NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4642 8.3049 120.3295 54.6703 33.4778 174.6436 2 E 3.8568 8.3361 119.4560 55.4123 29.9718 175.7617 3 A 4.0375 9.3033 126.5216 52.7714 19.7255 177.7939 4 L 3.9885 8.4917 122.1906 55.8905 42.0008 178.0666 5 G 3.8199 9.4668 105.1585 45.5550 0.0000 172.5910 6 A 4.6411 7.5300 116.9528 50.8729 22.1348 176.3144 7 D 4.8245 8.7827 120.8430 53.1572 42.7655 175.9506 8 V 4.7129 8.3786 121.9622 61.4062 34.7172 175.0941 9 T 4.4765 7.7867 122.4271 61.5413 69.4233 173.9916 10 Q 3.8619 8.7533 125.0045 56.7871 29.0219 177.5802 11 G 4.1191 8.9836 109.2747 45.9314 0.0000 172.6571 12 L 5.0985 8.1938 119.9700 52.8307 46.3335 175.1378 13 E 5.1164 8.8133 119.3102 53.8756 34.3771 175.3323 14 K 4.1240 8.3152 122.7326 58.0262 32.3902 177.0091 15 G 4.0402 8.9359 115.5006 45.1335 0.0000 174.0188 16 S 4.3357 8.1085 116.2071 58.6340 64.2389 173.1947 17 L 5.1551 8.4131 122.7778 53.1693 43.2658 175.7357 18 I 4.6961 8.9029 117.0463 58.9796 41.7076 174.6324 19 T 4.4836 8.6910 119.3176 63.5411 69.8116 174.2776 20 C 4.7120 8.5390 126.5413 57.4351 31.1438 173.8962 21 A 4.5405 8.2950 133.8491 49.8911 15.9815 174.3780 22 D 5.3758 7.6682 120.3192 52.7588 43.0699 176.6064 23 N 5.1262 8.4229 114.6535 52.9896 36.9105 176.5719 24 T 3.9266 8.3914 112.1581 64.1974 69.4683 175.2353 25 G 3.9843 8.3922 108.7599 44.9736 0.0000 172.3309 26 A 4.8890 7.4338 122.3126 50.6302 20.9159 176.6334 27 R 4.3759 8.8966 122.2999 57.6148 32.0719 176.0284 28 E 5.1448 8.0507 119.3294 54.2212 32.5018 174.2175 29 L 5.1504 9.0996 126.5791 52.7818 45.4178 175.0809 30 K 4.9507 8.9076 124.2421 54.4272 34.5497 175.4463 31 V 4.0060 8.7205 128.4702 63.3673 32.0486 175.9999 32 I 4.3274 8.4892 127.5841 62.7657 39.5850 175.6709 33 S 4.6470 7.7614 115.0722 57.4043 68.1742 173.5253 34 V 4.4961 8.1913 120.6026 61.1931 33.4625 174.0720 35 H 4.0235 9.0820 127.8631 58.0370 30.0858 174.2193 36 G 4.0446 8.4021 112.4575 46.3182 0.0000 171.6993 37 Y 4.6946 7.8102 119.3049 55.3102 40.3332 175.2204 38 S 4.4461 7.4446 120.1297 56.4167 66.8815 173.6592 39 G 4.0055 7.8603 112.6708 45.2547 0.0000 173.9755 40 T 4.5324 8.2775 117.4949 59.8503 70.2227 172.2278 41 K 3.9537 8.4159 125.5847 58.0393 32.4367 176.9241 42 N 4.5014 8.9450 121.2898 53.7572 37.3913 174.4792 43 R 4.1305 8.0205 119.2883 55.9011 30.7078 175.4214 44 H 4.5460 8.7458 123.1108 54.4796 29.5669 173.3039 45 P 4.6279 0.0000 0.0000 63.4891 31.7569 175.2270 46 K 5.0010 7.9105 122.8016 55.1206 35.0769 175.3496 47 A 4.7053 9.2519 123.2944 50.8414 23.2339 176.0202 48 G 4.1654 9.2576 107.7504 44.2341 0.0000 171.6895 49 L 4.0397 8.2922 119.3017 56.7620 41.8346 178.2447 50 G 4.0798 8.9382 111.0938 45.5269 0.0000 173.0679 51 D 4.8544 7.9570 119.9771 53.3233 43.0669 175.3341 52 K 4.8876 8.6461 123.0999 55.0180 33.8937 175.0618 53 I 4.9430 8.5645 121.1108 59.3508 41.1086 174.8735 54 T 4.6740 8.5876 120.5308 63.2493 70.2218 174.0412 55 V 5.0241 9.2541 124.2343 61.5696 36.2356 173.5546 56 S 5.0847 8.7357 116.6890 56.3419 66.7155 173.4625 57 V 4.3064 8.3472 122.8307 62.9395 31.5810 176.5691 58 T 4.1292 8.8200 126.1892 65.7250 69.2078 175.6781 59 K 4.5687 8.8151 118.7737 54.5342 36.6290 177.6685 60 G 4.0243 8.4752 108.6974 44.9075 0.0000 172.6991 61 T 4.0270 8.2634 111.6695 60.8434 69.5444 173.3037 62 P 4.1938 0.0000 0.0000 66.3351 31.1297 178.7554 63 E 3.8988 8.0917 115.1194 59.4336 29.4616 178.6477 64 M 4.2116 7.9996 118.0445 56.6332 32.9206 177.4273 65 R 4.0604 6.9485 117.3727 57.5973 30.7338 178.0155 66 R 3.9859 8.5081 117.5007 56.8895 29.4149 176.8800 67 Q 4.2012 7.6504 117.4414 55.6583 30.2222 175.5285 68 V 4.2795 8.3228 123.0936 61.9291 32.4164 174.2053 69 L 4.9520 8.6722 129.1487 52.8563 45.8044 174.8569 70 E 5.1427 8.4744 118.6718 55.2460 32.7343 174.7004 71 A 4.8751 8.5833 125.0596 51.1258 23.7844 174.9357 72 V 4.5117 8.2173 118.5211 60.8660 34.7147 174.8226 73 V 4.0364 8.5280 128.2895 63.1770 31.9716 176.2349 74 V 4.0571 8.9929 128.7413 64.0052 33.3584 175.4882 75 R 4.1741 7.4413 117.4612 54.7296 34.7293 173.9377 76 Q 4.9302 7.9615 117.6874 55.2424 31.5478 175.8057 77 R 4.3388 9.0446 119.9190 58.4023 30.5124 177.7915 78 K 4.2031 7.8621 118.3751 55.6185 33.2832 175.3353 79 P 4.9636 0.0000 0.0000 62.8415 32.9973 175.1111 80 I 4.8990 8.6980 114.8097 59.2733 41.3136 173.9483 81 R 4.9033 8.7220 125.7723 55.5105 31.5646 175.4630 82 R 4.7114 8.6876 125.2548 54.2675 31.8421 175.8784 83 P 4.2015 0.0000 0.0000 65.9329 31.4893 176.7880 84 D 4.6382 8.0842 115.1591 53.1273 39.3293 177.4282 85 G 4.0296 8.6429 109.7488 46.2795 0.0000 174.7965 86 T 4.1486 7.6858 116.2529 63.7555 69.5972 173.8740 87 R 5.1265 8.4114 122.7631 54.8501 32.6198 175.8901 88 V 4.5672 8.5760 121.0907 61.1104 34.9672 174.3965 89 K 5.0034 8.3361 124.7498 55.6839 35.4771 174.9642 90 F 4.7768 8.9884 120.1869 55.7469 41.9478 176.0875 91 E 4.2000 9.0684 119.4278 58.2054 29.7428 174.7011 92 D 4.6980 7.6902 115.5823 53.2388 42.4947 173.5456 93 N 5.2240 8.7114 114.9843 51.6822 41.0788 174.1490 94 A 5.2514 8.7833 124.1063 50.5222 23.4189 174.5343 95 A 4.9993 9.1518 120.5398 50.2929 23.6044 175.2673 96 V 4.5830 8.3455 119.6888 60.6669 34.3194 175.2236 97 I 4.3879 8.4669 128.9661 61.7056 38.0224 175.5242 98 V 4.8648 8.7219 125.5738 60.2412 35.0721 174.4208 99 D 5.0838 7.9049 120.7437 51.6404 41.7991 176.2877 100 E 3.9122 8.8473 117.1067 60.0659 29.3922 177.7694 101 N 4.5756 9.1728 113.9759 53.1353 38.8983 175.1773 102 E 3.7528 8.2198 116.9352 57.1713 27.3590 173.5719 103 D 5.0903 8.2418 118.1871 51.0881 41.4785 174.3868 104 P 4.4030 0.0000 0.0000 63.1100 31.5093 177.3730 105 R 3.9579 8.5920 123.1584 58.6545 30.3379 176.4576 106 G 4.0912 7.0781 103.0944 44.6509 0.0000 172.3747 107 T 4.4792 8.6628 113.3768 63.7093 70.9237 174.5484 108 E 4.7987 9.2078 120.0983 54.3995 33.9536 174.6601 109 L 5.0362 8.5197 122.7900 53.2765 43.4416 175.9325 110 K 4.2966 8.3366 123.7572 56.2334 33.2694 177.9842 111 G 3.9495 8.9411 110.7281 44.0707 0.0000 170.4604 112 P 4.8983 0.0000 0.0000 62.8684 32.6666 175.5641 113 I 4.7704 8.3231 118.9866 59.5154 42.1007 174.7660 114 A 4.9021 8.2644 126.6631 51.7512 19.1813 178.8985 115 R 3.8941 9.0205 119.2255 59.7641 28.9177 179.0135 116 E 4.0722 8.3686 118.6573 59.2048 29.3271 179.3716 117 V 3.3576 7.9108 117.6874 65.2019 31.4726 178.0216 118 A 3.9911 8.2879 121.4289 55.2845 18.1515 179.3009 119 Q 4.1095 7.2311 112.4885 57.4814 28.8141 177.2467 120 R 4.0637 7.7942 117.4534 57.0199 32.5794 176.1122 121 F 4.8777 7.6899 119.0808 54.4688 39.2639 175.8423 122 G 3.7830 8.5811 111.8028 47.9876 0.0000 172.4359 123 S 4.1184 8.1113 118.1789 60.1948 62.6792 176.6521 124 V 3.5759 7.8460 121.1630 65.6692 31.4156 177.7094 125 A 4.0985 8.1421 120.8114 55.1365 18.1216 179.8445 126 S 4.4629 8.8193 109.8204 58.9642 62.5939 174.9166 127 A 4.6844 7.5489 121.8136 51.8171 20.1294 177.0659 128 A 4.3086 8.2373 119.7824 52.2241 19.3376 178.1657 129 T 4.2049 8.4995 118.0126 65.9689 69.2905 175.1042 130 M 4.8493 7.8096 119.9736 53.4628 35.6581 174.6428 131 I 4.8067 8.3311 122.6680 59.5719 40.1692 175.5434 132 V 3.9425 8.5140 126.5747 62.9175 30.9930 175.6998 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 4.46 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 2 E 8.34 3.86 0.00 1.95 1.81 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 2.28 2.33 0.00 3 A 9.30 4.04 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 4 L 8.49 3.99 0.00 1.64 1.74 0.97 0.94 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 5 G 9.47 3.82 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 0.00 6 A 7.53 4.64 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.78 4.82 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.38 4.71 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 0.95 0.00 0.00 9 T 7.79 4.48 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 1.22 0.00 0.00 10 Q 8.75 3.86 0.00 1.87 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.97 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 11 G 8.98 4.12 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 0.00 0.00 0.00 12 L 8.19 5.10 0.00 1.64 1.48 0.88 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.81 5.12 0.00 1.87 1.81 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 2.21 2.22 0.00 14 K 8.32 4.12 0.00 1.73 1.70 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.55 7.81 15 G 8.94 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 16 S 8.11 4.34 0.00 3.83 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 17 L 8.41 5.16 0.00 1.50 1.57 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.90 4.70 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.10 0.88 0.00 0.00 19 T 8.69 4.48 4.31 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 1.20 0.00 0.00 20 C 8.54 4.71 0.00 2.97 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 21 A 8.30 4.54 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 22 D 7.67 5.38 0.00 2.68 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 23 N 8.42 5.13 0.00 2.72 2.91 0.00 0.00 6.00 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 24 T 8.39 3.93 4.22 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 1.27 0.00 0.00 25 G 8.39 3.98 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 0.00 0.00 0.00 26 A 7.43 4.89 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 27 R 8.90 4.38 0.00 1.77 1.96 0.00 3.07 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 28 E 8.05 5.14 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 29 L 9.10 5.15 0.00 1.53 1.48 0.88 0.62 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 30 K 8.91 4.95 0.00 1.75 1.75 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.33 7.81 31 V 8.72 4.01 2.22 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 0.86 0.00 0.00 0.94 0.00 0.00 32 I 8.49 4.33 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 0.91 0.00 0.00 33 S 7.76 4.65 0.00 3.74 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 34 V 8.19 4.50 2.02 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 0.99 0.00 0.00 0.80 0.00 0.00 35 H 9.08 4.02 0.00 3.22 3.36 0.00 6.15 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.40 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 37 Y 7.81 4.69 0.00 2.93 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 38 S 7.44 4.45 0.00 3.80 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 39 G 7.86 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.28 4.53 4.22 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 1.23 0.00 0.00 41 K 8.42 3.95 0.00 1.75 1.74 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.52 7.81 42 N 8.95 4.50 0.00 2.94 3.00 0.00 0.00 7.02 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.02 4.13 0.00 1.79 2.07 0.00 3.36 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 44 H 8.75 4.55 0.00 3.34 3.20 0.00 5.79 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.63 0.00 2.14 2.44 0.00 3.71 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 46 K 7.91 5.00 0.00 1.65 1.74 0.00 1.50 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.12 1.15 7.81 47 A 9.25 4.71 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 0.00 0.00 0.00 0.00 0.00 0.00 48 G 9.26 4.17 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 0.00 49 L 8.29 4.04 0.00 1.65 1.67 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.94 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 0.00 0.00 0.00 51 D 7.96 4.85 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.65 4.89 0.00 1.81 1.68 0.00 1.51 0.00 0.00 1.67 0.00 0.00 2.67 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.44 7.81 53 I 8.56 4.94 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 0.88 0.00 0.00 54 T 8.59 4.67 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 1.26 0.00 0.00 55 V 9.25 5.02 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 1.15 0.00 0.00 0.94 0.00 0.00 56 S 8.74 5.08 0.00 3.88 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 57 V 8.35 4.31 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 0.97 0.00 0.00 0.94 0.00 0.00 58 T 8.82 4.13 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 59 K 8.82 4.57 0.00 1.72 1.63 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.51 7.81 60 G 8.48 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.26 4.03 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 1.24 0.00 0.00 62 P 0.00 4.19 0.00 2.17 2.17 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 2.12 2.21 0.00 63 E 8.09 3.90 0.00 1.93 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 2.31 2.34 0.00 64 M 8.00 4.21 0.00 1.96 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 2.60 2.70 0.00 65 R 6.95 4.06 0.00 2.12 1.85 0.00 3.25 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 66 R 8.51 3.99 0.00 1.97 2.06 0.00 3.15 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 67 Q 7.65 4.20 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 68 V 8.32 4.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 69 L 8.67 4.95 0.00 1.56 1.52 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.47 5.14 0.00 1.98 1.69 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 2.20 2.24 0.00 71 A 8.58 4.88 1.14 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 0.00 0.00 72 V 8.22 4.51 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 0.94 0.00 0.00 -0.24 0.00 0.00 73 V 8.53 4.04 2.22 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 0.80 0.00 0.00 0.92 0.00 0.00 74 V 8.99 4.06 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 0.79 0.00 0.00 0.95 0.00 0.00 75 R 7.44 4.17 0.00 1.46 1.19 0.00 3.19 0.00 0.00 3.54 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 76 Q 7.96 4.93 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.66 0.00 77 R 9.04 4.34 0.00 1.86 2.06 0.00 3.15 0.00 0.00 3.03 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 78 K 7.86 4.20 0.00 1.76 1.73 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.56 7.81 79 P 0.00 4.96 0.00 2.13 1.96 0.00 3.61 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 80 I 8.70 4.90 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.00 0.99 0.00 0.00 81 R 8.72 4.90 0.00 1.94 1.84 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 82 R 8.69 4.71 0.00 1.82 1.82 0.00 3.22 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 83 P 0.00 4.20 0.00 2.03 2.15 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 84 D 8.08 4.64 0.00 2.78 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 85 G 8.64 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 0.00 0.00 0.00 0.00 86 T 7.69 4.15 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 1.19 0.00 0.00 87 R 8.41 5.13 0.00 1.67 1.83 0.00 3.32 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 88 V 8.58 4.57 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 0.82 0.00 0.00 0.89 0.00 0.00 89 K 8.34 5.00 0.00 1.99 1.72 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.25 1.42 7.81 90 F 8.99 4.78 0.00 3.29 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 E 9.07 4.20 0.00 1.97 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 2.30 2.26 0.00 92 D 7.69 4.70 0.00 2.69 2.65 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 93 N 8.71 5.22 0.00 2.62 2.71 0.00 0.00 6.47 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.78 5.25 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 0.00 0.00 0.00 0.00 0.00 95 A 9.15 5.00 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 96 V 8.35 4.58 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 1.00 0.00 0.00 0.93 0.00 0.00 97 I 8.47 4.39 1.83 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 1.24 0.52 0.90 0.00 0.00 98 V 8.72 4.86 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 0.57 0.00 0.00 0.81 0.00 0.00 99 D 7.90 5.08 0.00 2.84 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.85 3.91 0.00 1.97 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 2.31 2.34 0.00 101 N 9.17 4.58 0.00 2.94 2.86 0.00 0.00 7.15 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 0.00 102 E 8.22 3.75 0.00 2.21 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 0.00 2.19 2.29 0.00 103 D 8.24 5.09 0.00 2.88 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 0.00 104 P 0.00 4.40 0.00 2.19 2.18 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 105 R 8.59 3.96 0.00 1.78 1.98 0.00 3.22 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 106 G 7.08 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 0.00 107 T 8.66 4.48 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 0.00 108 E 9.21 4.80 0.00 1.81 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 0.00 2.21 2.26 0.00 109 L 8.52 5.04 0.00 1.52 1.59 0.96 0.94 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 0.00 110 K 8.34 4.30 0.00 1.60 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.38 7.81 111 G 8.94 3.95 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 0.00 0.00 0.00 112 P 0.00 4.90 0.00 2.26 2.16 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 113 I 8.32 4.77 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.83 0.93 0.00 0.00 114 A 8.26 4.90 1.41 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 0.00 115 R 9.02 3.89 0.00 2.07 2.25 0.00 3.01 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 116 E 8.37 4.07 0.00 2.11 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 0.00 2.42 2.62 0.00 117 V 7.91 3.36 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 1.29 0.00 0.00 0.99 0.00 0.00 118 A 8.29 3.99 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 0.00 119 Q 7.23 4.11 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 120 R 7.79 4.06 0.00 1.12 0.66 0.00 2.85 0.00 0.00 2.88 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.29 0.00 121 F 7.69 4.88 0.00 3.14 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 0.00 122 G 8.58 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 0.00 123 S 8.11 4.12 0.00 4.08 4.17 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 0.00 124 V 7.85 3.58 2.40 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 1.06 0.00 0.00 0.92 0.00 0.00 125 A 8.14 4.10 1.41 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 0.00 126 S 8.82 4.46 0.00 4.03 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 0.00 127 A 7.55 4.68 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.24 4.31 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 0.00 129 T 8.50 4.20 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 1.22 0.00 0.00 130 M 7.81 4.85 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 131 I 8.33 4.81 1.90 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 1.26 0.63 0.95 0.00 0.00 132 V 8.51 3.94 2.15 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 0.64 0.00 0.00 0.97 0.00 0.00