NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9486 8.3549 109.7428 44.1504 0.0000 173.1461 2 S 4.7590 7.2113 112.9791 58.4223 66.4478 176.8009 3 H 4.8186 8.9381 119.1163 54.1581 29.9054 171.8913 4 M 4.3088 8.1199 121.7538 55.7514 33.4292 175.3085 5 P 4.6179 0.0000 0.0000 62.3821 33.2964 175.7034 6 R 4.5806 8.1207 120.8102 56.6223 30.4554 176.4237 7 N 5.0192 8.4578 112.9159 54.3221 41.7621 175.0863 8 S 4.6829 8.0434 112.7116 58.5548 62.3505 175.1745 9 K 4.2809 7.9577 121.5585 57.3112 32.6798 177.6884 10 N 4.4941 8.2332 115.6288 56.5585 39.1635 175.8565 11 D 4.3369 8.4542 117.3313 57.2977 42.0161 176.0377 12 G 4.1513 7.1878 105.3240 46.2587 0.0000 173.2205 13 V 4.0656 7.2569 115.8523 60.0560 33.6711 175.8608 14 D 4.5744 8.1714 122.5786 53.7552 41.9754 176.5950 15 T 4.3713 7.9780 115.2141 60.1330 69.0652 172.1210 16 A 4.5154 7.8892 130.2161 50.3258 20.3408 175.0594 17 I 4.2274 7.8007 116.6576 61.6885 44.2460 175.5293 18 Y 4.0745 8.5682 120.7531 57.9540 39.1100 176.8344 19 H 4.0267 8.3912 119.8649 58.6047 29.6560 175.3810 20 H 3.7117 7.4618 112.6786 59.0331 28.4843 175.8179 21 K 4.2590 7.2485 121.2228 57.1733 33.5492 177.1367 22 L 5.3232 7.2129 114.5620 53.3785 42.5074 178.4159 23 R 3.9586 7.9997 119.5388 58.8401 29.8899 178.1618 24 D 4.4121 7.9322 119.3395 56.6293 39.5057 178.4537 25 Q 4.0141 8.1997 119.6995 58.3130 28.5494 178.9734 26 V 3.1517 7.4080 118.9159 65.9027 31.7425 177.9489 27 L 4.1317 8.3846 118.4175 56.6903 41.3320 179.6299 28 K 4.0260 7.9951 119.0073 59.2907 32.2673 179.0826 29 A 4.1538 8.2135 120.9964 54.9442 18.0428 179.7009 30 L 3.8749 8.1932 118.0158 57.7403 41.7009 178.9508 31 Y 3.9543 7.9111 119.3288 60.7833 39.0707 177.1361 32 D 4.8289 8.8024 120.5896 56.4934 40.7585 178.3613 33 V 3.8102 7.6124 119.1067 65.6824 31.5383 177.7490 34 L 3.8745 7.5639 116.4093 57.1088 41.5472 178.1871 35 A 3.9311 8.3002 122.5754 53.5088 18.1060 178.9440 36 K 3.7948 7.7272 117.3275 59.9170 32.4723 177.3845 37 E 3.7935 7.3753 117.1797 59.1773 29.9977 176.5099 38 S 4.6326 7.9770 112.8187 57.4660 67.3412 174.3996 39 E 4.3636 8.7702 123.1404 57.0911 30.2389 176.4632 40 H 4.5010 8.2285 118.0364 56.8500 30.5470 173.6730 41 P 4.8782 0.0000 0.0000 61.6401 32.0293 173.3484 42 P 4.3080 0.0000 0.0000 63.5189 31.5792 177.3766 43 Q 4.1039 8.4826 120.4368 56.8048 29.6505 175.6335 44 S 4.8851 7.9446 114.7010 59.1697 62.0050 171.6744 45 I 3.6376 8.0288 125.6712 65.3492 37.2245 177.3318 46 L 4.0388 8.0480 120.1423 58.7772 41.4823 178.1909 47 H 4.4067 8.2422 116.0162 58.1875 30.0004 176.5253 48 T 3.9379 8.4449 117.7456 66.6597 68.6857 176.8043 49 A 4.1658 8.5656 122.8253 54.8434 18.1849 179.6651 50 K 3.9234 7.7999 116.3295 58.6291 32.2986 178.3836 51 A 4.3585 7.3223 119.2718 52.6649 19.5420 178.5622 52 I 4.1096 7.4408 118.2264 63.1783 37.8395 177.6935 53 E 4.0880 7.6278 115.9669 58.2984 29.3278 177.8091 54 S 4.7666 7.7329 112.2063 58.6770 63.8644 174.2492 55 E 4.2687 8.2624 123.1487 58.0634 30.0885 177.5277 56 M 4.3823 8.0438 117.3499 57.4833 31.6183 176.5727 57 N 4.5445 8.0740 115.6137 52.8727 37.8540 176.4647 58 K 3.8564 7.3302 118.3733 59.0161 33.1027 177.0842 59 V 4.5167 7.0040 119.0292 60.4574 32.4470 172.6051 60 N 5.2716 8.8945 121.1103 55.1646 44.7666 175.7798 61 N 3.1400 7.3167 115.7810 54.0591 37.5352 175.9796 62 C 4.2502 7.7242 113.9962 59.0393 32.0351 175.1518 63 D 4.6585 7.6656 119.5797 52.5564 39.8139 174.9611 64 T 4.7233 6.7406 110.5900 62.1465 76.4400 173.6997 65 N 5.3248 8.3053 117.2635 49.3940 40.5855 175.3452 66 E 4.4251 8.5909 120.5296 58.8522 29.5651 179.5985 67 A 3.9907 7.9823 121.0367 55.0133 18.6583 179.3041 68 A 3.9478 8.5896 119.6273 55.3027 18.6128 178.8026 69 Y 4.2265 8.0855 117.7952 61.3076 38.6095 178.0693 70 K 3.7484 8.0045 119.9366 59.5345 32.3096 177.9753 71 A 3.9295 7.9787 120.4928 56.0999 18.3826 178.9492 72 R 3.6348 8.7736 114.8106 61.1192 29.9933 177.5052 73 Y 3.9716 8.4744 117.8043 60.9570 38.5839 178.4938 74 R 3.3620 8.3442 120.9085 60.7312 30.1722 178.4721 75 I 3.6768 8.5058 119.7880 64.0970 37.1815 177.7409 76 I 3.7344 8.2033 120.0430 63.2199 38.1789 177.3966 77 Y 4.3628 7.9296 120.6164 61.3224 37.2034 178.2763 78 S 3.6312 7.5700 113.0598 61.3531 62.5914 175.8367 79 N 4.4004 8.5106 118.7624 55.4212 38.3865 177.7059 80 V 3.6421 7.0208 120.7289 65.9419 31.5067 177.7516 81 I 3.9450 7.2946 117.1779 63.3400 36.8876 177.5482 82 S 4.4792 7.2137 114.7395 59.3845 63.4555 174.3699 83 K 4.4301 8.8668 120.0140 56.0516 34.2295 178.5591 84 N 4.6579 8.0890 119.3596 52.7017 40.1177 173.1903 85 N 4.8242 8.1798 115.3288 51.6807 39.4535 174.5719 86 P 4.5198 0.0000 0.0000 62.8839 31.5435 176.1133 87 D 4.3063 8.2095 116.8027 56.4825 37.9412 174.7641 88 L 3.9134 7.4631 121.3420 57.6383 43.2168 178.3504 89 K 4.3512 7.9917 116.6931 58.2619 33.1476 177.7032 90 H 4.5176 8.0268 113.3890 56.2415 28.9659 176.7777 91 K 3.8074 8.4440 124.2751 60.3107 31.7469 178.1991 92 I 3.7056 7.8062 117.4062 64.1334 37.0094 177.8699 93 A 4.1544 8.0258 121.4485 54.5672 19.4249 178.5863 94 N 4.8686 7.4981 111.5087 52.2853 38.9151 175.0233 95 G 3.9232 8.4036 107.6333 45.9400 0.0000 174.8279 96 D 4.5603 8.1144 119.0817 55.4907 39.5757 175.8571 97 I 4.5529 6.8669 120.0747 59.9376 39.7480 175.2461 98 T 4.0677 8.0381 110.0135 62.5866 68.8295 174.1451 99 P 4.0895 0.0000 0.0000 63.8183 28.6550 176.1503 100 E 4.2307 7.0512 123.4781 58.0273 30.4188 176.8658 101 F 4.6759 6.7949 117.9072 59.4333 39.1412 177.2265 102 L 4.1461 8.1260 120.2659 56.6843 41.8175 178.7589 103 A 4.1451 7.4668 121.0426 55.5817 18.5670 178.3709 104 T 4.6378 7.7521 108.5394 62.9126 73.7708 175.1882 105 C 3.9462 8.4159 120.8080 62.2372 31.4997 174.3689 106 D 4.5509 7.9398 118.1073 56.5974 41.1432 177.9164 107 A 4.1672 7.8893 119.8338 54.0381 18.1327 178.8736 108 K 3.9829 8.0634 117.7791 58.8570 32.3006 177.8638 109 D 4.6951 8.1597 118.8142 56.1363 42.1359 176.5080 110 L 4.5655 7.3542 118.4435 54.6325 41.2503 175.1512 111 A 4.2434 8.3235 129.6617 55.3099 19.6931 177.9710 112 P 4.5760 0.0000 0.0000 63.0716 31.1994 177.4398 113 A 4.4466 7.9102 115.6659 52.1203 20.1930 174.7516 114 P 4.4308 0.0000 0.0000 62.9247 31.3665 176.7947 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 G 8.35 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 2 S 7.21 4.76 0.00 3.95 3.73 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 0.00 0.00 0.00 0.00 3 H 8.94 4.82 0.00 3.05 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 M 8.12 4.31 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 5 P 0.00 4.62 0.00 2.16 2.11 0.00 3.42 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 1.98 2.10 0.00 6 R 8.12 4.58 0.00 1.83 1.84 0.00 3.17 0.00 0.00 3.23 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 7 N 8.46 5.02 0.00 2.73 2.78 0.00 0.00 6.54 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.04 4.68 0.00 3.87 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 9 K 7.96 4.28 0.00 1.74 1.82 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.45 7.81 10 N 8.23 4.49 0.00 2.78 2.88 0.00 0.00 6.88 8.08 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 11 D 8.45 4.34 0.00 2.84 2.73 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 0.00 0.00 0.00 0.00 12 G 7.19 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 0.00 0.00 0.00 13 V 7.26 4.07 2.26 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 0.66 0.00 0.00 -0.10 0.00 0.00 14 D 8.17 4.57 0.00 2.57 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.98 4.37 4.20 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 1.15 0.00 0.00 16 A 7.89 4.52 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 17 I 7.80 4.23 1.29 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.48 0.74 0.00 0.00 18 Y 8.57 4.07 0.00 3.02 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 19 H 8.39 4.03 0.00 3.08 3.28 0.00 5.77 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 7.46 3.71 0.00 3.23 3.20 0.00 5.69 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.25 4.26 0.00 1.70 1.70 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.42 7.81 22 L 7.21 5.32 0.00 1.77 1.79 0.80 0.73 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 23 R 8.00 3.96 0.00 2.05 2.10 0.00 3.22 0.00 0.00 3.37 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.66 0.00 24 D 7.93 4.41 0.00 2.90 2.91 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 0.00 0.00 0.00 25 Q 8.20 4.01 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 26 V 7.41 3.15 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 0.82 0.00 0.00 0.78 0.00 0.00 27 L 8.38 4.13 0.00 1.86 1.75 1.14 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.00 4.03 0.00 1.98 1.87 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.54 7.81 29 A 8.21 4.15 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.19 3.87 0.00 1.84 1.82 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 7.91 3.95 0.00 3.10 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 32 D 8.80 4.83 0.00 2.91 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 33 V 7.61 3.81 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 1.26 0.00 0.00 0.94 0.00 0.00 34 L 7.56 3.87 0.00 1.65 1.70 1.09 0.85 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 35 A 8.30 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.73 3.79 0.00 1.98 1.96 0.00 1.87 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.50 7.81 37 E 7.38 3.79 0.00 1.98 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 0.00 2.32 2.31 0.00 38 S 7.98 4.63 0.00 3.88 3.70 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 39 E 8.77 4.36 0.00 1.97 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 2.25 2.28 0.00 40 H 8.23 4.50 0.00 3.07 3.31 0.00 5.70 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.88 0.00 2.20 2.10 0.00 3.89 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 1.90 1.97 0.00 42 P 0.00 4.31 0.00 2.18 1.98 0.00 3.70 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 2.09 2.14 0.00 43 Q 8.48 4.10 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 44 S 7.94 4.89 0.00 4.25 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 0.00 45 I 8.03 3.64 1.82 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 1.45 0.65 0.84 0.00 0.00 46 L 8.05 4.04 0.00 1.76 1.76 1.01 1.08 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 47 H 8.24 4.41 0.00 3.22 3.30 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.44 3.94 4.49 0.00 0.00 0.00 0.00 0.00 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 49 A 8.57 4.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.80 3.92 0.00 1.83 1.86 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.55 1.64 7.81 51 A 7.32 4.36 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 52 I 7.44 4.11 2.07 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 1.65 0.52 1.03 0.00 0.00 53 E 7.63 4.09 0.00 1.90 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.32 0.00 54 S 7.73 4.77 0.00 3.93 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 55 E 8.26 4.27 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 56 M 8.04 4.38 0.00 2.48 2.42 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 2.74 2.64 0.00 57 N 8.07 4.54 0.00 2.80 3.21 0.00 0.00 5.82 6.37 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 58 K 7.33 3.86 0.00 1.83 1.77 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.42 7.81 59 V 7.00 4.52 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 0.63 0.00 0.00 0.90 0.00 0.00 60 N 8.89 5.27 0.00 2.80 2.88 0.00 0.00 6.60 7.31 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 61 N 7.32 3.14 0.00 2.15 2.11 0.00 0.00 5.69 7.54 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 62 C 7.72 4.25 0.00 3.02 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 63 D 7.67 4.66 0.00 2.60 2.62 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 64 T 6.74 4.72 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 65 N 8.31 5.32 0.00 2.95 2.77 0.00 0.00 6.93 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 66 E 8.59 4.43 0.00 2.23 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 2.41 2.32 0.00 67 A 7.98 3.99 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 68 A 8.59 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Y 8.09 4.23 0.00 3.33 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 70 K 8.00 3.75 0.00 1.85 2.00 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 71 A 7.98 3.93 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 72 R 8.77 3.63 0.00 1.87 2.13 0.00 3.23 0.00 0.00 3.18 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 73 Y 8.47 3.97 0.00 2.70 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 74 R 8.34 3.36 0.00 1.88 1.95 0.00 3.34 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 75 I 8.51 3.68 1.96 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 1.38 1.02 0.89 0.00 0.00 76 I 8.20 3.73 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.93 0.00 0.00 77 Y 7.93 4.36 0.00 2.53 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.57 3.63 0.00 3.82 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 79 N 8.51 4.40 0.00 2.86 2.81 0.00 0.00 6.69 7.55 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 80 V 7.02 3.64 2.33 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 1.18 0.00 0.00 1.05 0.00 0.00 81 I 7.29 3.94 1.62 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.26 0.83 0.00 0.00 82 S 7.21 4.48 0.00 4.03 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 83 K 8.87 4.43 0.00 1.57 1.51 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.36 7.81 84 N 8.09 4.66 0.00 3.01 2.77 0.00 0.00 5.90 8.01 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 85 N 8.18 4.82 0.00 2.88 2.80 0.00 0.00 7.23 7.98 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 86 P 0.00 4.52 0.00 2.18 2.13 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 87 D 8.21 4.31 0.00 2.63 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 88 L 7.46 3.91 0.00 1.61 1.74 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.99 4.35 0.00 1.79 1.86 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 90 H 8.03 4.52 0.00 3.34 3.69 0.00 5.50 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.44 3.81 0.00 1.91 1.90 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.53 7.81 92 I 7.81 3.71 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.65 0.90 0.00 0.00 93 A 8.03 4.15 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 94 N 7.50 4.87 0.00 2.56 2.70 0.00 0.00 6.72 7.63 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 95 G 8.40 3.92 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 0.00 0.00 0.00 96 D 8.11 4.56 0.00 2.80 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 97 I 6.87 4.55 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.96 1.05 0.00 0.00 98 T 8.04 4.07 3.91 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 0.00 0.00 1.27 0.00 0.00 99 P 0.00 4.09 0.00 2.07 2.46 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 100 E 7.05 4.23 0.00 1.37 1.76 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 2.13 2.34 0.00 101 F 6.79 4.68 0.00 3.10 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.13 4.15 0.00 1.64 1.79 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.47 4.15 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 0.00 104 T 7.75 4.64 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 0.00 105 C 8.42 3.95 0.00 3.01 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 0.00 106 D 7.94 4.55 0.00 2.85 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.89 4.17 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 0.00 108 K 8.06 3.98 0.00 1.80 2.07 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 109 D 8.16 4.70 0.00 2.72 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 0.00 110 L 7.35 4.57 0.00 1.75 1.61 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.32 4.24 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 0.00 112 P 0.00 4.58 0.00 2.05 1.96 0.00 3.64 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 2.03 2.08 0.00 113 A 7.91 4.45 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 0.00 114 P 0.00 4.43 0.00 2.05 1.98 0.00 3.71 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 2.03 2.08 0.00