NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3357 8.3044 120.3493 55.7882 32.9005 174.1378 2 S 4.4395 8.3593 112.4828 55.7849 63.9430 172.8310 3 S 4.3893 8.0773 117.9473 57.6969 63.7343 174.5608 4 Q 4.1078 8.6137 123.6129 58.6126 28.5811 177.1982 5 I 4.0524 7.4967 109.9018 61.1266 38.5578 175.9049 6 R 4.1440 7.2680 120.9106 56.0195 30.2163 175.6310 7 Q 4.3561 8.6981 124.8729 56.2356 31.8032 173.0118 8 N 4.1031 8.9945 124.6454 55.0903 37.2921 173.6055 9 Y 4.7180 7.9005 117.7184 54.6965 40.2521 175.0602 10 S 4.2302 8.1399 123.3918 58.1230 65.1833 175.0336 11 T 3.6965 8.3958 115.2056 64.9255 68.3776 176.3584 12 D 4.2419 7.8745 121.1709 57.2985 40.9115 178.6358 13 V 3.4741 6.9991 118.4093 65.9011 31.3151 177.4155 14 E 3.7912 7.9053 118.9707 59.4222 29.3896 178.7979 15 A 3.9773 8.1093 120.3710 54.8647 18.4001 179.4260 16 A 3.9454 8.3390 119.8825 55.1863 18.3161 180.1267 17 V 3.5337 8.0104 116.9285 66.2965 31.6783 178.0223 18 N 4.2192 7.9109 116.2663 56.1854 38.2703 177.3496 19 S 4.0211 8.0675 114.5395 61.4490 62.5093 176.0783 20 L 4.0476 8.2067 123.1283 57.8768 41.7090 179.1582 21 V 3.7130 7.9887 118.6298 66.1097 31.5780 177.4266 22 N 4.3099 8.1198 116.7832 56.7377 38.7559 176.5002 23 L 3.9897 8.1408 121.7312 58.3091 42.0625 178.6203 24 Y 3.9760 8.4377 117.0385 60.7775 37.9008 177.8226 25 L 3.7539 8.6175 120.3663 57.8248 41.6271 179.4593 26 Q 4.0440 8.3065 119.0394 59.1708 29.0529 177.8893 27 A 3.8307 7.9465 121.8239 55.3160 18.3540 179.5502 28 S 4.3049 8.6626 111.8451 61.9016 62.5520 175.7651 29 Y 4.5509 8.3095 122.2342 60.9886 38.3681 178.3086 30 T 3.6952 8.1933 116.9422 66.8982 68.5298 176.3982 31 Y 4.0697 7.6808 118.4672 60.7132 37.7811 178.6829 32 L 4.1550 8.1544 121.5628 58.2418 42.3425 178.8228 33 S 4.3051 7.9723 112.6219 61.4790 62.4527 175.8060 34 L 3.5280 7.7959 121.9145 57.7083 41.0522 179.4885 35 G 3.9911 8.2188 104.2874 48.4571 0.0000 175.3813 36 F 4.2240 8.6401 120.5891 59.8428 38.7547 177.1993 37 Y 4.2283 8.5182 119.5809 60.7389 38.5910 177.5269 38 F 4.2491 8.5517 115.8116 58.3431 38.9489 175.9756 39 D 4.6447 7.9697 117.4064 53.6654 42.1538 176.5530 40 R 4.1078 7.0427 118.7986 56.5877 30.6847 177.4020 41 D 4.6170 8.6359 120.2634 56.1190 39.5174 177.2366 42 D 4.4955 7.9419 117.5916 54.3991 40.3384 177.1726 43 V 3.7273 7.7091 118.2294 64.3936 32.6025 175.6974 44 A 3.8332 8.0678 118.0295 53.2806 16.0804 176.7631 45 L 4.7948 8.5708 121.7462 50.6966 43.3523 176.8762 46 E 4.0323 8.6497 123.2677 59.3600 29.9463 178.0343 47 G 3.6346 8.0921 104.8837 47.9924 0.0000 175.6291 48 V 3.2836 7.5649 120.2691 65.3513 31.6022 177.7379 49 S 4.2368 8.4488 113.4161 61.7222 62.2169 175.6745 50 H 4.0018 8.7418 121.0652 59.2687 29.4944 176.7092 51 F 4.1077 7.9412 122.1020 61.6623 39.0483 177.1885 52 F 4.1887 7.9453 117.0025 60.3948 38.5833 178.0681 53 R 4.0048 7.9339 117.8678 58.9614 29.7295 178.9714 54 E 3.8301 7.9362 118.6335 59.3529 29.3985 179.2651 55 L 3.6806 7.1508 118.7279 57.5459 41.4447 179.4653 56 A 4.1618 7.8784 120.8092 55.1512 18.2149 179.3211 57 E 3.9382 7.8718 118.0100 59.3024 29.8351 178.7554 58 E 3.8962 8.4556 119.1867 59.3536 29.4901 179.5271 59 K 4.4079 8.4457 118.7471 59.3082 32.2176 179.4037 60 R 3.2217 8.0288 119.1620 59.2803 29.9049 178.4422 61 E 3.9024 8.4025 118.7709 59.0541 29.4980 179.4499 62 G 3.5461 7.7495 105.5687 48.1272 0.0000 175.4152 63 Y 4.3132 7.9443 120.8310 59.4072 38.0568 177.9123 64 E 4.0596 7.7264 120.7078 59.2605 29.5955 179.1781 65 R 4.0019 8.3108 119.1111 59.1638 30.0246 178.7062 66 L 4.2167 8.0076 118.6974 57.9067 41.7312 179.3436 67 L 4.0203 8.4617 119.3383 57.5711 41.5968 179.6484 68 K 3.9372 8.1597 119.7778 59.7320 32.0746 178.6983 69 M 3.8171 7.8926 118.2267 58.1395 31.4485 177.9657 70 Q 3.8513 8.0698 120.1507 59.3976 28.8578 178.1612 71 N 4.3445 7.9245 116.9021 56.2854 38.2687 177.5011 72 Q 3.9303 7.6731 118.6917 58.6007 28.9338 178.2567 73 R 3.9500 7.4408 118.0423 56.2362 30.0632 177.9590 74 G 4.0684 7.3533 105.7412 44.8870 0.0000 174.1374 75 G 4.0402 7.4049 107.7814 44.2981 0.0000 173.6739 76 R 4.4622 8.4980 119.5024 53.6159 31.5850 176.5019 77 A 4.1847 8.4822 126.4319 52.0999 19.0019 176.4522 78 L 4.5698 8.9582 121.4536 52.9554 44.9403 176.3757 79 F 4.8503 8.6507 122.0100 55.9743 40.9521 174.8694 80 Q 4.7419 8.2528 120.8947 53.6231 32.6152 174.9677 81 D 4.5061 8.5976 118.7980 54.9716 41.3501 176.2960 82 I 4.4309 7.9885 122.1617 59.3244 38.6692 176.0139 83 K 4.2208 8.6330 125.8639 55.6299 32.5809 177.2810 84 K 3.9094 8.5115 122.7041 55.8954 33.2505 174.9942 85 P 4.3361 0.0000 0.0000 62.5875 31.9026 177.5370 86 A 3.9235 8.7627 123.3400 54.3804 18.5431 177.6750 87 E 4.3062 6.8387 110.4289 54.5149 32.3394 175.3963 88 D 4.6890 7.9283 118.5567 54.3605 42.8574 176.8765 89 E 4.3007 7.2030 116.7960 54.2262 32.6523 175.3466 90 W 4.2585 6.0459 121.1656 55.5831 30.4748 177.8547 91 G 3.6456 7.3846 107.7111 47.2848 0.0000 175.5209 92 K 4.6407 8.8741 124.7213 54.8935 34.9829 177.0230 93 T 4.2598 8.7370 116.4259 67.2115 68.3076 174.8466 94 P 4.4086 0.0000 0.0000 65.6439 31.3467 178.5226 95 D 4.3856 8.2498 117.0484 57.3057 40.8543 178.3688 96 A 4.1771 8.4007 121.1436 55.6672 18.4818 179.1004 97 M 4.2466 8.7339 117.1074 59.1105 32.1088 178.6364 98 K 4.0522 8.3225 118.2355 59.4338 32.2228 179.1404 99 A 4.0458 8.1217 120.8507 54.9993 18.1859 179.6109 100 A 3.8833 8.2669 119.3317 55.6121 18.6260 179.1601 101 M 3.9599 8.5373 116.9932 59.0633 32.1008 178.3785 102 A 3.9701 8.2831 120.5784 55.0724 18.5457 179.1730 103 L 3.8197 7.9481 118.9465 58.5109 42.0130 179.1458 104 E 3.9945 8.5833 118.6813 59.4256 29.4207 179.4922 105 K 3.7706 8.1657 118.5743 59.1201 32.0335 179.3560 106 K 3.8842 8.2007 120.1107 59.4352 32.1652 178.8509 107 L 3.8228 8.0159 119.3256 57.9150 41.5861 178.8172 108 N 4.2895 8.8528 117.7861 56.9102 38.6637 176.5682 109 Q 3.9085 8.1355 120.4409 59.2366 29.2553 177.9618 110 A 4.1171 7.9580 121.7571 55.2653 18.2984 179.6780 111 L 3.9584 8.1597 117.5241 57.9843 41.7537 179.7127 112 L 4.1736 7.9609 118.9486 57.6673 41.4008 179.4072 113 D 4.3517 8.3824 119.3106 57.2800 40.8343 178.4883 114 L 3.9621 8.0434 120.8901 58.3592 42.0828 178.4445 115 H 4.0917 8.8105 118.5164 59.0268 29.7558 177.1520 116 A 4.0231 8.0871 122.6078 55.2229 18.2994 179.2858 117 L 4.0030 8.3788 119.3889 58.1468 41.9903 179.5438 118 G 3.5329 8.0915 105.6237 48.0233 0.0000 175.7857 119 S 4.1513 8.1841 118.2992 60.9476 62.6017 176.6947 120 A 4.0282 7.8957 122.4135 55.2722 18.2501 179.1377 121 R 4.2340 7.8892 113.1703 55.0084 31.5464 177.1257 122 T 3.5272 7.4841 107.9237 63.0834 68.0609 173.1159 123 D 4.8924 8.0389 122.9418 51.6131 41.6876 173.9848 124 P 4.3417 0.0000 0.0000 65.4124 31.5228 178.0606 125 H 4.1755 8.2060 117.7827 59.1267 30.0321 176.8439 126 L 4.0734 8.0879 121.9859 58.2454 41.9158 178.7569 127 C 4.0112 8.0171 116.3578 62.8938 28.0859 175.6039 128 D 4.3590 8.3070 119.6849 57.2434 40.9219 177.8543 129 F 4.2671 8.4355 121.3034 61.4171 39.3063 177.1729 130 L 4.0354 7.9992 118.0910 57.5156 39.9444 179.2037 131 E 3.9681 8.3168 118.5358 59.9375 29.2657 179.6634 132 T 4.0550 8.1276 114.6314 66.1327 68.5348 175.6567 133 H 4.5809 7.7026 115.4731 55.6182 30.4842 175.5041 134 F 4.6801 7.6850 116.9667 58.9472 40.7022 177.1096 135 L 4.0056 8.2846 118.8323 58.4242 41.5423 179.4570 136 D 4.4073 7.6563 115.5759 57.1384 41.2451 178.1082 137 E 3.9867 8.1102 119.0299 59.2316 29.4328 178.9230 138 E 4.0593 8.3682 118.8318 59.2315 29.5764 179.4190 139 V 3.5970 7.6414 117.8885 66.0763 31.1472 178.1831 140 K 3.9630 8.1747 118.2074 59.3258 31.8390 179.1852 141 L 3.9826 7.8789 120.1959 58.1367 42.1049 178.9267 142 I 3.7333 8.1128 120.1979 64.4601 37.1001 178.3474 143 K 4.0636 8.0971 120.3025 59.3221 31.8586 178.7400 144 K 3.9231 7.7007 119.4222 59.6408 32.1173 178.8374 145 M 4.1881 8.2827 119.2964 58.0439 31.8768 178.9029 146 G 3.6518 8.7030 106.3329 48.0489 0.0000 175.3653 147 D 4.4169 8.2098 121.5764 57.3004 40.6749 178.7935 148 H 4.1784 7.8790 116.2121 58.9485 28.7214 177.6569 149 L 4.0022 8.0349 120.6533 58.3528 41.4659 179.8599 150 T 3.8717 7.9113 115.4206 66.7859 68.1810 176.3636 151 N 4.5049 7.8487 116.6191 55.5285 38.4211 177.3772 152 L 4.1399 8.0583 121.2217 57.9985 41.6173 178.7782 153 H 4.1917 8.2768 117.1498 59.1061 29.8326 176.7861 154 R 4.0488 7.6774 119.5119 59.2819 29.9341 176.1661 155 L 4.1759 7.4376 120.8757 54.9549 41.6755 176.5212 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.34 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 S 8.36 4.44 0.00 3.95 3.75 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 3 S 8.08 4.39 0.00 3.90 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.61 4.11 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 5 I 7.50 4.05 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.58 0.88 0.00 0.00 6 R 7.27 4.14 0.00 1.86 1.91 0.00 3.21 0.00 0.00 3.06 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 7 Q 8.70 4.36 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 8 N 8.99 4.10 0.00 2.88 2.89 0.00 0.00 6.91 7.54 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 9 Y 7.90 4.72 0.00 2.79 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 10 S 8.14 4.23 0.00 3.98 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 11 T 8.40 3.70 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 1.17 0.00 0.00 12 D 7.87 4.24 0.00 2.66 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 13 V 7.00 3.47 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.82 0.00 0.00 14 E 7.91 3.79 0.00 1.79 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 2.46 0.00 15 A 8.11 3.98 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 16 A 8.34 3.95 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 17 V 8.01 3.53 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 1.14 0.00 0.00 1.09 0.00 0.00 18 N 7.91 4.22 0.00 2.81 2.74 0.00 0.00 6.70 8.03 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 19 S 8.07 4.02 0.00 3.94 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 20 L 8.21 4.05 0.00 1.92 1.86 1.11 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.99 3.71 2.26 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 1.04 0.00 0.00 1.06 0.00 0.00 22 N 8.12 4.31 0.00 2.84 2.98 0.00 0.00 6.94 6.70 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 23 L 8.14 3.99 0.00 1.96 1.86 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 8.44 3.98 0.00 3.55 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 25 L 8.62 3.75 0.00 1.76 1.59 0.90 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.31 4.04 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 27 A 7.95 3.83 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 28 S 8.66 4.30 0.00 4.26 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 0.00 29 Y 8.31 4.55 0.00 3.21 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 30 T 8.19 3.70 4.03 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 0.66 0.00 0.00 31 Y 7.68 4.07 0.00 3.22 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 32 L 8.15 4.15 0.00 2.14 2.18 1.34 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 33 S 7.97 4.31 0.00 3.97 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 34 L 7.80 3.53 0.00 1.47 0.89 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.22 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 36 F 8.64 4.22 0.00 3.36 3.27 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 0.00 37 Y 8.52 4.23 0.00 3.40 3.46 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 38 F 8.55 4.25 0.00 3.32 3.19 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 39 D 7.97 4.64 0.00 2.66 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 40 R 7.04 4.11 0.00 1.73 1.84 0.00 3.25 0.00 0.00 3.05 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 41 D 8.64 4.62 0.00 2.78 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 42 D 7.94 4.50 0.00 2.77 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 43 V 7.71 3.73 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 0.52 0.00 0.00 0.21 0.00 0.00 44 A 8.07 3.83 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 45 L 8.57 4.79 0.00 1.96 1.65 1.22 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.65 4.03 0.00 2.04 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 2.37 2.41 0.00 47 G 8.09 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.56 3.28 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 -0.12 0.00 0.00 0.69 0.00 0.00 49 S 8.45 4.24 0.00 4.04 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 50 H 8.74 4.00 0.00 3.28 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 7.94 4.11 0.00 3.03 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 52 F 7.95 4.19 0.00 3.20 3.18 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 53 R 7.93 4.00 0.00 1.90 1.90 0.00 2.73 0.00 0.00 3.02 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.82 0.00 54 E 7.94 3.83 0.00 1.82 1.78 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 2.12 2.35 0.00 55 L 7.15 3.68 0.00 0.96 0.44 0.26 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.88 4.16 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.87 3.94 0.00 2.16 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 2.27 2.34 0.00 58 E 8.46 3.90 0.00 2.10 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 0.00 2.23 2.35 0.00 59 K 8.45 4.41 0.00 2.20 2.27 0.00 1.85 0.00 0.00 2.02 0.00 0.00 3.03 0.00 0.00 3.52 0.00 0.00 0.00 0.00 1.95 1.95 7.81 60 R 8.03 3.22 0.00 2.04 2.01 0.00 3.10 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.55 0.00 61 E 8.40 3.90 0.00 2.11 1.85 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 2.23 2.43 0.00 62 G 7.75 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 7.94 4.31 0.00 3.34 3.38 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 64 E 7.73 4.06 0.00 2.12 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 2.26 0.00 65 R 8.31 4.00 0.00 1.93 2.18 0.00 2.59 0.00 0.00 2.75 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.69 0.00 66 L 8.01 4.22 0.00 2.06 1.79 0.65 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.46 4.02 0.00 2.00 1.85 1.37 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.16 3.94 0.00 1.93 1.98 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 69 M 7.89 3.82 0.00 1.75 1.23 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.02 0.00 70 Q 8.07 3.85 0.00 2.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 71 N 7.92 4.34 0.00 2.86 2.82 0.00 0.00 7.13 8.58 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 72 Q 7.67 3.93 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 73 R 7.44 3.95 0.00 0.79 0.66 0.00 2.96 0.00 0.00 3.03 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.10 0.00 74 G 7.35 4.07 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 0.00 0.00 0.00 75 G 7.40 4.04 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 0.00 0.00 0.00 76 R 8.50 4.46 0.00 1.80 1.86 0.00 3.35 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 77 A 8.48 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.96 4.57 0.00 1.43 1.47 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.65 4.85 0.00 3.04 2.95 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 80 Q 8.25 4.74 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 81 D 8.60 4.51 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.99 4.43 1.89 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.54 1.04 0.00 0.00 83 K 8.63 4.22 0.00 1.77 1.77 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.38 7.81 84 K 8.51 3.91 0.00 1.73 1.85 0.00 1.55 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.41 7.81 85 P 0.00 4.34 0.00 2.51 2.21 0.00 3.28 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.78 0.00 86 A 8.76 3.92 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 87 E 6.84 4.31 0.00 1.16 1.12 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 1.52 1.53 0.00 88 D 7.93 4.69 0.00 2.47 2.61 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 89 E 7.20 4.30 0.00 1.65 1.71 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 2.21 2.16 0.00 90 W 6.05 4.26 0.00 2.64 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 91 G 7.38 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.87 4.64 0.00 1.96 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.54 7.81 93 T 8.74 4.26 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 1.18 0.00 0.00 94 P 0.00 4.41 0.00 2.23 2.18 0.00 3.71 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 95 D 8.25 4.39 0.00 3.17 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 96 A 8.40 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 97 M 8.73 4.25 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 98 K 8.32 4.05 0.00 2.25 1.92 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.52 7.81 99 A 8.12 4.05 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 3.88 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 0.00 0.00 0.00 0.00 0.00 101 M 8.54 3.96 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.68 0.00 102 A 8.28 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.95 3.82 0.00 1.75 1.81 0.78 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.58 3.99 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 105 K 8.17 3.77 0.00 2.08 1.87 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.58 7.81 106 K 8.20 3.88 0.00 1.89 2.01 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 107 L 8.02 3.82 0.00 1.86 1.59 0.50 0.21 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 0.00 108 N 8.85 4.29 0.00 2.90 2.99 0.00 0.00 6.93 5.12 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 0.00 109 Q 8.14 3.91 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 110 A 7.96 4.12 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 0.00 111 L 8.16 3.96 0.00 1.93 1.74 1.11 0.20 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 0.00 112 L 7.96 4.17 0.00 1.89 1.73 1.01 1.09 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 0.00 113 D 8.38 4.35 0.00 2.90 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 0.00 114 L 8.04 3.96 0.00 1.86 1.85 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.81 4.09 0.00 3.32 3.44 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.09 4.02 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.38 4.00 0.00 1.74 1.86 0.89 0.90 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 0.00 118 G 8.09 3.53 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 0.00 119 S 8.18 4.15 0.00 3.93 3.97 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 0.00 120 A 7.90 4.03 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 0.00 121 R 7.89 4.23 0.00 1.78 1.94 0.00 3.44 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 122 T 7.48 3.53 4.26 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 1.25 0.00 0.00 123 D 8.04 4.89 0.00 2.70 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 0.00 124 P 0.00 4.34 0.00 2.34 2.32 0.00 3.79 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 2.12 2.05 0.00 125 H 8.21 4.18 0.00 3.23 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.09 4.07 0.00 1.91 1.89 1.09 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 127 C 8.02 4.01 0.00 3.19 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 0.00 128 D 8.31 4.36 0.00 2.89 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 0.00 129 F 8.44 4.27 0.00 3.04 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 0.00 130 L 8.00 4.04 0.00 2.00 1.75 0.97 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.32 3.97 0.00 2.20 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 2.37 2.59 0.00 132 T 8.13 4.05 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 0.94 0.00 0.00 133 H 7.70 4.58 0.00 2.62 2.60 0.00 5.60 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 7.69 4.68 0.00 3.09 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 0.00 135 L 8.28 4.01 0.00 1.67 1.77 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 136 D 7.66 4.41 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.11 3.99 0.00 2.17 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 2.31 2.30 0.00 138 E 8.37 4.06 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.61 0.00 139 V 7.64 3.60 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 1.04 0.00 0.00 1.01 0.00 0.00 140 K 8.17 3.96 0.00 2.02 1.84 0.00 1.68 0.00 0.00 1.93 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.45 7.81 141 L 7.88 3.98 0.00 1.88 1.84 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 142 I 8.11 3.73 1.99 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 1.46 0.58 0.94 0.00 0.00 143 K 8.10 4.06 0.00 1.89 1.92 0.00 1.52 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 144 K 7.70 3.92 0.00 2.05 2.06 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.44 7.81 145 M 8.28 4.19 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.77 0.00 146 G 8.70 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.21 4.42 0.00 2.92 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 0.00 148 H 7.88 4.18 0.00 3.19 3.20 0.00 5.63 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 0.00 149 L 8.03 4.00 0.00 1.85 1.76 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 150 T 7.91 3.87 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 1.22 0.00 0.00 151 N 7.85 4.50 0.00 2.92 2.85 0.00 0.00 7.11 7.20 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 0.00 152 L 8.06 4.14 0.00 1.86 1.72 0.94 1.13 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 0.00 153 H 8.28 4.19 0.00 3.23 3.34 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.68 4.05 0.00 1.97 2.09 0.00 3.31 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 155 L 7.44 4.18 0.00 1.71 1.55 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00