NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4951 8.1693 120.6416 55.1719 43.1061 175.4422 8 H 4.9071 8.3973 115.1154 53.7166 31.6571 171.2051 9 K 4.6766 9.3673 120.2249 55.8677 33.9354 177.2100 10 E 4.9718 9.0291 121.8850 53.8374 33.9710 173.6067 11 P 5.0450 0.0000 0.0000 63.2641 32.4787 174.9551 12 A 4.9073 8.2801 121.0263 51.4575 22.9571 175.6615 13 T 4.6353 8.5770 115.3163 61.2168 72.2602 173.7274 14 L 4.1890 8.6637 128.1776 55.9721 42.2102 175.9260 15 I 4.2863 8.4808 126.7486 62.5922 38.5276 175.9638 16 K 4.5141 8.3089 121.1229 55.3091 36.0828 174.1756 17 A 4.4995 8.7190 130.5622 52.0331 19.3723 176.7433 18 I 4.2124 8.5154 123.5803 62.5165 38.9958 174.9191 19 D 4.6825 7.5422 117.0928 52.6274 44.2593 175.2245 20 G 3.7844 8.8675 108.5362 47.9695 0.0000 173.9254 21 D 4.9077 8.0773 116.2481 52.9144 40.6441 175.1267 22 T 5.2315 7.7016 116.6032 62.0428 72.3722 172.9291 23 L 5.1573 8.8970 124.9768 52.8076 46.4553 175.2853 24 K 4.9337 9.5132 124.5359 55.2169 33.7091 175.2439 25 L 5.2782 9.2278 127.3819 53.0146 46.0892 175.4780 26 M 4.9137 9.2585 122.3340 55.1350 33.4299 174.3231 27 Y 5.0292 9.2959 128.1794 56.0702 42.0691 175.6105 28 K 3.6941 9.3380 126.8947 57.4957 29.7664 176.0788 29 G 3.9652 8.3964 104.0520 45.4674 0.0000 173.5078 30 Q 4.9060 7.8383 118.2945 53.1542 31.6434 173.3162 31 P 4.9395 0.0000 0.0000 63.3629 32.2268 175.2092 32 M 4.8883 9.4207 122.9133 54.4456 36.4121 173.4559 33 T 4.8485 8.5612 121.8820 63.1459 70.4317 173.4608 34 F 5.0540 9.7126 125.1003 55.6139 42.1917 174.2578 35 R 5.0390 9.0248 123.6101 54.4077 32.1341 175.1531 36 L 4.3734 8.8611 127.5192 54.4008 41.9636 177.2897 37 L 3.8428 8.6685 125.0567 56.3092 42.2549 178.3085 38 L 3.9060 8.8243 120.0491 55.1343 39.5766 174.1218 39 V 4.9824 7.4339 111.0122 59.5345 35.2742 174.7843 40 D 5.0606 9.0793 123.9126 52.9010 43.0236 175.5584 41 T 4.7384 8.4178 114.0183 58.8306 71.1166 172.9164 42 P 4.4586 0.0000 0.0000 63.1831 32.1300 175.1966 43 E 4.7672 10.2138 120.7514 54.9996 32.0283 177.0450 44 T 4.2900 8.0396 110.5497 63.4277 71.1003 176.3044 45 K 4.3728 8.0210 124.0801 55.7532 30.8184 181.2816 46 H 3.9449 8.5638 127.3593 56.4011 25.2810 172.6455 47 P 4.5405 0.0000 0.0000 63.3635 31.6460 177.4532 48 K 4.1209 7.9938 118.9779 59.1290 32.1066 177.7605 49 K 4.5545 7.8135 113.9767 54.8501 36.3036 177.5193 50 G 3.7898 9.0014 107.4292 44.9554 0.0000 176.3986 51 V 4.3828 8.4624 127.4675 60.6413 32.2341 173.9845 52 E 4.2301 8.9516 127.3947 55.4245 31.0410 176.3062 53 K 3.9818 8.3049 123.1577 58.1943 32.5452 176.7141 54 Y 4.6092 8.1728 123.1874 59.4845 36.0315 171.2592 55 G 3.6028 8.1077 107.6885 47.4008 0.0000 174.1559 56 P 4.2825 0.0000 0.0000 65.0655 31.3222 178.6675 57 E 4.0044 8.1909 116.6894 59.3406 29.4966 178.9384 58 A 4.0287 8.4719 121.2896 55.3143 18.4248 179.6790 59 S 4.1215 8.3966 111.5160 61.4698 62.4238 176.2754 60 A 4.0419 8.3538 123.9045 54.8493 18.1026 179.3670 61 F 3.9487 8.7953 119.6709 61.8663 39.4730 177.5235 62 T 3.9127 8.3092 115.4530 66.4116 68.1427 176.5642 63 K 3.8835 8.0452 121.5897 59.3467 32.2031 178.8448 64 K 3.8529 8.1177 119.9757 59.5964 31.9123 178.3595 65 M 3.8021 7.4296 117.2416 58.8262 32.2775 178.2619 66 V 3.8163 7.9107 112.3029 64.0460 31.6139 178.4761 67 E 4.0398 8.3936 118.1648 58.7686 29.3215 177.9785 68 N 4.6783 7.9560 113.9851 52.2170 39.1794 174.9963 69 A 5.0153 6.9042 123.4007 50.7778 19.6892 178.5342 70 K 4.1781 8.9897 120.7711 58.8337 32.6411 178.0961 71 K 4.7011 8.2476 117.0741 54.6171 36.4356 175.5978 72 I 5.0373 8.4150 124.5345 59.6578 40.2434 174.4010 73 E 5.0869 9.2093 124.4413 54.7405 34.1305 174.8186 74 V 4.6763 9.1387 115.9428 59.4737 35.0015 174.5619 75 E 4.9619 8.7619 124.8471 54.4131 32.0401 174.9548 76 F 4.6949 8.8606 125.9963 57.5042 40.0390 176.2873 77 D 4.9278 8.5387 121.6358 54.0180 43.0264 175.6596 78 K 4.4285 8.9009 116.4541 57.2044 33.4245 177.9935 79 G 4.2187 8.5603 110.3352 44.5345 0.0000 173.6606 80 Q 4.0239 8.7055 122.3949 56.8848 29.3344 176.5969 81 R 4.6848 8.4708 119.3507 56.5264 31.6934 175.7595 82 T 5.1828 7.7293 108.2717 59.8892 72.3420 173.1108 83 D 4.9766 8.5366 123.1515 51.5029 42.3405 176.8937 84 K 3.9791 8.5408 116.2785 58.8867 32.5375 176.8579 85 Y 4.3850 8.3481 117.2653 57.7372 37.9270 176.5058 86 G 3.9216 8.3218 108.1732 45.4480 0.0000 173.9956 87 R 4.3066 7.9086 119.2547 55.0520 31.7534 176.3393 88 G 3.3672 8.4874 111.2702 46.3282 0.0000 172.4613 89 L 5.3409 9.0407 123.7948 53.0449 43.2961 175.5910 90 A 4.5588 8.4423 124.9626 50.6994 23.7287 173.9556 91 Y 4.8230 8.7013 117.4018 57.2111 39.6316 175.1442 92 I 4.8374 9.0634 125.3838 59.6720 40.2793 174.0998 93 Y 5.0281 9.0802 123.7900 56.0992 40.8717 174.4417 94 A 4.8613 9.3551 126.6464 50.1950 21.4500 176.4838 95 D 4.2905 9.9348 125.3434 55.9714 39.0477 176.0655 96 G 4.0364 8.4063 104.6943 45.4437 0.0000 173.5131 97 K 4.5640 8.0065 120.4810 54.6234 33.9980 175.2713 98 M 3.9184 8.5294 123.3675 54.9373 33.0591 176.9653 99 V 3.6313 8.7846 127.3625 66.2205 31.6291 177.6898 100 N 4.3528 8.0065 115.7633 56.2470 38.3450 176.8719 101 E 3.8647 8.0375 119.9923 59.0673 29.8790 178.2319 102 A 4.0245 8.0722 120.8672 55.4433 18.3802 179.5634 103 L 3.5845 7.9860 117.2428 57.8912 41.6708 180.0608 104 V 3.7436 7.4501 118.3051 65.9403 31.2774 178.0356 105 R 3.9384 8.5200 118.0459 59.1266 29.9227 177.4975 106 Q 4.3380 7.7391 115.3116 55.0128 29.0372 176.0891 107 G 3.8804 7.9144 108.5098 46.5980 0.0000 174.8132 108 L 4.4437 7.7031 116.5532 53.8786 42.2888 176.1811 109 A 4.6745 7.5014 118.8231 50.9110 22.0369 176.3035 110 K 4.8349 8.7337 119.8593 54.7120 35.0149 176.2075 111 V 4.1879 8.9629 123.4197 62.6970 31.8205 175.9870 112 A 4.7229 8.8577 130.2467 51.1325 19.4752 176.3835 113 Y 3.7367 8.5286 120.5813 57.6681 39.2306 175.5396 114 V 3.9342 7.1936 126.7221 61.6203 33.0794 174.7537 115 Y 4.6677 8.0967 123.0043 55.7945 39.3982 175.5230 116 K 4.4836 8.5839 124.6497 56.0710 32.7501 175.1716 117 P 4.7738 0.0000 0.0000 63.1623 31.7364 177.0855 118 N 4.9237 8.3244 119.3199 52.1859 36.9618 175.3655 119 N 5.0873 7.8053 114.3615 53.1772 38.8010 177.6631 120 T 3.8114 8.5153 117.3522 68.0788 68.7023 175.1546 121 H 4.8082 7.8855 116.5830 55.9837 28.9872 177.1136 122 E 3.9562 8.3474 123.0438 59.5680 29.3765 178.5393 123 Q 3.9772 8.1437 117.4862 59.3974 28.8098 178.3973 124 H 4.1866 8.2211 118.2066 59.5860 29.8904 177.1191 125 L 3.9437 8.0345 120.5547 57.8206 41.3446 179.8161 126 R 3.9147 8.2392 118.3116 58.9604 29.9193 179.2368 127 K 3.9485 8.1759 118.5598 59.5595 31.9968 179.5850 128 S 4.1322 8.0402 115.4905 61.4073 62.6894 176.3877 129 E 3.9337 8.3828 122.2265 59.0659 29.2924 178.6567 130 A 3.7639 8.1073 121.0842 54.9502 18.3316 179.4411 131 Q 3.7761 8.0582 117.8566 59.3517 29.2282 178.3162 132 A 4.0636 8.1014 121.7951 54.9949 18.3154 179.8777 133 K 3.4355 7.7135 117.1255 59.2664 31.8105 179.3901 134 K 3.8354 7.8575 118.9646 59.2590 32.1592 177.7153 135 E 4.2569 8.2924 116.1487 55.2214 30.2136 176.1394 136 K 4.1484 7.7553 117.1624 56.0910 30.5237 175.3306 137 L 4.4216 8.1362 117.7745 55.3324 44.6059 177.6929 138 N 3.5764 8.9618 119.6840 53.9329 38.0817 176.4461 139 I 3.3449 5.4263 126.1646 64.9887 37.1506 176.4514 140 W 4.8851 7.9773 118.6147 56.6497 28.9319 176.6559 141 S 4.4662 8.2797 120.1825 58.4193 62.5819 173.8631 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 7 L 8.17 4.50 0.00 1.74 1.81 1.01 0.84 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 8 H 8.40 4.91 0.00 3.18 3.24 0.00 5.71 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 9 K 9.37 4.68 0.00 1.57 1.68 0.00 1.42 0.00 0.00 1.22 0.00 0.00 2.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.30 7.81 10 E 9.03 4.97 0.00 2.11 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 2.33 2.14 0.00 11 P 0.00 5.05 0.00 2.09 2.06 0.00 3.85 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 2.00 1.99 0.00 12 A 8.28 4.91 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.58 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 14 L 8.66 4.19 0.00 1.62 1.58 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.48 4.29 2.03 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 1.26 0.82 0.93 0.00 0.00 16 K 8.31 4.51 0.00 1.78 1.61 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.38 7.81 17 A 8.72 4.50 1.25 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 0.00 0.00 18 I 8.52 4.21 1.99 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 1.18 0.68 0.89 0.00 0.00 19 D 7.54 4.68 0.00 2.60 2.61 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 0.00 0.00 0.00 0.00 20 G 8.87 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.08 4.91 0.00 2.85 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 22 T 7.70 5.23 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 1.27 0.00 0.00 23 L 8.90 5.16 0.00 1.60 1.51 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 24 K 9.51 4.93 0.00 1.88 1.82 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.52 7.81 25 L 9.23 5.28 0.00 1.64 1.50 0.36 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.26 4.91 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 27 Y 9.30 5.03 0.00 3.20 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.34 3.69 0.00 1.43 1.65 0.00 0.61 0.00 0.00 1.04 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.00 1.23 7.81 29 G 8.40 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 30 Q 7.84 4.91 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 31 P 0.00 4.94 0.00 2.15 2.15 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 32 M 9.42 4.89 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.31 0.00 33 T 8.56 4.85 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 34 F 9.71 5.05 0.00 2.88 2.87 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 35 R 9.02 5.04 0.00 1.89 1.79 0.00 3.34 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 36 L 8.86 4.37 0.00 1.54 1.61 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.67 3.84 0.00 1.11 1.16 0.40 0.38 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 38 L 8.82 3.91 0.00 2.02 1.89 1.15 1.00 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 39 V 7.43 4.98 2.10 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 0.83 0.00 0.00 0.95 0.00 0.00 40 D 9.08 5.06 0.00 2.59 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.42 4.74 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 1.24 0.00 0.00 42 P 0.00 4.46 0.00 2.32 2.23 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.04 0.00 43 E 10.21 4.77 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 44 T 8.04 4.29 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 1.19 0.00 0.00 45 K 8.02 4.37 0.00 1.68 0.80 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.49 7.81 46 H 8.56 3.94 0.00 3.25 3.52 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.54 0.00 2.18 2.16 0.00 3.82 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 1.99 1.99 0.00 48 K 7.99 4.12 0.00 1.70 1.88 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.37 7.81 49 K 7.81 4.55 0.00 1.65 1.77 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.45 7.81 50 G 9.00 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 0.00 0.00 0.00 51 V 8.46 4.38 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 0.82 0.00 0.00 0.98 0.00 0.00 52 E 8.95 4.23 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 53 K 8.30 3.98 0.00 1.63 1.65 0.00 1.33 0.00 0.00 1.43 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 0.98 7.81 54 Y 8.17 4.61 0.00 3.22 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.11 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.28 0.00 2.17 2.12 0.00 3.58 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 57 E 8.19 4.00 0.00 2.36 2.10 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 2.53 2.51 0.00 58 A 8.47 4.03 1.34 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 0.00 0.00 59 S 8.40 4.12 0.00 3.96 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 60 A 8.35 4.04 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 61 F 8.80 3.95 0.00 3.21 3.21 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 62 T 8.31 3.91 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 1.23 0.00 0.00 63 K 8.05 3.88 0.00 1.87 2.05 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.57 7.81 64 K 8.12 3.85 0.00 1.79 1.70 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.29 1.58 7.81 65 M 7.43 3.80 0.00 1.86 1.64 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 2.48 2.50 0.00 66 V 7.91 3.82 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 0.93 0.00 0.00 1.00 0.00 0.00 67 E 8.39 4.04 0.00 1.91 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 2.56 0.00 68 N 7.96 4.68 0.00 2.73 2.80 0.00 0.00 6.98 6.95 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 69 A 6.90 5.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.99 4.18 0.00 1.91 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 71 K 8.25 4.70 0.00 1.63 1.64 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.39 7.81 72 I 8.42 5.04 2.01 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 1.33 1.38 0.84 0.00 0.00 73 E 9.21 5.09 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 74 V 9.14 4.68 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 -0.02 0.00 0.00 0.63 0.00 0.00 75 E 8.76 4.96 0.00 2.27 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 2.50 2.55 0.00 76 F 8.86 4.69 0.00 3.04 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.54 4.93 0.00 2.71 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 78 K 8.90 4.43 0.00 1.79 1.88 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.44 7.81 79 G 8.56 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.71 4.02 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 81 R 8.47 4.68 0.00 1.45 1.27 0.00 2.47 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.00 82 T 7.73 5.18 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 1.12 0.00 0.00 83 D 8.54 4.98 0.00 2.80 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 84 K 8.54 3.98 0.00 1.61 1.75 0.00 1.31 0.00 0.00 1.48 0.00 0.00 2.57 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.80 0.49 7.81 85 Y 8.35 4.39 0.00 3.11 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 86 G 8.32 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 87 R 7.91 4.31 0.00 2.07 1.80 0.00 3.13 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 88 G 8.49 3.37 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 0.00 89 L 9.04 5.34 0.00 1.53 1.61 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.44 4.56 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 91 Y 8.70 4.82 0.00 3.02 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 92 I 9.06 4.84 1.77 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.00 0.86 0.00 0.00 93 Y 9.08 5.03 0.00 2.82 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 94 A 9.36 4.86 1.19 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 0.00 0.00 95 D 9.93 4.29 0.00 2.85 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 96 G 8.41 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.01 4.56 0.00 1.95 1.76 0.00 1.85 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.40 1.39 7.81 98 M 8.53 3.92 0.00 1.91 1.57 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.50 0.00 99 V 8.78 3.63 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 1.02 0.00 0.00 0.92 0.00 0.00 100 N 8.01 4.35 0.00 2.90 2.90 0.00 0.00 6.78 7.66 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 0.00 101 E 8.04 3.86 0.00 1.91 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 2.04 0.00 102 A 8.07 4.02 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.99 3.58 0.00 1.87 1.66 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.45 3.74 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 1.08 0.00 0.00 0.98 0.00 0.00 105 R 8.52 3.94 0.00 2.03 2.07 0.00 3.34 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 106 Q 7.74 4.34 0.00 1.60 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.26 0.00 0.00 0.00 0.00 0.00 2.27 1.91 0.00 107 G 7.91 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 0.00 0.00 0.00 108 L 7.70 4.44 0.00 1.32 1.51 0.50 0.57 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 0.00 109 A 7.50 4.67 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.73 4.83 0.00 1.75 1.84 0.00 2.11 0.00 0.00 1.52 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.21 7.81 111 V 8.96 4.19 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 0.76 0.00 0.00 0.96 0.00 0.00 112 A 8.86 4.72 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 0.00 113 Y 8.53 3.74 0.00 2.90 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 0.00 114 V 7.19 3.93 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 0.82 0.00 0.00 0.97 0.00 0.00 115 Y 8.10 4.67 0.00 3.14 2.89 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 0.00 0.00 0.00 116 K 8.58 4.48 0.00 1.79 1.78 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.46 7.81 117 P 0.00 4.77 0.00 2.21 2.16 0.00 3.81 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 1.98 2.01 0.00 118 N 8.32 4.92 0.00 2.94 2.88 0.00 0.00 6.64 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 0.00 119 N 7.81 5.09 0.00 2.83 2.97 0.00 0.00 6.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.52 3.81 4.27 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 1.08 0.00 0.00 121 H 7.89 4.81 0.00 2.93 3.13 0.00 5.63 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 0.00 122 E 8.35 3.96 0.00 2.17 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 2.29 2.35 0.00 123 Q 8.14 3.98 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.66 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 124 H 8.22 4.19 0.00 3.21 3.45 0.00 5.87 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 0.00 125 L 8.03 3.94 0.00 1.76 1.71 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.24 3.91 0.00 2.03 1.94 0.00 3.09 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 127 K 8.18 3.95 0.00 1.97 1.84 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.63 7.81 128 S 8.04 4.13 0.00 3.95 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 0.00 129 E 8.38 3.93 0.00 2.14 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 2.16 2.57 0.00 130 A 8.11 3.76 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 0.00 131 Q 8.06 3.78 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 132 A 8.10 4.06 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.71 3.44 0.00 1.47 1.20 0.00 0.68 0.00 0.00 0.78 0.00 0.00 2.53 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.30 0.75 7.81 134 K 7.86 3.84 0.00 1.64 2.03 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.45 7.81 135 E 8.29 4.26 0.00 1.94 1.97 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 2.30 2.50 0.00 136 K 7.76 4.15 0.00 1.91 1.92 0.00 1.69 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.36 7.81 137 L 8.14 4.42 0.00 1.77 1.66 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 138 N 8.96 3.58 0.00 2.57 1.42 0.00 0.00 7.11 7.52 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 0.00 139 I 5.43 3.34 0.89 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.07 -0.11 0.00 0.00 140 W 7.98 4.89 0.00 3.57 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.28 4.47 0.00 3.97 4.05 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