NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2839 8.2549 119.7038 55.3324 30.6884 173.5157 3 H 3.6542 8.1056 115.4883 56.4526 29.4104 170.2766 4 L 3.8152 10.8200 132.3045 55.6529 42.0501 173.8356 5 K 4.4718 8.2241 121.5423 57.2332 35.5116 175.2674 6 S 4.7821 7.9597 113.4037 56.3413 65.6675 173.4808 7 G 3.8597 8.0429 110.0917 44.2553 0.0000 173.9508 8 R 4.2480 8.5814 118.2899 55.9884 28.1889 175.8144 9 K 4.2210 8.4039 123.8724 56.3369 32.9028 176.4894 10 L 4.3221 7.7870 120.3280 54.2210 45.4080 173.4899 11 N 4.8572 8.0700 120.5385 52.2913 42.4149 173.5509 12 R 3.8663 9.5568 121.7480 55.7620 29.9488 176.1873 13 H 4.8344 8.1257 114.1469 55.4918 31.5471 176.8900 14 S 3.6942 7.8323 115.8527 60.7412 64.1084 176.0656 15 S 4.0497 8.2305 117.2315 60.9750 62.1623 175.8822 16 H 3.9909 8.0610 119.8822 59.2848 29.7940 176.8145 17 R 3.5160 7.9114 120.5031 59.1768 29.7472 178.1417 18 L 3.5561 7.7500 119.6057 58.0910 42.1089 178.4534 19 A 3.9468 7.7184 120.5110 55.2782 18.1444 179.2202 20 L 3.9111 7.8839 118.3705 58.5989 42.1718 178.6851 21 Y 4.0854 7.3721 115.9980 61.1916 37.6174 179.0202 22 R 4.1225 8.0060 118.6219 59.6556 30.4395 178.9148 23 N 4.3275 8.9584 116.5080 56.3341 38.3895 177.5018 24 Q 4.0734 8.2909 119.3657 58.5896 28.9582 178.0675 25 A 4.1293 8.5594 122.2534 55.0918 18.3566 179.6425 26 K 3.9042 8.4993 117.2334 59.7925 32.1941 179.2726 27 S 4.1315 7.9360 114.8332 62.5745 62.6246 176.1725 28 L 4.0189 8.5834 123.1388 57.1220 41.4177 178.6589 29 L 4.2499 8.3238 121.1058 58.3884 42.0663 179.6430 30 T 3.9832 7.8252 113.8746 66.9109 68.5633 175.7043 31 H 4.7696 8.2301 114.9929 55.4547 29.5535 175.5647 32 G 4.3972 9.5929 112.6603 44.7716 0.0000 173.3875 33 R 5.0190 7.6163 117.6758 54.4379 33.0688 174.7873 34 I 4.8509 8.7387 125.1606 59.9819 42.2126 174.1530 35 T 5.0869 8.5252 120.7734 62.4018 71.1905 173.3044 36 T 4.6484 8.3912 117.3693 61.0174 72.3739 173.3891 37 T 4.5432 8.5201 110.2278 61.5472 70.2296 175.2689 38 V 3.5682 8.0892 122.6710 66.1105 31.5329 176.6297 39 P 4.2157 0.0000 0.0000 65.7399 31.0834 178.6187 40 K 3.9137 7.9371 115.9877 59.4229 32.1932 179.0387 41 A 4.1177 8.0561 121.0637 55.0349 18.4245 179.5119 42 K 3.7725 8.0768 116.0646 59.7671 32.4622 178.7475 43 E 3.9569 8.0441 119.0639 58.9800 29.7682 178.3786 44 L 3.8058 7.7001 120.1823 57.6332 42.1196 178.0074 45 R 3.8217 7.8957 114.9985 60.3879 29.8312 177.1640 46 G 3.7785 8.4319 106.7329 46.3920 0.0000 174.3309 47 F 4.2463 7.8857 123.1372 61.1523 39.7311 177.3743 48 V 3.5748 7.7777 117.4229 65.8064 31.3305 177.3181 49 D 4.2952 7.8592 118.7243 57.9241 40.6266 178.6357 50 H 4.0330 7.6438 116.8523 59.2576 29.8245 177.1458 51 L 3.8400 7.2833 119.6533 57.7920 41.5836 179.4805 52 I 3.6490 8.2179 119.9004 64.7705 36.8930 177.7567 53 H 4.1685 8.5200 117.8261 59.6104 29.9438 176.8937 54 L 4.0633 8.2557 120.6170 57.6227 41.2398 179.3643 55 A 2.6426 7.7782 120.7757 54.3263 17.9815 179.5183 56 K 3.8666 7.3656 115.4521 58.6838 32.3548 179.1544 57 R 4.0749 7.7242 119.2351 57.0398 29.9580 179.0561 58 G 4.1760 7.6353 106.9310 45.9370 0.0000 173.9138 59 D 4.5498 7.6895 118.9991 52.9537 40.1632 176.8926 60 L 3.9095 8.8657 122.6551 58.9576 41.7949 178.6865 61 H 4.1436 8.4290 117.0379 59.4836 29.7160 176.3040 62 A 4.0203 7.7876 120.9383 55.4565 18.2331 179.1808 63 R 3.8208 8.1892 116.6867 59.9875 29.8100 178.8645 64 R 3.9248 8.1015 116.3159 59.2379 30.2522 178.6381 65 L 4.1077 8.5497 119.1729 57.9617 41.6653 179.8694 66 V 3.6987 8.4825 118.3280 65.6824 31.5837 178.0227 67 L 4.2463 8.0144 118.6868 57.3312 41.1021 179.4603 68 R 4.0545 7.5081 117.8164 58.8643 30.0192 177.9586 69 D 4.9196 7.8757 116.5165 55.6467 42.4592 178.0345 70 L 4.3673 7.5813 124.5952 53.3742 40.1704 177.2301 71 Q 4.3018 8.4145 124.1693 57.9438 29.7514 176.8322 72 D 4.4827 7.6426 119.1368 53.7642 42.0194 177.2107 73 V 3.6269 8.4809 127.0105 64.7300 31.6154 178.7228 74 K 3.8827 8.4383 119.2561 59.1379 31.9543 178.9004 75 L 3.9799 8.3128 120.3353 58.3676 41.9398 179.3103 76 V 3.7408 7.7520 118.5167 64.8331 31.3428 178.2476 77 R 3.7525 7.8744 118.8358 58.7761 29.8728 178.5393 78 K 3.9874 8.2906 119.2654 59.7865 32.1239 178.5310 79 L 4.0207 7.7876 119.9277 58.2956 41.9364 179.0444 80 F 4.1038 8.4428 116.2731 60.6632 38.9774 177.2209 81 D 4.5528 8.6857 117.5283 56.7694 40.9040 177.3283 82 E 4.3326 7.8626 116.3942 58.0804 30.2983 176.8537 83 I 3.9058 7.8169 120.2172 61.9714 38.0727 178.9944 84 A 3.8687 9.0363 123.7025 55.0782 19.5835 177.8747 85 P 4.1374 0.0000 0.0000 65.9456 31.3852 178.9096 86 R 3.6764 7.4463 115.1008 58.6541 30.0788 176.9563 87 Y 4.4632 7.5197 113.9296 58.1184 39.3519 178.4961 88 R 3.6429 7.7475 120.5041 59.2390 30.5881 176.7923 89 D 4.5345 7.8355 115.7343 55.8772 41.4678 176.9213 90 R 4.1274 8.5468 120.3806 56.0128 30.5480 176.0079 91 Q 4.5255 8.4792 123.2688 54.5596 29.7507 175.0824 92 G 3.4108 9.2539 112.7545 45.5788 0.0000 171.0810 93 G 3.6807 7.8049 104.5398 46.8945 0.0000 174.5187 94 Y 4.3036 7.7069 115.8334 58.7535 38.6034 175.5878 95 T 4.7856 7.0444 112.5458 60.0947 70.6054 173.0009 96 R 4.7270 8.7710 125.3951 54.5603 33.9841 173.9405 97 V 4.9202 8.4313 124.4247 61.1922 34.3100 174.4039 98 L 4.9640 8.8749 127.5605 52.4990 45.5048 176.0174 99 K 4.5958 8.7395 123.4154 56.8793 33.3174 176.7529 100 L 4.5215 8.5569 124.2671 53.9385 42.8896 176.5031 101 A 4.3270 8.4184 123.9037 52.1672 20.1542 173.3940 102 E 3.9023 8.6665 126.0659 56.2443 29.1760 175.2989 103 R 4.5196 8.1811 122.3300 54.3202 32.4790 175.8272 104 R 4.0518 8.4603 118.3886 56.5812 30.6469 178.4747 105 R 4.4199 8.4776 125.8156 54.5877 28.8943 176.8523 106 G 4.1018 7.0412 102.6638 46.0199 0.0000 172.0299 107 D 4.4314 8.4814 119.0246 52.3653 41.1983 175.9200 108 G 3.8741 8.2165 107.7322 46.7129 0.0000 173.5643 109 A 4.5637 8.2892 121.6571 49.8478 20.0653 176.1842 110 P 4.6391 0.0000 0.0000 62.7630 32.7964 175.5342 111 L 5.0094 8.5548 122.4950 53.3037 45.0787 174.9810 112 A 5.2137 8.9440 121.7649 50.5792 23.1952 175.1361 113 L 5.0633 9.3576 120.5334 54.0333 44.0319 175.8902 114 V 4.7380 9.0365 120.2124 61.5081 34.2228 174.3551 115 E 5.1793 9.0690 129.4018 54.2463 32.1009 175.8868 116 L 4.4792 8.5764 120.2914 53.7168 42.6367 173.2611 117 V 3.3690 8.0282 127.4631 60.8345 32.8260 171.2310 118 E 4.7662 9.0238 125.9781 56.2912 30.0066 176.2046 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 2 R 8.25 4.28 0.00 1.82 1.98 0.00 3.22 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 3 H 8.11 3.65 0.00 3.20 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 10.82 3.82 0.00 1.75 1.85 0.96 0.60 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 5 K 8.22 4.47 0.00 1.74 1.74 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.35 7.81 6 S 7.96 4.78 0.00 3.93 3.80 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 7 G 8.04 3.86 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 0.00 0.00 0.00 8 R 8.58 4.25 0.00 1.87 2.34 0.00 3.28 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 9 K 8.40 4.22 0.00 1.76 2.11 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.42 7.81 10 L 7.79 4.32 0.00 1.60 1.48 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.07 4.86 0.00 2.58 2.60 0.00 0.00 7.19 7.65 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 12 R 9.56 3.87 0.00 1.80 1.67 0.00 3.00 0.00 0.00 2.91 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.36 0.00 13 H 8.13 4.83 0.00 3.37 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.83 3.69 0.00 4.08 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 15 S 8.23 4.05 0.00 3.93 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 16 H 8.06 3.99 0.00 2.80 3.08 0.00 5.74 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 17 R 7.91 3.52 0.00 1.71 1.73 0.00 2.99 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.32 0.00 18 L 7.75 3.56 0.00 1.85 1.58 0.95 0.88 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 19 A 7.72 3.95 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 20 L 7.88 3.91 0.00 1.78 1.68 0.94 0.83 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 Y 7.37 4.09 0.00 2.50 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 22 R 8.01 4.12 0.00 2.05 2.08 0.00 3.19 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 1.91 1.94 0.00 23 N 8.96 4.33 0.00 2.78 2.90 0.00 0.00 7.15 7.60 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 24 Q 8.29 4.07 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 25 A 8.56 4.13 1.63 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 26 K 8.50 3.90 0.00 2.01 1.90 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.77 7.81 27 S 7.94 4.13 0.00 4.12 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 28 L 8.58 4.02 0.00 1.88 1.72 0.96 0.57 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 29 L 8.32 4.25 0.00 1.77 1.79 0.97 1.28 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 30 T 7.83 3.98 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 0.94 0.00 0.00 31 H 8.23 4.77 0.00 3.25 3.33 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.59 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 33 R 7.62 5.02 0.00 1.81 1.78 0.00 3.20 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 34 I 8.74 4.85 1.91 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 1.29 0.92 0.94 0.00 0.00 35 T 8.53 5.09 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 1.26 0.00 0.00 36 T 8.39 4.65 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 1.23 0.00 0.00 37 T 8.52 4.54 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 38 V 8.09 3.57 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 1.11 0.00 0.00 0.98 0.00 0.00 39 P 0.00 4.22 0.00 2.20 2.08 0.00 3.61 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 2.11 2.18 0.00 40 K 7.94 3.91 0.00 1.75 1.91 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.50 7.81 41 A 8.06 4.12 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 42 K 8.08 3.77 0.00 1.69 1.90 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 43 E 8.04 3.96 0.00 2.22 1.70 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 2.30 1.96 0.00 44 L 7.70 3.81 0.00 1.87 1.82 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.90 3.82 0.00 2.09 1.67 0.00 3.13 0.00 0.00 3.14 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 46 G 8.43 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 0.00 0.00 0.00 47 F 7.89 4.25 0.00 2.90 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 48 V 7.78 3.57 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 0.84 0.00 0.00 1.15 0.00 0.00 49 D 7.86 4.30 0.00 2.71 2.50 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 50 H 7.64 4.03 0.00 3.20 3.30 0.00 5.79 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 51 L 7.28 3.84 0.00 1.93 1.67 0.44 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.22 3.65 2.23 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 1.59 1.40 0.67 0.00 0.00 53 H 8.52 4.17 0.00 3.31 3.46 0.00 5.76 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 54 L 8.26 4.06 0.00 1.85 1.65 0.79 0.95 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 55 A 7.78 2.64 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.37 3.87 0.00 1.81 1.74 0.00 1.25 0.00 0.00 1.51 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.50 7.81 57 R 7.72 4.07 0.00 2.04 2.19 0.00 3.23 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 58 G 7.64 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 0.00 0.00 0.00 0.00 59 D 7.69 4.55 0.00 2.96 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 60 L 8.87 3.91 0.00 1.80 1.78 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.43 4.14 0.00 3.25 3.34 0.00 5.77 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 62 A 7.79 4.02 1.63 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 63 R 8.19 3.82 0.00 1.92 2.00 0.00 2.95 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 0.00 64 R 8.10 3.92 0.00 1.98 1.99 0.00 3.26 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 65 L 8.55 4.11 0.00 1.92 1.71 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.48 3.70 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 1.13 0.00 0.00 1.11 0.00 0.00 67 L 8.01 4.25 0.00 1.96 1.70 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.51 4.05 0.00 2.02 2.03 0.00 3.16 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 69 D 7.88 4.92 0.00 2.69 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 70 L 7.58 4.37 0.00 1.76 1.67 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.41 4.30 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 72 D 7.64 4.48 0.00 2.82 2.53 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 73 V 8.48 3.63 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 0.74 0.00 0.00 0.88 0.00 0.00 74 K 8.44 3.88 0.00 1.96 1.89 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.43 7.81 75 L 8.31 3.98 0.00 1.85 1.84 0.96 0.92 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 76 V 7.75 3.74 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 0.74 0.00 0.00 0.66 0.00 0.00 77 R 7.87 3.75 0.00 2.09 1.97 0.00 3.14 0.00 0.00 3.05 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 78 K 8.29 3.99 0.00 1.85 2.06 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.68 7.81 79 L 7.79 4.02 0.00 2.08 2.18 1.11 1.41 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 80 F 8.44 4.10 0.00 3.07 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.69 4.55 0.00 2.62 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 82 E 7.86 4.33 0.00 2.11 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 2.25 2.33 0.00 83 I 7.82 3.91 2.14 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.20 1.14 0.00 0.00 84 A 9.04 3.87 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 85 P 0.00 4.14 0.00 2.10 2.09 0.00 3.75 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.12 0.00 86 R 7.45 3.68 0.00 1.01 1.77 0.00 3.01 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.43 0.00 87 Y 7.52 4.46 0.00 2.63 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 0.00 0.00 0.00 88 R 7.75 3.64 0.00 1.83 1.86 0.00 3.38 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 89 D 7.84 4.53 0.00 2.69 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 90 R 8.55 4.13 0.00 1.82 2.03 0.00 3.50 0.00 0.00 3.67 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.76 0.00 91 Q 8.48 4.53 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.77 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 92 G 9.25 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.80 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 94 Y 7.71 4.30 0.00 2.65 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 0.00 0.00 0.00 95 T 7.04 4.79 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 96 R 8.77 4.73 0.00 1.91 1.71 0.00 3.29 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 97 V 8.43 4.92 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 0.92 0.00 0.00 0.92 0.00 0.00 98 L 8.87 4.96 0.00 1.59 1.50 0.93 0.56 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 99 K 8.74 4.60 0.00 1.76 1.82 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.42 7.81 100 L 8.56 4.52 0.00 1.65 1.63 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.42 4.33 1.23 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 0.00 0.00 102 E 8.67 3.90 0.00 2.16 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 2.19 2.32 0.00 103 R 8.18 4.52 0.00 1.79 2.02 0.00 3.21 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 104 R 8.46 4.05 0.00 2.02 1.86 0.00 3.27 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 105 R 8.48 4.42 0.00 1.80 1.91 0.00 3.24 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.48 4.43 0.00 2.73 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 0.00 108 G 8.22 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.29 4.56 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 0.00 110 P 0.00 4.64 0.00 2.13 2.19 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 111 L 8.55 5.01 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 0.00 112 A 8.94 5.21 1.18 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 0.00 0.00 113 L 9.36 5.06 0.00 1.76 1.78 0.93 -0.19 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 0.00 114 V 9.04 4.74 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 0.94 0.00 0.00 0.93 0.00 0.00 115 E 9.07 5.18 0.00 2.09 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 2.27 2.14 0.00 116 L 8.58 4.48 0.00 1.65 1.84 1.03 0.91 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 0.00 117 V 8.03 3.37 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 0.87 0.00 0.00 0.96 0.00 0.00 118 E 9.02 4.77 0.00 2.07 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 0.00 1.91 2.00 0.00