NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3571 8.2931 118.7958 54.5753 32.2310 173.3793 2 G 3.8314 7.6769 113.9335 44.4111 0.0000 170.2816 3 T 4.6517 9.0200 109.8877 61.2411 70.5413 174.4440 4 R 4.5157 7.7012 118.0168 55.9465 31.4996 175.4777 5 E 4.1383 7.8230 120.6738 56.7595 30.5972 175.9209 6 R 5.2276 8.3171 123.1268 55.1010 34.6230 174.0470 7 T 4.6129 8.3934 113.4251 60.9780 71.7708 171.7597 8 L 5.0272 8.4282 127.3280 53.4322 44.4195 175.0860 9 V 4.9233 8.6329 125.1149 61.0619 35.0161 173.9964 10 A 4.9922 8.9585 128.3275 50.2072 22.8100 174.9534 11 V 4.1721 8.7307 123.2621 61.8673 33.1019 176.1027 12 K 4.4015 9.1167 127.9365 55.4046 33.1631 176.2504 13 P 4.5008 0.0000 0.0000 65.3038 31.0817 178.6763 14 D 4.5815 8.3471 117.5573 56.3371 39.4567 178.7365 15 G 3.6049 8.1211 106.9106 47.3990 0.0000 176.0091 16 V 3.5760 7.6658 120.0085 66.0777 31.5634 178.1559 17 Q 4.0539 7.9775 116.2432 58.4592 28.5824 177.9477 18 R 4.2591 7.8780 116.6048 55.0563 31.1879 176.2206 19 R 3.7920 7.8627 116.8328 58.0362 27.8393 177.0894 20 L 4.6151 7.9537 114.7232 54.4078 42.4022 178.2778 21 V 3.6617 7.6355 120.7343 66.1110 31.4629 178.1283 22 G 3.6506 8.0518 104.9081 47.8726 0.0000 175.1140 23 D 4.3959 7.9406 119.8120 57.0823 41.3193 178.6676 24 V 3.8278 7.8947 118.6238 66.2842 31.6006 178.0207 25 I 4.0886 8.1986 119.8168 64.6642 36.9980 178.1342 26 Q 4.0682 8.5438 120.5348 59.3961 28.6038 178.7419 27 R 3.8887 7.7749 117.8536 59.1351 30.0961 178.7430 28 F 3.8633 7.9826 117.1930 60.1608 38.8321 177.4644 29 E 4.2284 8.4541 118.6780 59.4519 29.1589 179.3716 30 R 4.1240 7.8969 113.9932 58.1997 29.8533 178.0594 31 R 3.8990 7.3354 118.5855 57.3109 30.1440 176.8087 32 G 3.8955 7.5801 106.1394 45.2820 0.0000 173.7540 33 F 4.8304 7.4186 117.4216 57.6179 40.0007 174.4685 34 T 4.5992 8.9129 119.8126 61.8547 70.4467 173.8357 35 L 3.8199 8.8623 129.1100 54.6779 42.0747 176.4013 36 V 4.3460 7.7064 119.9404 60.0733 33.1417 175.9749 37 G 3.9005 7.0556 105.1257 45.7842 0.0000 172.4002 38 M 5.3483 8.4829 119.8248 54.7510 35.2102 173.7395 39 K 4.4621 8.6389 121.4352 56.4579 36.4197 173.3487 40 M 5.1302 8.6054 122.3235 54.2715 33.7754 174.8510 41 L 4.5447 8.5642 124.2467 54.7847 44.5690 174.2717 42 Q 4.4329 8.6087 121.9604 54.8649 29.0780 175.4309 43 A 4.1024 8.4797 129.4316 51.3109 19.4134 175.8043 44 P 4.4040 0.0000 0.0000 62.1276 33.4717 177.5756 45 E 4.0074 8.6697 121.2599 59.1655 29.7037 179.4123 46 S 4.0855 7.9322 114.2930 61.2598 63.0959 176.5897 47 V 3.2903 7.4299 121.3319 65.5148 31.2856 177.8526 48 L 3.9846 7.6359 118.1425 57.7777 41.2701 179.3279 49 A 4.3422 8.0756 121.2029 54.7478 18.1479 179.0285 50 E 4.0335 8.1646 117.6984 59.4904 29.4740 178.4322 51 H 4.1153 8.5260 117.9325 58.6299 30.0709 176.1076 52 Y 4.9609 8.4911 117.7229 57.8385 38.7660 177.6079 53 Q 4.0506 7.8562 121.9941 59.8242 28.1507 178.1122 54 D 4.5009 8.2284 118.5038 56.1749 41.4651 176.6402 55 L 4.6430 8.1823 118.3259 54.3305 42.2037 178.1999 56 R 3.0361 7.6833 119.7858 58.4042 29.9666 177.1665 57 R 4.5779 7.7992 115.2892 55.6919 30.6544 175.3805 58 K 4.7266 7.5521 115.8774 53.4350 34.1130 174.5365 59 P 4.0864 0.0000 0.0000 63.9237 31.8895 176.7816 60 F 4.1489 8.1791 117.2377 59.0157 36.5539 177.0326 61 Y 3.9969 7.6655 123.1019 60.5414 38.5365 176.1114 62 P 4.2205 0.0000 0.0000 65.5528 31.4541 178.4338 63 A 4.0622 8.0729 119.1603 54.8524 18.2969 179.3163 64 L 3.8621 7.7967 118.9659 58.5093 41.9678 179.3943 65 I 3.6288 7.2080 118.3496 64.0060 36.9570 178.1901 66 R 4.0226 7.9887 119.8122 59.4555 29.8169 177.9642 67 Y 4.2575 7.9777 119.2719 61.1107 38.7359 177.5818 68 M 4.0008 7.7265 116.8234 56.4784 32.3411 176.9231 69 S 4.6890 7.5982 113.1646 57.8258 63.7721 175.3111 70 S 4.3224 8.1640 114.5146 58.6477 62.9454 173.6590 71 G 3.9579 6.8282 109.4031 44.5797 0.0000 171.0264 72 P 4.6856 0.0000 0.0000 62.9208 32.7357 175.7698 73 V 4.5851 8.6332 113.5714 59.5798 36.0422 174.7587 74 V 4.7456 8.1748 121.7890 61.2986 33.6918 174.1204 75 A 4.9425 8.6121 130.2585 50.8241 21.1595 175.5454 76 M 5.2134 9.1737 120.4300 53.5307 37.2305 174.4740 77 V 4.6175 8.2894 120.9982 60.9744 34.5117 174.2943 78 W 5.0992 8.5686 127.2723 54.8428 32.0748 174.5850 79 E 5.0308 10.2562 124.1241 53.4969 32.7614 175.1866 80 G 4.7360 8.2730 114.8271 45.9609 0.0000 171.0860 81 Y 4.6686 8.6347 121.7649 58.8422 39.1672 175.0337 82 N 4.0261 8.5501 124.5705 54.2311 37.8060 176.1611 83 V 3.2740 7.4488 118.6343 63.9947 31.2239 177.7410 84 V 3.4697 8.0054 118.8934 66.1340 31.4579 178.3548 85 R 3.9367 7.8438 117.0282 58.9668 29.9689 178.8713 86 A 4.0082 8.0029 120.7908 55.3376 18.3116 179.8916 87 S 4.1876 8.1866 113.6723 61.6276 62.6533 177.2310 88 R 3.8941 7.8248 120.2003 59.3241 29.6519 179.0273 89 A 4.1212 7.7846 119.1108 55.2821 18.5900 179.2930 90 M 4.1143 8.1749 117.6918 58.0649 32.0205 178.6643 91 I 4.1028 7.7917 113.2340 61.3119 38.0553 177.0722 92 G 3.9544 7.5965 107.0570 44.1888 0.0000 172.1244 93 H 3.9990 8.6640 117.4080 56.7306 30.1028 174.9464 94 T 4.0088 8.4761 122.8518 66.9013 68.5484 174.4791 95 D 4.6837 8.4276 122.4127 52.4933 40.0673 176.4578 96 S 3.9670 8.2991 120.2424 61.1378 63.4660 176.9974 97 A 4.0040 8.0950 121.8315 54.3495 18.1668 177.6984 98 E 4.4939 8.6252 111.9511 55.8640 29.8923 175.7860 99 A 4.3647 7.7076 121.2794 51.8616 19.4196 178.0891 100 A 4.2594 8.5526 123.4934 50.8474 19.8379 175.2996 101 P 4.2769 0.0000 0.0000 64.2042 31.3631 175.7355 102 G 4.0337 9.3063 112.4144 46.2810 0.0000 175.0496 103 T 4.4087 7.7310 110.2002 60.5614 71.5072 175.9648 104 I 3.8923 8.5988 123.0552 64.7759 37.1277 179.1912 105 R 4.1722 8.2934 119.0990 59.1899 29.7058 179.3606 106 G 3.6165 8.1219 104.5885 47.4215 0.0000 174.7788 107 D 4.3728 7.8193 119.7755 55.1715 41.3545 177.2412 108 F 4.9356 8.0618 115.2266 56.9808 40.9345 175.0526 109 S 4.9303 8.2937 114.9856 56.2306 65.1439 174.2881 110 V 4.2817 8.1746 121.1515 61.5765 33.0097 175.5354 111 H 4.7841 7.8822 116.9173 54.4735 30.3687 174.8068 112 I 4.2189 8.1192 113.4407 63.3115 37.6481 177.0267 113 S 3.8523 7.2139 116.2487 60.7533 62.9169 174.9289 114 R 4.0766 7.6146 131.4516 55.1146 29.0174 176.3971 115 N 5.0186 8.3488 124.0600 51.4682 38.4359 178.2168 116 V 3.4399 8.7787 124.9032 65.3246 32.2170 171.4675 117 I 5.2337 8.4764 116.6271 59.6740 41.5787 173.5516 118 H 5.1634 9.3059 124.5742 54.4277 33.3347 171.9667 119 A 5.0429 7.9823 124.4574 49.9957 22.2851 176.0835 120 S 4.4098 8.5770 117.6837 59.1852 63.7920 175.2063 121 D 4.6643 8.7901 121.7915 54.0530 40.2836 176.3078 122 S 4.5352 7.3045 113.9724 56.4104 66.6635 175.8067 123 V 3.5627 8.1576 121.6014 66.1957 31.2645 177.8332 124 E 4.1277 8.2045 117.0435 59.2554 29.5361 179.1587 125 G 3.5720 8.2124 106.6142 47.3736 0.0000 175.5481 126 A 4.2431 8.4108 124.8841 54.6041 18.3283 179.5924 127 Q 3.9462 8.1276 116.5169 59.1256 28.7639 179.3527 128 R 3.8712 8.0062 119.4411 59.6063 30.2587 178.3348 129 E 4.1966 8.6362 118.7694 59.5795 29.4098 179.5020 130 I 3.9408 8.2169 120.0442 64.7430 37.0062 178.5761 131 Q 4.0700 7.7942 117.3243 58.6580 28.5163 178.4653 132 L 4.0385 7.8105 120.8558 57.9361 42.3234 178.5750 133 W 4.3149 8.4513 116.6873 56.8705 29.6561 176.4922 134 F 5.1404 8.0285 116.2063 55.6146 42.0528 174.5561 135 Q 4.6271 9.2636 122.4614 54.5653 30.2573 177.4276 136 S 4.1574 8.6492 116.4328 61.8076 62.9847 176.3366 137 S 4.5623 8.0775 111.7485 58.9556 62.8951 174.1355 138 E 4.5423 8.1518 119.8390 56.4773 30.5144 175.5756 139 L 4.6567 7.4962 119.4648 53.4000 43.2814 176.4831 140 V 4.4219 8.7217 117.0375 59.6807 34.7079 174.7388 141 S 4.6417 8.8254 122.4031 56.7088 63.9697 174.4652 142 W 4.6423 8.1817 121.3236 56.5799 28.1259 175.0054 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 4.36 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.12 0.00 2 G 7.68 3.83 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 0.00 0.00 0.00 3 T 9.02 4.65 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 1.27 0.00 0.00 4 R 7.70 4.52 0.00 1.89 1.94 0.00 3.38 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.51 0.00 5 E 7.82 4.14 0.00 2.16 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 2.24 2.26 0.00 6 R 8.32 5.23 0.00 1.63 1.70 0.00 3.43 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.65 0.00 7 T 8.39 4.61 4.16 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 1.14 0.00 0.00 8 L 8.43 5.03 0.00 1.82 1.65 1.00 0.35 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 9 V 8.63 4.92 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 0.80 0.00 0.00 0.70 0.00 0.00 10 A 8.96 4.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.73 4.17 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 0.93 0.00 0.00 0.94 0.00 0.00 12 K 9.12 4.40 0.00 2.01 1.63 0.00 2.00 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.40 1.45 7.81 13 P 0.00 4.50 0.00 2.17 2.12 0.00 3.45 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 2.10 2.06 0.00 14 D 8.35 4.58 0.00 2.95 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 15 G 8.12 3.60 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 0.00 0.00 0.00 16 V 7.67 3.58 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 1.06 0.00 0.00 0.98 0.00 0.00 17 Q 7.98 4.05 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 18 R 7.88 4.26 0.00 1.88 1.97 0.00 3.36 0.00 0.00 3.27 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 19 R 7.86 3.79 0.00 1.95 1.98 0.00 3.13 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 20 L 7.95 4.62 0.00 1.56 1.14 0.72 0.82 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 21 V 7.64 3.66 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 1.17 0.00 0.00 0.92 0.00 0.00 22 G 8.05 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 23 D 7.94 4.40 0.00 2.52 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 24 V 7.89 3.83 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 1.24 0.00 0.00 0.96 0.00 0.00 25 I 8.20 4.09 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.69 1.32 0.00 0.00 26 Q 8.54 4.07 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 27 R 7.77 3.89 0.00 1.81 1.74 0.00 3.24 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 1.68 1.96 0.00 28 F 7.98 3.86 0.00 2.04 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 29 E 8.45 4.23 0.00 2.38 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 0.00 2.72 2.86 0.00 30 R 7.90 4.12 0.00 1.95 2.06 0.00 3.03 0.00 0.00 3.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.55 0.00 31 R 7.34 3.90 0.00 1.64 1.72 0.00 3.07 0.00 0.00 3.05 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.14 0.00 32 G 7.58 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 33 F 7.42 4.83 0.00 3.18 3.23 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 34 T 8.91 4.60 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 -0.10 0.00 0.00 35 L 8.86 3.82 0.00 0.85 1.55 -0.42 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 36 V 7.71 4.35 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 0.72 0.00 0.00 0.76 0.00 0.00 37 G 7.06 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 38 M 8.48 5.35 0.00 1.92 1.73 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 39 K 8.64 4.46 0.00 1.83 1.90 0.00 1.24 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.03 1.19 7.81 40 M 8.61 5.13 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 41 L 8.56 4.54 0.00 1.73 1.69 0.93 0.49 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 42 Q 8.61 4.43 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 43 A 8.48 4.10 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.40 0.00 2.03 1.89 0.00 3.33 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 1.95 2.04 0.00 45 E 8.67 4.01 0.00 2.02 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 2.41 2.38 0.00 46 S 7.93 4.09 0.00 4.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.43 3.29 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 -0.41 0.00 0.00 0.57 0.00 0.00 48 L 7.64 3.98 0.00 1.95 1.86 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.08 4.34 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 50 E 8.16 4.03 0.00 2.19 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 2.28 2.29 0.00 51 H 8.53 4.12 0.00 3.11 3.28 0.00 5.97 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 52 Y 8.49 4.96 0.00 3.29 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 53 Q 7.86 4.05 0.00 2.31 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.82 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 54 D 8.23 4.50 0.00 2.76 2.84 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 0.00 0.00 0.00 55 L 8.18 4.64 0.00 2.07 1.86 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.68 3.04 0.00 1.87 1.76 0.00 3.06 0.00 0.00 2.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.49 0.00 57 R 7.80 4.58 0.00 1.79 1.86 0.00 3.16 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 58 K 7.55 4.73 0.00 1.83 1.75 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.58 7.81 59 P 0.00 4.09 0.00 2.29 1.55 0.00 3.80 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 60 F 8.18 4.15 0.00 3.29 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 7.67 4.00 0.00 3.35 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.26 2.15 0.00 3.71 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 63 A 8.07 4.06 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 64 L 7.80 3.86 0.00 1.65 1.55 0.58 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.21 3.63 1.71 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.59 0.88 0.00 0.00 66 R 7.99 4.02 0.00 2.11 2.07 0.00 3.11 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 67 Y 7.98 4.26 0.00 2.97 3.15 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 68 M 7.73 4.00 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.44 0.00 69 S 7.60 4.69 0.00 3.93 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 70 S 8.16 4.32 0.00 4.07 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 0.00 71 G 6.83 3.96 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 0.00 0.00 0.00 72 P 0.00 4.69 0.00 2.13 2.19 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 73 V 8.63 4.59 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 0.77 0.00 0.00 1.02 0.00 0.00 74 V 8.17 4.75 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 1.02 0.00 0.00 0.92 0.00 0.00 75 A 8.61 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 M 9.17 5.21 0.00 1.46 1.87 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.37 0.00 77 V 8.29 4.62 1.60 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 0.92 0.00 0.00 0.17 0.00 0.00 78 W 8.57 5.10 0.00 3.09 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 79 E 10.26 5.03 0.00 1.88 1.66 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 2.16 2.31 0.00 80 G 8.27 4.74 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 81 Y 8.63 4.67 0.00 2.95 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.55 4.03 0.00 1.78 2.39 0.00 0.00 6.95 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 83 V 7.45 3.27 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 0.65 0.00 0.00 -0.10 0.00 0.00 84 V 8.01 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 0.95 0.00 0.00 0.90 0.00 0.00 85 R 7.84 3.94 0.00 1.97 1.93 0.00 3.14 0.00 0.00 3.44 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 86 A 8.00 4.01 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.19 4.19 0.00 4.06 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.82 3.89 0.00 2.00 1.97 0.00 3.29 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 89 A 7.78 4.12 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 90 M 8.17 4.11 0.00 1.84 2.06 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.38 0.00 91 I 7.79 4.10 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.79 1.05 0.00 0.00 92 G 7.60 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 93 H 8.66 4.00 0.00 3.15 3.25 0.00 5.76 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 94 T 8.48 4.01 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 1.25 0.00 0.00 95 D 8.43 4.68 0.00 2.84 2.56 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 96 S 8.30 3.97 0.00 4.02 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 97 A 8.10 4.00 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 98 E 8.63 4.49 0.00 1.94 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 2.19 1.92 0.00 99 A 7.71 4.36 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 0.00 100 A 8.55 4.26 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 0.00 101 P 0.00 4.28 0.00 2.03 2.01 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 102 G 9.31 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 0.00 103 T 7.73 4.41 4.45 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 1.28 0.00 0.00 104 I 8.60 3.89 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.04 1.13 0.00 0.00 105 R 8.29 4.17 0.00 2.05 2.02 0.00 3.49 0.00 0.00 3.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 106 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 0.00 107 D 7.82 4.37 0.00 2.01 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 0.00 108 F 8.06 4.94 0.00 3.18 3.04 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 0.00 109 S 8.29 4.93 0.00 3.91 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 0.00 110 V 8.17 4.28 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 0.50 0.00 0.00 0.86 0.00 0.00 111 H 7.88 4.78 0.00 3.30 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 8.12 4.22 1.84 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 1.36 0.79 0.97 0.00 0.00 113 S 7.21 3.85 0.00 3.64 3.45 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 0.00 114 R 7.61 4.08 0.00 1.66 2.02 0.00 3.11 0.00 0.00 2.25 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.91 0.00 115 N 8.35 5.02 0.00 2.91 3.17 0.00 0.00 6.37 7.68 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 0.00 116 V 8.78 3.44 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 0.97 0.00 0.00 1.06 0.00 0.00 117 I 8.48 5.23 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.23 1.01 0.00 0.00 118 H 9.31 5.16 0.00 3.33 3.06 0.00 5.80 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 0.00 119 A 7.98 5.04 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 0.00 120 S 8.58 4.41 0.00 3.81 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.79 4.66 0.00 2.79 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 0.00 122 S 7.30 4.54 0.00 4.10 3.96 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 0.00 123 V 8.16 3.56 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 1.07 0.00 0.00 0.90 0.00 0.00 124 E 8.20 4.13 0.00 2.20 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 0.00 2.37 2.32 0.00 125 G 8.21 3.57 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 0.00 0.00 0.00 126 A 8.41 4.24 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 0.00 127 Q 8.13 3.95 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 128 R 8.01 3.87 0.00 1.91 2.12 0.00 3.11 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 129 E 8.64 4.20 0.00 2.12 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 0.00 2.41 2.62 0.00 130 I 8.22 3.94 1.92 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 1.52 0.78 0.92 0.00 0.00 131 Q 7.79 4.07 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 132 L 7.81 4.04 0.00 1.80 2.00 0.77 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 133 W 8.45 4.31 0.00 3.27 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 0.00 134 F 8.03 5.14 0.00 3.13 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 0.00 135 Q 9.26 4.63 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 S 8.65 4.16 0.00 3.90 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 0.00 137 S 8.08 4.56 0.00 4.00 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 0.00 138 E 8.15 4.54 0.00 2.39 2.28 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 2.35 2.33 0.00 139 L 7.50 4.66 0.00 1.45 1.49 0.85 0.84 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 0.00 140 V 8.72 4.42 2.14 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 0.93 0.00 0.00 1.07 0.00 0.00 141 S 8.83 4.64 0.00 3.75 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 0.00 142 W 8.18 4.64 0.00 3.45 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