NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3427 8.3001 120.3197 54.8783 33.2128 178.9087 2 A 3.9472 8.8913 127.2898 51.8565 19.0489 176.2474 3 K 4.3912 8.0701 121.8096 54.8774 34.4628 175.1797 4 Q 4.2463 8.2850 122.4199 56.4640 29.3842 175.2666 5 S 4.5840 7.9055 112.1490 57.6408 64.9128 171.5858 6 L 4.3548 7.5386 129.3244 56.0591 49.6967 173.8238 7 D 4.4141 8.0024 118.5909 54.1749 42.3431 177.5821 8 V 4.1713 8.1413 128.4396 61.5296 30.4953 175.5243 9 S 4.5221 7.5268 116.2628 57.0183 63.3475 174.3695 10 S 4.0541 8.4754 120.6110 59.5807 62.3436 173.5233 11 D 4.9881 7.2519 123.2706 53.3545 43.1890 177.3780 12 R 4.2840 7.8436 122.6687 57.9391 30.2789 178.4814 13 R 3.9879 8.2509 118.7621 59.6538 29.8110 178.1364 14 K 3.9476 7.8365 118.1213 59.3502 32.1669 178.7284 15 A 3.8368 7.8979 120.6781 55.1094 18.3571 179.6848 16 R 4.4154 8.0882 116.5098 59.1822 29.7508 179.4073 17 K 4.0903 8.1899 118.5832 59.2581 31.7755 179.2358 18 A 4.0490 7.3851 118.9234 55.4166 18.3983 179.0453 19 Y 4.2217 7.6932 114.1892 60.5111 37.9555 177.1648 20 F 4.8306 8.2409 115.3892 57.4539 41.6249 175.5493 21 T 4.3786 7.6809 115.6967 63.3566 70.2177 173.7170 22 A 3.5433 8.5010 123.4465 51.9719 14.5704 175.0857 23 P 4.2118 0.0000 0.0000 62.0968 32.8937 180.1051 24 S 3.7864 7.5736 114.2602 61.6968 63.0557 176.1880 25 S 4.7445 7.9098 111.8705 58.5084 62.7580 174.3708 26 Q 4.5948 8.1514 117.3349 55.3648 29.9710 176.7726 27 R 4.3789 7.6570 116.4278 56.7364 30.1371 178.2600 28 R 3.9056 7.8181 118.9755 59.3397 30.1985 177.9771 29 V 3.7289 7.7374 116.9330 65.2441 31.7188 176.8825 30 L 4.4561 7.5144 114.8968 54.4082 42.3218 176.4130 31 L 4.8169 7.6245 118.4910 54.3512 43.2488 176.0390 32 S 5.1732 8.1996 113.5272 56.9185 64.8403 173.4072 33 A 4.8559 8.2442 122.6159 49.1622 22.8944 173.5251 34 P 4.5360 0.0000 0.0000 63.5376 32.3181 176.1247 35 L 4.7688 8.3270 122.6747 53.4883 42.6690 178.6497 36 S 4.7714 8.5261 121.8844 58.5438 62.0709 175.8487 37 K 4.5653 8.5617 113.7018 55.9871 34.1436 178.2800 38 E 4.0983 8.2542 119.4611 58.6204 29.5249 177.7374 39 L 4.4114 7.6794 116.5768 55.3108 42.2470 179.0202 40 R 3.9225 7.8328 118.6039 59.1262 29.9301 178.4598 41 A 3.9983 7.4437 118.3686 55.0050 18.4154 179.1380 42 Q 3.7940 7.5207 117.2452 58.5758 29.1891 176.5265 43 Y 4.5895 7.1788 113.3028 56.9729 39.4868 176.6699 44 G 4.0772 8.3044 107.9859 45.8346 0.0000 173.8736 45 I 4.5538 6.9028 121.9238 60.2030 36.0154 174.7483 46 K 4.4292 8.7879 134.6730 57.7113 36.9400 172.6543 47 A 4.9108 7.9492 117.9876 50.9648 22.6159 174.9583 48 L 4.7250 8.2808 119.2667 52.5646 45.9592 173.5221 49 P 4.3731 0.0000 0.0000 63.0673 31.5212 176.2161 50 I 3.8489 8.1451 124.7778 61.5792 38.0392 175.6527 51 R 4.4528 8.3294 124.2957 54.7901 31.9435 176.3712 52 R 4.2444 8.2550 119.5487 56.8303 29.8905 176.1140 53 D 4.8061 7.5486 112.0276 54.2344 43.4387 175.2351 54 D 4.6478 7.9644 119.0785 54.2984 42.4299 175.0396 55 E 4.8473 8.8723 120.9172 54.8264 32.1317 175.3372 56 V 4.9299 8.4447 122.0097 61.2669 35.8341 173.3006 57 L 5.0948 8.7150 126.5401 53.9305 43.4639 175.4730 58 V 4.2296 8.1346 121.1176 62.5778 31.9501 175.6871 59 V 4.3293 8.4136 124.8217 63.5009 34.0672 175.8133 60 R 4.6580 7.9547 118.3426 53.3376 30.8617 175.3572 61 G 3.8765 7.7968 112.3341 45.2990 0.0000 171.2466 62 S 4.6780 8.7585 117.9903 58.1075 64.0872 174.2970 63 K 4.6833 7.6229 119.2271 55.9461 32.4339 176.2393 64 K 4.4655 7.9428 113.7132 56.5307 33.6767 177.9283 65 G 4.3893 7.3831 102.4250 46.0123 0.0000 173.8518 66 Q 4.8101 7.7506 117.1827 54.3122 32.3774 176.7321 67 E 4.9089 9.1725 121.7727 54.5962 31.6329 175.5037 68 G 4.4222 7.6485 113.4343 44.8321 0.0000 172.4118 69 K 4.4242 7.8437 121.1718 56.3770 33.5746 176.1641 70 I 4.4447 7.7727 123.9706 61.0949 36.8923 176.3102 71 S 4.3717 8.5397 122.9695 60.9885 63.9752 174.2647 72 S 4.5839 7.6761 112.3838 57.4757 65.4736 174.1732 73 V 4.5801 7.6880 122.0860 60.3695 33.8728 173.2595 74 Y 4.7417 8.3684 120.5734 56.3034 40.1776 177.2767 75 R 4.0525 8.8829 120.4390 59.1324 30.1703 178.0537 76 L 4.0562 7.9765 117.2984 56.2685 41.8195 177.3871 77 K 3.9740 8.0011 117.0720 54.9831 33.4873 175.2111 78 F 4.0315 7.6846 111.7099 57.7824 37.4600 175.0918 79 A 5.0212 7.7194 119.3240 51.4820 23.2639 176.2111 80 V 4.6810 8.5546 120.4964 61.1168 34.3357 174.2483 81 Q 4.9031 8.8447 129.0820 54.2545 30.8122 174.1828 82 V 4.5559 8.2518 125.0714 61.0229 34.2161 174.1295 83 D 4.7634 8.7569 128.2805 53.5666 41.6145 175.8805 84 K 4.2604 9.1204 124.8720 58.1527 34.2140 176.0386 85 V 2.9610 8.5007 113.7232 61.8677 28.1884 175.6817 86 T 3.3724 7.4520 119.8274 61.9474 67.7450 170.6477 87 K 4.6790 7.8376 120.5720 55.9079 34.4509 174.4984 88 E 4.3150 8.9465 126.3609 56.2092 30.8581 176.2575 89 K 4.6902 8.5095 120.7755 54.8236 34.5572 178.1499 90 V 3.7349 8.5493 115.7889 63.6102 31.7559 176.8717 91 N 4.6538 8.2031 115.3715 52.4923 37.5739 175.2648 92 G 3.7957 8.1608 106.6140 45.7959 0.0000 173.1794 93 A 4.4155 7.7574 120.8175 51.1845 19.5536 177.8954 94 S 5.0406 8.6398 117.6329 56.8324 67.2901 173.8490 95 V 4.1591 8.0573 114.5534 59.3595 34.3124 174.3199 96 P 4.2970 0.0000 0.0000 60.9410 31.9939 171.8684 97 I 3.4825 7.8028 128.3122 61.0759 36.3108 172.4893 98 N 5.4863 8.4086 121.0088 50.7083 42.6897 173.2648 99 L 4.7807 8.2254 118.8565 54.1619 47.3429 173.8381 100 H 5.1994 8.5834 118.5421 53.9987 31.9006 172.8895 101 P 4.3077 0.0000 0.0000 65.3875 31.4658 177.7364 102 S 4.7208 8.0837 112.1516 58.4799 62.8915 174.3153 103 K 4.5645 8.0751 118.7057 55.9373 32.3217 175.1266 104 L 5.3075 7.4714 116.9626 53.0657 46.1402 176.0298 105 V 4.6746 8.3408 118.8374 61.3272 35.0984 173.8456 106 I 4.5688 8.3184 121.7014 60.5335 38.4176 174.8689 107 T 4.3940 8.7883 116.7029 62.8867 69.7693 174.5903 108 K 4.7232 7.8757 121.8991 53.5954 35.4088 175.1235 109 L 5.0592 8.5737 123.2510 53.6782 44.0760 175.7193 110 H 4.8119 8.5525 117.9450 55.4564 30.3635 174.1399 111 L 4.0616 7.7992 117.7606 56.5167 40.6458 175.6959 112 D 4.9397 8.0768 118.6443 51.8280 43.9016 175.8932 113 K 3.7474 8.1149 119.9489 59.2613 32.4517 177.1464 114 D 4.8048 7.6778 115.6947 54.0825 41.4702 178.3997 115 R 3.8530 7.6969 121.1413 59.3155 30.1501 178.2981 116 K 4.0232 7.8749 117.7800 59.2714 32.4254 179.1706 117 A 3.9690 7.0135 122.5603 55.1426 18.5225 179.2472 118 L 4.0810 7.7052 117.2409 58.0057 41.4374 179.8731 119 I 3.7543 7.2572 117.5898 63.7504 37.0786 177.2403 120 Q 4.4491 7.5121 117.6561 55.5744 29.9221 175.6652 121 R 4.6338 7.4642 115.9734 55.6281 30.5114 175.1647 122 K 4.0942 9.2577 118.0234 55.3724 31.9759 177.2360 123 G 3.7121 8.2858 106.4738 47.3214 0.0000 174.9281 124 G 3.7021 8.8067 112.3915 46.1946 0.0000 172.3329 125 K 3.8183 8.9130 116.4938 57.4540 30.6419 177.9555 126 L 4.6687 7.8137 116.7417 52.8027 43.8666 176.7751 127 E 4.2556 8.5425 122.2612 56.4712 30.4874 175.8911 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 4.34 0.00 1.95 1.30 0.00 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 2 A 8.89 3.95 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 3 K 8.07 4.39 0.00 1.71 1.69 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.40 7.81 4 Q 8.28 4.25 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 5 S 7.91 4.58 0.00 3.79 3.71 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 6 L 7.54 4.35 0.00 1.56 1.50 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.00 4.41 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.14 4.17 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 0.89 0.00 0.00 0.98 0.00 0.00 9 S 7.53 4.52 0.00 4.01 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.48 4.05 0.00 3.83 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 11 D 7.25 4.99 0.00 2.77 2.58 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 12 R 7.84 4.28 0.00 2.01 1.95 0.00 3.38 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.86 0.00 13 R 8.25 3.99 0.00 2.14 2.01 0.00 3.17 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 14 K 7.84 3.95 0.00 2.05 1.99 0.00 1.56 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.47 7.81 15 A 7.90 3.84 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 16 R 8.09 4.42 0.00 2.21 2.28 0.00 3.23 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.10 0.00 17 K 8.19 4.09 0.00 2.02 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.61 7.81 18 A 7.39 4.05 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 19 Y 7.69 4.22 0.00 2.76 1.75 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 20 F 8.24 4.83 0.00 3.25 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 21 T 7.68 4.38 4.46 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 1.26 0.00 0.00 22 A 8.50 3.54 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.21 0.00 2.21 2.07 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 24 S 7.57 3.79 0.00 3.92 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 25 S 7.91 4.74 0.00 3.85 3.87 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 26 Q 8.15 4.59 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 27 R 7.66 4.38 0.00 2.05 2.01 0.00 3.57 0.00 0.00 3.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.93 0.00 28 R 7.82 3.91 0.00 1.79 1.99 0.00 3.40 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 29 V 7.74 3.73 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 0.89 0.00 0.00 0.92 0.00 0.00 30 L 7.51 4.46 0.00 1.62 1.38 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.62 4.82 0.00 1.62 1.61 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.20 5.17 0.00 3.85 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 33 A 8.24 4.86 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 34 P 0.00 4.54 0.00 2.12 2.21 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 35 L 8.33 4.77 0.00 1.71 1.70 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.53 4.77 0.00 3.98 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 37 K 8.56 4.57 0.00 1.86 2.03 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.37 1.35 7.81 38 E 8.25 4.10 0.00 2.07 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 2.38 2.44 0.00 39 L 7.68 4.41 0.00 1.77 1.83 0.99 1.41 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 40 R 7.83 3.92 0.00 1.93 1.98 0.00 3.14 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.84 0.00 41 A 7.44 4.00 1.35 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 42 Q 7.52 3.79 0.00 1.95 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.64 0.00 0.00 0.00 0.00 0.00 1.17 2.00 0.00 43 Y 7.18 4.59 0.00 3.17 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 44 G 8.30 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 6.90 4.55 1.92 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 1.35 0.75 0.92 0.00 0.00 46 K 8.79 4.43 0.00 1.78 1.71 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.32 7.81 47 A 7.95 4.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.28 4.73 0.00 1.80 1.44 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.37 0.00 2.09 2.18 0.00 3.79 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 1.96 1.99 0.00 50 I 8.15 3.85 1.92 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 1.10 0.58 0.88 0.00 0.00 51 R 8.33 4.45 0.00 1.87 1.92 0.00 3.09 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 52 R 8.26 4.24 0.00 1.74 1.83 0.00 3.17 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 53 D 7.55 4.81 0.00 2.16 2.41 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 54 D 7.96 4.65 0.00 2.71 2.58 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 55 E 8.87 4.85 0.00 1.92 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 0.00 2.23 2.23 0.00 56 V 8.44 4.93 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 0.99 0.00 0.00 0.93 0.00 0.00 57 L 8.71 5.09 0.00 1.85 1.72 0.99 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.13 4.23 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 0.78 0.00 0.00 0.94 0.00 0.00 59 V 8.41 4.33 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 0.84 0.00 0.00 0.99 0.00 0.00 60 R 7.95 4.66 0.00 1.78 1.80 0.00 3.45 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 61 G 7.80 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 0.00 0.00 0.00 62 S 8.76 4.68 0.00 3.97 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 63 K 7.62 4.68 0.00 1.72 1.93 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.33 1.34 7.81 64 K 7.94 4.47 0.00 2.01 2.03 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.37 7.81 65 G 7.38 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 66 Q 7.75 4.81 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 67 E 9.17 4.91 0.00 1.88 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 2.28 2.31 0.00 68 G 7.65 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 69 K 7.84 4.42 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.48 7.81 70 I 7.77 4.44 1.83 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 1.27 0.46 0.93 0.00 0.00 71 S 8.54 4.37 0.00 3.84 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 72 S 7.68 4.58 0.00 3.78 3.43 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 0.00 0.00 0.00 0.00 73 V 7.69 4.58 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.91 0.00 0.00 74 Y 8.37 4.74 0.00 3.09 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.88 4.05 0.00 1.96 2.09 0.00 3.14 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 76 L 7.98 4.06 0.00 1.62 1.69 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.00 3.97 0.00 1.67 1.82 0.00 1.75 0.00 0.00 1.50 0.00 0.00 2.75 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.19 1.21 7.81 78 F 7.68 4.03 0.00 3.10 3.13 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 0.00 79 A 7.72 5.02 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.55 4.68 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 0.93 0.00 0.00 0.93 0.00 0.00 81 Q 8.84 4.90 0.00 2.29 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 82 V 8.25 4.56 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.94 0.00 0.00 83 D 8.76 4.76 0.00 2.77 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 84 K 9.12 4.26 0.00 1.90 1.77 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.16 1.25 7.81 85 V 8.50 2.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.94 0.00 0.00 86 T 7.45 3.37 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 1.22 0.00 0.00 87 K 7.84 4.68 0.00 1.78 1.70 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.17 1.29 7.81 88 E 8.95 4.31 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 89 K 8.51 4.69 0.00 1.95 1.73 0.00 1.55 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.43 7.81 90 V 8.55 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 0.72 0.00 0.00 0.93 0.00 0.00 91 N 8.20 4.65 0.00 2.82 2.91 0.00 0.00 6.27 7.00 0.00 0.00 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 G 8.16 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 0.00 0.00 0.00 93 A 7.76 4.42 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 8.64 5.04 0.00 3.71 3.73 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 95 V 8.06 4.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.94 0.00 0.00 96 P 0.00 4.30 0.00 2.20 2.01 0.00 3.68 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 2.10 2.11 0.00 97 I 7.80 3.48 1.89 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 1.43 0.61 0.93 0.00 0.00 98 N 8.41 5.49 0.00 2.60 2.75 0.00 0.00 7.06 7.85 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 99 L 8.23 4.78 0.00 1.73 1.57 0.94 0.86 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 0.00 100 H 8.58 5.20 0.00 3.20 3.08 0.00 5.67 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 0.00 101 P 0.00 4.31 0.00 2.13 2.05 0.00 3.45 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 102 S 8.08 4.72 0.00 3.94 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 0.00 103 K 8.08 4.56 0.00 2.00 1.91 0.00 1.59 0.00 0.00 1.84 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.34 7.81 104 L 7.47 5.31 0.00 1.62 1.53 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.34 4.67 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.93 0.00 0.00 106 I 8.32 4.57 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.77 0.91 0.00 0.00 107 T 8.79 4.39 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 1.22 0.00 0.00 108 K 7.88 4.72 0.00 1.75 1.73 0.00 1.53 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.50 7.81 109 L 8.57 5.06 0.00 1.67 1.65 0.99 1.11 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 0.00 110 H 8.55 4.81 0.00 3.23 3.30 0.00 5.77 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.80 4.06 0.00 1.63 1.58 0.63 0.02 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 0.00 112 D 8.08 4.94 0.00 2.73 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.11 3.75 0.00 1.77 1.72 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.48 7.81 114 D 7.68 4.80 0.00 2.77 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.70 3.85 0.00 1.84 2.04 0.00 3.20 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 116 K 7.87 4.02 0.00 1.73 1.80 0.00 1.18 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.38 7.81 117 A 7.01 3.97 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 0.00 118 L 7.71 4.08 0.00 1.70 1.71 1.01 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 119 I 7.26 3.75 1.82 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 1.38 0.54 0.88 0.00 0.00 120 Q 7.51 4.45 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.36 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 121 R 7.46 4.63 0.00 1.81 1.84 0.00 3.36 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 122 K 9.26 4.09 0.00 1.78 2.17 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.21 7.81 123 G 8.29 3.71 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 0.00 0.00 0.00 124 G 8.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.91 3.82 0.00 1.89 2.05 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.43 7.81 126 L 7.81 4.67 0.00 1.61 1.55 0.92 0.90 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 0.00 127 E 8.54 4.26 0.00 1.87 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00