NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2286 8.3344 116.7755 57.8801 65.2689 173.1016 5 V 3.7621 7.4314 124.3279 60.9274 31.6557 170.6421 6 V 4.1458 8.9528 128.5599 61.8400 33.8616 174.5926 7 K 4.7643 8.0995 123.3720 54.3312 35.6521 177.3914 8 S 4.1807 8.8809 118.0990 62.0593 62.7938 176.3885 9 E 4.4365 8.2205 113.3304 57.3178 29.4394 176.4443 10 D 4.7137 7.9996 118.9358 54.3562 41.1632 177.7216 11 Y 4.1465 7.5518 120.1118 60.0610 37.7552 177.5785 12 A 4.1229 6.9437 120.6483 53.0354 18.8402 176.7911 13 L 4.7039 7.2393 115.5181 51.7263 43.8589 174.7867 14 P 4.3066 0.0000 0.0000 63.0080 31.6658 175.9803 15 S 4.8485 8.3810 115.9306 56.3839 66.0224 172.2747 16 Y 4.4871 8.3362 121.0310 56.5951 39.6327 174.8128 17 V 4.2929 6.9227 117.7638 60.0023 35.6768 174.6479 18 D 4.6609 8.4230 123.5142 52.7327 40.7630 175.8265 19 R 4.5466 7.8020 122.2768 53.8807 34.0193 176.9574 20 R 3.5412 8.6453 121.6524 58.9973 30.1595 177.1840 21 D 4.7910 7.9746 113.9319 53.5568 40.4358 175.9266 22 Y 4.7972 7.7830 120.0492 55.3377 38.7518 172.5695 23 P 4.4773 0.0000 0.0000 65.2035 31.7771 177.0034 24 L 4.6303 7.2216 118.9714 51.5843 41.2511 174.1707 25 P 4.6640 0.0000 0.0000 62.2684 32.0115 176.8220 26 D 4.5659 8.8066 119.3310 56.8590 40.9283 176.9553 27 V 4.5580 7.4594 109.4596 58.9909 35.6747 174.6411 28 A 4.3268 8.2810 123.8065 51.8092 19.2093 177.1978 29 H 3.5118 8.6573 122.5304 58.2651 29.8874 175.7606 30 V 4.1075 7.6116 119.4309 60.7861 32.5556 174.8552 31 K 4.1833 8.5406 126.6792 57.8838 33.6021 176.5200 32 N 4.7286 7.9169 116.9771 51.6697 39.5563 174.0447 33 L 4.6682 8.2076 123.1295 52.7817 44.2029 177.2549 34 S 4.4909 8.2610 117.5823 57.1848 65.9368 175.0173 35 A 3.9774 8.4257 122.6304 55.5829 18.0421 179.9189 36 S 4.1269 7.9999 112.1596 61.5830 63.1774 176.5427 37 Q 3.9844 7.8650 121.7022 58.6973 28.5907 178.6940 38 K 3.9582 8.4840 119.7506 59.4104 31.9943 179.2480 39 A 4.0169 7.9509 120.8497 55.0046 18.2257 179.4480 40 L 3.9018 7.9785 118.8741 58.3164 41.9780 179.4259 41 K 4.1544 7.9840 117.2319 59.2347 32.2608 178.9419 42 E 4.1556 8.0087 118.9134 59.1950 29.4996 179.0983 43 K 4.0505 8.2997 119.8267 59.2946 32.0036 178.4244 44 E 4.2808 8.3401 119.0176 58.8355 29.6033 178.4322 45 K 4.2347 7.8808 116.6323 57.4558 32.3416 176.6494 46 A 4.4699 7.4148 122.1040 49.7791 20.9279 176.3631 47 S 3.8801 8.4273 112.6023 59.1009 62.6650 175.1879 48 W 4.7587 8.4278 125.9523 58.7003 29.2889 178.4237 49 S 4.3061 7.9183 114.2250 61.2055 62.3181 175.4320 50 S 4.4457 7.7948 114.1932 59.3048 63.0442 174.3671 51 L 4.5013 7.5471 121.4556 54.0744 42.2841 177.5498 52 S 4.5486 8.9024 118.1929 57.4604 65.4526 175.5768 53 I 3.6712 8.2345 123.0459 64.9926 36.8598 178.3910 54 D 4.3562 8.0966 118.8683 57.4390 40.6494 178.5961 55 E 4.0695 7.9844 119.0438 59.0339 29.4792 179.4398 56 K 3.9574 8.3984 119.1229 59.3751 32.0437 179.5723 57 V 3.6364 8.0629 118.8148 65.9819 31.2165 177.7481 58 E 3.9645 8.0338 118.2326 59.1772 29.6226 178.4676 59 L 4.0990 8.1228 119.2481 57.7064 41.6762 178.8243 60 Y 4.0675 8.2272 119.5416 60.8829 38.6585 178.3183 61 R 4.3702 8.1571 118.4863 58.0674 30.2823 178.4965 62 L 4.1104 7.5088 119.4609 56.9917 41.7588 178.9334 63 K 3.5597 7.5468 119.0186 57.2787 32.3205 176.3535 64 F 5.3031 7.2981 116.7244 55.4231 41.8988 175.4697 65 K 3.7950 9.1898 124.7980 57.9773 32.4774 176.5897 66 E 5.0288 8.3664 118.6599 54.3057 32.2178 176.8897 67 S 5.3382 8.8410 118.6998 57.1725 65.6587 175.5645 68 F 3.9256 8.9783 119.9647 60.6100 38.3825 177.6795 69 A 4.0832 8.0971 118.9659 55.1918 18.0724 179.1920 70 E 4.0963 8.0364 117.3512 59.8328 29.4573 179.5191 71 M 4.1673 8.2277 115.6991 57.5959 31.2918 177.1752 72 N 4.7778 7.7238 116.1076 51.9352 39.3857 175.2719 73 R 4.0833 7.0748 117.4587 56.1175 30.1181 176.5902 74 S 4.6223 8.3517 115.0501 57.6254 64.6280 172.5633 75 T 4.7471 8.0247 110.1105 60.4597 71.8224 173.2127 76 N 4.7480 8.4614 115.8462 53.2514 39.0072 176.6184 77 E 3.9091 8.1807 121.9617 59.2390 29.4487 178.8215 78 W 4.3379 8.3581 116.1687 59.5951 27.9064 178.3351 79 K 3.0604 6.7408 118.9780 59.2111 31.2909 179.4625 80 T 3.7718 7.4934 115.4356 66.4533 68.3978 176.7298 81 V 3.5972 7.8844 120.1301 66.1229 31.6579 178.2219 82 V 3.7825 8.4188 118.4614 65.9729 31.4152 178.2392 83 G 3.6065 8.3138 105.3111 47.8210 0.0000 175.5951 84 A 4.1407 8.4021 123.4042 54.6187 18.3412 179.5192 85 A 4.1368 8.3749 119.4538 55.9101 18.4702 179.8552 86 M 4.0702 8.3192 117.1142 58.2952 31.9460 178.8803 87 F 3.9941 8.2232 120.9459 61.4336 39.6454 177.3588 88 F 4.1807 8.4982 117.3374 60.4115 38.4175 177.7871 89 I 4.0102 8.0435 119.2716 63.8959 37.1963 178.4080 90 G 3.5985 8.1427 107.1642 47.7193 0.0000 175.5567 91 F 3.9464 8.1817 123.7515 61.1808 39.2229 177.2409 92 T 3.6791 7.8699 115.1870 66.5407 68.2465 176.3124 93 A 4.0051 7.7805 122.4235 55.0113 18.3039 179.7345 94 L 3.9018 7.4977 117.7231 57.8094 41.5449 179.6050 95 L 3.8954 7.2625 118.4828 57.7692 41.5696 179.4195 96 L 4.0445 7.9315 118.9516 57.6737 41.4706 179.7097 97 I 3.7362 7.7817 120.0011 63.9682 37.0550 178.1007 98 W 4.1663 8.3624 129.2713 60.4458 30.4507 177.4869 99 E 3.8939 8.7290 119.3465 59.3434 28.9102 178.6438 100 K 4.0577 7.9589 118.1654 59.7826 32.2653 177.9408 101 H 4.0220 8.0796 117.5633 58.9661 29.9434 176.1076 102 Y 4.2252 7.5945 116.0225 57.8833 38.4786 176.6174 103 V 3.9609 7.2784 118.2889 64.4145 32.7849 175.8142 104 Y 4.5503 7.4705 116.1692 57.8210 38.5358 175.9622 105 G 4.1037 8.3397 113.4268 43.5901 0.0000 171.3866 106 P 4.4033 0.0000 0.0000 62.1744 32.1325 175.9630 107 I 4.0341 7.7802 113.5562 59.0657 38.9955 173.6919 108 P 4.3094 0.0000 0.0000 63.0136 31.8413 177.4765 109 H 4.3125 8.5365 116.2294 57.9106 28.5419 176.9707 110 T 2.4831 6.9566 109.1559 62.6291 68.5633 174.6971 111 F 4.5197 7.4568 119.7371 57.6083 39.8310 176.6274 112 E 4.1918 7.9285 121.7123 56.0677 31.1396 177.1305 113 E 3.9887 8.9587 123.0819 59.6449 29.6586 179.0950 114 E 3.9102 8.2074 118.5273 59.0124 29.8702 178.1439 115 W 3.9665 8.3590 127.9503 60.6906 30.6434 177.8185 116 V 3.7666 8.2853 117.8246 65.9705 30.9633 177.8454 117 A 4.0359 8.1027 120.5549 55.1063 18.1822 179.8540 118 K 3.8090 8.0886 117.0366 59.5192 32.0277 179.3954 119 Q 3.8490 8.3385 120.2589 59.4655 28.9583 178.5393 120 T 3.9958 8.2881 117.1599 66.4036 68.4520 176.6138 121 K 3.6420 7.8199 121.4818 59.3852 32.1609 178.6687 122 R 3.8230 8.1897 119.3697 59.8769 29.8677 178.2885 123 M 4.0034 8.3293 118.6172 58.4898 31.9111 178.7998 124 L 4.2301 8.0158 119.0117 57.6898 41.4846 179.2478 125 D 4.4470 8.2688 119.1763 56.9020 40.8421 177.5733 126 M 4.2786 8.1464 114.9195 53.9715 32.6331 176.0691 127 K 4.1093 7.6684 117.1504 56.5103 30.3056 176.1788 128 V 3.5089 8.4072 118.9608 64.3343 32.8625 174.9925 129 A 3.8319 8.7304 128.4443 52.9638 15.4535 175.2745 130 P 4.5377 0.0000 0.0000 63.9537 32.7213 178.8057 131 I 4.1462 7.8323 119.4353 63.8024 37.6715 176.0310 132 Q 4.6753 7.9701 114.2161 57.3102 35.1608 176.2620 133 G 3.8104 8.3603 105.7552 48.0728 0.0000 172.9968 134 F 4.7184 8.2948 121.0281 59.2270 42.0840 176.5661 135 S 4.2641 9.4681 117.1892 61.4064 63.1322 176.8015 136 A 4.2304 8.2284 121.8489 54.3570 18.3896 177.9037 137 K 4.4946 8.4491 114.8610 55.8986 32.4673 175.5706 138 W 4.5707 7.9697 129.5360 55.2454 32.5119 174.7212 139 D 4.4248 7.3498 125.6591 52.8497 40.1883 176.5869 140 Y 4.3269 8.3962 125.2120 60.4803 38.4238 177.4475 141 D 4.5297 8.1871 119.5952 57.0274 41.1743 178.0082 142 K 3.9587 8.0378 114.8617 56.4784 32.7952 176.1693 143 N 4.0269 7.3720 116.9815 53.4151 37.6570 172.1539 144 E 3.7364 5.9000 114.0637 54.3647 33.4257 175.8573 145 W 4.3031 7.9566 120.5599 56.3812 29.8231 176.5038 146 K 3.8890 8.7546 124.2247 56.4973 32.2072 177.3732 147 K 4.1397 8.5333 122.7367 56.7891 32.0196 176.8656 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 4 S 8.33 4.23 0.00 3.80 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 5 V 7.43 3.76 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 0.74 0.00 0.00 0.92 0.00 0.00 6 V 8.95 4.15 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 0.90 0.00 0.00 0.97 0.00 0.00 7 K 8.10 4.76 0.00 1.81 1.76 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.88 4.18 0.00 3.93 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 9 E 8.22 4.44 0.00 2.06 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 2.25 2.27 0.00 10 D 8.00 4.71 0.00 3.07 2.68 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 0.00 0.00 0.00 0.00 11 Y 7.55 4.15 0.00 2.97 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 12 A 6.94 4.12 0.96 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 13 L 7.24 4.70 0.00 1.74 1.57 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.31 0.00 2.07 2.03 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 15 S 8.38 4.85 0.00 3.99 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 16 Y 8.34 4.49 0.00 3.01 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 17 V 6.92 4.29 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 0.68 0.00 0.00 0.83 0.00 0.00 18 D 8.42 4.66 0.00 2.66 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 19 R 7.80 4.55 0.00 1.84 1.96 0.00 3.09 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 20 R 8.65 3.54 0.00 1.80 2.08 0.00 3.16 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 21 D 7.97 4.79 0.00 2.84 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 22 Y 7.78 4.80 0.00 2.82 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 23 P 0.00 4.48 0.00 2.23 2.38 0.00 3.76 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 1.94 2.02 0.00 24 L 7.22 4.63 0.00 1.52 1.67 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.66 0.00 2.22 1.77 0.00 3.96 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.12 0.00 26 D 8.81 4.57 0.00 2.92 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 27 V 7.46 4.56 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 0.77 0.00 0.00 1.11 0.00 0.00 28 A 8.28 4.33 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 29 H 8.66 3.51 0.00 2.28 3.25 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.61 4.11 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 0.80 0.00 0.00 0.63 0.00 0.00 31 K 8.54 4.18 0.00 1.86 1.87 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.41 7.81 32 N 7.92 4.73 0.00 2.69 2.76 0.00 0.00 6.76 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 33 L 8.21 4.67 0.00 1.58 1.53 0.89 0.90 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 34 S 8.26 4.49 0.00 4.03 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 35 A 8.43 3.98 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 36 S 8.00 4.13 0.00 4.06 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 37 Q 7.86 3.98 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 38 K 8.48 3.96 0.00 1.92 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.67 7.81 39 A 7.95 4.02 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 40 L 7.98 3.90 0.00 1.89 1.89 0.98 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.98 4.15 0.00 1.95 1.87 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.61 7.81 42 E 8.01 4.16 0.00 2.27 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 0.00 2.51 2.46 0.00 43 K 8.30 4.05 0.00 1.93 2.01 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.34 4.28 0.00 2.14 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 0.00 2.58 2.51 0.00 45 K 7.88 4.23 0.00 1.91 1.88 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.34 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.71 7.81 46 A 7.41 4.47 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 47 S 8.43 3.88 0.00 3.80 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 48 W 8.43 4.76 0.00 3.51 3.10 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 49 S 7.92 4.31 0.00 3.93 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 50 S 7.79 4.45 0.00 4.08 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 51 L 7.55 4.50 0.00 1.99 1.64 1.01 0.95 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 52 S 8.90 4.55 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.23 3.67 1.87 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 1.64 0.87 0.90 0.00 0.00 54 D 8.10 4.36 0.00 2.72 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 55 E 7.98 4.07 0.00 2.20 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 2.34 2.36 0.00 56 K 8.40 3.96 0.00 1.93 1.82 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.40 1.58 7.81 57 V 8.06 3.64 2.24 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 1.10 0.00 0.00 0.91 0.00 0.00 58 E 8.03 3.96 0.00 2.13 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 2.32 2.36 0.00 59 L 8.12 4.10 0.00 1.89 1.63 0.82 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.23 4.07 0.00 3.14 3.20 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 61 R 8.16 4.37 0.00 2.01 2.04 0.00 3.45 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.76 0.00 62 L 7.51 4.11 0.00 1.70 1.59 0.88 0.93 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 63 K 7.55 3.56 0.00 1.41 1.05 0.00 1.17 0.00 0.00 1.46 0.00 0.00 2.82 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.54 0.21 7.81 64 F 7.30 5.30 0.00 2.55 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 65 K 9.19 3.80 0.00 1.05 2.08 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.16 7.81 66 E 8.37 5.03 0.00 2.16 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 2.28 2.25 0.00 67 S 8.84 5.34 0.00 4.10 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 68 F 8.98 3.93 0.00 3.05 3.21 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 69 A 8.10 4.08 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 70 E 8.04 4.10 0.00 2.29 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 0.00 2.36 2.35 0.00 71 M 8.23 4.17 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 72 N 7.72 4.78 0.00 2.81 2.87 0.00 0.00 7.02 7.02 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 73 R 7.07 4.08 0.00 1.95 1.95 0.00 3.07 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.59 0.00 74 S 8.35 4.62 0.00 4.05 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 75 T 8.02 4.75 4.27 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 1.24 0.00 0.00 76 N 8.46 4.75 0.00 2.71 2.69 0.00 0.00 6.44 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 8.18 3.91 0.00 2.09 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 0.00 2.34 2.34 0.00 78 W 8.36 4.34 0.00 3.67 3.35 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 79 K 6.74 3.06 0.00 1.43 1.38 0.00 1.29 0.00 0.00 1.28 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.49 3.77 4.31 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 1.18 0.00 0.00 81 V 7.88 3.60 2.30 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 1.14 0.00 0.00 0.98 0.00 0.00 82 V 8.42 3.78 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 1.10 0.00 0.00 1.21 0.00 0.00 83 G 8.31 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 84 A 8.40 4.14 1.56 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 0.00 0.00 85 A 8.37 4.14 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.32 4.07 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.61 0.00 87 F 8.22 3.99 0.00 3.13 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 88 F 8.50 4.18 0.00 3.28 3.11 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 89 I 8.04 4.01 2.04 0.00 0.00 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 1.52 0.69 0.93 0.00 0.00 90 G 8.14 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 91 F 8.18 3.95 0.00 2.49 2.98 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 0.00 0.00 0.00 0.00 92 T 7.87 3.68 4.43 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 1.20 0.00 0.00 93 A 7.78 4.01 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 94 L 7.50 3.90 0.00 1.44 1.56 0.94 0.57 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 95 L 7.26 3.90 0.00 1.70 1.60 0.86 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.93 4.04 0.00 1.88 1.74 0.92 0.93 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 97 I 7.78 3.74 2.06 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.79 0.91 0.00 0.00 98 W 8.36 4.17 0.00 3.53 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.73 3.89 0.00 2.29 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 0.00 1.69 2.09 0.00 100 K 7.96 4.06 0.00 1.87 1.99 0.00 1.89 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.50 7.81 101 H 8.08 4.02 0.00 3.00 3.09 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.59 4.23 0.00 1.43 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 0.00 0.00 0.00 0.00 103 V 7.28 3.96 1.82 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 0.59 0.00 0.00 0.83 0.00 0.00 104 Y 7.47 4.55 0.00 3.13 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 0.00 105 G 8.34 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 0.00 0.00 0.00 106 P 0.00 4.40 0.00 2.16 2.03 0.00 3.74 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 1.96 1.92 0.00 107 I 7.78 4.03 1.54 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.53 0.60 0.00 0.00 108 P 0.00 4.31 0.00 2.28 1.93 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.10 0.00 109 H 8.54 4.31 0.00 3.43 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 6.96 2.48 3.42 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 0.09 0.00 0.00 111 F 7.46 4.52 0.00 3.00 3.11 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 0.00 112 E 7.93 4.19 0.00 2.26 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 0.00 2.39 2.43 0.00 113 E 8.96 3.99 0.00 2.09 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 2.44 2.45 0.00 114 E 8.21 3.91 0.00 2.13 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 2.39 2.38 0.00 115 W 8.36 3.97 0.00 3.59 3.21 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 0.00 116 V 8.29 3.77 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 1.14 0.00 0.00 1.13 0.00 0.00 117 A 8.10 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.09 3.81 0.00 1.63 1.60 0.00 1.45 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.49 7.81 119 Q 8.34 3.85 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 120 T 8.29 4.00 4.48 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 1.49 0.00 0.00 121 K 7.82 3.64 0.00 1.70 1.81 0.00 1.54 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.26 7.81 122 R 8.19 3.82 0.00 1.78 1.99 0.00 3.06 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 1.58 1.62 0.00 123 M 8.33 4.00 0.00 1.84 2.23 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.41 0.00 124 L 8.02 4.23 0.00 1.60 1.38 -0.62 0.79 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 0.00 125 D 8.27 4.45 0.00 2.77 2.70 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 0.00 126 M 8.15 4.28 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.80 0.00 127 K 7.67 4.11 0.00 1.90 1.92 0.00 1.53 0.00 0.00 1.22 0.00 0.00 2.47 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.54 1.23 7.81 128 V 8.41 3.51 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 0.91 0.00 0.00 0.89 0.00 0.00 129 A 8.73 3.83 1.49 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 0.00 130 P 0.00 4.54 0.00 2.26 2.27 0.00 3.83 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 131 I 7.83 4.15 1.92 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 1.45 0.47 0.95 0.00 0.00 132 Q 7.97 4.68 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.36 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 0.00 0.00 0.00 134 F 8.29 4.72 0.00 3.14 3.26 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 0.00 135 S 9.47 4.26 0.00 4.21 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 0.00 136 A 8.23 4.23 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 0.00 137 K 8.45 4.49 0.00 2.09 1.94 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.43 7.81 138 W 7.97 4.57 0.00 2.75 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 0.00 139 D 7.35 4.42 0.00 2.35 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 0.00 0.00 0.00 0.00 140 Y 8.40 4.33 0.00 3.10 3.07 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 0.00 0.00 0.00 141 D 8.19 4.53 0.00 2.82 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 0.00 142 K 8.04 3.96 0.00 1.52 1.69 0.00 1.89 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.33 7.81 143 N 7.37 4.03 0.00 2.80 2.77 0.00 0.00 6.93 8.76 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 0.00 144 E 5.90 3.74 0.00 1.75 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 0.00 1.87 1.96 0.00 145 W 7.96 4.30 0.00 3.18 3.15 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 0.00 146 K 8.75 3.89 0.00 1.66 1.75 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.39 1.28 7.81 147 K 8.53 4.14 0.00 1.72 1.71 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.38 7.81