2.17 1.79 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.72 3.83 0.00 1.90 2.03 0.00 3.15 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.63 0.00 82 V 7.47 3.55 2.20 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 0.96 0.00 0.00 1.01 0.00 0.00 83 A 7.95 3.98 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 84 V 8.00 3.51 2.21 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 1.02 0.00 0.00 0.98 0.00 0.00 85 E 8.40 3.93 0.00 2.01 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 2.35 2.47 0.00 86 R 8.36 4.49 0.00 1.82 1.97 0.00 3.27 0.00 0.00 3.24 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 87 G 7.71 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 88 L 7.51 4.80 0.00 1.66 1.59 0.94 0.77 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 89 T 8.06 4.26 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 1.28 0.00 0.00 90 F 8.50 3.98 0.00 3.01 2.71 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 0.00 0.00 0.00 0.00 91 Y 7.67 4.43 0.00 3.17 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 92 D 8.51 4.68 0.00 2.81 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 93 A 8.15 4.05 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 7.64 3.89 0.00 3.87 3.66 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 95 Y 7.69 4.10 0.00 3.17 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 96 A 8.07 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.49 3.99 0.00 2.98 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 98 V 7.79 3.29 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 0.91 0.00 0.00 0.97 0.00 0.00 99 A 7.96 3.93 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 0.00 100 E 7.96 3.82 0.00 2.07 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 2.30 2.37 0.00 101 S 7.82 3.94 0.00 2.73 3.25 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 0.00 102 S 7.61 4.63 0.00 3.86 3.79 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 0.00 0.00 0.00 0.00 103 G 7.74 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 0.00 104 L 8.38 4.60 0.00 1.45 1.70 0.92 -0.21 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 0.00 105 V 8.39 4.27 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 1.22 0.00 0.00 0.79 0.00 0.00 106 L 8.55 4.69 0.00 1.81 1.55 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 107 V 9.31 4.75 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 0.80 0.00 0.00 0.95 0.00 0.00 108 T 8.70 4.96 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 109 Q 8.61 4.35 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.67 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 110 D 8.29 4.57 0.00 2.67 2.50 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 0.00 111 R 8.64 3.90 0.00 1.86 1.98 0.00 3.34 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 112 E 8.82 3.88 0.00 2.05 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 2.32 2.40 0.00 113 L 8.04 4.05 0.00 1.84 1.69 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.90 3.95 0.00 1.81 1.74 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.85 4.17 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 0.00 116 K 7.72 4.47 0.00 1.83 1.85 0.00 1.66 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.58 7.81 117 T 7.25 4.74 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 1.27 0.00 0.00 118 K 8.92 3.96 0.00 1.72 1.71 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.38 7.81 119 G 8.97 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 0.00 120 A 7.38 4.54 1.28 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 0.00 0.00 121 I 8.86 4.81 1.90 0.00 0.00 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 1.30 1.13 1.01 0.00 0.00 122 D 8.26 5.33 0.00 3.00 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 0.00 123 V 8.46 3.46 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 1.03 0.00 0.00 0.94 0.00 0.00 124 E 8.26 3.88 0.00 2.06 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 2.38 2.42 0.00 125 T 9.12 3.82 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 0.00 126 L 7.96 3.78 0.00 1.56 1.72 -0.07 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.18 3.95 0.00 1.82 1.68 0.84 0.89 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 0.00 128 V 7.87 3.73 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 0.92 0.00 0.00 1.00 0.00 0.00 129 R 7.65 3.81 0.00 2.03 2.06 0.00 3.39 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.93 0.00 130 L 7.97 3.99 0.00 1.53 1.44 0.89 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 131 A 7.70 4.17 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 0.00 132 A 7.45 4.34 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 7.88 4.28 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00