NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9702 8.3393 109.7289 46.1659 0.0000 174.0267 2 H 4.4765 8.0378 119.7778 54.0722 28.8206 171.2012 3 H 4.9167 8.2611 118.0336 56.0069 34.2864 172.5923 4 H 4.3206 7.6957 114.8070 56.7124 31.3063 172.1683 5 H 4.2876 7.9406 125.5958 56.1877 32.2366 172.4698 6 H 5.0262 8.0143 117.3788 53.9379 30.9426 172.9212 7 H 4.1304 8.7819 118.0796 57.3275 33.2149 172.1998 8 L 3.6008 8.7106 124.2359 54.6289 41.1955 172.1719 9 E 4.7235 7.4034 127.1878 56.8001 34.5117 178.3028 10 D 4.3372 8.3583 122.0588 56.7327 39.8329 178.4821 11 A 3.9574 7.8997 121.3621 54.6733 18.5409 177.8413 12 D 4.6414 7.2483 117.9662 51.5209 41.2479 176.7121 13 A 3.9687 8.2890 125.4279 54.9463 18.8011 178.6329 14 E 3.7643 8.1576 115.6865 59.7170 29.0821 178.9031 15 F 4.2635 8.1244 120.7662 61.3258 39.5863 176.4183 16 D 3.8213 7.8642 117.4771 57.1097 40.8799 178.2979 17 I 3.5981 7.6888 120.3871 64.5766 37.1129 178.8442 18 V 3.5746 7.8248 113.0767 64.2181 31.4170 178.7098 19 I 3.5863 7.7120 120.0120 64.2066 36.7890 178.5185 20 G 3.5481 7.8948 106.1519 48.1388 0.0000 175.4735 21 N 4.3459 8.0300 119.4010 55.5268 38.2860 177.7449 22 I 3.5855 7.7485 121.7733 64.3831 36.9967 178.0650 23 E 3.9992 7.8071 118.2114 58.8830 29.7758 178.0735 24 D 4.4103 7.7285 118.5962 56.9975 41.4582 178.2489 25 I 3.9455 8.3006 115.1458 62.9183 37.0957 177.7080 26 I 3.7771 7.1980 121.4483 64.7122 36.9470 176.9391 27 M 4.5040 7.7951 117.3758 55.1527 32.7686 176.3823 28 E 4.6911 8.0657 118.7888 54.0597 33.4251 176.2168 29 D 4.3857 8.8776 123.8862 57.4311 41.3344 178.3112 30 E 3.9828 8.2964 118.6185 59.8522 29.4288 179.1827 31 F 3.7636 8.4861 116.8926 60.8716 38.8471 177.5237 32 Q 3.9383 8.3817 118.9966 59.2590 28.9464 177.2869 33 H 3.6178 7.8754 118.9350 59.3074 29.7437 176.8093 34 L 3.7274 7.6106 121.1337 58.1526 42.1436 178.3492 35 Q 3.8812 7.8513 117.8225 59.1047 28.7412 178.6776 36 Q 3.9510 8.7018 121.0118 59.6268 29.1103 178.4727 37 S 4.1575 7.9687 113.6232 61.5218 62.2541 176.0771 38 F 3.9604 8.1791 123.0502 61.6169 39.2709 176.8689 39 M 4.1273 8.3045 117.8599 58.4178 31.9893 177.7062 40 E 3.9958 8.9017 119.8666 59.3092 29.8806 178.8905 41 K 3.9492 8.0948 118.3516 59.6041 31.9304 178.6763 42 Y 3.9546 7.7313 118.2675 60.8113 39.0016 177.1892 43 Y 4.3947 8.6643 120.5951 61.0135 38.7980 178.0450 44 L 4.1598 8.4657 118.7592 57.2739 41.6961 178.1392 45 E 4.5147 7.9722 117.2364 56.6680 29.6490 175.9949 46 F 4.3145 8.7601 113.9402 57.5651 42.2146 176.8038 47 D 4.5519 7.4816 123.9417 53.4893 45.2954 172.4133 48 D 4.2995 7.8249 117.6053 53.1422 44.2837 174.7402 49 S 4.6151 8.5256 114.0143 59.8600 63.8837 174.8005 50 E 4.0823 9.0414 124.4106 57.9763 27.9297 174.9635 51 E 4.4303 7.4789 119.0606 55.4884 31.7330 175.1241 52 N 4.3324 8.6573 116.1054 52.6855 36.9672 173.5077 53 K 4.2762 8.4341 118.0279 57.1454 33.7636 176.6368 54 L 4.2691 8.6794 118.9889 56.3123 41.9571 178.6089 55 S 4.3834 7.8124 113.8441 60.9489 63.6462 175.9490 56 Y 4.3644 7.7638 120.0771 60.7627 37.1769 177.6992 57 T 4.0890 7.7959 110.6331 64.6915 68.6217 174.5674 58 P 4.2568 0.0000 0.0000 65.2861 31.6822 178.1112 59 I 3.7121 7.7493 120.4575 63.8372 36.9233 178.2507 60 F 4.2605 8.8991 121.5338 61.3011 39.3539 176.5767 61 N 4.0702 8.2915 116.6311 56.8273 38.7067 176.3101 62 E 3.8396 8.6316 119.8983 59.9625 29.6013 178.5140 63 Y 4.1516 7.7869 116.2189 61.6088 38.0126 178.8891 64 I 3.6390 7.9664 120.2856 64.7011 37.2515 178.1491 65 E 4.0114 8.5495 120.1935 59.2051 29.3923 178.9198 66 I 3.6371 8.0790 120.3058 64.2352 37.2639 178.1264 67 L 4.0083 8.0363 120.8776 58.3713 41.9759 178.6634 68 E 4.0964 8.7622 118.8720 59.3994 29.3879 179.3703 69 K 3.9034 8.2308 119.4115 59.8351 32.3238 178.4343 70 H 4.1475 8.0915 116.2251 59.1450 28.7157 177.9540 71 L 4.0325 8.5143 120.8052 57.4255 41.2054 179.2566 72 E 3.9479 8.4412 119.8862 59.4838 29.6971 178.6897 73 Q 4.0079 8.0981 119.5266 59.1585 28.8579 178.3157 74 Q 4.0880 7.9451 118.2055 59.1255 29.3171 178.3296 75 L 4.0405 8.5108 120.3203 57.6022 41.3947 179.7694 76 V 3.6057 7.9551 117.6138 66.0506 31.6836 177.2995 77 E 4.3749 7.9410 114.4208 57.3251 29.5222 178.3577 78 R 4.0111 7.8216 119.5177 56.2262 31.1816 176.3907 79 I 3.1839 7.4831 119.7288 61.7771 35.1235 173.1193 80 P 2.9700 0.0000 0.0000 66.7057 31.4476 176.1786 81 G 3.7560 7.4628 110.5423 45.0592 0.0000 173.2890 82 F 4.2365 7.8461 124.3465 56.3391 40.5499 173.6475 83 N 4.7765 7.6135 124.2997 53.2569 37.9253 174.9441 84 M 4.6263 7.7617 120.6201 56.9357 33.3470 175.5399 85 D 4.8132 7.5625 115.7165 50.8818 42.6379 175.8609 86 A 4.4899 8.7575 125.2946 52.9900 18.5703 178.8366 87 F 3.7649 8.5377 119.5083 61.7329 39.1422 177.0037 88 T 3.9181 7.7311 112.2898 65.2644 66.9209 175.4360 89 H 4.0811 8.2469 119.7493 59.4616 29.9046 176.3582 90 S 4.3385 8.0075 110.9403 59.9938 62.3603 174.6512 91 L 4.2070 7.7613 122.1885 57.9078 42.0474 177.6485 92 K 4.0891 7.7956 119.2414 57.1638 31.4673 177.4615 93 Q 4.3527 7.3693 120.5587 56.0866 32.5628 175.2240 94 H 3.7165 7.2901 116.9548 54.8765 30.3792 173.8363 95 K 4.2589 8.4349 123.8244 56.7072 33.2363 178.0640 96 D 4.3620 8.2509 120.0326 56.8414 39.0079 177.7471 97 E 3.9692 8.1304 117.7927 59.0385 29.4892 177.4821 98 V 4.1566 7.9580 111.9907 60.6624 33.9705 172.7374 99 S 4.9309 8.0380 122.5187 55.9471 65.2100 173.9845 100 G 4.1770 8.4631 105.4878 47.7672 0.0000 174.3907 101 D 4.1666 8.0278 119.8306 57.8633 40.8203 178.6497 102 I 3.8443 7.3731 117.6238 63.9295 38.4258 177.6370 103 L 3.9136 8.2643 120.4436 58.2434 41.5369 179.3490 104 D 4.4850 8.1453 118.6832 56.4866 38.9754 177.9344 105 M 3.9365 7.2169 117.6354 58.6987 32.2484 177.6758 106 L 4.3361 7.4756 116.4270 57.0231 42.6762 178.4236 107 L 4.2414 8.5150 118.1753 56.0735 41.7148 177.9994 108 T 3.8253 7.7838 112.6588 65.9597 67.1803 173.9409 109 F 4.2610 8.3111 121.6769 61.6176 39.8181 175.5544 110 T 4.6054 8.5010 113.4754 60.3755 68.1347 171.2477 111 D 4.7485 8.0743 125.7636 53.1319 40.1144 178.1750 112 F 4.4619 9.4185 113.3853 59.2345 37.2824 176.5616 113 M 3.3238 7.9214 119.2087 58.7756 31.8239 177.9524 114 A 3.9798 7.9088 119.7361 55.2543 18.9429 178.8879 115 F 3.9120 8.5724 115.6139 61.0489 39.0510 177.6860 116 K 4.3401 9.0588 120.7550 59.1255 31.8369 178.1756 117 E 3.7960 7.6911 118.5835 60.2203 29.4263 179.4901 118 M 4.0975 8.0107 117.6507 58.4012 32.3947 178.2931 119 F 3.9540 8.6516 121.0767 61.9194 39.4314 177.1026 120 T 4.0366 8.7792 115.1886 66.9247 68.2389 175.9964 121 D 4.3507 7.8143 120.6910 57.8653 40.7733 178.8560 122 Y 3.9602 7.9718 116.6395 60.8746 37.9971 177.6087 123 R 3.8391 8.4946 119.5416 59.9680 30.0902 177.8840 124 A 4.0160 8.7284 120.6497 55.3069 18.2113 178.9527 125 E 3.8139 7.9557 117.3780 59.0260 29.4041 179.2968 126 K 4.1661 8.2205 119.8460 59.5670 32.2654 178.5870 127 E 3.8892 8.3397 117.0579 56.9799 29.6645 177.1716 128 G 4.2344 7.9599 108.7021 45.8449 0.0000 175.5580 129 R 3.7859 7.7848 120.6294 59.6971 30.5029 176.0481 130 G 3.6971 8.2417 109.7399 45.3538 0.0000 173.3355 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 8.34 3.97 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 0.00 0.00 0.00 2 H 8.04 4.48 0.00 3.28 3.36 0.00 5.67 0.00 0.00 0.00 0.00 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 H 8.26 4.92 0.00 3.19 3.44 0.00 5.77 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 H 7.70 4.32 0.00 3.09 3.17 0.00 6.04 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 H 7.94 4.29 0.00 3.08 3.13 0.00 5.72 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.01 5.03 0.00 3.24 3.22 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.78 4.13 0.00 3.10 3.30 0.00 6.06 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.71 3.60 0.00 1.82 1.68 0.31 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.40 4.72 0.00 1.96 1.74 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 2.14 2.04 0.00 10 D 8.36 4.34 0.00 2.76 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 11 A 7.90 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.25 4.64 0.00 2.33 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 0.00 0.00 0.00 13 A 8.29 3.97 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 14 E 8.16 3.76 0.00 1.84 1.75 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 1.47 2.18 0.00 15 F 8.12 4.26 0.00 3.38 3.36 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 16 D 7.86 3.82 0.00 2.71 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 17 I 7.69 3.60 2.01 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 1.47 0.65 0.88 0.00 0.00 18 V 7.82 3.57 1.96 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 0.78 0.00 0.00 0.97 0.00 0.00 19 I 7.71 3.59 1.59 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 0.76 -0.36 0.83 0.00 0.00 20 G 7.89 3.55 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 0.00 21 N 8.03 4.35 0.00 2.79 2.87 0.00 0.00 7.19 7.32 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 22 I 7.75 3.59 1.91 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.56 0.97 0.00 0.00 23 E 7.81 4.00 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 24 D 7.73 4.41 0.00 2.71 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 25 I 8.30 3.95 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.03 0.99 0.00 0.00 26 I 7.20 3.78 2.01 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.88 1.07 0.00 0.00 27 M 7.80 4.50 0.00 2.05 2.08 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 2.63 2.60 0.00 28 E 8.07 4.69 0.00 1.92 1.92 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 2.25 2.24 0.00 29 D 8.88 4.39 0.00 2.74 2.71 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 0.00 0.00 0.00 0.00 30 E 8.30 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 2.43 2.43 0.00 31 F 8.49 3.76 0.00 3.21 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 32 Q 8.38 3.94 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.50 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 33 H 7.88 3.62 0.00 3.20 3.50 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.61 3.73 0.00 1.58 1.43 0.75 0.50 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 35 Q 7.85 3.88 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.39 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 36 Q 8.70 3.95 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.09 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 37 S 7.97 4.16 0.00 4.08 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.18 3.96 0.00 3.24 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 39 M 8.30 4.13 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.75 0.00 40 E 8.90 4.00 0.00 2.23 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 2.39 2.45 0.00 41 K 8.09 3.95 0.00 2.04 1.81 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.51 7.81 42 Y 7.73 3.95 0.00 2.73 2.85 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 43 Y 8.66 4.39 0.00 3.22 3.03 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 44 L 8.47 4.16 0.00 1.82 1.76 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.97 4.51 0.00 2.13 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 2.23 2.31 0.00 46 F 8.76 4.31 0.00 3.00 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 47 D 7.48 4.55 0.00 2.48 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 7.82 4.30 0.00 2.44 2.52 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 49 S 8.53 4.62 0.00 4.10 4.10 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 50 E 9.04 4.08 0.00 2.17 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 0.00 2.24 2.34 0.00 51 E 7.48 4.43 0.00 1.96 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 2.30 2.34 0.00 52 N 8.66 4.33 0.00 3.06 2.93 0.00 0.00 6.69 7.67 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 53 K 8.43 4.28 0.00 2.05 1.77 0.00 1.79 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.58 7.81 54 L 8.68 4.27 0.00 1.64 1.71 0.94 0.99 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 55 S 7.81 4.38 0.00 3.76 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.76 4.36 0.00 3.14 2.96 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 57 T 7.80 4.09 4.32 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 1.30 0.00 0.00 58 P 0.00 4.26 0.00 2.29 2.36 0.00 3.77 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 2.28 2.12 0.00 59 I 7.75 3.71 2.11 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 1.42 0.65 1.20 0.00 0.00 60 F 8.90 4.26 0.00 3.12 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.29 4.07 0.00 3.02 2.93 0.00 0.00 7.29 6.98 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 62 E 8.63 3.84 0.00 1.97 1.80 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 2.26 2.40 0.00 63 Y 7.79 4.15 0.00 3.26 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 64 I 7.97 3.64 1.45 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 -0.36 0.88 0.00 0.00 65 E 8.55 4.01 0.00 1.98 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 66 I 8.08 3.64 2.12 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.81 1.00 0.00 0.00 67 L 8.04 4.01 0.00 1.84 1.78 1.08 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.76 4.10 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.58 0.00 69 K 8.23 3.90 0.00 1.97 1.98 0.00 1.39 0.00 0.00 1.34 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.57 7.81 70 H 8.09 4.15 0.00 3.37 3.29 0.00 5.69 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 71 L 8.51 4.03 0.00 1.69 1.45 0.27 -0.16 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 72 E 8.44 3.95 0.00 2.15 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 0.00 2.35 2.50 0.00 73 Q 8.10 4.01 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 74 Q 7.95 4.09 0.00 2.39 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 75 L 8.51 4.04 0.00 1.85 1.76 1.02 1.08 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 76 V 7.96 3.61 2.30 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 0.93 0.00 0.00 1.04 0.00 0.00 77 E 7.94 4.37 0.00 2.12 2.03 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 2.36 2.50 0.00 78 R 7.82 4.01 0.00 1.92 1.75 0.00 2.89 0.00 0.00 2.25 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.77 0.00 79 I 7.48 3.18 1.81 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 1.43 0.66 0.86 0.00 0.00 80 P 0.00 2.97 0.00 1.99 1.45 0.00 3.53 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.78 0.00 81 G 7.46 3.76 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 0.00 0.00 0.00 82 F 7.85 4.24 0.00 3.09 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 N 7.61 4.78 0.00 2.70 2.84 0.00 0.00 7.36 7.49 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 84 M 7.76 4.63 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.75 0.00 85 D 7.56 4.81 0.00 3.14 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 86 A 8.76 4.49 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 87 F 8.54 3.76 0.00 3.25 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 T 7.73 3.92 4.28 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 0.00 0.00 1.33 0.00 0.00 89 H 8.25 4.08 0.00 3.18 3.46 0.00 5.80 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 90 S 8.01 4.34 0.00 3.85 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 91 L 7.76 4.21 0.00 1.97 1.93 1.02 0.61 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 92 K 7.80 4.09 0.00 1.80 1.63 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.42 7.81 93 Q 7.37 4.35 0.00 1.80 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 94 H 7.29 3.72 0.00 3.22 3.10 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.43 4.26 0.00 1.99 2.08 0.00 1.42 0.00 0.00 1.96 0.00 0.00 3.18 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.55 7.81 96 D 8.25 4.36 0.00 2.36 2.52 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 97 E 8.13 3.97 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 98 V 7.96 4.16 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 0.55 0.00 0.00 0.90 0.00 0.00 99 S 8.04 4.93 0.00 3.77 3.64 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 0.00 100 G 8.46 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 0.00 0.00 0.00 101 D 8.03 4.17 0.00 2.67 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 0.00 102 I 7.37 3.84 1.83 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 1.61 1.33 0.95 0.00 0.00 103 L 8.26 3.91 0.00 1.67 1.67 0.87 1.02 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 0.00 104 D 8.15 4.48 0.00 3.08 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 0.00 105 M 7.22 3.94 0.00 2.08 2.30 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 2.61 2.60 0.00 106 L 7.48 4.34 0.00 1.66 1.70 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.52 4.24 0.00 1.83 1.64 1.05 0.74 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 0.00 108 T 7.78 3.83 4.60 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 1.31 0.00 0.00 109 F 8.31 4.26 0.00 3.01 3.18 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 0.00 110 T 8.50 4.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 111 D 8.07 4.75 0.00 3.28 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 0.00 112 F 9.42 4.46 0.00 3.39 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 0.00 113 M 7.92 3.32 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 114 A 7.91 3.98 1.28 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 0.00 0.00 0.00 0.00 0.00 115 F 8.57 3.91 0.00 3.16 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 0.00 116 K 9.06 4.34 0.00 2.05 1.89 0.00 0.61 0.00 0.00 1.46 0.00 0.00 2.65 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.37 7.81 117 E 7.69 3.80 0.00 2.12 1.92 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 2.25 2.43 0.00 118 M 8.01 4.10 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 119 F 8.65 3.95 0.00 3.32 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.78 4.04 4.39 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 1.32 0.00 0.00 121 D 7.81 4.35 0.00 2.93 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 0.00 122 Y 7.97 3.96 0.00 3.12 2.79 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 0.00 123 R 8.49 3.84 0.00 1.73 2.10 0.00 3.17 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.85 0.00 124 A 8.73 4.02 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 0.00 125 E 7.96 3.81 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 126 K 8.22 4.17 0.00 1.93 2.07 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.58 7.81 127 E 8.34 3.89 0.00 2.12 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 2.44 2.58 0.00 128 G 7.96 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 0.00 129 R 7.78 3.79 0.00 1.90 1.98 0.00 3.40 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 1.67 1.78 0.00 130 G 8.24 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 0.00 0.00 0.00