NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.6422 8.4093 118.1266 53.2729 39.4198 172.3864 8 S 4.5179 7.4201 114.7494 55.1918 66.0440 172.2455 9 P 4.2754 0.0000 0.0000 62.7114 32.4033 177.4772 10 V 3.9867 8.0510 121.6950 61.8523 32.3346 175.4886 11 R 4.5093 8.4709 126.9209 55.6036 31.3665 175.4589 12 F 5.5377 8.4391 117.8045 55.0081 41.2820 174.1178 13 V 4.3280 9.4680 121.6320 61.0676 34.0958 174.5515 14 K 4.7233 8.6389 127.3835 55.8971 31.9594 176.7017 15 E 4.3190 9.8512 127.4899 58.9318 29.9637 176.9982 16 T 4.7663 7.6954 107.7774 59.4235 72.1298 173.8149 17 N 4.6045 8.6454 117.5378 54.6673 37.4521 176.2030 18 R 3.9988 7.6992 117.5747 58.1148 30.6062 177.1345 19 A 4.2621 7.4136 119.3871 51.9993 18.9006 176.6447 20 K 4.5513 8.2417 120.5805 54.0637 34.4491 176.6895 21 S 4.0371 8.6132 119.3601 58.0892 63.2591 172.5789 22 P 5.2331 0.0000 0.0000 62.6664 31.8112 175.8066 23 T 4.8415 8.5145 112.1649 60.1188 72.7639 172.4977 24 R 4.3708 8.2682 121.9614 54.9308 30.8698 176.2637 25 Q 4.1520 8.9482 123.9451 58.5477 29.1445 177.1520 26 S 4.7075 7.4975 110.0808 55.4801 66.0641 172.8720 27 P 4.2085 0.0000 0.0000 65.0680 30.8837 177.1609 28 G 3.9549 7.8171 105.6226 44.8960 0.0000 173.2683 29 A 4.0624 7.7177 122.8290 51.5919 18.9924 178.4240 30 A 4.0789 8.6558 124.8248 54.6705 18.6697 177.4252 31 G 4.3543 7.4985 99.6556 45.0439 0.0000 171.1558 32 Y 4.7831 8.9409 117.6383 56.2643 39.9834 175.6099 33 D 4.7849 9.3900 125.6590 54.2420 42.1282 175.4566 34 L 4.8522 8.4550 123.0537 53.2513 44.2692 175.1093 35 Y 5.2414 8.1939 118.3263 55.9488 42.3778 174.7395 36 S 4.7231 9.0823 118.4485 58.6992 63.1687 174.3294 37 A 4.3216 9.2120 128.7468 53.0345 19.1804 175.7210 38 Y 4.7732 7.8456 111.7560 56.4650 42.8204 173.9730 39 D 5.1665 8.4467 119.6294 53.2167 42.5434 176.0508 40 Y 4.9558 9.4636 120.5250 56.4694 42.7787 174.5248 41 T 4.8910 8.6873 117.3043 61.9895 71.7132 173.4543 42 I 4.4898 8.7709 128.2362 58.9042 39.4246 173.9135 43 P 4.8844 0.0000 0.0000 61.0097 32.8504 174.4750 44 P 4.2897 0.0000 0.0000 64.6305 31.3753 176.8162 45 G 3.9193 8.9375 109.3792 45.5652 0.0000 172.6127 46 E 4.9687 7.8919 118.5227 54.2025 33.1582 175.0757 47 R 5.1834 8.4484 116.9047 54.6672 32.9277 174.7450 48 Q 4.4269 8.7035 120.8351 54.3133 32.7876 173.4474 49 L 4.5374 8.6333 128.8440 55.1552 42.7879 175.7913 50 I 3.7014 9.1246 129.4651 60.0220 39.0420 175.1299 51 K 4.9281 8.9285 126.2035 55.6155 33.3945 177.4698 52 T 4.3461 8.6932 114.0848 60.5775 70.2660 175.4446 53 D 4.5892 8.5633 119.9730 54.9449 39.2355 172.3013 54 I 5.1548 7.8001 120.6494 59.7095 39.4216 174.8944 55 S 5.3343 9.2962 121.2338 56.7284 66.0096 172.8562 56 M 5.2183 8.5745 118.8643 53.5941 34.5748 174.9588 57 S 4.5706 8.6811 116.3489 57.4675 63.5608 174.0399 58 M 4.3712 8.6212 125.1793 54.0528 32.5525 174.9273 59 P 4.4936 0.0000 0.0000 62.3116 32.0202 176.2180 60 K 4.5497 8.2979 117.5629 56.7294 32.7972 177.1233 61 F 3.9114 8.3529 116.8070 58.7190 37.0585 174.6396 62 C 5.6638 7.6572 116.3250 58.4245 32.6257 172.7228 63 Y 4.9777 8.8241 117.1022 55.5096 41.8986 174.4389 64 G 3.9296 8.9856 108.2368 45.0070 0.0000 172.8108 65 R 4.8062 8.4865 128.1600 55.2416 31.4132 175.7189 66 I 4.2029 8.7939 128.6036 61.2413 36.6010 175.2395 67 A 4.7801 9.0252 129.9497 49.3789 21.4220 174.2950 68 P 4.6356 0.0000 0.0000 62.4770 32.5509 176.3921 69 R 4.1515 8.4212 121.7770 55.9440 31.1394 177.9672 70 S 4.2138 8.7847 118.9690 61.3059 62.8748 176.8603 71 G 3.7456 8.1132 108.1330 48.1787 0.0000 175.6021 72 L 4.0949 7.8249 121.2160 57.1855 41.6310 179.6637 73 S 4.3440 7.6358 116.7800 60.8389 62.5356 176.5291 74 L 4.0989 7.8266 120.7287 56.9320 41.4376 178.6314 75 K 4.3262 7.3523 115.1340 56.3436 32.4689 177.3099 76 G 3.7534 8.1029 108.3811 45.4627 0.0000 172.6562 77 I 4.5716 7.9569 121.5518 59.5395 38.9142 175.0785 78 D 4.8120 8.5837 127.0137 52.6553 44.3269 175.1759 79 I 4.7442 8.1697 120.1151 59.7703 38.8819 175.8935 80 G 3.9617 8.7426 114.5124 44.5142 0.0000 174.9988 81 G 3.7477 9.7953 111.8147 45.8188 0.0000 174.8635 82 G 3.7632 9.1709 114.0337 44.7779 0.0000 172.2928 83 V 4.5189 7.3498 119.7307 61.4430 31.6705 175.3132 84 I 4.1136 8.9204 130.6070 60.0458 37.9998 175.6055 85 D 4.7499 8.6432 127.5751 53.9899 41.6396 177.3201 86 E 3.9854 9.2879 122.5113 59.1128 29.6301 177.9942 87 D 4.8739 7.9478 114.5865 52.8904 40.0369 175.3682 88 Y 4.3247 7.8079 122.2559 57.9664 39.1272 175.2132 89 R 4.3200 7.9199 123.9063 55.6358 31.4086 175.5687 90 G 3.5889 5.3951 107.5442 43.4099 0.0000 172.8403 91 N 4.4931 8.6255 117.6911 54.1070 39.4644 174.4823 92 I 4.1341 9.5605 128.8349 61.5145 38.2315 175.5483 93 G 4.4706 8.7747 113.1850 44.2953 0.0000 171.9871 94 V 4.4321 8.8518 122.6532 60.7515 34.5071 174.5948 95 I 4.4870 8.3474 129.0718 60.7062 38.2358 174.5626 96 L 4.9052 8.6197 128.5547 53.4024 43.5998 175.9851 97 I 4.4575 8.4722 125.7267 59.6286 39.0636 174.9280 98 N 4.5219 8.9012 127.9201 53.2578 38.5855 174.2547 99 N 4.8128 8.8422 121.8432 52.7581 39.5566 175.6400 100 G 3.9146 8.1658 109.4330 44.7023 0.0000 174.2406 101 K 4.1389 8.4184 117.6113 57.7593 32.4699 176.3738 102 C 5.0031 7.6232 116.8177 56.9152 35.0439 173.5591 103 T 4.2108 8.5763 117.8380 64.0723 68.7222 173.5357 104 F 4.9078 9.4937 128.6621 56.5775 41.6994 173.7171 105 N 5.0444 8.0834 123.5349 51.8532 40.1842 174.3937 106 V 4.2094 8.8342 124.2606 61.3779 33.7892 174.4424 107 N 5.3916 8.9202 125.3027 51.5188 41.4685 174.8665 108 T 4.2452 8.7269 118.9080 65.2849 68.8346 175.0822 109 G 4.0111 9.2006 115.7423 45.1038 0.0000 173.5973 110 D 4.6054 7.9064 120.3226 54.2572 41.8864 175.9199 111 R 4.3682 8.8305 124.4964 56.4296 30.1610 175.8172 112 I 4.6150 8.3221 118.4632 60.8982 39.9140 174.5493 113 A 4.4710 7.2355 122.9148 51.3945 22.8701 174.5469 114 Q 4.7429 8.8300 117.2056 54.3731 31.5378 174.6203 115 L 4.6839 9.0292 127.1476 54.2600 43.3066 175.0681 116 I 4.4507 8.3660 128.5969 60.0590 39.1828 175.3118 117 Y 4.6915 8.4788 125.2501 57.4063 37.1453 173.5372 118 Q 4.2592 8.4776 123.1009 54.8411 30.4242 175.2430 119 R 4.7392 8.5677 124.0151 55.9946 30.7530 175.8987 120 I 4.6795 8.5043 116.7890 59.3691 41.0687 174.2004 121 Y 4.7828 8.4270 119.8599 56.8110 39.9685 176.0872 122 Y 5.0061 8.3323 120.8093 56.0374 37.6632 173.8190 123 P 4.6405 0.0000 0.0000 61.6043 32.8610 176.1588 124 E 4.2687 8.5011 119.9276 56.1216 30.2116 176.4220 125 L 4.5573 8.2986 122.7594 53.1614 43.2624 175.6963 126 E 4.5115 8.4415 122.9741 53.9325 31.7635 174.6819 127 E 4.0927 8.8282 127.8194 56.1198 30.2363 175.8579 128 V 4.5923 7.9749 117.9302 59.5077 35.7335 175.8227 129 Q 4.1632 8.7082 119.4526 58.5428 28.7864 176.4629 130 S 4.6402 7.5617 108.4829 57.1293 66.1666 173.7487 131 L 4.2801 8.3187 119.3289 54.9212 41.6491 176.7759 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 7 N 8.41 4.64 0.00 2.73 2.85 0.00 0.00 6.87 6.68 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 8 S 7.42 4.52 0.00 4.04 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 9 P 0.00 4.28 0.00 2.06 2.03 0.00 3.66 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 2.02 2.07 0.00 10 V 8.05 3.99 1.91 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 0.88 0.00 0.00 0.61 0.00 0.00 11 R 8.47 4.51 0.00 1.80 1.79 0.00 3.10 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 12 F 8.44 5.54 0.00 3.12 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 13 V 9.47 4.33 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 1.06 0.00 0.00 0.90 0.00 0.00 14 K 8.64 4.72 0.00 1.73 2.00 0.00 1.87 0.00 0.00 1.97 0.00 0.00 3.12 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.66 7.81 15 E 9.85 4.32 0.00 1.96 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 2.53 2.46 0.00 16 T 7.70 4.77 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 1.37 0.00 0.00 17 N 8.65 4.60 0.00 2.85 2.99 0.00 0.00 6.00 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 18 R 7.70 4.00 0.00 1.62 1.84 0.00 3.18 0.00 0.00 2.91 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 19 A 7.41 4.26 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 20 K 8.24 4.55 0.00 1.45 1.20 0.00 1.51 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.09 1.25 7.81 21 S 8.61 4.04 0.00 3.92 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 5.23 0.00 1.90 2.00 0.00 2.66 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 23 T 8.51 4.84 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 24 R 8.27 4.37 0.00 1.44 1.81 0.00 2.21 0.00 0.00 2.77 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.00 25 Q 8.95 4.15 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 26 S 7.50 4.71 0.00 3.90 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 27 P 0.00 4.21 0.00 2.18 2.22 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 28 G 7.82 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 29 A 7.72 4.06 1.23 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 30 A 8.66 4.08 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 31 G 7.50 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 0.00 0.00 0.00 0.00 32 Y 8.94 4.78 0.00 2.86 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 33 D 9.39 4.78 0.00 2.48 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 0.00 0.00 0.00 34 L 8.46 4.85 0.00 1.46 1.49 0.87 0.50 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 35 Y 8.19 5.24 0.00 2.85 2.80 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 36 S 9.08 4.72 0.00 4.05 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 37 A 9.21 4.32 1.06 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 38 Y 7.85 4.77 0.00 2.67 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 39 D 8.45 5.17 0.00 2.46 2.54 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 40 Y 9.46 4.96 0.00 2.89 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 41 T 8.69 4.89 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 1.24 0.00 0.00 42 I 8.77 4.49 2.03 0.00 0.00 1.00 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 0.81 0.98 0.00 0.00 43 P 0.00 4.88 0.00 2.10 1.99 0.00 3.65 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 44 P 0.00 4.29 0.00 2.18 2.20 0.00 3.84 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 2.01 2.13 0.00 45 G 8.94 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 46 E 7.89 4.97 0.00 1.99 1.84 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 2.23 2.38 0.00 47 R 8.45 5.18 0.00 1.83 1.85 0.00 2.98 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 48 Q 8.70 4.43 0.00 2.16 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.03 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 49 L 8.63 4.54 0.00 1.65 1.57 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 50 I 9.12 3.70 1.76 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 0.86 0.00 0.00 51 K 8.93 4.93 0.00 2.19 1.96 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.56 7.81 52 T 8.69 4.35 4.32 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 1.30 0.00 0.00 53 D 8.56 4.59 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 54 I 7.80 5.15 1.94 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.24 0.99 0.00 0.00 55 S 9.30 5.33 0.00 3.96 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 56 M 8.57 5.22 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.61 0.00 57 S 8.68 4.57 0.00 3.92 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 58 M 8.62 4.37 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.59 0.00 59 P 0.00 4.49 0.00 2.14 1.93 0.00 3.92 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.63 0.00 60 K 8.30 4.55 0.00 1.95 1.70 0.00 2.10 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.40 7.81 61 F 8.35 3.91 0.00 3.23 3.06 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 62 C 7.66 5.66 0.00 3.21 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 63 Y 8.82 4.98 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 64 G 8.99 3.93 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 0.00 0.00 0.00 65 R 8.49 4.81 0.00 1.48 1.66 0.00 3.24 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.91 0.00 66 I 8.79 4.20 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.88 0.86 0.00 0.00 67 A 9.03 4.78 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 68 P 0.00 4.64 0.00 2.04 2.01 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 69 R 8.42 4.15 0.00 1.82 1.85 0.00 3.25 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 70 S 8.78 4.21 0.00 3.84 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 71 G 8.11 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 72 L 7.82 4.09 0.00 1.61 1.54 0.96 1.06 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 73 S 7.64 4.34 0.00 3.92 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 74 L 7.83 4.10 0.00 1.78 1.72 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.35 4.33 0.00 1.86 1.80 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.57 7.81 76 G 8.10 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 77 I 7.96 4.57 1.64 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.19 0.59 0.00 0.00 78 D 8.58 4.81 0.00 2.54 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 79 I 8.17 4.74 1.83 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 1.22 0.86 0.94 0.00 0.00 80 G 8.74 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 81 G 9.80 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 0.00 0.00 0.00 82 G 9.17 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 83 V 7.35 4.52 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 0.59 0.00 0.00 0.85 0.00 0.00 84 I 8.92 4.11 1.99 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 1.21 0.71 1.08 0.00 0.00 85 D 8.64 4.75 0.00 2.70 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 86 E 9.29 3.99 0.00 2.33 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 2.40 2.54 0.00 87 D 7.95 4.87 0.00 2.80 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 88 Y 7.81 4.32 0.00 2.96 3.12 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 89 R 7.92 4.32 0.00 1.62 1.74 0.00 3.36 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.46 0.00 90 G 5.40 3.59 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 0.00 0.00 0.00 91 N 8.63 4.49 0.00 2.82 2.88 0.00 0.00 6.97 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 9.56 4.13 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.25 0.95 0.00 0.00 93 G 8.77 4.47 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 0.00 94 V 8.85 4.43 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 0.93 0.00 0.00 0.91 0.00 0.00 95 I 8.35 4.49 2.03 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 1.31 0.74 0.88 0.00 0.00 96 L 8.62 4.91 0.00 1.58 1.54 1.03 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.47 4.46 1.82 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 1.08 0.58 0.94 0.00 0.00 98 N 8.90 4.52 0.00 2.83 2.89 0.00 0.00 6.72 6.83 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 99 N 8.84 4.81 0.00 2.73 2.78 0.00 0.00 6.95 7.43 0.00 0.00 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 G 8.17 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 0.00 101 K 8.42 4.14 0.00 1.77 1.88 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.36 7.81 102 C 7.62 5.00 0.00 2.96 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 0.00 103 T 8.58 4.21 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 1.29 0.00 0.00 104 F 9.49 4.91 0.00 3.06 2.94 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 0.00 105 N 8.08 5.04 0.00 2.42 2.60 0.00 0.00 6.92 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 0.00 106 V 8.83 4.21 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 1.13 0.00 0.00 1.05 0.00 0.00 107 N 8.92 5.39 0.00 3.00 2.69 0.00 0.00 6.57 6.82 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 0.00 108 T 8.73 4.25 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 1.10 0.00 0.00 109 G 9.20 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 0.00 110 D 7.91 4.61 0.00 2.97 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 0.00 111 R 8.83 4.37 0.00 1.78 1.84 0.00 3.37 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.25 0.00 112 I 8.32 4.61 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 1.02 0.00 0.00 113 A 7.24 4.47 1.15 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 0.00 114 Q 8.83 4.74 0.00 1.98 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.19 0.00 115 L 9.03 4.68 0.00 1.61 1.68 0.69 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.37 4.45 1.71 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 1.17 0.36 0.86 0.00 0.00 117 Y 8.48 4.69 0.00 2.87 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 8.48 4.26 0.00 1.43 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.02 0.00 0.00 0.00 0.00 0.00 2.15 1.95 0.00 119 R 8.57 4.74 0.00 1.62 1.74 0.00 3.13 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 120 I 8.50 4.68 1.82 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.36 1.13 0.00 0.00 121 Y 8.43 4.78 0.00 2.99 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 0.00 122 Y 8.33 5.01 0.00 3.16 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 0.00 123 P 0.00 4.64 0.00 2.07 1.95 0.00 3.80 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 124 E 8.50 4.27 0.00 1.98 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 2.35 2.30 0.00 125 L 8.30 4.56 0.00 1.64 1.59 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.44 4.51 0.00 1.87 1.79 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 2.17 2.25 0.00 127 E 8.83 4.09 0.00 1.97 1.84 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 2.29 2.33 0.00 128 V 7.97 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 0.81 0.00 0.00 0.95 0.00 0.00 129 Q 8.71 4.16 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 130 S 7.56 4.64 0.00 3.91 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 0.00 131 L 8.32 4.28 0.00 1.64 1.59 0.92 0.80 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