NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7313 8.3133 118.0959 57.0783 42.1681 172.7671 2 E 4.6854 8.4869 121.2658 54.9166 30.3370 172.6509 3 E 4.4690 8.7727 122.2358 56.3697 31.2043 174.5551 4 P 3.5716 0.0000 0.0000 61.4726 31.7115 174.0611 5 P 4.1900 0.0000 0.0000 63.0311 31.7263 175.5456 6 T 4.5418 7.5353 108.3795 59.8578 70.9961 173.2878 7 F 4.8397 8.2229 121.0540 55.6237 42.7907 174.6463 8 E 4.1382 8.8754 121.8620 57.8613 30.0052 176.8139 9 A 3.4720 7.6767 118.3560 52.0128 21.0509 176.6005 10 M 5.1338 7.9220 113.7175 53.6787 34.8519 175.4918 11 E 4.8615 8.9230 121.5303 54.0919 32.8279 175.5792 12 L 3.5561 8.6862 125.9667 55.2525 42.9965 175.8907 13 I 4.1762 8.1432 125.6287 60.8961 38.4666 176.7646 14 G 4.0586 8.7703 111.5918 45.2566 0.0000 173.0125 15 K 4.2814 8.1590 118.5023 54.4886 33.0625 175.6560 16 P 4.3588 0.0000 0.0000 63.1805 31.7431 176.1950 17 K 4.4901 8.5134 122.1502 54.0762 33.9323 174.9947 18 P 5.2927 0.0000 0.0000 64.5537 31.9058 175.5586 19 Y 5.0799 7.5168 117.8060 55.6879 41.8472 174.1672 20 Y 4.7105 8.1812 123.1934 55.8510 41.1553 175.6167 21 E 4.1004 9.3335 123.6690 55.8828 31.1071 176.6839 22 I 3.8446 8.0816 123.4166 62.8823 37.5536 176.8166 23 G 3.9496 9.8582 114.1631 44.9015 0.0000 173.2151 24 E 4.3531 7.9993 120.2018 55.9459 30.9176 175.5998 25 R 5.2977 8.6693 123.4839 54.7201 32.6040 174.9983 26 V 4.4455 8.6033 119.2061 59.6396 34.6244 174.4362 27 D 5.3631 8.3788 122.6754 52.8868 44.5196 174.6755 28 Y 5.2453 8.4862 119.3541 56.2971 41.4432 174.3826 29 K 4.6276 8.7381 117.9130 55.9481 36.7299 174.5814 30 C 4.9206 8.5719 118.5951 55.9641 36.7452 174.0288 31 K 4.5449 8.9597 123.9277 56.1158 32.7955 176.1697 32 K 3.7691 8.5970 124.3976 57.7081 32.7876 176.1220 33 G 3.9175 9.2832 113.1759 45.4383 0.0000 171.8142 34 Y 4.9836 7.3660 115.5400 56.0143 41.9556 174.8575 35 F 4.9510 9.2391 119.8528 55.7831 43.1755 173.7857 36 Y 5.2133 8.7733 122.4728 57.5311 39.9724 175.1805 37 I 4.2658 7.5619 125.7080 58.8987 40.3557 173.3913 38 P 4.1032 0.0000 0.0000 61.6817 31.9120 175.0249 39 P 4.4393 0.0000 0.0000 65.7936 31.8192 176.6998 40 L 3.6602 7.4227 116.0949 52.9717 42.2270 176.6642 41 A 4.2942 8.4888 126.5048 52.3527 19.8632 177.7056 42 T 4.4788 7.8399 109.8157 59.3715 68.5349 171.2825 43 H 5.1209 7.4186 115.6659 56.8320 31.9489 173.7067 44 T 4.5555 8.4369 112.0912 61.7184 71.3880 171.7682 45 I 5.3740 8.3344 123.1320 59.8289 41.7743 175.5555 46 C 4.0516 8.7271 125.4050 55.5618 42.2576 172.3857 47 D 4.8008 7.8978 128.3874 51.8671 41.8314 177.2858 48 R 3.7833 8.5759 116.6299 59.8084 30.0625 177.4784 49 N 4.4672 7.9258 112.6760 53.9215 37.8902 174.5551 50 H 3.9752 8.4852 115.8690 56.9974 26.2221 174.3231 51 T 4.6663 6.9780 108.2841 59.5835 72.2733 172.8160 52 W 4.8440 8.5321 121.4301 55.5185 30.6211 176.5958 53 L 4.3209 8.5238 123.1110 53.9132 41.7766 175.7066 54 P 4.4740 0.0000 0.0000 63.2648 31.9616 176.0659 55 V 4.3634 7.7383 118.2552 61.0992 33.6788 172.6100 56 S 4.2799 7.7950 114.4925 56.4223 65.5046 173.7236 57 D 4.1739 8.0269 122.8231 54.6424 39.6526 177.7803 58 D 4.3133 7.9911 119.3735 56.9062 41.0507 176.9934 59 A 4.3300 7.9362 120.6060 53.0022 19.0601 176.8968 60 C 6.3000 8.6436 114.0232 54.4028 39.1045 173.2789 61 Y 5.4172 8.4546 119.8183 55.6166 41.3157 174.6902 62 R 4.5388 9.3458 118.9275 53.8797 31.6987 175.2384 63 E 3.8520 8.4085 119.1425 55.5466 30.4245 175.7318 64 T 5.2632 8.1894 114.6030 60.2357 71.6929 174.2928 65 C 4.5905 9.2022 121.5159 55.8276 41.2533 171.8099 66 P 4.7902 0.0000 0.0000 62.4106 31.7590 176.1877 67 Y 4.4754 8.8168 122.7866 58.1011 39.2571 176.0564 68 I 4.1973 7.6824 125.2300 58.9856 39.0430 175.9476 69 R 3.6949 7.9849 124.3832 55.7875 30.7203 176.7019 70 D 4.4742 8.8026 120.5165 54.1050 41.2057 174.5623 71 P 4.2733 0.0000 0.0000 62.7421 31.3563 175.7292 72 L 3.9768 8.1354 120.8175 56.2989 40.5721 176.9881 73 N 4.6282 8.1928 124.7599 51.8791 34.7122 173.8338 74 G 4.2199 6.9733 105.7195 45.2336 0.0000 170.7496 75 Q 5.3313 7.8263 118.0606 53.9201 30.7536 175.8303 76 A 5.1596 8.9412 126.1614 50.8856 18.6607 175.2664 77 V 4.0909 7.9763 120.7225 60.3729 33.3588 173.6943 78 P 4.7303 0.0000 0.0000 61.3169 32.1178 175.7223 79 A 4.0948 8.1586 125.5686 51.9588 19.9052 177.3994 80 N 4.0076 8.6492 114.1446 53.6315 36.2270 175.6049 81 G 3.8002 7.5499 105.0730 45.9655 0.0000 173.9594 82 T 4.6420 7.3114 113.2148 61.0173 70.7659 172.3572 83 Y 4.6390 8.5957 122.0761 57.8812 38.5987 175.7124 84 E 4.8025 7.9688 120.0268 55.2448 30.6155 176.3267 85 F 4.4027 8.3304 117.0482 58.1795 38.4264 175.8347 86 G 4.2600 9.6148 111.8773 45.0865 0.0000 172.2557 87 Y 5.0568 7.4355 116.2425 55.9992 42.5620 174.0459 88 Q 5.0834 9.2208 117.0156 55.0268 32.7488 173.6272 89 M 4.4053 8.7250 119.7840 54.4202 34.3476 174.7955 90 H 5.1021 8.3266 122.5671 54.0784 32.7861 172.6293 91 F 5.1362 8.1284 114.2485 57.4126 42.5515 173.9684 92 I 4.6153 8.4729 124.3807 59.5718 40.2716 173.6549 93 C 4.9363 8.8019 126.6210 54.9930 39.0177 172.7754 94 N 4.3242 9.0788 122.5610 53.4842 38.8500 174.1383 95 E 4.1363 8.6139 121.5279 58.2308 29.9943 177.5595 96 G 4.0318 8.9786 111.3467 45.2402 0.0000 172.3196 97 Y 5.2042 7.7139 119.1819 56.0091 41.8324 174.1928 98 Y 5.1857 9.0089 124.0086 55.2751 41.5174 173.9020 99 L 4.5306 8.4480 117.3553 54.6966 43.7349 175.8935 100 I 4.4917 8.0712 120.9360 58.0650 41.1841 172.3583 101 G 4.2034 8.0457 117.6219 45.0054 0.0000 175.4615 102 E 4.7881 8.4417 121.8225 54.0819 32.7598 175.2095 103 E 4.2107 8.8141 122.3790 58.3134 30.2347 176.2367 104 I 4.6879 7.4010 116.5409 59.4353 40.4770 175.1635 105 L 4.9119 8.2779 122.6360 53.5022 46.5868 174.7740 106 Y 4.9070 10.1308 120.9934 56.5046 40.6847 173.9265 107 C 4.6053 9.4086 125.1603 55.1105 43.8950 171.9600 108 E 5.1419 8.6681 126.7786 54.8399 33.4571 173.7207 109 L 4.6894 7.8200 123.0191 54.0805 42.8856 176.4820 110 K 4.2562 8.2930 120.2148 54.8209 34.4048 178.9840 111 G 3.8892 8.7841 119.3626 46.7211 0.0000 172.8196 112 S 4.7808 8.8975 113.1777 57.6086 64.1246 173.9748 113 V 4.1847 7.0891 115.9341 60.9698 33.9968 171.2438 114 A 4.6728 8.5521 125.2628 51.1840 19.9997 176.6092 115 I 4.6669 8.0645 122.6844 59.1060 41.3743 174.7721 116 W 5.1126 8.5227 123.0110 55.9847 30.2531 177.8326 117 S 4.1600 9.1594 119.7906 61.4229 62.6056 175.3157 118 G 3.9182 7.5890 110.5957 45.7445 0.0000 173.0501 119 K 4.6779 8.5138 124.2947 53.2059 35.5022 173.7899 120 P 4.0503 0.0000 0.0000 61.4650 31.7120 174.6108 121 P 4.1496 0.0000 0.0000 62.7413 31.8177 176.0201 122 I 3.9014 8.0188 123.4105 61.2871 38.4268 175.6741 123 C 4.6516 7.7549 123.2368 55.6161 40.3760 172.8466 124 E 4.2140 7.2952 120.4543 54.2729 32.9607 175.1871 125 K 4.9810 8.0790 126.8746 55.9054 35.0924 176.5741 126 V 4.0976 8.1558 119.3090 62.5755 30.7200 172.4793 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 C 8.31 4.73 0.00 2.56 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.49 4.69 0.00 2.23 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 2.39 2.46 0.00 3 E 8.77 4.47 0.00 2.16 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 2.46 2.68 0.00 4 P 0.00 3.57 0.00 1.61 0.49 0.00 3.86 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.34 0.00 5 P 0.00 4.19 0.00 1.61 1.67 0.00 3.43 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 6 T 7.54 4.54 4.13 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 0.00 0.00 1.16 0.00 0.00 7 F 8.22 4.84 0.00 3.07 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 8 E 8.88 4.14 0.00 1.96 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 2.34 0.00 9 A 7.68 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 7.92 5.13 0.00 1.77 1.65 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 11 E 8.92 4.86 0.00 1.90 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 2.22 2.22 0.00 12 L 8.69 3.56 0.00 1.12 1.36 0.21 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.14 4.18 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.74 0.86 0.00 0.00 14 G 8.77 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 0.00 0.00 0.00 15 K 8.16 4.28 0.00 1.75 1.74 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.44 7.81 16 P 0.00 4.36 0.00 2.06 2.05 0.00 3.65 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 2.02 2.09 0.00 17 K 8.51 4.49 0.00 0.79 1.29 0.00 1.08 0.00 0.00 1.58 0.00 0.00 3.06 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.25 1.22 7.81 18 P 0.00 5.29 0.00 2.25 2.30 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.90 0.00 19 Y 7.52 5.08 0.00 2.88 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 20 Y 8.18 4.71 0.00 2.83 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 21 E 9.33 4.10 0.00 1.85 1.87 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 2.36 2.49 0.00 22 I 8.08 3.84 1.78 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.09 0.84 0.00 0.00 23 G 9.86 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 24 E 8.00 4.35 0.00 2.18 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 2.40 2.44 0.00 25 R 8.67 5.30 0.00 1.86 1.84 0.00 3.22 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 26 V 8.60 4.45 1.57 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 0.10 0.00 0.00 0.36 0.00 0.00 27 D 8.38 5.36 0.00 2.57 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.49 5.25 0.00 2.63 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 29 K 8.74 4.63 0.00 1.75 1.82 0.00 1.28 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.41 7.81 30 C 8.57 4.92 0.00 2.90 3.13 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 0.00 0.00 0.00 31 K 8.96 4.54 0.00 1.66 1.87 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.62 1.29 7.81 32 K 8.60 3.77 0.00 1.72 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.45 7.81 33 G 9.28 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 34 Y 7.37 4.98 0.00 2.96 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.24 4.95 0.00 2.01 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 36 Y 8.77 5.21 0.00 2.96 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 37 I 7.56 4.27 1.98 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.49 0.78 0.00 0.00 38 P 0.00 4.10 0.00 1.93 1.98 0.00 3.47 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.84 0.00 39 P 0.00 4.44 0.00 2.18 2.15 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 40 L 7.42 3.66 0.00 1.71 1.64 0.90 0.76 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 41 A 8.49 4.29 1.29 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 0.00 0.00 0.00 42 T 7.84 4.48 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 1.07 0.00 0.00 43 H 7.42 5.12 0.00 3.41 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.44 4.56 4.30 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 1.18 0.00 0.00 45 I 8.33 5.37 1.92 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 1.32 0.69 0.94 0.00 0.00 46 C 8.73 4.05 0.00 1.66 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 47 D 7.90 4.80 0.00 2.66 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 48 R 8.58 3.78 0.00 1.78 2.02 0.00 3.17 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 49 N 7.93 4.47 0.00 2.80 2.93 0.00 0.00 6.19 7.90 0.00 0.00 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 H 8.49 3.98 0.00 3.29 3.53 0.00 5.59 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 6.98 4.67 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 1.21 0.00 0.00 52 W 8.53 4.84 0.00 3.23 3.19 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 53 L 8.52 4.32 0.00 1.63 1.64 0.95 1.12 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 54 P 0.00 4.47 0.00 2.05 2.02 0.00 3.74 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 2.05 2.12 0.00 55 V 7.74 4.36 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 0.54 0.00 0.00 0.80 0.00 0.00 56 S 7.80 4.28 0.00 3.70 3.58 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 57 D 8.03 4.17 0.00 2.66 2.56 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 0.00 0.00 0.00 0.00 58 D 7.99 4.31 0.00 2.64 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 59 A 7.94 4.33 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.64 6.30 0.00 2.90 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 61 Y 8.45 5.42 0.00 3.21 3.04 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 62 R 9.35 4.54 0.00 1.29 0.91 0.00 2.89 0.00 0.00 2.93 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.71 0.00 63 E 8.41 3.85 0.00 2.30 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 0.00 2.47 2.49 0.00 64 T 8.19 5.26 4.37 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 1.38 0.00 0.00 65 C 9.20 4.59 0.00 2.28 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 66 P 0.00 4.79 0.00 2.22 2.15 0.00 3.86 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 67 Y 8.82 4.48 0.00 2.76 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 68 I 7.68 4.20 1.75 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.97 0.93 0.00 0.00 69 R 7.98 3.69 0.00 1.67 1.81 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 70 D 8.80 4.47 0.00 2.72 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 71 P 0.00 4.27 0.00 2.02 1.70 0.00 3.90 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.88 0.00 72 L 8.14 3.98 0.00 1.70 1.67 0.86 0.73 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 73 N 8.19 4.63 0.00 2.99 3.45 0.00 0.00 7.08 7.65 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 74 G 6.97 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 75 Q 7.83 5.33 0.00 1.89 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 76 A 8.94 5.16 1.49 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 0.00 0.00 77 V 7.98 4.09 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 0.69 0.00 0.00 0.87 0.00 0.00 78 P 0.00 4.73 0.00 2.06 1.95 0.00 3.79 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 1.98 2.16 0.00 79 A 8.16 4.09 1.12 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 0.00 0.00 80 N 8.65 4.01 0.00 2.87 2.71 0.00 0.00 6.92 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 81 G 7.55 3.80 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 0.00 82 T 7.31 4.64 4.01 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 0.49 0.00 0.00 83 Y 8.60 4.64 0.00 3.05 2.99 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 84 E 7.97 4.80 0.00 2.27 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 2.70 2.30 0.00 85 F 8.33 4.40 0.00 2.95 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 9.61 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 0.00 0.00 0.00 0.00 87 Y 7.44 5.06 0.00 3.19 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 88 Q 9.22 5.08 0.00 1.87 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 89 M 8.73 4.41 0.00 1.22 1.03 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.52 0.00 90 H 8.33 5.10 0.00 3.03 3.08 0.00 5.73 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 91 F 8.13 5.14 0.00 2.84 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 92 I 8.47 4.62 1.92 0.00 0.00 0.90 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 1.29 0.95 0.00 0.00 93 C 8.80 4.94 0.00 2.98 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 94 N 9.08 4.32 0.00 2.82 2.75 0.00 0.00 7.15 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 95 E 8.61 4.14 0.00 1.98 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 2.35 2.28 0.00 96 G 8.98 4.03 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 0.00 0.00 0.00 97 Y 7.71 5.20 0.00 2.96 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 9.01 5.19 0.00 2.92 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 99 L 8.45 4.53 0.00 1.54 1.53 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.07 4.49 1.64 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 0.45 0.84 0.00 0.00 101 G 8.05 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 0.00 0.00 0.00 0.00 102 E 8.44 4.79 0.00 1.99 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 2.22 2.25 0.00 103 E 8.81 4.21 0.00 2.02 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 2.38 2.35 0.00 104 I 7.40 4.69 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.53 0.31 0.00 0.00 105 L 8.28 4.91 0.00 1.25 1.51 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 10.13 4.91 0.00 2.94 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 0.00 107 C 9.41 4.61 0.00 1.51 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 0.00 108 E 8.67 5.14 0.00 2.07 1.69 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 2.17 2.19 0.00 109 L 7.82 4.69 0.00 1.47 0.85 0.36 -0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.29 4.26 0.00 1.70 1.62 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.30 7.81 111 G 8.78 3.89 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 0.00 0.00 0.00 112 S 8.90 4.78 0.00 3.85 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 0.00 113 V 7.09 4.18 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 0.66 0.00 0.00 0.95 0.00 0.00 114 A 8.55 4.67 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 I 8.06 4.67 1.86 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 1.23 1.27 0.98 0.00 0.00 116 W 8.52 5.11 0.00 3.34 3.04 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 0.00 117 S 9.16 4.16 0.00 4.01 4.13 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 0.00 0.00 0.00 118 G 7.59 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 0.00 119 K 8.51 4.68 0.00 1.68 1.65 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.32 7.81 120 P 0.00 4.05 0.00 1.73 1.79 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 121 P 0.00 4.15 0.00 2.04 2.03 0.00 2.80 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 2.11 0.00 122 I 8.02 3.90 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.70 0.80 0.00 0.00 123 C 7.75 4.65 0.00 2.79 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 0.00 124 E 7.30 4.21 0.00 1.53 1.12 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 1.80 1.91 0.00 125 K 8.08 4.98 0.00 2.31 1.94 0.00 1.83 0.00 0.00 2.24 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.60 7.81 126 V 8.16 4.10 2.36 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 0.58 0.00 0.00 1.08 0.00 0.00