NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9027 8.0549 120.2905 61.0700 32.6991 174.2411 2 E 3.9847 8.1729 119.7937 55.0125 29.8815 174.9090 3 W 4.9019 8.4096 123.8834 54.9604 32.6206 176.1707 4 T 4.4168 9.7557 114.7559 61.0742 70.8735 175.8116 5 D 4.3757 8.6011 121.1978 57.5851 40.8913 178.9674 6 A 4.0621 8.0066 120.8399 54.8764 18.4176 179.0699 7 E 3.9806 7.9499 117.5329 59.5877 29.7893 179.2609 8 K 3.7983 8.3003 118.7395 59.4258 31.9968 179.5182 9 S 4.2067 8.0228 114.0644 61.4959 63.0188 176.7820 10 T 3.9216 7.9090 119.5106 66.4056 68.2153 176.7110 11 I 3.7406 7.6914 121.9527 64.5576 37.1968 178.7956 12 S 4.4991 8.0882 114.5354 61.0696 62.6029 176.2955 13 A 4.0435 8.1995 124.6050 54.9292 18.1188 179.5082 14 V 3.9222 8.4122 117.2416 66.0896 31.8448 178.1681 15 W 4.5449 9.1108 128.6225 60.4356 30.2779 178.0709 16 G 3.6696 8.1824 107.3354 48.0416 0.0000 174.2962 17 K 4.0643 7.5761 116.9425 56.6518 32.5665 176.8741 18 V 3.7772 7.2087 119.5090 61.8189 32.2651 175.0783 19 N 4.6389 8.2894 124.8848 51.6877 40.4656 174.6938 20 I 3.6199 8.1879 129.8515 65.0283 37.0576 177.9584 21 D 4.3469 8.1341 117.4063 56.4816 40.5267 177.6446 22 E 4.2481 7.7391 119.2045 58.6872 30.2591 178.0233 23 I 3.8268 8.2938 120.2880 64.5415 37.0846 177.8932 24 G 3.8507 8.3219 105.3856 48.5287 0.0000 173.6344 25 P 4.2824 0.0000 0.0000 64.5360 31.7592 178.6713 26 L 3.9437 7.6438 117.1878 57.8582 41.5556 179.4838 27 A 3.9850 7.9576 120.2268 55.2868 18.4558 179.4352 28 L 3.8991 7.8080 118.2391 58.2111 42.2279 179.0807 29 A 3.9766 7.9272 120.4501 55.0549 18.3003 179.6151 30 R 3.8208 7.9342 116.9958 59.3941 30.0931 178.8436 31 V 3.7018 8.0324 118.2324 66.2064 31.1879 178.0811 32 L 4.1542 7.9569 119.5198 56.4632 41.1303 179.4392 33 I 3.8156 7.1205 118.9434 64.0365 37.5676 178.1063 34 V 3.4544 8.0017 117.7750 64.2893 32.7613 175.6211 35 Y 3.6712 6.8604 115.9339 54.1933 37.7883 174.2074 36 P 4.4303 0.0000 0.0000 63.7997 31.3030 177.3243 37 W 4.4467 7.2358 114.9529 58.5784 28.4188 177.9280 38 T 4.3222 7.6710 111.1035 64.4391 68.2371 176.4848 39 Q 4.3304 8.0367 121.5661 58.9161 28.5225 178.5573 40 R 3.9504 7.4611 115.1197 59.1362 29.2870 178.1408 41 Y 4.2966 7.2126 116.9461 59.4681 38.8819 175.9939 42 F 4.1540 7.6868 119.6738 55.3170 37.1809 175.6997 43 G 3.7280 7.8536 112.7176 48.5757 0.0000 172.8168 44 S 4.3878 8.0417 114.9290 59.7361 63.5119 176.1928 45 F 4.3028 8.8095 119.5968 59.3027 39.8294 175.8243 46 G 3.9941 7.4881 105.5480 45.2062 0.0000 176.6658 47 N 4.5942 8.6558 125.2830 52.2409 36.9093 173.9901 48 V 4.2353 7.9707 123.5074 62.0008 32.7821 177.4024 49 S 4.1809 8.1288 113.6510 61.9187 62.5218 174.1263 50 T 4.7560 7.5788 108.0807 58.1402 71.9686 172.9672 51 P 4.2428 0.0000 0.0000 65.5902 31.1254 178.9263 52 A 3.9605 7.9356 118.9837 54.9069 18.1538 179.3902 53 A 3.9093 8.4683 118.9430 55.3592 18.7799 179.6198 54 I 3.7902 9.1632 118.2541 64.9953 37.0363 178.4715 55 M 4.1230 8.8230 119.2812 58.2775 31.9245 178.3101 56 G 3.9095 8.0969 102.8326 43.9172 0.0000 172.9761 57 N 4.5922 7.8409 121.9558 52.3366 39.7372 174.0362 58 P 4.3992 0.0000 0.0000 65.3899 31.7834 178.5777 59 K 3.7776 8.7759 118.7956 58.6197 31.8585 179.5461 60 V 3.4541 7.7189 118.0947 65.9417 31.2295 177.2908 61 A 3.8850 8.0985 120.6071 55.5980 18.1695 179.3408 62 A 3.9180 7.9344 118.3729 55.6897 18.4359 179.4133 63 H 4.3168 8.3578 116.6371 59.0564 29.9139 177.7089 64 G 3.6509 8.1942 107.9568 47.6786 0.0000 175.7778 65 K 4.1507 7.7596 120.0406 58.6812 31.7913 179.7057 66 V 3.5646 7.7119 118.8712 66.0113 31.4530 178.0989 67 V 3.6118 8.0162 118.3355 66.4492 31.3253 177.8080 68 C 4.6153 8.2293 116.0308 62.7843 27.8198 176.3317 69 G 3.7455 8.2500 106.8612 47.5941 0.0000 175.7099 70 A 4.0292 7.8290 122.8352 55.0796 18.4018 179.7611 71 L 4.0522 7.8654 118.4984 57.2882 41.5070 179.2339 72 D 4.2023 8.2274 118.2670 57.1658 41.1092 178.4471 73 K 4.0025 8.0748 118.8801 59.1692 31.7799 179.2149 74 A 3.8546 7.6084 120.3690 55.1606 18.4053 179.4496 75 V 3.2748 7.4162 115.4601 65.9719 31.5307 178.1326 76 K 4.1431 8.1825 117.6113 58.5143 32.4538 178.5315 77 N 4.9751 8.3365 117.0711 52.4545 39.6574 176.6420 78 M 3.9146 8.2520 121.1473 57.6754 32.6021 178.2054 79 G 3.9018 8.0619 106.7029 47.4660 0.0000 175.2050 80 N 4.9879 7.8616 117.6604 52.8866 40.0443 177.6319 81 I 3.3836 7.7108 123.5470 64.3954 37.0616 177.6907 82 L 3.9557 7.7634 118.3593 57.4964 41.6539 179.0511 83 A 4.1279 7.8674 120.2374 55.5328 18.3072 179.2856 84 T 3.9688 8.5442 113.9807 66.7960 68.7870 175.6447 85 Y 4.7522 8.0174 117.2803 58.1948 39.2293 178.4386 86 K 4.1415 7.9138 122.8318 59.6755 32.2820 179.1165 87 S 4.3432 7.9680 114.8528 61.1082 62.8313 176.5916 88 L 3.9356 7.7237 121.5987 57.6086 41.4868 179.1534 89 S 4.1023 7.8586 112.6393 61.4287 62.3320 175.9226 90 E 3.8231 8.4207 121.9214 59.6062 29.1028 179.5816 91 T 3.7312 7.9397 109.7114 65.1552 68.8814 176.4026 92 H 3.9795 8.3700 119.0575 58.1965 28.1414 177.6458 93 A 3.4724 7.6666 122.5099 54.8032 18.1511 179.0387 94 N 4.0900 7.9318 112.7069 53.7153 39.0347 176.1329 95 K 4.0359 7.2412 119.8751 57.4607 33.5159 176.8875 96 L 4.1630 7.5754 117.0458 54.5579 42.2955 176.5593 97 F 3.9477 6.6233 114.8531 58.3252 36.7389 175.7542 98 V 3.3120 7.7593 120.1802 61.6830 32.0519 174.9891 99 D 4.3768 8.6623 127.6422 53.9743 41.5114 175.1624 100 P 3.6522 0.0000 0.0000 64.1612 31.7549 177.7657 101 D 4.3848 8.1630 120.1267 57.1307 40.7413 177.9884 102 N 4.3216 7.6281 116.6281 56.0341 38.3822 177.2909 103 F 4.4891 6.9924 118.1759 60.5680 38.9444 177.5831 104 R 3.9641 8.0297 118.2637 59.0685 29.8362 178.6091 105 V 3.4051 7.6748 117.7907 65.7384 31.4062 177.4726 106 L 3.9695 7.8808 119.5690 58.3304 42.0540 178.5856 107 A 4.0510 8.0831 120.5641 55.5899 18.2612 179.4218 108 D 4.4104 8.2238 117.2123 57.5003 41.0358 179.2018 109 V 3.7084 8.1091 118.9278 65.8258 31.5428 177.7858 110 L 4.0684 8.3827 120.4658 58.5465 41.9006 179.1570 111 T 3.9739 8.0403 115.2482 66.7670 68.4456 176.7666 112 I 3.7450 7.7366 121.3018 64.1446 36.9723 178.7651 113 V 3.5362 7.6527 118.7928 66.0932 31.3634 178.2796 114 I 3.2099 7.4652 119.3138 63.7174 36.6131 178.4332 115 A 3.3943 7.3642 121.5110 55.0078 18.0586 179.5935 116 A 3.8711 7.6821 117.8515 54.9502 18.4304 179.6091 117 K 4.0598 7.8940 117.6989 59.7272 32.6096 178.7515 118 F 4.4658 9.0592 117.5077 59.1164 39.4347 177.0645 119 G 3.9205 9.2148 108.4376 45.8482 0.0000 174.5946 120 A 4.0535 8.8728 122.6605 54.7196 18.4484 178.5908 121 S 4.4436 7.7400 108.9735 59.1854 63.6630 175.1886 122 F 4.7309 8.3389 125.5558 57.5367 37.4829 175.4280 123 T 4.2850 7.6144 116.1988 59.5491 71.5720 173.5306 124 P 4.3915 0.0000 0.0000 66.0683 31.3599 178.5714 125 E 3.9401 8.1043 116.3253 59.5195 29.4605 179.4683 126 I 3.6616 7.1575 118.1259 64.4246 37.1881 177.9492 127 Q 3.5744 8.4347 121.2579 59.3285 28.7933 178.6647 128 A 4.0394 8.3770 121.7547 55.3931 18.5754 179.0748 129 T 4.2900 7.9562 110.3044 63.5475 67.5737 176.6409 130 W 4.4307 8.7876 131.1950 60.8678 30.8363 177.6150 131 Q 3.9720 8.8083 120.0909 58.9892 28.3920 178.0429 132 K 3.9806 8.1135 120.3596 59.4283 32.2535 178.6217 133 F 4.4617 8.3412 120.5860 61.6516 39.2804 177.0818 134 M 3.6265 7.8623 118.6151 57.9254 31.5686 178.8492 135 K 3.9469 7.8590 118.6381 59.5913 32.8748 179.5624 136 V 3.4476 7.4744 119.3105 65.7428 31.4929 178.0845 137 V 3.1778 7.1967 117.9163 65.9452 31.3791 178.1878 138 V 3.4730 7.7285 117.6662 65.6796 31.0876 177.6756 139 A 3.8693 7.9357 119.6980 55.2281 18.4565 178.8976 140 A 4.0298 8.2968 119.2454 55.8493 18.1660 179.8409 141 M 3.9927 7.9970 116.0599 57.6089 31.8921 178.1975 142 G 4.0949 7.4156 103.3891 44.5204 0.0000 174.9064 143 S 4.3005 7.8098 116.9957 60.0048 63.2697 175.1202 144 R 4.3710 7.9190 119.7592 55.9329 30.4703 175.4214 145 Y 4.1740 7.5721 116.9937 56.8099 37.3662 175.8356 146 F 4.7327 8.2291 122.7174 57.7084 40.1622 175.0608 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 V 8.05 3.90 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 2 E 8.17 3.98 0.00 1.94 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 2.14 2.24 0.00 3 W 8.41 4.90 0.00 3.27 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 4 T 9.76 4.42 4.29 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 1.24 0.00 0.00 5 D 8.60 4.38 0.00 2.82 2.78 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 6 A 8.01 4.06 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 7 E 7.95 3.98 0.00 2.28 2.35 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 2.91 2.59 0.00 8 K 8.30 3.80 0.00 1.99 1.76 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.28 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.20 1.61 7.81 9 S 8.02 4.21 0.00 4.07 4.30 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 10 T 7.91 3.92 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 1.31 0.00 0.00 11 I 7.69 3.74 1.72 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.28 0.19 0.00 0.00 12 S 8.09 4.50 0.00 4.10 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 13 A 8.20 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 14 V 8.41 3.92 2.43 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 0.76 0.00 0.00 1.16 0.00 0.00 15 W 9.11 4.54 0.00 3.50 3.12 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 0.00 0.00 0.00 16 G 8.18 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 17 K 7.58 4.06 0.00 1.35 1.35 0.00 1.54 0.00 0.00 1.33 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.14 1.20 7.81 18 V 7.21 3.78 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 0.23 0.00 0.00 0.96 0.00 0.00 19 N 8.29 4.64 0.00 2.73 2.57 0.00 0.00 7.19 8.23 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 20 I 8.19 3.62 1.82 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.39 0.94 0.00 0.00 21 D 8.13 4.35 0.00 2.77 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 22 E 7.74 4.25 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 23 I 8.29 3.83 1.80 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 1.38 0.20 0.93 0.00 0.00 24 G 8.32 3.85 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 0.00 0.00 0.00 25 P 0.00 4.28 0.00 2.15 2.09 0.00 3.72 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 2.09 2.36 0.00 26 L 7.64 3.94 0.00 1.88 1.72 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.96 3.99 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 28 L 7.81 3.90 0.00 1.78 1.68 0.83 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.93 3.98 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 30 R 7.93 3.82 0.00 2.15 2.02 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 31 V 8.03 3.70 2.27 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 1.08 0.00 0.00 1.08 0.00 0.00 32 L 7.96 4.15 0.00 1.83 1.69 0.82 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.12 3.82 1.80 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 1.37 0.56 0.84 0.00 0.00 34 V 8.00 3.45 1.61 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 0.05 0.00 0.00 0.76 0.00 0.00 35 Y 6.86 3.67 0.00 2.62 1.73 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 36 P 0.00 4.43 0.00 2.16 2.06 0.00 3.47 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 37 W 7.24 4.45 0.00 3.57 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 38 T 7.67 4.32 4.50 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 1.19 0.00 0.00 39 Q 8.04 4.33 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 40 R 7.46 3.95 0.00 1.83 1.99 0.00 2.76 0.00 0.00 2.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.39 0.00 41 Y 7.21 4.30 0.00 2.53 2.41 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 42 F 7.69 4.15 0.00 2.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.85 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 0.00 0.00 0.00 44 S 8.04 4.39 0.00 4.17 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.81 4.30 0.00 2.97 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 46 G 7.49 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 47 N 8.66 4.59 0.00 2.69 2.79 0.00 0.00 6.64 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 48 V 7.97 4.24 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 1.02 0.00 0.00 1.01 0.00 0.00 49 S 8.13 4.18 0.00 4.02 4.29 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 50 T 7.58 4.76 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 51 P 0.00 4.24 0.00 2.16 2.11 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 52 A 7.94 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.47 3.91 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 54 I 9.16 3.79 2.01 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 1.53 0.74 0.90 0.00 0.00 55 M 8.82 4.12 0.00 1.83 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.78 0.00 56 G 8.10 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 57 N 7.84 4.59 0.00 2.95 2.79 0.00 0.00 6.91 7.25 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 58 P 0.00 4.40 0.00 2.24 2.24 0.00 3.70 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 59 K 8.78 3.78 0.00 1.63 1.07 0.00 1.58 0.00 0.00 1.47 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.13 1.25 7.81 60 V 7.72 3.45 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 1.03 0.00 0.00 1.02 0.00 0.00 61 A 8.10 3.88 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 62 A 7.93 3.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.36 4.32 0.00 3.42 3.49 0.00 5.79 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 64 G 8.19 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 65 K 7.76 4.15 0.00 1.98 1.88 0.00 1.66 0.00 0.00 1.57 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.44 7.81 66 V 7.71 3.56 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 67 V 8.02 3.61 2.27 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 1.06 0.00 0.00 0.98 0.00 0.00 68 C 8.23 4.62 0.00 3.15 3.24 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 69 G 8.25 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 0.00 0.00 0.00 70 A 7.83 4.03 1.21 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 0.00 0.00 71 L 7.87 4.05 0.00 1.90 1.22 0.90 1.44 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 72 D 8.23 4.20 0.00 3.43 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.07 4.00 0.00 1.92 1.91 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.77 7.81 74 A 7.61 3.85 1.21 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 0.00 0.00 75 V 7.42 3.27 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 0.66 0.00 0.00 0.18 0.00 0.00 76 K 8.18 4.14 0.00 1.99 1.85 0.00 1.91 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.53 7.81 77 N 8.34 4.98 0.00 3.01 2.76 0.00 0.00 7.01 7.70 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 78 M 8.25 3.91 0.00 1.41 1.83 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.80 0.00 79 G 8.06 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 80 N 7.86 4.99 0.00 2.74 2.81 0.00 0.00 7.04 7.49 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 81 I 7.71 3.38 1.68 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 1.42 0.81 0.13 0.00 0.00 82 L 7.76 3.96 0.00 1.59 1.73 0.92 0.75 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 83 A 7.87 4.13 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 84 T 8.54 3.97 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 1.47 0.00 0.00 85 Y 8.02 4.75 0.00 2.99 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 86 K 7.91 4.14 0.00 1.74 1.86 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.65 1.64 7.81 87 S 7.97 4.34 0.00 3.83 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 88 L 7.72 3.94 0.00 1.46 1.47 0.25 0.78 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 89 S 7.86 4.10 0.00 4.11 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 90 E 8.42 3.82 0.00 1.95 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 2.28 2.40 0.00 91 T 7.94 3.73 4.11 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 1.17 0.00 0.00 92 H 8.37 3.98 0.00 3.32 3.71 0.00 5.81 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 93 A 7.67 3.47 0.21 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 0.00 0.00 94 N 7.93 4.09 0.00 2.57 2.77 0.00 0.00 6.99 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 95 K 7.24 4.04 0.00 1.58 1.64 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.24 1.28 7.81 96 L 7.58 4.16 0.00 1.67 1.54 0.61 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 97 F 6.62 3.95 0.00 3.38 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 98 V 7.76 3.31 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 0.00 0.00 0.40 0.00 0.00 99 D 8.66 4.38 0.00 2.82 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 3.65 0.00 1.86 1.21 0.00 3.60 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.36 0.00 101 D 8.16 4.38 0.00 2.80 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 0.00 102 N 7.63 4.32 0.00 2.38 2.75 0.00 0.00 6.88 9.03 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 0.00 103 F 6.99 4.49 0.00 3.06 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 0.00 104 R 8.03 3.96 0.00 1.91 1.89 0.00 3.09 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 105 V 7.67 3.41 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 0.41 0.00 0.00 0.74 0.00 0.00 106 L 7.88 3.97 0.00 2.01 1.90 1.07 1.20 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 0.00 107 A 8.08 4.05 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 0.00 108 D 8.22 4.41 0.00 3.00 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 0.00 109 V 8.11 3.71 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 1.11 0.00 0.00 1.17 0.00 0.00 110 L 8.38 4.07 0.00 1.98 1.83 1.44 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.04 3.97 4.60 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 1.53 0.00 0.00 112 I 7.74 3.75 2.03 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.12 0.93 0.00 0.00 113 V 7.65 3.54 2.18 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 1.06 0.00 0.00 1.00 0.00 0.00 114 I 7.47 3.21 1.21 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 0.93 0.46 -0.92 0.00 0.00 115 A 7.36 3.39 1.29 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 0.00 0.00 116 A 7.68 3.87 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 0.00 117 K 7.89 4.06 0.00 1.83 2.07 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.57 1.70 7.81 118 F 9.06 4.47 0.00 2.98 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 9.21 3.92 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 0.00 0.00 0.00 120 A 8.87 4.05 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 0.00 121 S 7.74 4.44 0.00 4.01 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 0.00 122 F 8.34 4.73 0.00 2.96 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.61 4.28 4.41 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 1.26 0.00 0.00 124 P 0.00 4.39 0.00 2.15 2.16 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 E 8.10 3.94 0.00 2.03 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 2.40 2.47 0.00 126 I 7.16 3.66 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.54 0.92 0.00 0.00 127 Q 8.43 3.57 0.00 1.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 128 A 8.38 4.04 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 0.00 129 T 7.96 4.29 4.42 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 1.38 0.00 0.00 130 W 8.79 4.43 0.00 3.58 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 0.00 131 Q 8.81 3.97 0.00 2.39 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 132 K 8.11 3.98 0.00 1.94 2.15 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.45 1.29 7.81 133 F 8.34 4.46 0.00 3.02 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 0.00 134 M 7.86 3.63 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.00 0.00 135 K 7.86 3.95 0.00 1.93 2.01 0.00 1.27 0.00 0.00 1.54 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.38 7.81 136 V 7.47 3.45 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 0.89 0.00 0.00 1.00 0.00 0.00 137 V 7.20 3.18 1.76 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 0.79 0.00 0.00 0.01 0.00 0.00 138 V 7.73 3.47 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 0.96 0.00 0.00 0.92 0.00 0.00 139 A 7.94 3.87 1.29 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 0.00 0.00 140 A 8.30 4.03 1.15 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 0.00 0.00 141 M 8.00 3.99 0.00 0.67 1.69 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.46 0.00 142 G 7.42 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 0.00 0.00 0.00 143 S 7.81 4.30 0.00 3.95 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 0.00 144 R 7.92 4.37 0.00 1.68 1.87 0.00 3.44 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.83 0.00 145 Y 7.57 4.17 0.00 2.85 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 0.00 146 F 8.23 4.73 0.00 3.06 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