NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4015 8.2893 118.1910 55.3441 32.5269 174.2992 2 H 4.6428 8.6506 115.9319 53.4733 29.8457 172.7640 3 L 4.7965 7.9596 124.2206 52.3002 45.6871 178.1826 4 T 4.1742 9.8133 113.4340 60.8616 70.8461 174.0762 5 P 4.2194 0.0000 0.0000 65.6872 31.2346 178.8764 6 E 3.9500 8.0732 116.9388 59.3596 29.3662 179.0412 7 E 3.8867 8.2386 118.5629 59.2681 29.4936 179.2844 8 K 3.7834 8.0542 119.5768 59.6550 32.2229 178.7279 9 S 4.0457 8.2469 113.1574 61.2241 62.2830 175.9896 10 A 3.9963 8.2633 124.0037 55.0023 18.1475 179.8210 11 V 3.4116 7.9662 116.9771 66.5000 31.7346 178.4479 12 T 3.9869 8.1487 115.4337 66.4697 68.0354 176.5317 13 A 4.0346 8.0149 121.7873 55.2398 18.7492 179.1847 14 L 3.9133 7.9407 118.4187 57.9803 42.1593 178.9549 15 W 4.3120 8.8120 128.4674 60.1628 30.4083 178.0758 16 G 3.7427 8.0973 104.4626 46.7576 0.0000 174.7039 17 K 4.4845 7.7868 118.4285 55.2456 32.8228 176.4212 18 V 3.6975 6.9985 120.7651 61.8951 31.9807 175.6826 19 N 4.4614 8.3848 125.7920 52.5340 38.8839 175.2616 20 V 3.4743 8.0989 128.3270 66.1045 31.7643 177.3017 21 D 4.3323 8.0543 117.9660 57.3778 40.7183 178.5579 22 E 3.8784 8.4160 118.9325 59.5368 29.5321 179.6813 23 V 3.6260 8.1067 118.7669 65.5796 31.3794 178.3954 24 G 3.6655 8.3844 106.0478 47.8026 0.0000 176.0044 25 G 3.6227 8.1157 108.8176 47.2338 0.0000 175.4606 26 E 3.8772 8.2084 121.4086 59.0548 29.7329 178.8313 27 A 3.9445 8.4241 121.3186 55.3120 18.3342 179.0304 28 Y 3.8745 8.5065 118.6284 60.5567 38.9419 178.3583 29 G 3.5942 8.4318 106.9899 47.9337 0.0000 176.0033 30 R 3.9046 8.2140 120.7291 58.4587 29.9627 178.8327 31 L 3.8943 7.8565 120.3974 58.3269 42.1791 179.2270 32 L 3.9893 7.4553 119.7238 56.5793 41.1948 179.7377 33 V 3.5204 7.0888 117.3511 65.8429 31.7357 177.9939 34 V 3.5189 7.7580 116.8212 64.3066 32.7353 175.5446 35 Y 3.6672 7.2287 116.3655 54.2056 37.9111 174.1212 36 P 4.7673 0.0000 0.0000 64.0272 31.9599 178.3164 37 W 4.3655 7.9859 116.8018 59.3041 27.6270 177.7056 38 T 4.2154 7.6676 110.5986 63.9221 68.1522 175.7663 39 Q 4.4867 8.1468 121.1254 57.4565 28.5095 177.9221 40 R 3.7315 7.5792 117.1592 58.6646 29.3104 177.7885 41 F 4.3451 6.9088 114.6889 57.0680 39.6235 175.5541 42 F 4.5926 7.8277 118.6843 56.6818 39.7882 177.1290 43 E 4.0415 8.4792 122.1738 59.2613 29.4996 178.3986 44 S 4.6703 8.0930 110.6598 58.5341 63.4240 174.4691 45 F 4.5380 8.4391 119.2457 58.2104 39.6187 176.9688 46 G 3.8937 8.1097 106.9258 44.6066 0.0000 173.6418 47 D 4.4935 8.5963 124.2025 54.5503 41.0869 176.1804 48 L 4.9252 8.2936 127.4456 54.4355 42.9839 178.2920 49 S 4.2913 8.8531 117.3360 60.8880 63.2554 174.5018 50 T 4.7352 7.4471 109.6908 58.1987 73.0162 172.6992 51 P 4.1973 0.0000 0.0000 66.0704 31.3587 178.7482 52 D 4.3086 8.0810 116.8125 57.0869 40.5203 178.5798 53 A 3.9685 7.9740 120.6715 55.0696 18.6948 179.4590 54 V 3.7107 8.0271 117.0514 66.6738 31.4179 178.2342 55 M 4.2088 8.1669 117.1726 57.8527 31.8813 178.1574 56 G 3.9324 7.9037 103.2015 43.9130 0.0000 173.3455 57 N 4.4737 7.4863 121.3462 52.6875 39.5236 173.9206 58 P 4.2248 0.0000 0.0000 65.6236 31.3500 178.8247 59 K 3.6847 8.5242 117.7497 58.8867 31.6890 179.6674 60 V 3.7280 7.8122 118.3138 65.9474 31.5428 178.0423 61 K 3.9187 8.2226 118.1171 59.4628 32.0176 179.2097 62 A 3.9218 8.1583 121.2100 55.1118 18.2373 179.5191 63 Q 3.9299 8.3275 118.4233 59.1231 29.0436 178.5923 64 G 3.4312 8.1952 107.1226 47.5902 0.0000 175.7284 65 K 3.9564 8.1889 120.9898 59.2247 32.0614 179.5901 66 K 4.0086 7.8755 118.2314 59.3312 31.9484 179.6337 67 V 3.6083 7.7805 118.4892 66.1370 31.5582 177.9599 68 L 4.3224 8.3691 120.2350 57.7119 41.8908 178.9951 69 G 3.7657 8.3877 105.9501 47.9142 0.0000 175.5955 70 A 4.1542 8.2745 123.5053 54.6016 18.1744 179.4839 71 F 4.2117 8.5002 118.7180 61.5406 39.9213 176.9559 72 S 4.2400 9.0273 113.2023 61.6447 62.3199 175.8337 73 D 4.4966 8.4733 121.7152 57.3963 40.4992 179.0954 74 G 3.5378 8.0670 105.9623 47.3358 0.0000 175.3791 75 L 3.8015 7.1755 119.1035 56.4659 41.6189 178.2872 76 A 4.1792 7.5494 119.5096 52.9815 19.5858 176.6766 77 H 4.8960 7.9936 114.8614 54.9823 29.5110 175.2857 78 L 3.9751 7.7983 118.8243 57.0887 41.9874 178.4005 79 D 4.5858 7.8897 116.6977 55.2537 41.9812 176.3981 80 N 5.0215 8.1052 118.1218 51.5569 39.9381 174.6370 81 L 4.0932 7.8805 123.1746 57.6773 42.1621 179.1888 82 K 4.0786 8.0817 117.1182 59.5507 32.1496 179.1262 83 G 3.7017 8.1416 105.4417 48.1071 0.0000 175.8917 84 T 3.6736 7.6959 117.2170 65.4638 68.6618 175.7708 85 F 4.7481 7.8896 116.9456 57.0718 39.3538 177.3367 86 A 4.0830 7.6961 123.4527 55.7183 18.1733 180.5422 87 T 3.8550 7.8378 113.6381 66.8544 68.5512 176.9071 88 L 4.1801 7.9720 120.3523 57.4150 41.6645 179.3484 89 S 4.4122 8.5309 115.1411 61.0947 62.3727 176.0463 90 E 3.8915 8.3404 121.2681 59.1254 29.1620 179.1438 91 L 3.8970 7.9788 120.3226 58.6967 42.1641 178.8838 92 H 4.1923 8.5979 116.3325 59.0866 28.0569 177.0444 93 C 3.6358 7.9685 120.8750 62.1329 31.0896 175.3248 94 D 4.3152 8.3460 121.0658 56.6813 40.6211 177.6426 95 K 4.2289 7.6882 116.4746 57.8530 33.2558 177.5187 96 L 4.1933 7.7369 116.1883 54.7791 42.2452 176.1820 97 H 4.1825 7.2367 113.9498 56.6928 26.6620 174.9800 98 V 3.9219 7.9383 118.4620 60.7844 32.7068 174.7866 99 D 4.3698 8.7217 127.1075 53.8138 41.6974 175.1165 100 P 3.3910 0.0000 0.0000 64.1800 31.8343 177.8566 101 E 3.8790 8.3224 119.4666 59.3338 29.2276 178.3376 102 N 4.2559 7.8895 116.4567 56.2226 38.4783 177.3034 103 F 4.4845 7.4556 119.3117 60.5224 38.9343 177.9681 104 R 3.9839 7.8403 117.3672 59.1821 29.9694 178.8462 105 L 3.7418 7.8159 118.8265 57.6249 41.4629 179.3441 106 L 4.0427 8.3112 120.7331 58.0309 42.0095 179.1937 107 G 3.6784 8.2470 105.7197 47.9931 0.0000 175.4339 108 N 4.4400 8.3840 118.9264 56.0833 38.4799 177.7452 109 V 3.6844 7.9676 119.7941 65.6045 31.5259 177.8980 110 L 3.8990 8.2867 120.7263 58.0377 41.8626 179.1039 111 V 3.5588 7.9884 118.2343 66.2545 31.3975 177.8145 112 C 4.1028 8.0800 116.4852 62.7751 27.8565 176.3044 113 V 3.5227 8.0429 120.2914 65.7866 30.9917 178.0992 114 L 3.8628 7.9150 118.7511 57.6083 41.3801 179.3238 115 A 3.7605 7.3764 120.7026 55.3129 18.0909 179.2033 116 H 4.1408 8.1035 115.8739 59.5927 30.0105 176.7686 117 H 3.9682 8.1671 119.3378 58.9224 29.6733 176.6718 118 F 4.5026 8.4523 118.6456 56.8918 39.4902 177.1228 119 G 3.9101 8.7386 107.7633 46.0294 0.0000 177.1303 120 K 3.9308 8.9808 124.1098 59.1829 32.0416 177.6503 121 E 4.1244 7.8383 116.2608 58.7057 29.8283 177.5141 122 F 4.5060 8.1768 123.5240 56.9548 37.8009 175.0577 123 T 4.1891 7.3161 116.0059 60.1322 71.3025 173.5303 124 P 4.1501 0.0000 0.0000 65.5247 31.3430 177.1969 125 P 4.1832 0.0000 0.0000 65.4046 31.2602 178.8784 126 V 3.5414 7.4651 116.9013 65.8584 31.4373 177.8163 127 Q 3.4838 7.7469 119.2738 59.0655 29.0033 178.0275 128 A 4.0362 8.1557 121.6793 55.1766 18.3413 179.5126 129 A 3.8852 7.9451 118.9896 55.6620 18.4516 179.5846 130 Y 3.9192 8.3143 115.2251 61.1021 37.9048 178.6962 131 Q 4.1462 8.9270 119.6020 58.8845 28.7583 178.9665 132 K 3.9686 7.9947 119.1747 59.3714 32.0159 179.5983 133 V 3.4813 7.7584 118.4015 66.2063 31.4170 178.5688 134 V 3.8382 8.4053 112.3400 64.3243 31.2448 178.5101 135 A 4.1063 8.2702 120.9182 54.9584 18.1661 179.9356 136 G 3.4842 8.2787 104.4288 47.9285 0.0000 176.1718 137 V 3.2633 8.0868 121.0907 65.4333 31.5395 177.9397 138 A 3.8510 8.1753 120.7820 55.1417 17.9975 179.1085 139 N 4.2401 8.2625 114.6495 56.6968 39.2948 176.6737 140 A 4.1536 8.1110 122.2887 55.2563 18.5848 179.6866 141 L 3.8996 8.0708 117.3467 57.0877 41.6508 178.7708 142 A 4.4322 7.8525 119.6112 53.2468 18.7163 178.6280 143 H 4.1678 7.9050 116.7188 58.8314 30.0383 176.0450 144 K 4.4425 8.2919 116.2587 56.3378 32.1166 176.5271 145 Y 4.1560 7.9610 117.4528 58.5392 38.4199 175.7588 146 H 4.4364 8.3608 117.0958 56.2634 28.1670 173.4053 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 8.29 4.40 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 2 H 8.65 4.64 0.00 3.34 3.31 0.00 5.47 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 3 L 7.96 4.80 0.00 1.54 1.49 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.81 4.17 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 1.23 0.00 0.00 5 P 0.00 4.22 0.00 2.16 2.12 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 6 E 8.07 3.95 0.00 2.03 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 2.45 0.00 7 E 8.24 3.89 0.00 2.19 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 0.00 2.28 2.27 0.00 8 K 8.05 3.78 0.00 1.76 1.90 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.39 7.81 9 S 8.25 4.05 0.00 3.92 4.05 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 10 A 8.26 4.00 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 11 V 7.97 3.41 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 0.65 0.00 0.00 0.46 0.00 0.00 12 T 8.15 3.99 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 1.26 0.00 0.00 13 A 8.01 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.94 3.91 0.00 1.88 1.98 0.21 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.81 4.31 0.00 3.82 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 16 G 8.10 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.79 4.48 0.00 1.92 2.07 0.00 1.69 0.00 0.00 1.51 0.00 0.00 3.22 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.42 7.81 18 V 7.00 3.70 1.10 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 -0.11 0.00 0.00 0.72 0.00 0.00 19 N 8.38 4.46 0.00 2.71 2.58 0.00 0.00 6.83 7.71 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 20 V 8.10 3.47 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 1.31 0.00 0.00 1.00 0.00 0.00 21 D 8.05 4.33 0.00 2.82 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 22 E 8.42 3.88 0.00 2.02 1.87 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 2.26 2.37 0.00 23 V 8.11 3.63 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 0.93 0.00 0.00 0.70 0.00 0.00 24 G 8.38 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.12 3.62 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 0.00 0.00 0.00 26 E 8.21 3.88 0.00 2.15 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 2.24 2.32 0.00 27 A 8.42 3.94 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 28 Y 8.51 3.87 0.00 3.19 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 29 G 8.43 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.21 3.90 0.00 1.99 1.91 0.00 3.08 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 1.58 1.76 0.00 31 L 7.86 3.89 0.00 1.56 1.51 0.89 0.01 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 32 L 7.46 3.99 0.00 1.73 1.65 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.09 3.52 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 0.70 0.00 0.00 0.93 0.00 0.00 34 V 7.76 3.52 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.71 0.00 0.00 35 Y 7.23 3.67 0.00 2.55 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 36 P 0.00 4.77 0.00 2.29 2.25 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 2.22 1.88 0.00 37 W 7.99 4.37 0.00 3.55 3.49 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 38 T 7.67 4.22 4.34 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 1.07 0.00 0.00 39 Q 8.15 4.49 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 40 R 7.58 3.73 0.00 1.66 1.93 0.00 3.00 0.00 0.00 2.70 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.50 0.00 41 F 6.91 4.35 0.00 1.60 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 0.00 0.00 0.00 0.00 42 F 7.83 4.59 0.00 2.81 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 0.00 0.00 0.00 0.00 43 E 8.48 4.04 0.00 1.96 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 2.25 2.21 0.00 44 S 8.09 4.67 0.00 4.11 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 45 F 8.44 4.54 0.00 3.30 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 46 G 8.11 3.89 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 0.00 0.00 0.00 47 D 8.60 4.49 0.00 2.67 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 48 L 8.29 4.93 0.00 1.67 1.63 1.08 1.06 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 49 S 8.85 4.29 0.00 3.96 4.05 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 50 T 7.45 4.74 4.23 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 52 D 8.08 4.31 0.00 2.75 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 53 A 7.97 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.03 3.71 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 1.03 0.00 0.00 0.97 0.00 0.00 55 M 8.17 4.21 0.00 2.00 2.10 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 2.61 2.92 0.00 56 G 7.90 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 0.00 0.00 0.00 57 N 7.49 4.47 0.00 2.96 2.85 0.00 0.00 7.10 8.85 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 58 P 0.00 4.22 0.00 2.13 2.04 0.00 3.61 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 59 K 8.52 3.68 0.00 1.36 0.74 0.00 1.62 0.00 0.00 1.05 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.10 1.21 7.81 60 V 7.81 3.73 2.36 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 1.28 0.00 0.00 1.09 0.00 0.00 61 K 8.22 3.92 0.00 1.95 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.58 7.81 62 A 8.16 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 63 Q 8.33 3.93 0.00 2.44 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.24 1.89 0.00 64 G 8.20 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 65 K 8.19 3.96 0.00 1.95 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.76 7.81 66 K 7.88 4.01 0.00 1.96 1.88 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.64 7.81 67 V 7.78 3.61 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 1.17 0.00 0.00 0.69 0.00 0.00 68 L 8.37 4.32 0.00 1.97 1.79 0.80 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.39 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 0.00 0.00 0.00 70 A 8.27 4.15 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 71 F 8.50 4.21 0.00 3.22 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 72 S 9.03 4.24 0.00 4.62 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 73 D 8.47 4.50 0.00 2.90 2.66 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 0.00 0.00 0.00 0.00 74 G 8.07 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.18 3.80 0.00 1.42 1.37 -0.63 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.55 4.18 1.17 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 0.00 0.00 77 H 7.99 4.90 0.00 3.09 3.14 0.00 5.82 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 78 L 7.80 3.98 0.00 1.54 1.63 0.78 0.93 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 D 7.89 4.59 0.00 2.64 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 80 N 8.11 5.02 0.00 2.63 2.59 0.00 0.00 7.09 7.52 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 81 L 7.88 4.09 0.00 1.75 1.80 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.08 4.08 0.00 1.68 1.83 0.00 1.49 0.00 0.00 1.18 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.46 7.81 83 G 8.14 3.70 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 0.00 0.00 0.00 84 T 7.70 3.67 3.94 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 0.63 0.00 0.00 85 F 7.89 4.75 0.00 3.17 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 86 A 7.70 4.08 1.42 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 0.00 0.00 87 T 7.84 3.85 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 1.22 0.00 0.00 88 L 7.97 4.18 0.00 1.88 1.88 1.12 0.91 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 89 S 8.53 4.41 0.00 4.14 4.14 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 90 E 8.34 3.89 0.00 2.19 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 2.33 2.50 0.00 91 L 7.98 3.90 0.00 1.78 1.88 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.60 4.19 0.00 3.62 3.78 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.97 3.64 0.00 1.23 2.32 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 94 D 8.35 4.32 0.00 2.74 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 95 K 7.69 4.23 0.00 1.78 1.81 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.36 7.81 96 L 7.74 4.19 0.00 1.73 1.63 0.73 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.24 4.18 0.00 3.43 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.94 3.92 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 0.16 0.00 0.00 0.38 0.00 0.00 99 D 8.72 4.37 0.00 2.79 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 0.00 100 P 0.00 3.39 0.00 1.96 1.93 0.00 3.36 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.44 0.00 101 E 8.32 3.88 0.00 2.03 1.90 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 2.31 2.39 0.00 102 N 7.89 4.26 0.00 2.44 2.68 0.00 0.00 6.94 8.12 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 0.00 103 F 7.46 4.48 0.00 3.15 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 0.00 104 R 7.84 3.98 0.00 1.87 1.97 0.00 3.12 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 105 L 7.82 3.74 0.00 1.62 1.18 0.69 -0.16 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 0.00 106 L 8.31 4.04 0.00 1.75 1.89 0.93 1.42 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 0.00 107 G 8.25 3.68 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 0.00 0.00 0.00 108 N 8.38 4.44 0.00 2.95 2.96 0.00 0.00 6.68 7.29 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 0.00 109 V 7.97 3.68 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 1.12 0.00 0.00 1.13 0.00 0.00 110 L 8.29 3.90 0.00 1.75 1.82 0.91 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.99 3.56 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 1.38 0.00 0.00 1.17 0.00 0.00 112 C 8.08 4.10 0.00 3.17 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.04 3.52 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.95 0.00 0.00 114 L 7.92 3.86 0.00 0.97 0.98 0.58 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.38 3.76 1.38 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 0.00 0.00 116 H 8.10 4.14 0.00 3.17 3.39 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.17 3.97 0.00 2.86 2.78 0.00 5.99 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 0.00 118 F 8.45 4.50 0.00 3.31 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 0.00 119 G 8.74 3.91 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 0.00 0.00 0.00 120 K 8.98 3.93 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 121 E 7.84 4.12 0.00 2.15 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 2.41 2.56 0.00 122 F 8.18 4.51 0.00 3.04 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 0.00 123 T 7.32 4.19 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.18 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.47 3.54 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 1.05 0.00 0.00 0.91 0.00 0.00 127 Q 7.75 3.48 0.00 1.58 2.05 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 2.42 2.60 0.00 128 A 8.16 4.04 1.38 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 0.00 0.00 129 A 7.95 3.89 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 0.00 130 Y 8.31 3.92 0.00 3.29 3.31 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 0.00 131 Q 8.93 4.15 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 132 K 7.99 3.97 0.00 1.96 1.81 0.00 1.60 0.00 0.00 1.49 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.61 7.81 133 V 7.76 3.48 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 0.93 0.00 0.00 0.70 0.00 0.00 134 V 8.41 3.84 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 0.98 0.00 0.00 1.09 0.00 0.00 135 A 8.27 4.11 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 0.00 136 G 8.28 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 0.00 0.00 0.00 0.00 137 V 8.09 3.26 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 0.59 0.00 0.00 0.63 0.00 0.00 138 A 8.18 3.85 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 0.00 139 N 8.26 4.24 0.00 2.84 3.02 0.00 0.00 7.23 8.35 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 0.00 140 A 8.11 4.15 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 0.00 141 L 8.07 3.90 0.00 1.03 0.54 0.01 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.85 4.43 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 0.00 143 H 7.91 4.17 0.00 3.33 3.51 0.00 5.75 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 0.00 144 K 8.29 4.44 0.00 1.84 1.85 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.76 7.81 145 Y 7.96 4.16 0.00 3.13 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 0.00 146 H 8.36 4.44 0.00 3.22 3.24 0.00 5.75 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