NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4511 8.3049 118.1930 54.5413 32.9450 174.7013 2 N 4.2727 10.4025 116.5035 51.7001 39.2592 173.4292 3 T 4.5379 8.7875 112.3145 60.4593 72.6890 174.0466 4 P 4.1922 0.0000 0.0000 65.6260 31.3609 179.0064 5 E 3.9213 8.0227 117.2471 59.4835 29.3826 178.5761 6 H 4.0448 8.2076 118.2307 59.6548 29.9767 177.3390 7 M 3.3319 7.6434 120.2707 58.1490 31.4917 179.0359 8 T 3.7757 7.8928 115.8750 66.4729 68.5709 176.5062 9 A 4.1751 7.9261 124.0654 54.5564 18.2943 179.8024 10 V 3.4869 7.8326 116.7837 66.1172 31.7487 178.3376 11 V 3.3861 7.8686 117.8852 66.1396 30.8067 178.0017 12 Q 3.9420 8.1705 117.8406 59.0586 28.4837 179.0776 13 R 3.9427 8.3619 119.4800 59.0720 30.0298 178.2249 14 Y 4.1009 8.3673 119.8925 60.8372 38.7463 178.4049 15 V 3.4016 7.6697 118.1377 66.0559 31.6369 177.8181 16 A 3.9363 8.1619 120.2225 55.1838 18.1619 179.5126 17 A 3.9536 8.3980 119.6831 54.9606 18.3819 179.9281 18 L 3.8185 7.8333 117.6743 58.1273 41.5029 179.3588 19 N 4.3398 8.0858 114.8521 55.9561 38.5759 176.3841 20 A 4.4314 7.9101 119.2241 51.1567 19.1608 177.3137 21 G 3.8391 7.7033 105.1740 46.9005 0.0000 175.4247 22 D 4.6115 8.0668 121.4293 51.6756 39.0028 175.2643 23 L 3.9558 7.9990 125.6927 58.1864 42.3611 177.9119 24 D 4.5228 8.1538 118.0699 56.9471 40.5758 178.7236 25 G 3.7330 7.9550 107.1123 47.2194 0.0000 175.4753 26 I 3.8895 7.8306 122.4666 64.1799 37.1706 178.7913 27 V 3.7560 7.8277 118.7666 65.9426 31.1072 177.8305 28 A 4.1301 8.1821 119.7995 54.7628 18.3532 179.2518 29 L 3.9268 8.0473 117.7426 56.3471 41.6204 177.2258 30 F 4.5607 7.5424 116.5063 55.6586 40.6343 175.6344 31 A 4.2860 8.8064 126.9436 51.9131 18.4690 178.7424 32 D 4.5916 8.9274 118.4530 54.7950 39.8482 177.3033 33 D 4.6865 7.8520 118.5105 52.8714 40.0718 176.0776 34 A 4.6906 7.8184 121.6781 53.1403 19.9779 177.2480 35 T 5.1160 8.8096 108.4890 59.9056 72.6109 173.1303 36 V 4.7343 8.5025 122.8745 61.0486 34.6625 173.7834 37 E 4.7854 9.2259 128.8888 54.6323 31.9964 174.3800 38 D 4.9126 8.2530 127.4183 52.5701 44.1682 173.1482 39 P 4.7767 0.0000 0.0000 61.3793 33.6470 175.5293 40 V 3.7762 7.7098 119.5706 64.9837 31.6540 174.3634 41 G 4.0880 8.9905 114.0972 45.8786 0.0000 174.2715 42 S 4.2265 7.7394 114.5022 58.0549 63.4058 173.4217 43 E 4.1197 8.3806 122.8973 55.1275 29.9495 174.5948 44 P 4.4969 0.0000 0.0000 62.9196 32.1141 176.0014 45 R 4.3843 8.9972 124.1001 55.3825 31.8255 175.4068 46 S 4.8394 8.5255 117.2772 57.6254 65.2287 174.7743 47 G 4.1308 9.0051 111.1200 45.7175 0.0000 174.4548 48 T 3.8253 8.5164 115.1992 66.4940 68.3349 176.7028 49 A 4.0659 7.9840 121.6910 55.3039 18.4842 179.3840 50 A 3.9438 7.9513 118.6998 55.3126 18.4613 179.8412 51 I 3.6536 7.9023 118.4021 64.4907 37.1207 178.5584 52 R 4.0399 8.7691 120.0774 59.4859 29.7962 178.4861 53 E 3.9467 8.4959 118.6062 59.1625 29.4503 178.7698 54 F 3.9594 8.3207 120.8208 61.8254 39.4531 176.9554 55 Y 3.7568 8.0559 115.7818 60.5985 37.4040 177.9519 56 A 4.0003 8.1435 121.5210 55.3293 18.8827 179.1712 57 N 4.3233 8.2426 115.0146 56.4836 38.3791 177.7736 58 S 3.9040 7.5324 115.5929 61.1220 62.9292 175.8483 59 L 4.3694 7.3709 118.5068 54.8250 41.7080 178.4041 60 K 3.9787 7.7291 119.4211 57.5891 32.3123 176.7510 61 L 4.7665 7.0109 117.9110 51.6461 43.9842 174.2810 62 P 4.4034 0.0000 0.0000 62.8035 31.9532 175.4897 63 L 5.0701 8.4054 121.5498 52.9396 44.4012 175.7531 64 A 4.7872 9.0283 124.5089 50.4577 21.1000 175.2148 65 V 4.9453 9.6706 123.2260 61.7881 33.8853 174.8746 66 E 4.7178 9.3161 127.9341 54.2494 32.8086 174.3860 67 L 4.7616 8.9038 127.8617 55.3845 41.9721 177.0589 68 T 4.5871 8.8802 113.1252 61.9756 69.8660 174.0126 69 Q 4.6259 7.9092 119.7885 54.2330 33.0292 173.6898 70 E 4.0994 8.5618 117.2802 56.7159 29.9474 176.9308 71 V 4.0103 8.1245 120.3150 62.9624 32.8186 175.1403 72 R 4.7579 9.0141 125.7837 54.5383 32.1366 175.1172 73 A 5.2383 8.3687 125.1923 50.2857 22.0745 175.3883 74 V 4.0908 9.4290 119.5415 61.4138 34.4148 173.0923 75 A 3.5645 9.4839 123.1197 53.8456 17.6297 176.5732 76 N 4.2993 8.6200 112.0532 53.9175 36.6954 173.7887 77 E 5.5430 8.4549 117.5668 54.6353 33.6487 174.7876 78 A 5.3548 9.1597 122.3367 50.4904 23.2314 175.0061 79 A 5.3248 9.2419 121.2680 50.4174 23.1779 175.2352 80 F 5.3007 8.8043 114.0331 55.5338 41.9726 173.0272 81 A 5.4182 8.4678 121.8039 50.5715 22.0534 175.2376 82 F 5.2661 7.8765 113.5160 56.8670 41.9193 172.5769 83 T 4.7659 8.8057 108.6807 59.7707 72.4435 172.9363 84 V 4.8871 8.6219 123.0642 61.3983 34.2619 174.2704 85 S 5.3083 9.3181 124.5788 56.7176 65.7679 173.3039 86 F 5.4401 8.3766 118.3355 55.4267 42.1077 173.0566 87 E 5.0655 8.8486 118.2981 54.6287 32.7095 173.3185 88 Y 4.8452 8.7936 125.9511 57.0840 41.7300 175.1120 89 Q 3.0230 9.4290 126.9585 57.0422 26.2331 174.7807 90 G 4.0108 8.3115 103.4370 45.5596 0.0000 173.4648 91 R 4.5055 7.7438 119.8388 54.2110 31.6212 175.0842 92 K 4.7897 8.3848 122.7192 55.7418 34.1084 175.9812 93 T 4.7147 8.4094 120.3808 61.5393 72.7628 173.1116 94 V 4.5814 8.7322 124.6904 61.1687 34.4305 174.2104 95 V 4.6072 8.9175 128.3662 61.3625 33.6580 174.4679 96 A 4.9494 8.6006 129.6320 48.6899 19.2508 173.9385 97 P 4.7816 0.0000 0.0000 61.6527 34.4688 174.3852 98 I 4.5786 8.4898 121.1074 59.8509 40.0741 174.9786 99 N 5.2473 8.3008 124.3516 51.8260 41.2752 173.4579 100 H 5.2524 9.0300 121.4854 54.4857 33.1046 172.0443 101 F 5.5828 9.1421 124.6231 55.8688 41.6660 174.4628 102 R 5.1121 8.8512 123.5130 54.7164 32.2803 174.6584 103 F 5.1830 9.3566 125.1723 55.7604 41.6275 175.4435 104 N 4.7935 9.0138 120.3008 51.2343 39.0159 176.3103 105 G 3.5428 8.6733 106.5870 48.7740 0.0000 174.4744 106 A 4.0789 7.9927 119.6747 52.5597 18.5122 177.9237 107 G 4.2848 8.9408 104.7114 45.4240 0.0000 173.7900 108 K 4.5504 8.3060 119.0385 54.3194 34.1529 175.7489 109 V 3.2879 7.7651 122.3940 62.8049 31.8171 176.8766 110 V 4.5452 8.7748 121.3565 62.0774 33.6242 176.0020 111 S 5.1770 7.6683 114.9619 57.1461 66.3504 172.6535 112 M 5.4376 9.4571 124.1099 53.9315 35.0440 174.4988 113 R 5.1505 9.1455 123.5434 54.4199 34.3662 173.9522 114 A 5.4420 9.0832 126.3089 49.7063 21.2305 175.2118 115 L 4.7829 8.9955 126.4133 53.9811 43.7854 175.2379 116 F 5.1361 7.9976 119.1925 56.3791 40.5598 173.4331 117 G 4.1812 9.6116 109.7649 43.4488 0.0000 172.6916 118 E 3.9358 8.9012 118.4414 59.3691 29.4501 179.6935 119 K 4.0416 8.0085 116.0672 58.9918 32.3381 177.1989 120 N 4.6608 8.3883 115.3874 53.2002 38.6938 173.8802 121 I 4.7117 7.4471 120.5214 60.0458 38.5425 174.8626 122 H 5.0894 9.2162 123.8560 53.3258 32.8895 173.3235 123 A 4.4528 8.6388 122.0914 51.8951 19.4406 177.9174 124 G 3.7166 8.0789 105.6351 46.5217 0.0000 174.0043 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 4.45 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 2 N 10.40 4.27 0.00 2.84 2.59 0.00 0.00 7.17 6.17 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 3 T 8.79 4.54 4.40 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 1.17 0.00 0.00 4 P 0.00 4.19 0.00 2.14 2.10 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 5 E 8.02 3.92 0.00 2.02 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 2.37 2.40 0.00 6 H 8.21 4.04 0.00 3.18 3.31 0.00 5.78 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 7 M 7.64 3.33 0.00 1.60 1.77 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.81 0.00 8 T 7.89 3.78 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 1.16 0.00 0.00 9 A 7.93 4.18 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.83 3.49 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 1.07 0.00 0.00 0.84 0.00 0.00 11 V 7.87 3.39 1.99 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 -0.18 0.00 0.00 0.77 0.00 0.00 12 Q 8.17 3.94 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 13 R 8.36 3.94 0.00 2.05 1.98 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 14 Y 8.37 4.10 0.00 3.15 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 7.67 3.40 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 0.95 0.00 0.00 0.88 0.00 0.00 16 A 8.16 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.40 3.95 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 18 L 7.83 3.82 0.00 1.72 1.66 0.35 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.09 4.34 0.00 2.81 2.89 0.00 0.00 7.04 6.88 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 20 A 7.91 4.43 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 21 G 7.70 3.84 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 0.00 0.00 0.00 22 D 8.07 4.61 0.00 2.74 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 23 L 8.00 3.96 0.00 1.80 1.68 1.04 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.15 4.52 0.00 2.77 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 25 G 7.95 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 0.00 0.00 0.00 26 I 7.83 3.89 1.79 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.82 0.25 0.00 0.00 27 V 7.83 3.76 2.13 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 1.06 0.00 0.00 1.04 0.00 0.00 28 A 8.18 4.13 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 29 L 8.05 3.93 0.00 1.47 1.34 0.98 0.87 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 30 F 7.54 4.56 0.00 3.15 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 31 A 8.81 4.29 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 32 D 8.93 4.59 0.00 2.93 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 33 D 7.85 4.69 0.00 2.79 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 34 A 7.82 4.69 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 35 T 8.81 5.12 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 36 V 8.50 4.73 1.64 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 0.77 0.00 0.00 37 E 9.23 4.79 0.00 1.97 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 2.28 2.28 0.00 38 D 8.25 4.91 0.00 2.52 2.33 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 39 P 0.00 4.78 0.00 1.63 1.33 0.00 3.76 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 1.90 1.71 0.00 40 V 7.71 3.78 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 0.70 0.00 0.00 0.93 0.00 0.00 41 G 8.99 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 7.74 4.23 0.00 3.82 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 43 E 8.38 4.12 0.00 1.88 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 2.27 2.36 0.00 44 P 0.00 4.50 0.00 1.94 1.94 0.00 3.69 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 2.00 2.08 0.00 45 R 9.00 4.38 0.00 1.57 1.75 0.00 2.99 0.00 0.00 2.72 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 46 S 8.53 4.84 0.00 3.80 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 9.01 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.52 3.83 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 1.23 0.00 0.00 49 A 7.98 4.07 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 50 A 7.95 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.90 3.65 1.96 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.69 0.60 0.00 0.00 52 R 8.77 4.04 0.00 1.88 2.09 0.00 3.12 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 53 E 8.50 3.95 0.00 2.21 1.99 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 2.33 2.43 0.00 54 F 8.32 3.96 0.00 3.02 3.05 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 55 Y 8.06 3.76 0.00 3.14 2.97 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 A 8.14 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.24 4.32 0.00 2.67 2.71 0.00 0.00 7.03 6.94 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 58 S 7.53 3.90 0.00 3.78 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.37 4.37 0.00 1.62 1.67 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.73 3.98 0.00 1.70 1.80 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.67 7.81 61 L 7.01 4.77 0.00 1.44 1.56 0.70 1.03 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 62 P 0.00 4.40 0.00 2.21 2.08 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 63 L 8.41 5.07 0.00 1.56 1.68 0.97 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 64 A 9.03 4.79 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 65 V 9.67 4.95 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 0.99 0.00 0.00 1.02 0.00 0.00 66 E 9.32 4.72 0.00 2.08 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 2.26 2.32 0.00 67 L 8.90 4.76 0.00 1.62 1.67 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.88 4.59 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 1.27 0.00 0.00 69 Q 7.91 4.63 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 70 E 8.56 4.10 0.00 2.09 1.99 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 2.31 2.34 0.00 71 V 8.12 4.01 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 0.86 0.00 0.00 72 R 9.01 4.76 0.00 2.03 1.86 0.00 3.29 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 73 A 8.37 5.24 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 9.43 4.09 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 0.77 0.00 0.00 0.94 0.00 0.00 75 A 9.48 3.56 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 76 N 8.62 4.30 0.00 2.99 3.19 0.00 0.00 6.57 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 77 E 8.45 5.54 0.00 2.06 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 0.00 2.34 2.34 0.00 78 A 9.16 5.35 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 79 A 9.24 5.32 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 80 F 8.80 5.30 0.00 3.07 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 81 A 8.47 5.42 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 82 F 7.88 5.27 0.00 3.40 3.28 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 83 T 8.81 4.77 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 1.18 0.00 0.00 84 V 8.62 4.89 2.16 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 1.07 0.00 0.00 1.16 0.00 0.00 85 S 9.32 5.31 0.00 3.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.38 5.44 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.85 5.07 0.00 1.99 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 2.30 2.32 0.00 88 Y 8.79 4.85 0.00 3.08 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 89 Q 9.43 3.02 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 1.16 1.66 0.00 90 G 8.31 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 91 R 7.74 4.51 0.00 2.06 1.87 0.00 3.12 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 92 K 8.38 4.79 0.00 1.65 1.62 0.00 1.57 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.44 7.81 93 T 8.41 4.71 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 0.99 0.00 0.00 94 V 8.73 4.58 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 0.81 0.00 0.00 0.84 0.00 0.00 95 V 8.92 4.61 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 0.49 0.00 0.00 0.95 0.00 0.00 96 A 8.60 4.95 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 97 P 0.00 4.78 0.00 1.73 1.93 0.00 2.22 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.44 0.00 98 I 8.49 4.58 1.87 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 1.24 0.66 0.89 0.00 0.00 99 N 8.30 5.25 0.00 1.44 1.94 0.00 0.00 5.96 8.16 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 0.00 100 H 9.03 5.25 0.00 3.14 3.12 0.00 5.55 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.14 5.58 0.00 3.05 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 0.00 0.00 0.00 0.00 102 R 8.85 5.11 0.00 1.98 1.79 0.00 3.11 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 103 F 9.36 5.18 0.00 2.97 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 0.00 104 N 9.01 4.79 0.00 2.94 2.98 0.00 0.00 6.96 6.99 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 0.00 105 G 8.67 3.54 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 0.00 106 A 7.99 4.08 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 0.00 107 G 8.94 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 0.00 0.00 0.00 0.00 108 K 8.31 4.55 0.00 1.87 1.63 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.49 7.81 109 V 7.77 3.29 0.67 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 -0.15 0.00 0.00 -0.79 0.00 0.00 110 V 8.77 4.55 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 0.72 0.00 0.00 0.92 0.00 0.00 111 S 7.67 5.18 0.00 3.88 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 0.00 112 M 9.46 5.44 0.00 2.41 2.37 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.71 0.00 113 R 9.15 5.15 0.00 1.80 1.78 0.00 3.16 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 114 A 9.08 5.44 1.58 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 0.00 0.00 115 L 9.00 4.78 0.00 1.73 1.67 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.00 5.14 0.00 3.06 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 0.00 117 G 9.61 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.90 3.94 0.00 2.06 1.97 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 2.39 2.42 0.00 119 K 8.01 4.04 0.00 1.79 1.87 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.41 7.81 120 N 8.39 4.66 0.00 3.06 3.06 0.00 0.00 6.71 6.97 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 0.00 121 I 7.45 4.71 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.93 0.00 0.00 122 H 9.22 5.09 0.00 3.03 3.10 0.00 5.62 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 0.00 123 A 8.64 4.45 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 0.00 124 G 8.08 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 0.00 0.00 0.00