NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7143 8.1633 120.6179 55.4778 34.2502 173.7028 2 R 4.9501 8.8337 124.4477 53.5516 33.1402 169.7344 3 V 4.8812 9.1915 123.8988 60.9156 35.6985 173.4511 4 L 5.0336 9.0641 129.5851 53.3910 44.6898 174.7964 5 L 5.0725 9.4471 128.1197 53.3658 43.6532 175.7451 6 I 4.9234 8.4877 125.6099 59.5021 40.1926 174.6172 7 H 4.8642 9.2538 129.1842 56.1599 30.6200 174.3221 8 S 5.1352 9.3865 121.8283 56.6633 66.5169 175.1491 9 D 4.5169 8.8665 122.2503 57.6367 41.6910 175.8785 10 Y 5.2230 6.9796 113.6091 56.4808 41.2653 173.1848 11 I 5.0228 8.7814 119.9524 59.7067 41.7693 173.5981 12 E 5.4869 9.6904 127.9743 54.9281 34.0859 174.1903 13 Y 5.5878 8.3488 119.0494 55.7857 42.4093 173.6795 14 E 4.9842 9.5763 121.4054 54.4597 33.0085 174.6541 15 V 4.0447 9.3344 128.6395 62.1302 32.0159 174.9612 16 K 4.7610 8.8784 125.9993 56.6127 34.4732 178.3225 17 D 4.7686 9.1419 131.3504 55.6357 41.9033 175.5624 18 K 4.4444 8.8249 124.6514 55.5997 32.0598 177.2429 19 A 4.2537 8.3995 124.5427 51.2600 20.1038 176.8486 20 L 4.6851 7.2047 113.5212 52.1102 45.7500 176.4957 21 K 4.0086 8.8157 121.9953 59.3099 32.2214 177.2548 22 N 4.8519 7.5850 115.9225 50.4818 38.4126 171.8264 23 P 4.4640 0.0000 0.0000 61.3374 33.5950 175.8554 24 E 4.1399 8.7422 121.8214 55.7693 29.7521 174.9904 25 P 4.7047 0.0000 0.0000 62.7035 32.0186 175.7881 26 I 4.6724 8.2383 116.2114 59.1451 41.0291 174.5157 27 S 4.6106 8.1700 115.8755 56.8093 65.1532 174.7232 28 E 3.9046 8.6410 120.0146 59.4713 29.0178 177.8799 29 D 4.4548 7.5468 116.6066 56.5403 41.8950 176.9399 30 M 4.4799 7.7526 117.6629 55.7654 32.4808 177.9314 31 K 3.9258 8.0178 119.6599 57.7877 32.1625 176.5378 32 R 4.9290 5.9566 114.0259 53.4050 34.0157 175.1003 33 G 3.9915 7.1108 105.6204 45.8934 0.0000 171.9496 34 R 5.2892 8.3124 119.2700 55.3935 33.2827 173.7062 35 M 5.0151 9.1167 123.6830 54.2306 36.1457 173.4500 36 E 5.1060 8.8504 123.1601 54.2234 33.0458 175.6030 37 E 3.9334 8.5838 119.0524 57.5473 27.5186 175.0710 38 V 4.7806 8.1690 118.5564 59.7585 36.2582 176.3809 39 L 4.6557 8.7308 125.3200 53.9170 43.1554 175.3896 40 V 4.3078 8.7055 128.1623 62.2070 32.9563 174.6806 41 A 4.7753 9.0935 130.8909 50.2217 20.1497 174.7535 42 F 4.9135 8.7936 120.8061 58.0372 40.3170 175.0481 43 I 5.1010 9.2384 124.7717 59.4567 40.9308 174.4283 44 S 5.0075 9.1073 121.4108 56.4535 64.9277 172.8615 45 V 4.2638 8.4970 127.8210 62.4354 32.7992 175.1439 46 E 5.0509 9.7434 127.5379 54.4870 31.9271 176.8434 47 K 3.8387 8.7881 121.7454 60.2514 32.1497 179.5100 48 V 3.7130 7.8446 111.5358 64.3090 31.3739 177.9587 49 D 4.4894 8.1306 118.4655 56.7850 40.3604 178.2813 50 E 4.0660 7.9892 118.5883 58.9933 29.4008 178.9628 51 K 4.2746 7.6528 117.8133 58.5634 33.4905 177.2470 52 N 4.9668 7.9464 116.4840 50.5671 40.7067 172.3471 53 P 4.2356 0.0000 0.0000 65.1445 31.7316 177.2975 54 E 3.8870 8.0929 117.3370 59.1629 29.6722 178.1501 55 E 3.8849 8.4414 119.2656 59.4454 29.7308 178.9274 56 V 3.6141 7.7702 118.1482 66.0405 31.4514 178.0952 57 S 4.1203 8.2424 114.8964 61.7577 62.7517 176.7512 58 L 3.9928 8.1579 121.7285 57.6679 41.2438 179.8169 59 K 3.9790 8.2249 118.3460 59.2885 31.9767 179.2817 60 A 3.9746 8.1798 121.1055 55.1646 18.2992 179.5998 61 I 3.6235 7.9902 118.6108 64.5127 37.1408 178.2890 62 E 3.9180 8.1211 119.8914 59.2450 29.5755 178.3979 63 E 3.9024 8.3021 119.3924 59.5175 29.6906 178.8918 64 I 3.6860 8.1957 120.1891 64.2916 37.0737 178.6511 65 S 3.8814 8.1833 116.1540 61.4016 62.6059 176.8214 66 K 3.9763 8.2123 121.2321 59.4650 31.7409 179.5712 67 V 3.5119 7.7019 118.0767 65.8821 31.4509 177.7275 68 A 3.8635 7.9723 120.5548 55.3639 17.9986 179.5004 69 E 4.0233 8.3368 116.9598 59.6207 29.3135 179.4207 70 Q 3.9856 8.1652 118.9394 58.7671 29.2566 177.7356 71 V 4.0256 7.8282 110.5048 60.2969 32.1147 175.9151 72 K 3.8062 7.5751 116.9578 57.4209 29.5866 175.5214 73 A 4.5863 8.2974 122.2628 51.1917 19.9741 177.9323 74 E 4.6356 8.8194 122.0419 57.0933 31.4904 175.5282 75 N 5.6064 8.1341 117.2218 51.4308 41.5847 173.9756 76 V 4.8292 8.9067 122.1049 61.0761 35.7394 173.6673 77 F 5.0144 8.9939 129.1006 56.3617 42.0773 173.9781 78 V 4.3210 8.3488 127.5632 62.2165 32.4226 173.9808 79 Y 4.7696 8.8461 131.1304 55.0014 40.7279 173.0674 80 P 4.6388 0.0000 0.0000 62.8612 31.9166 177.1789 81 F 4.7743 9.4051 127.4738 56.2501 39.0868 173.4044 82 A 4.1715 8.3391 126.2383 55.3581 18.7092 179.9645 83 H 4.4880 7.8173 108.6891 56.5602 28.0920 176.3928 84 L 4.4696 8.1286 122.1549 56.0368 41.9845 176.9104 85 S 4.8829 7.8960 112.4733 56.7656 66.1321 173.3965 86 S 4.6224 8.5775 114.4132 58.4856 63.5126 173.9123 87 E 4.6583 7.7704 119.9453 54.5995 29.5665 175.0470 88 L 4.7752 8.1468 122.4186 54.1031 43.0581 176.2361 89 A 4.6684 8.5077 123.8191 50.6669 19.9711 177.8438 90 K 4.0602 9.2727 119.3848 56.3029 33.4482 176.2861 91 P 4.4553 0.0000 0.0000 66.2924 31.1494 179.0996 92 S 4.0116 8.0306 112.2756 61.3789 62.9142 176.5846 93 V 3.5159 7.7338 121.2051 65.4708 31.3003 177.7418 94 A 3.9917 8.0155 120.6781 55.2575 18.2779 179.1811 95 M 2.9594 7.7543 116.7865 58.3894 32.1100 177.6932 96 D 4.2197 7.9433 118.0922 57.6079 41.3344 178.4563 97 I 3.6920 7.9950 120.3923 64.3822 37.2513 178.4433 98 L 3.9859 8.2386 120.2670 57.8044 41.3382 179.2027 99 N 4.3469 8.2533 117.0395 56.7096 38.8489 177.2619 100 R 3.9588 8.1281 119.6839 59.1082 30.1157 179.2731 101 V 3.5622 8.0688 118.2899 65.9964 31.5598 177.4275 102 Y 4.0077 7.8842 118.8087 60.8762 38.6180 178.0673 103 Q 3.9187 8.6300 119.4364 58.8522 28.9257 179.1135 104 G 3.6096 8.2432 106.7693 47.9212 0.0000 175.7696 105 L 4.1847 7.9896 121.6985 57.1677 41.4933 179.5979 106 K 3.8363 7.8327 119.6691 59.5966 31.9559 178.8707 107 E 3.9319 8.2387 117.6587 58.9633 29.4083 178.6920 108 R 4.1924 7.5715 115.8677 56.5217 30.4131 177.2225 109 G 3.7957 8.0186 107.8056 44.8157 0.0000 173.7220 110 F 4.5694 7.3674 117.4336 56.6736 40.5342 175.1226 111 N 4.7146 8.9452 120.4063 52.9967 39.5175 173.8651 112 V 4.9510 8.4962 126.2981 61.0649 34.2083 174.6716 113 G 4.4929 9.1009 114.0953 44.5359 0.0000 171.5887 114 K 4.4332 8.1482 117.3638 55.1753 35.5329 174.8180 115 A 4.5357 7.7575 121.9442 48.7563 21.7090 174.4592 116 P 4.5162 0.0000 0.0000 63.2933 32.1192 175.4214 117 F 4.3562 9.5259 124.4537 58.0509 41.2599 176.2549 118 G 3.4278 8.0386 112.5734 45.3583 0.0000 171.9044 119 Y 5.0518 7.0717 114.4954 55.9054 42.3229 174.2789 120 Y 4.6761 8.8728 119.2523 57.2037 39.6192 175.1325 121 K 5.2802 8.7883 121.9650 54.6492 36.1907 175.8693 122 A 4.7921 9.2332 126.0476 51.7859 20.2869 176.2881 123 F 5.6082 8.2500 113.2618 55.7203 41.3090 173.6744 124 K 4.7636 9.4812 119.1600 54.8498 35.5640 175.2757 125 I 5.0063 8.5043 123.2773 59.4736 41.8912 174.3320 126 S 4.3053 7.8346 120.9402 56.4235 63.4599 172.4737 127 C 4.6335 8.4209 128.1994 58.3504 31.0056 174.6968 128 K 3.9327 8.6868 126.5608 57.6941 31.7888 178.8302 129 G 3.7577 7.4367 104.5382 46.2697 0.0000 173.3853 130 H 4.6755 7.2449 114.9060 54.0075 29.6211 174.6039 131 P 4.2135 0.0000 0.0000 65.5128 29.7733 177.5745 132 L 4.5576 7.8266 114.8967 54.3809 42.0118 177.8328 133 A 4.0716 8.1665 123.9594 53.9551 18.5274 177.3238 134 E 5.0981 7.6029 114.2692 54.6061 32.3189 175.5909 135 L 4.9810 9.0354 124.1861 52.9330 46.4810 175.6829 136 S 5.3299 8.6703 115.9796 56.8667 65.9968 173.4857 137 R 4.7399 8.9406 119.6710 55.1289 34.8487 173.9628 138 T 5.0158 8.5970 119.3344 61.8712 70.7946 173.5657 139 I 4.6087 8.9471 127.6550 59.6209 39.6544 175.6178 140 V 4.5748 8.3034 119.2008 58.3650 35.6698 173.5776 141 P 4.4676 0.0000 0.0000 62.4662 31.7392 176.1435 142 E 3.9730 8.9853 120.8752 56.7619 29.5505 176.9596 143 E 4.2039 8.7203 123.9555 56.2108 29.7295 175.3542 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 8.16 4.71 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.62 0.00 2 R 8.83 4.95 0.00 1.80 1.84 0.00 3.30 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 1.65 1.87 0.00 3 V 9.19 4.88 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 0.99 0.00 0.00 0.96 0.00 0.00 4 L 9.06 5.03 0.00 1.72 1.50 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 5 L 9.45 5.07 0.00 1.57 1.54 0.89 0.07 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 6 I 8.49 4.92 1.92 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 1.20 0.78 0.92 0.00 0.00 7 H 9.25 4.86 0.00 3.18 3.18 0.00 5.54 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 9.39 5.14 0.00 3.63 3.77 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 0.00 0.00 0.00 9 D 8.87 4.52 0.00 2.45 2.77 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 0.00 0.00 0.00 10 Y 6.98 5.22 0.00 3.10 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 11 I 8.78 5.02 1.75 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.36 0.63 0.00 0.00 12 E 9.69 5.49 0.00 1.99 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 2.18 2.28 0.00 13 Y 8.35 5.59 0.00 3.28 3.29 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 14 E 9.58 4.98 0.00 2.02 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 2.22 2.23 0.00 15 V 9.33 4.04 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 0.16 0.00 0.00 0.81 0.00 0.00 16 K 8.88 4.76 0.00 1.95 1.23 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.68 1.64 7.81 17 D 9.14 4.77 0.00 2.88 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 18 K 8.82 4.44 0.00 1.54 1.60 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.02 7.81 19 A 8.40 4.25 0.20 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 0.00 0.00 0.00 20 L 7.20 4.69 0.00 1.36 1.40 0.71 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.82 4.01 0.00 1.66 1.81 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.51 7.81 22 N 7.58 4.85 0.00 2.68 2.69 0.00 0.00 6.92 8.02 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 23 P 0.00 4.46 0.00 0.89 1.48 0.00 3.71 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 1.81 1.54 0.00 24 E 8.74 4.14 0.00 2.21 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 2.40 2.34 0.00 25 P 0.00 4.70 0.00 2.01 2.01 0.00 3.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 26 I 8.24 4.67 1.87 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 1.44 0.81 1.03 0.00 0.00 27 S 8.17 4.61 0.00 4.03 4.06 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 28 E 8.64 3.90 0.00 2.10 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 2.37 2.42 0.00 29 D 7.55 4.45 0.00 2.70 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 30 M 7.75 4.48 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 31 K 8.02 3.93 0.00 1.89 1.83 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.73 7.81 32 R 5.96 4.93 0.00 1.56 1.56 0.00 3.10 0.00 0.00 3.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.31 0.00 33 G 7.11 3.99 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 0.00 0.00 0.00 34 R 8.31 5.29 0.00 1.73 1.74 0.00 3.31 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 35 M 9.12 5.02 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.65 0.00 36 E 8.85 5.11 0.00 1.92 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 2.30 2.36 0.00 37 E 8.58 3.93 0.00 2.06 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 2.32 2.41 0.00 38 V 8.17 4.78 2.28 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 0.85 0.00 0.00 1.07 0.00 0.00 39 L 8.73 4.66 0.00 1.68 1.51 0.86 0.97 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 40 V 8.71 4.31 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 -0.21 0.00 0.00 0.76 0.00 0.00 41 A 9.09 4.78 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 42 F 8.79 4.91 0.00 2.92 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 43 I 9.24 5.10 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.11 0.98 0.00 0.00 44 S 9.11 5.01 0.00 4.20 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 45 V 8.50 4.26 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 1.01 0.00 0.00 0.99 0.00 0.00 46 E 9.74 5.05 0.00 2.12 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 2.41 0.00 47 K 8.79 3.84 0.00 2.01 1.83 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.26 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.56 7.81 48 V 7.84 3.71 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 0.89 0.00 0.00 0.94 0.00 0.00 49 D 8.13 4.49 0.00 2.85 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 50 E 7.99 4.07 0.00 2.07 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 2.43 0.00 51 K 7.65 4.27 0.00 1.81 1.88 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.53 7.81 52 N 7.95 4.97 0.00 2.65 2.63 0.00 0.00 7.15 8.94 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 53 P 0.00 4.24 0.00 2.18 2.14 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.26 0.00 54 E 8.09 3.89 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 2.37 2.36 0.00 55 E 8.44 3.88 0.00 2.16 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 0.00 2.31 2.32 0.00 56 V 7.77 3.61 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 1.04 0.00 0.00 1.07 0.00 0.00 57 S 8.24 4.12 0.00 4.10 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 58 L 8.16 3.99 0.00 1.81 1.72 0.92 0.91 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 59 K 8.22 3.98 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.61 7.81 60 A 8.18 3.97 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 61 I 7.99 3.62 2.04 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 1.53 0.74 0.94 0.00 0.00 62 E 8.12 3.92 0.00 2.11 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 2.31 2.37 0.00 63 E 8.30 3.90 0.00 2.13 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 2.29 2.35 0.00 64 I 8.20 3.69 1.87 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 1.47 0.22 0.73 0.00 0.00 65 S 8.18 3.88 0.00 4.13 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 66 K 8.21 3.98 0.00 1.96 1.86 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.64 7.81 67 V 7.70 3.51 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 1.05 0.00 0.00 0.94 0.00 0.00 68 A 7.97 3.86 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 69 E 8.34 4.02 0.00 2.31 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 2.45 2.61 0.00 70 Q 8.17 3.99 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 71 V 7.83 4.03 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 0.79 0.00 0.00 0.78 0.00 0.00 72 K 7.58 3.81 0.00 1.93 1.98 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.39 7.81 73 A 8.30 4.59 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 E 8.82 4.64 0.00 2.01 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 2.41 2.39 0.00 75 N 8.13 5.61 0.00 2.87 2.79 0.00 0.00 6.53 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 76 V 8.91 4.83 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 0.94 0.00 0.00 0.57 0.00 0.00 77 F 8.99 5.01 0.00 3.25 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 78 V 8.35 4.32 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 0.86 0.00 0.00 0.96 0.00 0.00 79 Y 8.85 4.77 0.00 3.15 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 80 P 0.00 4.64 0.00 1.90 2.06 0.00 3.27 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 1.95 2.10 0.00 81 F 9.41 4.77 0.00 3.36 3.08 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 82 A 8.34 4.17 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 83 H 7.82 4.49 0.00 3.01 3.33 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.13 4.47 0.00 1.84 1.82 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.90 4.88 0.00 3.86 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 86 S 8.58 4.62 0.00 3.84 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 87 E 7.77 4.66 0.00 1.99 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 2.30 2.37 0.00 88 L 8.15 4.78 0.00 1.54 1.61 0.88 0.97 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 89 A 8.51 4.67 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 90 K 9.27 4.06 0.00 1.93 1.97 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.42 7.81 91 P 0.00 4.46 0.00 2.24 2.31 0.00 3.62 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 92 S 8.03 4.01 0.00 3.99 4.10 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 0.00 0.00 0.00 0.00 93 V 7.73 3.52 2.23 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 1.12 0.00 0.00 0.92 0.00 0.00 94 A 8.02 3.99 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.75 2.96 0.00 1.76 0.79 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.16 0.00 96 D 7.94 4.22 0.00 2.81 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 97 I 7.99 3.69 1.92 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 1.51 0.56 0.92 0.00 0.00 98 L 8.24 3.99 0.00 1.78 1.72 1.19 0.50 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 99 N 8.25 4.35 0.00 2.67 2.97 0.00 0.00 7.20 7.27 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 0.00 100 R 8.13 3.96 0.00 2.03 1.96 0.00 3.16 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 101 V 8.07 3.56 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 1.00 0.00 0.00 1.00 0.00 0.00 102 Y 7.88 4.01 0.00 3.08 3.14 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 0.00 103 Q 8.63 3.92 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.77 2.57 0.00 104 G 8.24 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.99 4.18 0.00 1.63 1.73 0.86 0.30 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 0.00 106 K 7.83 3.84 0.00 1.42 1.70 0.00 1.32 0.00 0.00 1.50 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.32 7.81 107 E 8.24 3.93 0.00 2.05 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 2.30 2.57 0.00 108 R 7.57 4.19 0.00 2.11 1.89 0.00 3.28 0.00 0.00 3.34 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 109 G 8.02 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 0.00 110 F 7.37 4.57 0.00 3.05 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 0.00 111 N 8.95 4.71 0.00 2.89 3.05 0.00 0.00 6.94 7.87 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 0.00 112 V 8.50 4.95 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 0.87 0.00 0.00 0.94 0.00 0.00 113 G 9.10 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.15 4.43 0.00 1.24 1.17 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.77 0.89 7.81 115 A 7.76 4.54 0.41 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 0.00 0.00 116 P 0.00 4.52 0.00 2.14 2.07 0.00 3.29 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.01 0.00 117 F 9.53 4.36 0.00 3.12 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 0.00 118 G 8.04 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 0.00 0.00 0.00 119 Y 7.07 5.05 0.00 2.68 2.77 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 0.00 0.00 0.00 120 Y 8.87 4.68 0.00 3.11 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 0.00 121 K 8.79 5.28 0.00 1.85 1.99 0.00 1.55 0.00 0.00 1.53 0.00 0.00 2.61 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.40 1.63 7.81 122 A 9.23 4.79 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 0.00 123 F 8.25 5.61 0.00 3.38 3.37 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 0.00 124 K 9.48 4.76 0.00 1.86 1.92 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.39 7.81 125 I 8.50 5.01 2.13 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.96 1.13 0.00 0.00 126 S 7.83 4.31 0.00 3.19 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 0.00 127 C 8.42 4.63 0.00 2.96 2.72 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 0.00 128 K 8.69 3.93 0.00 1.71 1.50 0.00 1.34 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.49 1.35 7.81 129 G 7.44 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 0.00 130 H 7.24 4.68 0.00 3.20 3.21 0.00 5.65 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 0.00 131 P 0.00 4.21 0.00 2.05 2.15 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 132 L 7.83 4.56 0.00 1.71 1.66 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 0.00 133 A 8.17 4.07 1.41 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 0.00 0.00 134 E 7.60 5.10 0.00 1.86 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 2.22 2.24 0.00 135 L 9.04 4.98 0.00 1.53 1.48 0.96 0.46 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 0.00 136 S 8.67 5.33 0.00 3.83 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 0.00 137 R 8.94 4.74 0.00 1.66 1.96 0.00 3.46 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 138 T 8.60 5.02 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 1.27 0.00 0.00 139 I 8.95 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 1.21 0.49 0.92 0.00 0.00 140 V 8.30 4.57 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 0.00 141 P 0.00 4.47 0.00 2.18 2.06 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 142 E 8.99 3.97 0.00 1.98 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 2.35 2.39 0.00 143 E 8.72 4.20 0.00 1.92 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 2.28 0.00