NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.3154 8.1849 120.6286 54.1417 43.0875 176.5283 5 N 4.2889 8.5365 119.2913 52.0374 39.1353 169.8834 6 V 3.5578 8.6470 122.0753 63.0908 32.9346 175.6227 7 A 4.1511 8.5426 130.0642 52.4907 18.2926 175.4371 8 T 4.4567 7.8798 109.2877 61.8524 71.7594 174.3191 9 V 4.4670 8.2740 117.1421 58.6871 35.6252 175.5710 10 T 4.4969 8.0272 112.4325 59.4806 71.0213 174.3157 11 R 4.0359 8.2753 117.4454 56.0030 29.6815 176.3774 12 R 4.0034 8.3548 119.3515 55.8812 30.8913 174.5632 13 P 4.6198 0.0000 0.0000 63.2314 32.9075 174.8066 14 E 5.1113 9.4938 123.0480 54.7712 31.9376 174.9909 15 I 4.7647 8.7807 125.9377 59.1953 40.6893 174.2225 16 L 4.8595 8.7577 129.1741 53.2733 44.2959 174.7122 17 L 4.9492 8.5501 126.7623 52.9069 44.3292 175.5629 18 V 4.8608 8.5000 123.8848 61.6213 34.1367 173.6942 19 D 4.9490 8.8847 125.3651 53.7625 44.6544 176.4272 20 S 4.4017 9.0161 119.1044 59.6193 64.1742 174.5656 21 Q 4.3231 8.7460 122.7329 55.0913 29.4064 176.3573 22 E 4.0328 8.8456 125.8731 59.3081 29.6066 179.5540 23 V 3.6968 7.8401 118.8250 64.9374 31.2275 178.5040 24 I 3.9626 7.7291 119.8052 64.2610 37.1048 178.1792 25 L 4.2089 8.0129 119.8173 57.9056 41.3079 179.7529 26 Q 3.9714 8.6221 118.4644 59.0479 28.7039 178.8622 27 R 4.0413 8.2990 119.1381 59.2593 30.0325 179.1497 28 L 4.1054 8.5313 118.9635 57.8888 41.5970 179.2922 29 Q 4.1959 8.6164 119.7937 59.3968 28.7849 178.1099 30 Q 3.9807 8.2448 119.6355 59.1763 29.1541 177.7233 31 L 4.2161 8.0203 120.4151 57.5546 42.5411 177.9966 32 L 4.5673 8.3445 118.5417 56.2294 42.1263 178.9172 33 S 4.2524 8.2732 113.9608 60.9436 62.8563 173.9579 34 P 4.3573 0.0000 0.0000 64.0827 31.4969 176.3261 35 L 4.2627 7.3497 118.3177 52.8372 42.9369 175.7119 36 P 4.5135 0.0000 0.0000 62.1004 29.6552 174.8217 37 Y 5.2008 7.1822 119.3143 57.2613 42.6446 175.4862 38 T 4.4527 9.1461 119.4149 62.5944 70.0455 173.8186 39 L 5.0558 8.4805 126.2723 53.2439 44.1995 175.6312 40 H 4.9996 8.7419 119.1069 53.9404 32.7334 172.4477 41 F 5.2632 9.0186 119.7051 55.5892 41.8141 174.4632 42 A 5.0353 9.3260 124.9332 50.4464 21.7064 176.7504 43 R 4.7947 9.5421 119.6120 55.7346 31.2166 175.9857 44 D 4.6917 7.4879 117.1635 51.0198 43.4960 175.7192 45 A 3.9977 8.5689 120.7522 55.6048 18.2782 179.8177 46 T 3.8045 8.2200 114.3075 66.8491 68.4290 176.6361 47 Q 3.9362 8.7720 121.5098 58.9596 29.0362 178.0533 48 A 3.9389 7.9604 121.7999 55.2921 18.4940 179.6757 49 L 3.9410 8.1815 117.6544 57.9966 41.4329 179.8376 50 Q 4.0040 8.0787 117.3893 58.6291 28.9201 178.0395 51 L 4.0141 8.1440 121.7257 58.2691 41.9242 179.1646 52 L 3.6272 7.6551 117.2799 57.4061 41.4351 179.0759 53 A 4.3125 7.9688 121.2861 53.5702 18.4058 178.7608 54 S 4.5609 7.6842 111.2955 58.3033 64.0651 173.9403 55 R 4.5105 6.7665 116.4208 54.8541 31.6255 174.1869 56 E 4.0557 8.5536 118.8722 56.4048 29.9715 176.9601 57 V 4.3575 7.9462 121.9167 61.2450 34.4713 174.8088 58 D 4.6073 8.9495 127.0806 56.4630 42.2998 176.3411 59 L 5.0508 7.6265 119.7963 53.4148 45.8884 174.7785 60 V 4.7727 8.8998 125.9476 59.8857 34.2901 174.4296 61 I 4.7427 8.6878 125.7474 59.6268 39.5076 174.3696 62 S 5.2359 8.7800 122.1129 55.9075 65.4825 173.4715 63 A 5.3518 9.2011 127.9008 51.6927 19.3300 178.2469 64 A 4.0701 8.7614 120.4778 54.1226 19.9454 177.5212 65 H 5.1510 8.1464 111.9755 54.0141 30.8830 173.6933 66 L 4.7176 8.2927 122.5592 52.5689 45.4094 173.7456 67 P 4.2441 0.0000 0.0000 66.5522 31.6847 177.8101 68 Q 4.2343 8.0155 116.6508 58.4698 29.2563 176.3426 69 M 4.8162 7.4490 111.9761 52.4804 34.1614 174.4702 70 D 4.7578 8.5032 120.5768 52.6345 41.9526 177.6541 71 G 4.1108 8.7368 108.4602 47.1868 0.0000 174.2235 72 P 4.3778 0.0000 0.0000 65.4329 31.3016 178.9314 73 T 3.8783 8.3471 114.6582 66.3742 68.3104 176.4730 74 L 3.9615 8.1071 122.3889 58.3611 42.0744 179.0956 75 L 3.9913 8.4352 119.0123 57.6460 41.3500 179.3853 76 A 4.2657 8.1942 122.2723 54.5970 18.2251 179.6847 77 R 3.8635 8.1119 117.2152 59.6469 30.1953 178.7997 78 I 3.8928 8.1044 119.8828 64.5783 36.8614 177.6437 79 H 4.1618 8.3372 118.4439 59.7395 29.7332 176.9209 80 Q 3.9702 7.6233 118.1740 58.2574 28.7241 177.5066 81 Q 4.0055 8.1334 119.5099 56.7300 30.7067 175.2786 82 Y 4.8025 8.0192 117.1045 55.6056 38.2077 174.4501 83 P 4.5212 0.0000 0.0000 65.3328 32.0629 178.4406 84 S 4.2910 8.0701 113.3367 59.8620 63.0853 173.4838 85 T 4.6653 7.6592 118.3872 62.0886 69.5064 174.9830 86 T 4.2425 8.8135 123.9531 63.4363 70.2957 173.8303 87 R 5.0937 8.5378 122.4456 54.5540 33.7531 174.6630 88 I 5.0644 8.7619 123.5415 59.4339 41.5312 173.8938 89 L 4.9399 8.5006 127.8015 53.4485 44.2580 174.7392 90 L 5.0720 8.9131 128.4832 53.8710 44.4784 174.7817 91 T 4.9351 9.0744 120.6371 61.0534 71.1133 174.1529 92 G 4.0707 8.7405 114.0239 44.4791 0.0000 173.0870 93 D 4.4944 8.2283 121.2919 53.4181 41.2805 174.0729 94 P 4.4985 0.0000 0.0000 62.9598 32.0775 175.8926 95 D 4.3463 8.4366 119.8893 54.8463 41.7592 176.4954 96 L 4.1548 8.4631 127.6438 56.6684 41.9520 179.3048 97 K 4.0017 8.3102 119.4451 59.2187 31.9583 178.9645 98 L 3.9559 7.7975 120.1449 58.1318 42.1483 178.7870 99 I 3.6255 7.6447 119.3196 64.3753 37.0232 178.2049 100 A 3.9542 8.2835 121.9667 55.0677 18.1106 179.6036 101 K 3.9383 8.0117 117.4387 59.5557 32.2603 178.9425 102 A 3.9983 8.0145 121.1591 54.9812 18.1000 179.8293 103 I 3.6337 7.9236 118.3879 64.7336 37.1320 178.2598 104 N 4.4903 8.4576 115.7024 54.6956 38.4718 175.7988 105 E 4.5265 8.3797 118.9742 57.6588 31.6905 178.5762 106 G 3.5228 8.1508 105.8294 46.5310 0.0000 172.9975 107 E 4.0784 8.4322 118.0792 55.8239 27.0398 175.1332 108 I 4.0243 7.4781 110.6441 61.2905 38.7311 175.8927 109 Y 4.4387 9.0324 124.7674 60.2191 39.4973 175.6560 110 R 4.7382 7.9350 115.7206 54.4592 35.1535 173.4482 111 Y 5.2178 8.5667 121.5988 55.8996 41.3508 174.6780 112 L 4.5318 8.3690 125.7490 52.6718 45.8559 176.1687 113 S 5.5897 8.2220 116.2523 56.9165 65.4203 173.2061 114 K 4.9068 8.3927 120.0119 53.9630 34.2755 174.6969 115 P 4.3135 0.0000 0.0000 62.0254 32.2002 175.1787 116 W 4.8083 7.2970 115.5612 54.4176 30.9297 174.9368 117 D 4.7018 8.4985 118.1371 53.3354 42.1419 176.3720 118 D 4.6896 8.9200 127.1223 58.1143 40.9525 179.1430 119 Q 4.0469 8.2101 117.6978 58.7351 28.7758 178.3653 120 E 3.9596 8.8129 120.0929 59.2671 29.4634 179.1276 121 L 3.8474 8.1776 120.4121 58.1502 42.1532 179.0038 122 L 3.9984 8.2238 119.2486 57.6149 41.4264 179.2993 123 L 3.9513 8.2633 120.3116 58.1160 41.9871 178.8312 124 A 3.9638 8.1059 120.7563 54.9883 18.1862 179.3898 125 L 3.8098 8.0870 118.8928 58.3126 42.1691 179.3566 126 R 3.9633 8.1008 117.9691 59.5476 29.9705 179.1199 127 Q 4.0738 8.4713 117.7820 58.9049 28.6415 178.7657 128 A 3.9526 8.5213 122.2431 55.1730 18.4569 179.7454 129 L 3.8837 8.3242 118.0088 57.7527 41.6228 179.3745 130 E 3.9505 8.4283 119.5210 59.3358 29.4958 178.2485 131 H 4.0217 8.4136 118.5512 59.3222 29.8887 176.9117 132 Q 3.7644 8.0689 121.3580 59.4501 28.8414 177.8544 133 H 4.1410 8.3165 119.1727 59.4081 29.6922 177.4930 134 S 4.0922 7.9847 116.0093 61.5918 63.0454 176.2437 135 E 4.0456 8.3573 121.8816 59.1084 28.9297 179.4370 136 R 3.9876 7.8520 115.4269 58.7720 29.7660 178.1411 137 E 3.9760 7.9408 119.0526 58.2796 29.5446 178.4008 138 R 4.1978 7.4553 117.3924 58.1144 30.7856 176.1878 139 L 4.2412 7.6609 121.5140 55.7622 40.8523 176.1389 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 4 L 8.18 4.32 0.00 1.65 1.67 0.92 0.73 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 5 N 8.54 4.29 0.00 2.79 2.76 0.00 0.00 6.90 6.79 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 6 V 8.65 3.56 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 0.77 0.00 0.00 0.93 0.00 0.00 7 A 8.54 4.15 1.26 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 0.00 0.00 0.00 8 T 7.88 4.46 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 9 V 8.27 4.47 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 0.74 0.00 0.00 0.93 0.00 0.00 10 T 8.03 4.50 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 11 R 8.28 4.04 0.00 1.95 2.00 0.00 3.05 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 12 R 8.35 4.00 0.00 1.81 1.90 0.00 3.17 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 13 P 0.00 4.62 0.00 2.22 1.93 0.00 3.97 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 14 E 9.49 5.11 0.00 1.81 1.83 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 2.39 2.47 0.00 15 I 8.78 4.76 1.64 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.49 0.72 0.00 0.00 16 L 8.76 4.86 0.00 1.62 1.39 0.88 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.55 4.95 0.00 1.27 1.46 0.72 -0.16 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 18 V 8.50 4.86 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 1.08 0.00 0.00 0.90 0.00 0.00 19 D 8.88 4.95 0.00 2.78 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 20 S 9.02 4.40 0.00 4.04 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 21 Q 8.75 4.32 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 22 E 8.85 4.03 0.00 1.98 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 2.41 2.31 0.00 23 V 7.84 3.70 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 0.89 0.00 0.00 0.91 0.00 0.00 24 I 7.73 3.96 2.13 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.10 1.20 0.00 0.00 25 L 8.01 4.21 0.00 1.74 1.76 1.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.62 3.97 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 27 R 8.30 4.04 0.00 2.14 2.26 0.00 2.95 0.00 0.00 2.76 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 28 L 8.53 4.11 0.00 2.03 1.79 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.62 4.20 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 30 Q 8.24 3.98 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 31 L 8.02 4.22 0.00 1.94 1.88 1.09 1.26 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 32 L 8.34 4.57 0.00 1.89 1.90 0.85 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.27 4.25 0.00 4.06 4.15 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 34 P 0.00 4.36 0.00 2.05 2.14 0.00 3.81 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 2.04 2.12 0.00 35 L 7.35 4.26 0.00 1.38 0.74 0.96 0.67 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 36 P 0.00 4.51 0.00 2.08 1.98 0.00 3.24 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 37 Y 7.18 5.20 0.00 2.80 2.67 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 38 T 9.15 4.45 4.34 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 1.24 0.00 0.00 39 L 8.48 5.06 0.00 1.52 1.15 1.07 1.04 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 40 H 8.74 5.00 0.00 2.91 3.09 0.00 5.55 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 9.02 5.26 0.00 2.90 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.33 5.04 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 43 R 9.54 4.79 0.00 1.83 2.00 0.00 3.17 0.00 0.00 3.15 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 44 D 7.49 4.69 0.00 3.02 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.57 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 T 8.22 3.80 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 1.22 0.00 0.00 47 Q 8.77 3.94 0.00 2.18 2.23 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 2.37 2.39 0.00 48 A 7.96 3.94 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 49 L 8.18 3.94 0.00 1.84 1.79 0.96 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.08 4.00 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 51 L 8.14 4.01 0.00 1.71 1.73 0.67 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.66 3.63 0.00 1.23 0.25 0.77 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.97 4.31 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 54 S 7.68 4.56 0.00 4.01 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 55 R 6.77 4.51 0.00 1.85 1.85 0.00 2.65 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.48 0.00 56 E 8.55 4.06 0.00 1.96 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 0.00 2.31 2.29 0.00 57 V 7.95 4.36 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 0.78 0.00 0.00 0.82 0.00 0.00 58 D 8.95 4.61 0.00 2.68 2.63 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 59 L 7.63 5.05 0.00 1.60 1.29 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.90 4.77 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 0.71 0.00 0.00 0.93 0.00 0.00 61 I 8.69 4.74 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.66 0.75 0.00 0.00 62 S 8.78 5.24 0.00 3.85 3.66 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 63 A 9.20 5.35 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 64 A 8.76 4.07 1.26 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 0.00 0.00 0.00 65 H 8.15 5.15 0.00 3.13 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.29 4.72 0.00 1.84 1.53 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.24 0.00 2.05 2.13 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 2.06 2.18 0.00 68 Q 8.02 4.23 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 69 M 7.45 4.82 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 70 D 8.50 4.76 0.00 3.17 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 71 G 8.74 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 0.00 0.00 0.00 72 P 0.00 4.38 0.00 2.16 2.22 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 73 T 8.35 3.88 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 1.22 0.00 0.00 74 L 8.11 3.96 0.00 1.76 1.84 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.44 3.99 0.00 1.84 1.73 0.94 0.87 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 76 A 8.19 4.27 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 77 R 8.11 3.86 0.00 1.93 2.11 0.00 3.15 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 78 I 8.10 3.89 2.07 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 1.53 0.63 1.00 0.00 0.00 79 H 8.34 4.16 0.00 3.19 3.58 0.00 5.77 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 80 Q 7.62 3.97 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.67 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 81 Q 8.13 4.01 0.00 1.87 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.28 0.00 0.00 0.00 0.00 0.00 1.24 2.01 0.00 82 Y 8.02 4.80 0.00 3.08 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 83 P 0.00 4.52 0.00 2.16 2.15 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 84 S 8.07 4.29 0.00 3.91 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 85 T 7.66 4.67 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 1.19 0.00 0.00 86 T 8.81 4.24 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 1.05 0.00 0.00 87 R 8.54 5.09 0.00 1.76 1.81 0.00 3.23 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 88 I 8.76 5.06 1.82 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 1.15 0.74 0.88 0.00 0.00 89 L 8.50 4.94 0.00 1.86 1.67 1.03 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.91 5.07 0.00 1.62 1.44 0.82 0.25 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 91 T 9.07 4.94 4.34 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 1.49 0.00 0.00 92 G 8.74 4.07 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 0.00 0.00 0.00 93 D 8.23 4.49 0.00 2.78 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 94 P 0.00 4.50 0.00 2.23 2.16 0.00 3.86 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 1.99 1.97 0.00 95 D 8.44 4.35 0.00 2.95 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 96 L 8.46 4.15 0.00 1.70 1.65 0.88 0.84 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 97 K 8.31 4.00 0.00 1.93 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.44 7.81 98 L 7.80 3.96 0.00 1.75 1.74 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.64 3.63 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.50 0.67 0.00 0.00 100 A 8.28 3.95 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 0.00 101 K 8.01 3.94 0.00 1.86 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.62 7.81 102 A 8.01 4.00 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 0.00 103 I 7.92 3.63 1.97 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.04 0.89 0.00 0.00 104 N 8.46 4.49 0.00 2.70 2.86 0.00 0.00 6.95 7.56 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 0.00 105 E 8.38 4.53 0.00 2.15 1.95 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 2.22 2.21 0.00 106 G 8.15 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.43 4.08 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.15 0.00 108 I 7.48 4.02 2.06 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 1.37 0.56 0.94 0.00 0.00 109 Y 9.03 4.44 0.00 2.82 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 0.00 110 R 7.93 4.74 0.00 1.69 1.67 0.00 3.15 0.00 0.00 2.99 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.52 0.00 111 Y 8.57 5.22 0.00 2.92 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.37 4.53 0.00 1.32 1.29 0.70 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.22 5.59 0.00 3.92 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 0.00 114 K 8.39 4.91 0.00 1.85 1.82 0.00 1.77 0.00 0.00 1.99 0.00 0.00 3.03 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.75 1.56 7.81 115 P 0.00 4.31 0.00 1.93 1.81 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.86 0.00 116 W 7.30 4.81 0.00 3.33 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.50 4.70 0.00 2.85 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 0.00 118 D 8.92 4.69 0.00 2.82 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 0.00 119 Q 8.21 4.05 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 120 E 8.81 3.96 0.00 2.21 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 2.35 2.59 0.00 121 L 8.18 3.85 0.00 1.50 1.71 -0.30 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.22 4.00 0.00 1.75 1.75 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.26 3.95 0.00 1.76 1.86 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.11 3.96 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 0.00 125 L 8.09 3.81 0.00 1.84 1.80 0.73 0.35 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 0.00 126 R 8.10 3.96 0.00 2.09 2.01 0.00 3.22 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.95 0.00 127 Q 8.47 4.07 0.00 2.32 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 128 A 8.52 3.95 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 0.00 129 L 8.32 3.88 0.00 1.67 1.71 0.78 0.54 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 0.00 130 E 8.43 3.95 0.00 2.13 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 2.34 2.34 0.00 131 H 8.41 4.02 0.00 3.10 3.08 0.00 5.84 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 0.00 132 Q 8.07 3.76 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.73 0.00 133 H 8.32 4.14 0.00 3.21 3.42 0.00 5.64 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 0.00 134 S 7.98 4.09 0.00 3.96 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 0.00 135 E 8.36 4.05 0.00 1.94 1.88 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 2.12 2.05 0.00 136 R 7.85 3.99 0.00 1.93 2.23 0.00 3.12 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 137 E 7.94 3.98 0.00 2.03 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 2.28 2.27 0.00 138 R 7.46 4.20 0.00 2.08 1.93 0.00 3.17 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 139 L 7.66 4.24 0.00 1.72 1.62 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00