NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6444 8.4244 119.2052 53.2526 39.9746 176.7634 3 T 3.5993 8.5691 109.7578 60.5505 67.5670 171.1025 4 K 4.4112 8.9228 130.0110 54.8310 34.3888 174.8027 5 Y 4.5955 8.8947 124.8436 56.7281 39.4331 175.6603 6 N 4.5221 8.6631 121.1904 53.5221 40.7719 176.0702 7 K 3.9379 8.7039 128.0457 59.7335 32.5211 178.9766 8 E 3.9137 8.2471 118.4831 59.1653 29.3709 178.8275 9 F 4.2338 8.5715 120.8374 61.2875 39.4167 177.2343 10 L 3.7041 7.9210 118.5832 57.4979 41.5078 179.4729 11 L 3.6424 7.6297 118.9633 57.7855 41.5774 178.9473 12 Y 3.9380 7.7863 119.2575 60.6627 38.7961 177.8575 13 L 3.9107 8.2005 121.4801 57.8712 42.0221 178.6021 14 A 4.1191 8.3990 121.4266 55.2512 18.2605 179.8890 15 G 3.4394 7.9030 103.8515 47.7289 0.0000 175.7300 16 F 3.6575 7.9735 123.0206 60.8934 39.4056 177.4323 17 V 3.8518 8.5208 118.2727 66.2752 31.1786 177.7056 18 D 4.5224 8.2660 117.8834 57.2184 40.6841 178.8760 19 G 3.6278 7.9481 105.5024 47.2901 0.0000 174.9534 20 D 4.4949 8.0503 117.3836 53.9537 42.5337 174.5762 21 G 4.2260 8.2830 105.7148 44.5282 0.0000 173.6993 22 S 4.7915 8.5569 114.7148 56.6453 67.0175 173.6960 23 I 4.9564 8.6210 124.9447 59.8038 39.0005 174.9272 24 I 4.8265 8.9887 127.7195 59.3021 41.1555 174.7148 25 A 5.2447 8.5984 125.7161 50.4848 22.2763 175.3007 26 Q 4.6305 9.3957 118.5613 54.2744 33.8821 174.1383 27 I 5.0025 8.3735 121.8157 59.5988 39.9193 175.0751 28 K 4.7885 8.7750 125.9666 53.5555 35.8951 174.1281 29 P 4.5889 0.0000 0.0000 63.1027 32.4646 175.9246 30 N 4.5992 9.1482 122.0010 53.0694 41.5309 175.2008 31 Q 4.0913 9.0955 126.9914 58.8926 29.0073 177.9625 32 S 4.3051 8.1851 110.5195 59.4917 63.7209 173.8659 33 Y 4.2387 7.8162 119.6202 56.4680 38.9093 176.3194 34 K 3.5902 8.4417 123.7978 58.9599 31.9324 177.5402 35 F 4.8653 7.4854 115.1745 56.8034 39.4461 176.1595 36 K 4.5804 8.7168 118.5770 57.3660 29.9824 174.6398 37 H 5.5272 7.8218 114.1496 54.3259 33.2914 172.7920 38 Q 4.2406 9.1781 119.0809 54.0234 31.3347 174.3594 39 L 4.8687 8.5796 124.3062 54.9723 43.4037 175.8344 40 S 4.8973 9.0055 121.0558 56.6966 66.7571 172.9373 41 L 5.2966 8.5434 122.8432 53.3237 45.4282 175.6084 42 T 4.9998 9.0591 119.6215 61.9789 72.9593 172.4294 43 F 5.2502 9.3065 129.4603 56.8082 41.5546 174.2349 44 Q 4.7500 8.2887 126.5172 54.2321 32.7429 173.6506 45 V 4.7910 8.6589 125.1235 61.3559 34.9402 174.1483 46 T 5.2073 8.6301 122.7982 62.0838 71.5203 173.1894 47 Q 4.6472 8.9069 122.6316 53.7821 33.9567 174.8205 48 K 4.3930 8.6454 120.0008 56.9975 32.9230 178.5399 49 T 3.9108 8.6873 118.9843 66.6060 68.5269 176.6132 50 Q 4.2397 8.1114 117.8373 58.0289 29.1610 176.7945 51 R 4.4278 8.0580 118.5781 55.7098 30.7869 177.8774 52 R 3.8894 8.0184 121.8666 59.1571 29.8418 177.8312 53 W 4.3890 8.3305 116.2765 59.9275 27.7851 177.9264 54 F 3.7236 7.0112 121.0211 60.6182 38.6080 177.2523 55 L 3.8162 7.5375 118.2446 57.8466 41.7656 178.9294 56 D 4.4336 8.4330 119.1789 57.1641 40.6660 178.7687 57 K 3.9399 8.5491 120.7671 59.2867 32.1347 178.6492 58 L 3.6152 7.3585 120.5088 57.7758 41.8735 178.9673 59 V 3.6759 7.5972 118.2907 66.1628 31.2209 177.4913 60 D 4.3053 7.7178 116.2380 57.3202 41.1303 177.4808 61 E 3.9485 7.9797 118.7124 59.0162 30.0182 178.2984 62 I 3.9526 8.3777 119.9898 62.0797 37.0358 177.9939 63 G 4.0182 9.3281 106.9929 45.5239 0.0000 173.1054 64 V 4.3971 7.3561 110.5766 60.3637 35.9307 173.9378 65 G 3.8257 10.1367 107.3106 45.1546 0.0000 171.5055 66 Y 4.9433 7.7355 115.1811 55.8948 41.8380 173.7619 67 V 4.9804 8.5533 119.8258 61.0584 33.7263 174.7630 68 R 4.8641 8.9892 123.9176 54.4760 32.7230 174.0329 69 D 4.9437 8.7592 121.2652 53.1349 41.7028 176.3438 70 R 4.7012 8.9571 123.1717 56.1150 31.1430 175.8322 71 G 3.4661 9.0464 115.7409 48.5972 0.0000 174.0891 72 S 4.3180 9.0599 118.5047 58.8916 64.8288 174.5506 73 V 5.0553 7.3179 114.0764 59.9936 35.9294 174.5082 74 S 5.1197 9.1277 116.9667 57.1995 67.7330 172.9281 75 D 5.4375 9.0197 121.0698 52.7203 44.6527 174.4463 76 Y 4.8238 8.9935 123.7629 56.8240 40.6584 174.1845 77 I 4.5116 7.5621 126.8046 59.0468 40.9541 173.9883 78 L 4.9027 8.7922 129.3065 53.3363 44.1157 176.5650 79 S 5.1669 8.7277 117.9408 55.9138 64.6950 174.4566 80 E 4.2441 8.0798 122.4644 56.0095 30.7898 177.0882 81 I 3.7723 8.4124 125.2031 64.5133 37.4109 178.7952 82 K 4.0120 8.0024 118.5262 59.2411 32.0919 177.6632 83 P 4.4007 0.0000 0.0000 65.2828 31.2586 178.3402 84 L 4.0954 8.4515 119.7793 58.4981 41.9464 178.5020 85 H 4.0567 8.7680 118.4512 59.3354 29.4218 176.6536 86 N 4.3656 8.3363 118.8017 56.6282 38.8122 176.5721 87 F 4.3631 8.8651 122.3468 61.5752 39.5867 177.2473 88 L 3.6109 8.3760 118.8762 57.6811 41.0870 179.5282 89 T 3.7463 7.7784 115.4389 66.7670 68.4294 176.1688 90 Q 4.1662 7.5275 118.2948 58.2722 29.0817 177.7062 91 L 4.1648 7.4114 121.3189 57.2722 42.0020 178.2090 92 Q 3.8147 7.9044 119.8751 58.9572 28.6791 177.0462 93 P 4.0450 0.0000 0.0000 64.5839 31.2968 177.4511 94 F 4.6738 7.4739 114.6373 56.6746 39.9635 176.1756 95 L 4.2518 7.2007 119.2444 54.5870 41.9724 176.9208 96 K 4.5175 9.8298 121.3920 56.2345 34.4075 177.1499 97 L 4.5801 8.4717 116.9283 54.8186 43.9336 177.3832 98 K 4.9380 7.9168 115.2578 55.3501 32.8055 177.6337 99 Q 3.9476 8.0476 123.0486 59.2579 28.8658 178.3745 100 K 3.9328 7.9540 119.1152 59.3545 31.9962 179.1386 101 Q 3.9785 8.0588 117.7161 58.9241 28.7125 178.6078 102 A 3.9989 7.9054 121.4702 55.3201 18.3677 179.5043 103 N 4.2283 8.3368 115.0506 56.2294 38.4766 177.6674 104 L 3.7214 7.9864 120.6385 57.2103 41.6585 179.4431 105 V 3.5877 7.8852 118.3442 66.0137 31.4230 177.8643 106 L 3.9620 7.8836 118.6340 57.8798 41.2652 179.5391 107 K 3.7520 7.8112 118.1034 59.3903 32.2921 178.5777 108 I 4.2173 8.0997 120.4594 64.6755 37.1322 178.4670 109 I 3.8261 8.2046 120.9954 64.5409 36.7351 178.3329 110 E 4.1399 8.4242 118.2755 58.5475 29.6048 178.1235 111 Q 4.4231 8.0943 118.5423 56.8348 29.2248 177.2468 112 L 4.1503 7.8575 120.1943 58.0350 41.4475 177.2960 113 P 4.3548 0.0000 0.0000 65.7388 31.6595 178.5521 114 S 4.3350 8.1731 112.1904 61.1282 62.9191 175.8062 115 A 4.3479 8.0574 123.0664 54.0144 18.2110 178.9851 116 K 4.1604 7.8990 118.1979 58.7106 32.3397 177.1721 117 E 4.5165 8.3001 116.1478 55.9992 31.9191 175.5591 118 S 4.8398 8.1796 114.6705 55.5999 63.9061 172.7860 119 P 2.9700 0.0000 0.0000 65.7273 30.7497 178.3508 120 D 4.2070 7.8368 118.0162 56.9743 40.8595 178.5599 121 K 3.8206 7.9795 118.9809 59.4516 32.0997 179.1742 122 F 4.1612 8.2802 120.8670 61.3570 39.3247 177.2141 123 L 3.8047 8.3031 119.0581 57.5346 41.4013 179.0609 124 E 3.4408 8.0990 119.5898 58.9723 29.3672 178.9193 125 V 3.2802 7.1856 118.1845 66.1361 31.4646 177.6989 126 C 3.8640 7.5296 116.5429 62.9622 27.8887 176.2779 127 T 3.8420 7.4430 111.2733 64.4914 68.2419 176.8089 128 W 4.3951 7.7061 121.7303 59.3076 29.0760 178.3542 129 V 3.6232 8.1798 118.8079 66.5544 30.8136 177.9428 130 D 4.4095 8.0823 118.1449 57.4424 40.5841 178.8839 131 Q 4.0262 8.1907 118.7588 58.8257 28.6295 178.7107 132 I 3.7047 8.1146 120.8853 64.2297 37.1739 178.1637 133 A 3.9774 8.1029 121.3575 55.2438 18.1579 179.5779 134 A 3.9683 8.2569 119.3397 55.3495 18.2453 179.8308 135 L 3.9764 7.8631 116.4340 57.8488 41.7053 178.7070 136 N 4.6460 8.2642 113.7237 52.5518 38.4882 174.5277 137 D 4.3917 7.9634 119.0225 55.5526 39.1553 173.6828 138 S 4.8011 8.2221 113.5273 56.2110 65.4726 174.2613 139 K 4.2630 8.3335 121.2232 56.9798 33.1020 177.0419 140 T 4.4801 8.4026 110.0539 61.4406 69.8947 174.2918 141 R 4.7143 7.7395 120.4421 54.3616 33.5724 174.6360 142 K 4.8149 8.3245 119.7656 54.3715 35.5457 176.7876 143 T 4.3414 8.8057 113.2165 61.1203 71.3083 176.2167 144 T 3.8324 8.2635 117.1387 66.7987 68.3527 176.7355 145 S 4.0980 8.0389 114.4886 61.5095 62.4774 175.8672 146 E 3.9874 8.2848 121.1747 59.7200 29.2594 179.5624 147 T 3.8908 8.2246 116.0450 66.5933 68.4548 177.0470 148 V 3.5761 7.9296 120.1780 65.8467 31.5518 177.7817 149 R 3.8445 8.3500 118.7389 59.6612 29.6423 178.0623 150 A 3.9768 7.8231 118.9261 55.2480 18.5709 179.5129 151 V 3.6863 7.6740 116.3336 66.1855 31.4353 178.2923 152 L 3.9924 7.8258 117.5057 58.0170 41.5713 179.0803 153 D 4.5094 8.6316 118.1279 56.8967 40.7464 177.2379 154 S 4.4480 7.7624 118.8138 58.6594 63.3969 173.8000 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 N 8.42 4.64 0.00 2.70 2.11 0.00 0.00 6.96 6.82 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 3 T 8.57 3.60 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 1.16 0.00 0.00 4 K 8.92 4.41 0.00 1.67 1.61 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.42 7.81 5 Y 8.89 4.60 0.00 3.22 3.14 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 6 N 8.66 4.52 0.00 2.79 2.78 0.00 0.00 6.71 6.03 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 7 K 8.70 3.94 0.00 1.91 1.80 0.00 1.85 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.32 1.30 7.81 8 E 8.25 3.91 0.00 2.09 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 2.39 2.37 0.00 9 F 8.57 4.23 0.00 3.17 3.25 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 10 L 7.92 3.70 0.00 1.66 1.64 1.24 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.63 3.64 0.00 1.66 1.60 0.77 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.79 3.94 0.00 3.15 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 13 L 8.20 3.91 0.00 1.25 1.26 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.40 4.12 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 15 G 7.90 3.44 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 0.00 16 F 7.97 3.66 0.00 2.85 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 17 V 8.52 3.85 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 1.19 0.00 0.00 1.51 0.00 0.00 18 D 8.27 4.52 0.00 2.79 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.95 3.63 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 0.00 20 D 8.05 4.49 0.00 2.20 2.20 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 21 G 8.28 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 0.00 0.00 0.00 22 S 8.56 4.79 0.00 3.65 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 23 I 8.62 4.96 1.95 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 1.71 0.83 1.01 0.00 0.00 24 I 8.99 4.83 1.89 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 1.17 0.76 0.92 0.00 0.00 25 A 8.60 5.24 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 26 Q 9.40 4.63 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 I 8.37 5.00 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.71 0.95 0.00 0.00 28 K 8.78 4.79 0.00 1.67 1.66 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.38 7.81 29 P 0.00 4.59 0.00 1.92 1.92 0.00 3.73 0.00 0.00 3.63 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 30 N 9.15 4.60 0.00 2.65 2.62 0.00 0.00 7.07 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 9.10 4.09 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 32 S 8.19 4.31 0.00 3.88 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 33 Y 7.82 4.24 0.00 3.14 2.88 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 34 K 8.44 3.59 0.00 1.30 1.14 0.00 1.40 0.00 0.00 1.30 0.00 0.00 2.68 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 0.90 7.81 35 F 7.49 4.87 0.00 2.30 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.72 4.58 0.00 1.97 1.89 0.00 1.84 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.58 7.81 37 H 7.82 5.53 0.00 3.21 3.40 0.00 5.79 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.18 4.24 0.00 1.23 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 39 L 8.58 4.87 0.00 1.72 1.69 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 40 S 9.01 4.90 0.00 3.79 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.54 5.30 0.00 1.62 1.59 1.00 0.74 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 42 T 9.06 5.00 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 1.15 0.00 0.00 43 F 9.31 5.25 0.00 3.29 3.02 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 44 Q 8.29 4.75 0.00 1.95 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 45 V 8.66 4.79 2.09 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 0.99 0.00 0.00 0.85 0.00 0.00 46 T 8.63 5.21 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 1.26 0.00 0.00 47 Q 8.91 4.65 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 48 K 8.65 4.39 0.00 1.80 1.74 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.46 7.81 49 T 8.69 3.91 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 1.24 0.00 0.00 50 Q 8.11 4.24 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.47 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 51 R 8.06 4.43 0.00 1.68 1.48 0.00 2.97 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 52 R 8.02 3.89 0.00 2.00 2.04 0.00 3.16 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 53 W 8.33 4.39 0.00 3.67 3.40 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 54 F 7.01 3.72 0.00 1.67 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 55 L 7.54 3.82 0.00 1.85 1.73 0.96 1.24 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 56 D 8.43 4.43 0.00 2.87 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 57 K 8.55 3.94 0.00 2.02 1.84 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.45 7.81 58 L 7.36 3.62 0.00 1.56 0.78 0.58 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.60 3.68 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.26 0.00 0.00 60 D 7.72 4.31 0.00 2.71 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.98 3.95 0.00 1.77 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 1.47 1.50 0.00 62 I 8.38 3.95 1.84 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.65 0.71 0.00 0.00 63 G 9.33 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 64 V 7.36 4.40 2.16 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 0.73 0.00 0.00 1.08 0.00 0.00 65 G 10.14 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 66 Y 7.74 4.94 0.00 3.07 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.55 4.98 2.16 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 0.95 0.00 0.00 1.07 0.00 0.00 68 R 8.99 4.86 0.00 1.94 2.19 0.00 2.86 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 69 D 8.76 4.94 0.00 2.61 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.96 4.70 0.00 1.72 1.60 0.00 3.16 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 71 G 9.05 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 9.06 4.32 0.00 4.02 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 73 V 7.32 5.06 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 0.69 0.00 0.00 0.93 0.00 0.00 74 S 9.13 5.12 0.00 3.70 3.79 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 0.00 0.00 0.00 0.00 75 D 9.02 5.44 0.00 2.42 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 0.00 0.00 0.00 0.00 76 Y 8.99 4.82 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.56 4.51 0.56 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.28 0.70 0.00 0.00 78 L 8.79 4.90 0.00 1.61 1.61 0.96 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.73 5.17 0.00 4.10 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 80 E 8.08 4.24 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 81 I 8.41 3.77 1.94 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 1.71 0.90 0.99 0.00 0.00 82 K 8.00 4.01 0.00 1.89 1.90 0.00 1.60 0.00 0.00 1.85 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.63 7.81 83 P 0.00 4.40 0.00 2.26 2.20 0.00 3.66 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 2.19 2.21 0.00 84 L 8.45 4.10 0.00 1.94 1.95 1.12 0.90 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 85 H 8.77 4.06 0.00 3.35 3.51 0.00 5.65 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 86 N 8.34 4.37 0.00 3.00 3.12 0.00 0.00 6.91 7.83 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 87 F 8.87 4.36 0.00 3.23 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 88 L 8.38 3.61 0.00 1.61 1.58 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.78 3.75 4.36 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 1.18 0.00 0.00 90 Q 7.53 4.17 0.00 2.28 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 91 L 7.41 4.16 0.00 1.00 1.18 0.77 0.49 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 92 Q 7.90 3.81 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.56 0.00 0.00 0.00 0.00 0.00 2.25 2.72 0.00 93 P 0.00 4.04 0.00 0.81 1.64 0.00 3.51 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.92 0.00 94 F 7.47 4.67 0.00 2.99 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 95 L 7.20 4.25 0.00 1.68 1.64 0.89 1.35 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 96 K 9.83 4.52 0.00 1.76 1.80 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.49 7.81 97 L 8.47 4.58 0.00 1.74 1.66 0.89 0.60 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 98 K 7.92 4.94 0.00 1.82 1.80 0.00 2.00 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.35 7.81 99 Q 8.05 3.95 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.09 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 100 K 7.95 3.93 0.00 1.81 1.80 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.49 7.81 101 Q 8.06 3.98 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 102 A 7.91 4.00 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.34 4.23 0.00 2.64 2.76 0.00 0.00 7.07 6.66 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 0.00 104 L 7.99 3.72 0.00 1.77 1.63 0.92 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.89 3.59 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 1.17 0.00 0.00 1.01 0.00 0.00 106 L 7.88 3.96 0.00 1.84 1.64 0.80 0.67 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 0.00 107 K 7.81 3.75 0.00 1.34 1.37 0.00 0.98 0.00 0.00 1.21 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.92 7.81 108 I 8.10 4.22 2.12 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 1.91 0.83 1.03 0.00 0.00 109 I 8.20 3.83 2.14 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 1.61 1.10 0.99 0.00 0.00 110 E 8.42 4.14 0.00 2.03 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 2.36 2.46 0.00 111 Q 8.09 4.42 0.00 2.48 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 112 L 7.86 4.15 0.00 1.95 1.82 1.02 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.35 0.00 2.07 2.16 0.00 3.84 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 2.07 2.20 0.00 114 S 8.17 4.33 0.00 4.11 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 0.00 115 A 8.06 4.35 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 0.00 116 K 7.90 4.16 0.00 2.05 1.95 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.52 7.81 117 E 8.30 4.52 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 2.22 2.21 0.00 118 S 8.18 4.84 0.00 3.91 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 0.00 119 P 0.00 2.97 0.00 2.06 1.94 0.00 3.81 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 120 D 7.84 4.21 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.98 3.82 0.00 1.99 1.90 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.64 7.81 122 F 8.28 4.16 0.00 3.18 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.30 3.80 0.00 1.58 1.55 0.82 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 124 E 8.10 3.44 0.00 1.75 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 125 V 7.19 3.28 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.01 0.00 0.00 126 C 7.53 3.86 0.00 2.96 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 T 7.44 3.84 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 1.12 0.00 0.00 128 W 7.71 4.40 0.00 3.56 3.11 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 0.00 129 V 8.18 3.62 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 1.01 0.00 0.00 0.96 0.00 0.00 130 D 8.08 4.41 0.00 2.88 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 0.00 131 Q 8.19 4.03 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 132 I 8.11 3.70 2.07 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 1.47 0.83 0.93 0.00 0.00 133 A 8.10 3.98 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 0.00 134 A 8.26 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.86 3.98 0.00 1.81 1.75 0.91 0.94 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 0.00 136 N 8.26 4.65 0.00 2.87 2.84 0.00 0.00 7.14 7.61 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 0.00 137 D 7.96 4.39 0.00 2.78 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.22 4.80 0.00 3.92 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.33 4.26 0.00 1.86 1.80 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.42 7.81 140 T 8.40 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 1.30 0.00 0.00 141 R 7.74 4.71 0.00 1.76 1.82 0.00 3.14 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 142 K 8.32 4.81 0.00 1.69 1.67 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.38 7.81 143 T 8.81 4.34 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 0.00 144 T 8.26 3.83 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 1.22 0.00 0.00 145 S 8.04 4.10 0.00 3.89 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 0.00 146 E 8.28 3.99 0.00 2.31 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 2.33 2.36 0.00 147 T 8.22 3.89 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 1.24 0.00 0.00 148 V 7.93 3.58 2.09 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 1.08 0.00 0.00 0.94 0.00 0.00 149 R 8.35 3.84 0.00 1.99 1.93 0.00 3.17 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 1.64 1.67 0.00 150 A 7.82 3.98 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 0.00 151 V 7.67 3.69 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 1.00 0.00 0.00 152 L 7.83 3.99 0.00 1.81 1.72 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.63 4.51 0.00 2.61 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 0.00 154 S 7.76 4.45 0.00 4.13 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