NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 L 4.2159 8.1849 120.6083 54.3660 43.2231 176.7988 6 S 4.1179 8.2542 117.4525 57.1192 64.9514 174.2913 7 W 4.4465 9.1759 123.5816 60.2182 29.1905 178.4586 8 Q 4.0935 8.2065 117.4387 59.3298 28.3155 178.6664 9 D 4.5803 8.1339 119.2238 57.4991 40.7683 178.1317 10 Y 4.1741 8.0214 120.1937 60.4269 38.6923 177.8538 11 F 4.0602 7.8463 118.7633 60.8858 39.0746 177.8478 12 M 4.1502 8.4361 118.2075 58.1282 31.6279 178.8363 13 A 3.9917 7.8177 120.8384 55.2282 18.3574 179.4470 14 N 4.2064 7.7668 114.5624 56.0655 38.5254 177.3003 15 A 4.3776 8.1925 122.5058 55.5009 18.3056 179.3714 16 E 3.9471 7.9506 116.0546 59.1049 30.0499 178.6625 17 L 4.0604 7.9866 120.5530 58.2955 42.2771 178.9116 18 I 3.7786 8.8570 119.7677 63.7529 37.8990 177.8149 19 S 5.0090 8.0862 116.4704 60.5397 62.4997 176.2478 20 K 4.2576 7.7923 120.7363 58.3581 31.8435 178.2050 21 R 3.9994 7.4527 117.0325 55.2217 30.6462 176.7377 22 S 4.4868 7.2236 116.5011 59.6167 63.7416 174.8645 23 T 5.0462 8.7810 111.9341 60.4944 68.9545 173.0667 24 C 4.6852 7.2929 122.0216 58.4973 33.2646 174.2559 25 N 4.2291 8.8976 125.4153 56.6580 38.2799 177.0008 26 R 4.0441 7.7847 114.6045 58.6243 30.3983 176.8326 27 A 4.5470 7.6639 118.9365 51.1192 22.2801 175.3710 28 Y 4.6701 8.6425 120.1311 55.3383 39.5064 175.0525 29 V 4.5555 7.6701 123.5388 60.1938 35.7461 174.4224 30 G 4.6415 8.4096 110.7107 45.0261 0.0000 171.3758 31 A 5.3331 9.4163 127.3815 50.0054 22.3754 175.1084 32 V 4.4914 8.9708 121.8062 60.9463 34.4657 174.0121 33 L 4.7464 8.9586 131.4878 54.0399 43.5454 175.3695 34 V 4.6832 9.1140 126.4417 60.8668 35.0207 174.0527 35 K 4.5039 8.4746 127.3820 55.1763 35.2831 175.8684 36 N 4.0112 9.5261 125.5239 55.0812 35.9431 173.6745 37 N 4.1205 7.9618 107.7207 53.8094 37.1509 174.6026 38 R 4.5419 7.6928 117.5866 53.9626 32.4795 175.3737 39 I 4.0608 8.4868 124.2894 61.5024 37.3400 175.4745 40 I 4.4158 8.2398 119.1736 61.6419 39.5557 175.6185 41 A 4.7348 7.5287 122.0593 51.2698 22.7455 175.0228 42 T 5.0617 8.1430 108.9445 60.8073 73.2616 172.3269 43 G 4.4010 8.9226 106.7161 45.9347 0.0000 171.8091 44 Y 5.2913 7.5712 118.0404 55.2800 41.7966 174.9116 45 N 4.5907 9.0870 118.3130 53.9505 38.1679 173.3953 46 G 4.4325 8.5748 111.0574 44.2906 0.0000 170.6768 47 G 4.0054 7.6821 109.9145 43.9461 0.0000 173.6268 48 V 3.5902 8.1549 118.6181 62.4175 32.0169 176.4725 49 A 4.0598 8.3318 129.4023 53.6506 18.7547 176.5852 50 D 4.5621 8.9147 119.1775 55.3949 38.0693 174.0421 51 T 4.7242 7.6460 106.2070 59.5110 71.9577 172.9885 52 D 4.5614 8.6574 122.5157 54.9007 41.6757 176.0460 53 N 5.1254 8.2812 117.3668 50.4496 40.1728 176.0103 54 C 4.8886 8.8795 119.0727 59.8057 34.3117 176.6055 55 D 4.3951 8.0044 120.0015 57.4801 40.2704 178.4268 56 D 4.3257 8.0723 117.7164 57.2001 41.1745 178.5751 57 V 4.1947 7.6602 108.6591 60.1643 32.4020 176.5224 58 G 3.8805 7.6412 105.8511 45.0302 0.0000 172.8782 59 H 4.9342 7.9714 115.8605 55.5036 29.6890 175.8519 60 E 4.5889 8.1846 120.6394 54.0341 28.9152 175.3769 61 M 3.8550 7.9108 122.0803 55.8228 32.7196 175.6966 62 E 3.5336 9.0937 122.7018 58.0534 27.7227 174.8515 63 D 4.6527 9.1061 122.7849 54.6338 38.3804 174.9663 64 G 3.9039 9.0845 106.6422 45.4282 0.0000 173.8270 65 H 4.4844 8.0392 116.9934 54.1038 31.6527 172.1286 66 C 4.2608 8.9081 126.5140 56.9768 42.4215 173.3286 67 I 4.1307 8.6296 117.9875 61.1081 37.2965 177.8042 68 R 3.9550 7.7045 122.5865 60.0202 29.9898 177.1331 69 T 4.2888 7.6784 106.0321 61.8553 69.8457 172.7944 70 V 4.4523 8.8123 122.2518 60.9383 34.5112 174.5247 71 H 4.2915 9.0108 124.1452 56.4486 29.3612 175.6373 72 A 4.0758 9.1098 125.3862 55.6836 17.9924 179.4378 73 E 3.8565 8.2929 116.1266 60.1148 29.4455 179.4590 74 M 3.9688 7.9763 117.5406 58.6643 32.0759 178.1386 75 N 3.9770 8.3116 116.2809 56.6649 38.5680 177.2773 76 A 4.5118 8.0925 123.2937 54.6341 18.3638 179.7693 77 L 3.9163 7.6096 117.4059 57.9424 41.7665 179.6493 78 I 3.6509 8.3838 120.5183 64.3785 37.1146 178.1873 79 Q 3.9615 8.3695 120.7176 59.2533 28.6624 178.1466 80 C 4.0538 7.7439 117.4760 63.0953 28.2411 175.4544 81 A 3.9910 8.2559 122.4480 55.2050 17.7093 179.2411 82 K 3.9566 8.4168 117.9125 59.0818 32.2690 177.8101 83 E 4.5523 7.7863 115.2210 55.1237 30.0102 176.9902 84 G 3.8392 8.3599 107.1558 45.6368 0.0000 173.9258 85 I 3.8657 7.2413 120.9357 60.0460 38.2521 175.5753 86 S 4.1631 8.6345 122.6827 58.5458 62.7976 173.2209 87 A 4.6394 8.2737 127.8545 51.6637 19.4256 175.7919 88 N 4.3362 8.0790 116.9827 55.6788 39.6936 174.7451 89 N 4.1519 8.3639 122.2163 54.9230 36.8660 172.8748 90 T 4.7213 7.3343 107.7202 59.9731 72.9271 173.2033 91 E 4.9145 9.2672 121.2179 54.5885 33.2562 174.2591 92 I 5.0135 8.5228 126.1749 59.3947 41.4825 173.5035 93 Y 5.1112 8.8963 125.1621 56.3438 41.0332 175.1611 94 V 5.0714 8.6359 116.9447 59.6655 35.8343 176.8459 95 T 4.0506 8.7127 114.1410 64.7271 69.5573 173.8579 96 H 5.4316 7.9564 117.0447 52.9339 32.1863 173.5732 97 F 3.9282 8.6910 124.8482 57.4977 39.6808 173.3162 98 P 5.0421 0.0000 0.0000 62.4024 31.8263 176.4534 99 C 4.9798 8.4767 118.2341 57.1443 32.1198 174.5107 100 I 3.6846 8.2811 119.5615 64.3028 37.3709 177.3913 101 N 4.3680 8.0900 116.9613 56.4406 38.4194 177.0598 102 C 4.1519 8.0150 117.6830 62.8960 28.1694 175.9328 103 T 3.7987 7.9881 117.3862 66.7250 68.0977 176.3329 104 K 3.7527 8.0008 119.7755 59.3915 32.0174 178.7437 105 A 3.9153 8.3075 121.0462 55.5106 18.4055 179.4541 106 L 3.8530 8.4660 117.5866 58.0713 41.7112 179.9264 107 L 3.9243 8.0529 118.8666 57.9410 41.3744 179.4721 108 Q 3.9065 8.4102 118.1363 58.9690 28.9783 177.8663 109 A 4.1731 7.9714 121.3582 53.2232 18.6495 178.2519 110 G 4.0238 8.0478 106.0665 45.2186 0.0000 173.5029 111 V 4.2756 7.3341 112.1936 60.9293 32.4123 176.4363 112 K 4.5621 8.9514 122.3833 56.0713 33.7753 175.5021 113 K 4.9777 7.6034 120.9014 55.3446 36.0892 174.5907 114 I 4.6186 8.8823 127.1776 59.9552 39.9819 174.5285 115 T 4.8898 8.8165 126.0378 62.4108 68.9342 174.1055 116 Y 5.4078 8.8663 125.6221 55.3680 40.7231 175.6827 117 N 4.9459 8.9265 116.7292 54.5954 41.0290 174.3546 118 T 5.1701 8.1718 114.3319 62.0032 72.3793 173.4585 119 A 4.4168 8.1390 124.2423 51.4957 23.4085 174.5092 120 Y 4.6840 6.8842 126.8198 56.6028 36.8549 178.3817 121 R 4.5687 9.3543 124.6268 53.8522 30.1426 174.4362 122 I 3.4397 8.1086 125.9892 61.5328 37.7610 175.9516 123 H 4.1897 8.8756 124.6322 55.8157 30.5725 173.9775 124 P 4.2855 0.0000 0.0000 65.8743 31.2290 178.8280 125 F 4.5071 8.7195 118.6423 61.1147 39.2656 176.7512 126 A 3.8480 7.8882 120.1833 55.2682 18.2048 179.7522 127 I 3.5364 7.5750 117.7324 64.2037 37.2036 177.8437 128 E 3.9469 8.4503 120.5310 59.5555 29.3783 178.8762 129 L 3.8209 8.1276 119.0436 58.0966 41.7263 179.1938 130 M 4.0029 8.3991 118.8334 59.0184 31.8472 179.0304 131 T 3.9050 8.5182 116.0148 66.6350 68.4687 176.4606 132 Q 3.9466 8.1468 119.2915 59.2936 28.8743 178.6066 133 K 4.0982 8.6263 114.3416 56.3302 31.9486 176.2376 134 E 3.8114 7.7554 115.6523 57.6101 27.6578 174.7541 135 V 4.5501 8.1174 117.4410 61.4849 33.3703 174.9633 136 E 5.0697 8.7691 125.2299 54.8946 32.2837 174.1783 137 Y 5.4280 8.6202 119.4536 55.4442 40.4386 174.8091 138 V 4.4654 8.8939 123.1979 60.9473 35.2162 173.8503 139 Q 3.9341 8.1190 126.9867 55.0790 30.7250 174.2406 140 H 4.5698 8.4801 121.9345 55.6164 33.9237 173.3805 141 D 5.4865 8.4904 125.0458 53.0037 41.7045 176.1685 142 V 3.8327 8.2166 121.0500 61.5114 31.3638 174.1245 143 P 4.3329 0.0000 0.0000 62.6377 31.5382 176.2198 144 R 4.0910 8.4686 117.9716 56.1791 30.0440 176.2519 145 V 4.5874 7.9900 115.0300 58.9986 35.5616 178.1204 146 K 4.3919 8.4440 123.7762 55.7676 31.7529 177.0032 147 L 4.0664 8.6517 125.7460 56.6074 41.8430 177.3130 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 5 L 8.18 4.22 0.00 1.61 1.66 0.97 0.64 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 6 S 8.25 4.12 0.00 3.96 3.78 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 7 W 9.18 4.45 0.00 3.29 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.21 4.09 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.68 2.56 0.00 9 D 8.13 4.58 0.00 2.99 2.75 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 10 Y 8.02 4.17 0.00 3.00 3.04 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 0.00 0.00 0.00 11 F 7.85 4.06 0.00 2.01 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 0.00 0.00 0.00 12 M 8.44 4.15 0.00 2.09 2.41 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 3.19 0.00 13 A 7.82 3.99 1.46 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 0.00 0.00 0.00 14 N 7.77 4.21 0.00 2.76 2.78 0.00 0.00 6.92 8.88 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 15 A 8.19 4.38 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.95 3.95 0.00 2.02 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 2.34 2.37 0.00 17 L 7.99 4.06 0.00 1.96 1.65 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.86 3.78 1.97 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 1.74 1.35 1.10 0.00 0.00 19 S 8.09 5.01 0.00 4.32 4.33 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 20 K 7.79 4.26 0.00 1.87 1.89 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.76 7.81 21 R 7.45 4.00 0.00 0.67 0.94 0.00 3.12 0.00 0.00 3.10 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 22 S 7.22 4.49 0.00 3.68 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 23 T 8.78 5.05 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 1.36 0.00 0.00 24 C 7.29 4.69 0.00 2.85 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 25 N 8.90 4.23 0.00 2.89 2.96 0.00 0.00 7.20 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 26 R 7.78 4.04 0.00 1.72 1.98 0.00 3.10 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 27 A 7.66 4.55 1.25 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 0.00 0.00 0.00 28 Y 8.64 4.67 0.00 2.85 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 29 V 7.67 4.56 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 1.27 0.00 0.00 0.89 0.00 0.00 30 G 8.41 4.64 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 0.00 0.00 0.00 31 A 9.42 5.33 1.19 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 0.00 0.00 0.00 0.00 0.00 32 V 8.97 4.49 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 0.82 0.00 0.00 0.99 0.00 0.00 33 L 8.96 4.75 0.00 1.80 1.49 0.86 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 34 V 9.11 4.68 1.95 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 0.38 0.00 0.00 0.13 0.00 0.00 35 K 8.47 4.50 0.00 1.77 1.52 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.28 1.36 7.81 36 N 9.53 4.01 0.00 2.81 2.78 0.00 0.00 7.18 8.00 0.00 0.00 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 N 7.96 4.12 0.00 2.67 2.29 0.00 0.00 7.02 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 38 R 7.69 4.54 0.00 1.84 1.76 0.00 3.12 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 39 I 8.49 4.06 1.91 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 1.26 0.53 0.87 0.00 0.00 40 I 8.24 4.42 1.83 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 1.30 0.58 0.94 0.00 0.00 41 A 7.53 4.73 1.22 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 0.00 0.00 42 T 8.14 5.06 4.36 0.00 0.00 0.00 0.00 0.00 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 43 G 8.92 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 0.00 0.00 0.00 0.00 44 Y 7.57 5.29 0.00 2.97 3.01 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 45 N 9.09 4.59 0.00 2.81 2.78 0.00 0.00 6.49 7.90 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 46 G 8.57 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 0.00 0.00 0.00 0.00 47 G 7.68 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 48 V 8.15 3.59 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 0.91 0.00 0.00 49 A 8.33 4.06 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 50 D 8.91 4.56 0.00 2.85 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 51 T 7.65 4.72 4.24 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 1.21 0.00 0.00 52 D 8.66 4.56 0.00 2.69 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 53 N 8.28 5.13 0.00 2.84 2.89 0.00 0.00 6.00 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 54 C 8.88 4.89 0.00 3.13 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 0.00 55 D 8.00 4.40 0.00 2.86 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 56 D 8.07 4.33 0.00 2.81 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 57 V 7.66 4.19 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 0.84 0.00 0.00 0.94 0.00 0.00 58 G 7.64 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 59 H 7.97 4.93 0.00 3.17 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.18 4.59 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 61 M 7.91 3.85 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 62 E 9.09 3.53 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 63 D 9.11 4.65 0.00 2.90 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 64 G 9.08 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 0.00 0.00 0.00 65 H 8.04 4.48 0.00 3.07 3.21 0.00 5.88 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 C 8.91 4.26 0.00 2.93 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 I 8.63 4.13 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 1.48 0.71 1.00 0.00 0.00 68 R 7.70 3.96 0.00 1.79 2.00 0.00 3.49 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 69 T 7.68 4.29 4.24 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 1.25 0.00 0.00 70 V 8.81 4.45 2.31 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 0.93 0.00 0.00 0.90 0.00 0.00 71 H 9.01 4.29 0.00 3.10 3.40 0.00 5.73 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 72 A 9.11 4.08 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 73 E 8.29 3.86 0.00 2.04 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 2.33 2.44 0.00 74 M 7.98 3.97 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 75 N 8.31 3.98 0.00 2.76 2.72 0.00 0.00 7.02 7.50 0.00 0.00 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 A 8.09 4.51 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 77 L 7.61 3.92 0.00 1.79 1.68 0.87 1.09 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 78 I 8.38 3.65 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.76 0.87 0.00 0.00 79 Q 8.37 3.96 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 80 C 7.74 4.05 0.00 3.08 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.26 3.99 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 K 8.42 3.96 0.00 1.72 1.90 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 83 E 7.79 4.55 0.00 1.98 1.92 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 2.40 2.42 0.00 84 G 8.36 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 85 I 7.24 3.87 1.85 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 1.16 0.70 0.95 0.00 0.00 86 S 8.63 4.16 0.00 3.85 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 87 A 8.27 4.64 1.20 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 88 N 8.08 4.34 0.00 2.69 2.71 0.00 0.00 7.20 7.13 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 89 N 8.36 4.15 0.00 2.85 2.82 0.00 0.00 6.87 7.17 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 90 T 7.33 4.72 4.33 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 1.24 0.00 0.00 91 E 9.27 4.91 0.00 1.92 1.72 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 1.92 2.03 0.00 92 I 8.52 5.01 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.31 0.80 0.00 0.00 93 Y 8.90 5.11 0.00 2.87 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.64 5.07 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 0.82 0.00 0.00 0.98 0.00 0.00 95 T 8.71 4.05 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 1.32 0.00 0.00 96 H 7.96 5.43 0.00 3.04 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 F 8.69 3.93 0.00 2.48 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 5.04 0.00 1.74 1.84 0.00 2.20 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.78 0.00 99 C 8.48 4.98 0.00 3.24 3.23 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 0.00 100 I 8.28 3.68 1.82 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.25 0.92 0.00 0.00 101 N 8.09 4.37 0.00 2.75 2.82 0.00 0.00 7.16 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 0.00 102 C 8.02 4.15 0.00 3.11 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.99 3.80 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 104 K 8.00 3.75 0.00 1.95 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.28 1.68 7.81 105 A 8.31 3.92 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 0.00 106 L 8.47 3.85 0.00 1.76 1.65 0.77 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.05 3.92 0.00 1.70 1.65 0.80 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.41 3.91 0.00 1.98 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 109 A 7.97 4.17 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 0.00 110 G 8.05 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.33 4.28 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 0.64 0.00 0.00 0.86 0.00 0.00 112 K 8.95 4.56 0.00 1.62 1.78 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.48 7.81 113 K 7.60 4.98 0.00 1.76 1.50 0.00 1.64 0.00 0.00 2.03 0.00 0.00 2.79 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.57 7.81 114 I 8.88 4.62 1.88 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.77 0.53 0.00 0.00 115 T 8.82 4.89 3.48 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 1.18 0.00 0.00 116 Y 8.87 5.41 0.00 3.13 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 0.00 117 N 8.93 4.95 0.00 2.95 3.17 0.00 0.00 7.48 7.22 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 0.00 118 T 8.17 5.17 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 119 A 8.14 4.42 1.03 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 0.00 0.00 0.00 0.00 0.00 120 Y 6.88 4.68 0.00 3.17 2.29 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 0.00 121 R 9.35 4.57 0.00 1.80 1.94 0.00 3.31 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 122 I 8.11 3.44 1.53 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 -0.36 0.37 0.00 0.00 123 H 8.88 4.19 0.00 3.28 3.21 0.00 5.88 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.29 0.00 2.24 2.11 0.00 3.36 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 2.05 2.12 0.00 125 F 8.72 4.51 0.00 3.03 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.89 3.85 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.58 3.54 1.98 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 1.24 0.66 0.95 0.00 0.00 128 E 8.45 3.95 0.00 2.16 2.29 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 2.41 2.46 0.00 129 L 8.13 3.82 0.00 1.60 1.46 0.24 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 130 M 8.40 4.00 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.52 0.00 131 T 8.52 3.90 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 132 Q 8.15 3.95 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.19 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 133 K 8.63 4.10 0.00 1.64 1.84 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.43 7.81 134 E 7.76 3.81 0.00 2.10 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 2.28 2.41 0.00 135 V 8.12 4.55 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 0.77 0.00 0.00 1.03 0.00 0.00 136 E 8.77 5.07 0.00 2.14 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 2.23 2.26 0.00 137 Y 8.62 5.43 0.00 3.42 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 0.00 138 V 8.89 4.47 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 0.95 0.00 0.00 0.90 0.00 0.00 139 Q 8.12 3.93 0.00 1.60 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 1.93 2.21 0.00 140 H 8.48 4.57 0.00 3.23 3.12 0.00 5.83 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.49 5.49 0.00 2.64 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 0.00 142 V 8.22 3.83 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 0.83 0.00 0.00 1.02 0.00 0.00 143 P 0.00 4.33 0.00 2.23 2.23 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 144 R 8.47 4.09 0.00 1.94 1.99 0.00 3.13 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 145 V 7.99 4.59 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 0.85 0.00 0.00 0.94 0.00 0.00 146 K 8.44 4.39 0.00 1.72 1.64 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.48 7.81 147 L 8.65 4.07 0.00 1.60 1.59 0.92 0.78 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