NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 3.8477 8.0549 120.3832 62.6587 32.4775 174.5791 4 I 4.1602 8.3218 128.5483 58.3081 37.4600 173.7421 5 N 5.0589 8.2607 122.0918 52.0580 39.2992 174.0147 6 T 4.5729 7.6927 109.5037 60.7742 72.0255 175.1418 7 F 4.1815 8.3454 120.4077 61.1862 38.9843 177.7841 8 D 4.5975 8.3419 117.9971 57.0011 40.7629 178.9362 9 G 3.6517 8.2680 106.4120 47.9773 0.0000 176.0343 10 V 3.7082 8.2720 121.3017 65.2669 31.4668 177.8717 11 A 4.0904 8.2843 120.7336 55.4851 18.2672 179.4392 12 D 4.3084 8.4288 117.4636 57.4709 40.8395 178.4018 13 Y 3.9711 8.2884 120.1059 60.5921 38.7893 177.8350 14 L 4.1719 8.4860 120.3397 58.3515 41.6152 179.8150 15 Q 3.8833 8.0503 116.0878 58.7703 28.6089 178.8257 16 T 3.6204 7.5575 116.2932 66.2722 67.3472 175.8586 17 Y 4.3532 7.7243 116.7811 56.8781 38.5630 175.9754 18 H 3.4825 8.2351 116.3451 55.5752 26.8170 174.3961 19 K 4.7512 7.3221 113.9770 55.6518 35.4290 175.3455 20 L 4.1545 8.3150 120.0995 53.6309 42.5220 175.3374 21 P 3.8557 0.0000 0.0000 62.5351 31.7241 176.6574 22 D 4.6369 8.2977 116.9723 55.5121 40.8180 176.7176 23 N 4.6280 7.8962 116.7664 53.2022 38.6102 173.8827 24 Y 5.1431 7.7462 117.5408 56.6544 39.9870 175.1969 25 I 4.9849 8.5912 115.9372 59.1099 41.4537 175.3263 26 T 4.6606 9.1590 114.5182 60.6487 69.8221 175.6787 27 K 3.9638 9.1893 122.1361 60.0263 31.9563 179.9665 28 S 4.4459 8.1427 114.7614 61.6031 62.8242 176.3526 29 E 3.9901 8.2910 121.0926 59.4100 29.1755 179.2974 30 A 4.0517 8.5315 121.1154 55.2801 18.4537 179.6416 31 Q 4.4864 9.1351 118.1312 58.7203 28.6128 178.8939 32 A 4.0897 8.2193 120.8558 55.1384 18.5091 178.9137 33 L 4.3083 7.7693 114.5149 54.8603 42.0048 177.3706 34 G 4.0072 7.8161 106.3061 44.9780 0.0000 174.4612 35 W 4.4933 8.7723 131.9543 57.1570 31.4506 174.9089 36 V 3.8245 8.8076 124.7223 60.4736 33.4785 175.6269 37 A 3.5671 7.7407 130.8168 55.2227 18.1948 179.1863 38 S 4.5389 7.7451 107.6244 60.2284 63.3939 175.1820 39 K 4.1113 7.9951 120.2563 56.7469 32.1283 177.1421 40 G 2.8567 7.5267 106.2245 46.3470 0.0000 173.7579 41 N 5.0939 7.9865 113.4376 51.3390 38.0461 176.1397 42 L 3.8803 8.2460 122.6824 58.6909 41.8102 178.8439 43 A 4.3148 8.0449 119.8738 54.2130 18.6357 179.1106 44 D 4.4115 8.0708 116.1737 57.2640 41.2406 179.0317 45 V 3.8179 7.7214 110.7615 63.2080 32.4204 176.5878 46 A 4.6416 8.1985 122.3976 48.8425 18.7162 172.6704 47 P 4.5360 0.0000 0.0000 62.7822 32.2054 177.5632 48 G 3.8488 8.7954 109.7613 45.5961 0.0000 173.1647 49 K 4.7333 7.7185 118.4602 55.0415 34.2846 176.0567 50 S 4.5752 8.3380 117.1954 56.4250 67.4255 173.7120 51 I 4.2314 7.9409 123.3605 61.5520 37.7666 175.3264 52 G 4.2271 9.4001 111.8519 46.8635 0.0000 174.2020 53 G 4.5125 9.6302 108.9753 44.6714 0.0000 174.2329 54 D 4.7462 8.0703 119.7217 53.5488 42.5315 175.8770 55 I 4.2179 8.3720 122.0023 61.9143 37.5207 175.0743 56 F 4.8848 9.1157 129.6705 56.4937 40.4901 176.6860 57 S 3.9739 8.0911 121.0481 58.9315 63.6782 173.4263 58 N 3.7008 5.7700 115.7388 53.8765 37.5884 176.1652 59 R 3.8240 7.7734 116.8765 59.1254 29.9336 178.0539 60 E 4.0665 8.1075 115.2950 56.5706 29.8987 177.7017 61 G 3.8010 7.9033 106.7081 46.2674 0.0000 175.2435 62 K 4.1081 7.4515 118.0358 58.0255 32.3862 177.6931 63 L 3.8585 7.1551 118.2222 51.9154 42.6612 174.6938 64 P 4.3296 0.0000 0.0000 62.8933 31.8207 176.2458 65 G 4.2082 8.3543 110.8219 44.4038 0.0000 172.5510 66 K 4.4586 7.9614 118.8709 54.5601 35.0335 174.9843 67 S 4.2203 8.5509 119.5089 60.0488 62.5041 174.7580 68 G 3.8788 8.9087 115.4952 45.2605 0.0000 172.8746 69 R 4.0691 7.7050 120.8048 55.3447 30.9449 175.3095 70 T 4.7164 8.2149 114.6568 59.5877 72.5790 172.6805 71 W 5.0808 8.4989 120.6784 55.0059 32.9964 174.7756 72 R 5.2052 8.7471 121.6339 54.2674 34.1581 173.9936 73 E 5.5164 8.9221 117.2469 55.0665 33.5666 174.3994 74 A 5.0019 8.8646 120.7029 50.6173 23.1076 175.4497 75 D 4.9499 9.2758 121.8842 54.4596 41.2434 176.1273 76 I 4.3677 8.3870 123.0115 60.1132 40.6294 175.7850 77 N 4.5955 8.7949 121.0533 54.1746 36.7176 173.7737 78 Y 4.2826 7.3999 120.4074 57.4760 39.5921 175.0156 79 T 3.9365 7.3840 115.2220 62.4346 70.5898 173.7649 80 S 4.2686 6.4210 112.4547 58.3578 65.7790 175.3844 81 G 3.8019 8.5445 107.3598 44.8752 0.0000 173.3773 82 F 4.4324 8.6106 118.6880 57.2469 39.6612 175.3524 83 R 4.2544 8.6654 121.8167 56.4421 30.6873 177.0469 84 N 4.9464 8.4790 118.0982 52.4761 40.0322 175.1707 85 S 4.6587 8.5788 115.2496 58.9762 64.5505 173.0262 86 D 5.5538 8.5412 121.7161 53.0293 42.6336 175.8636 87 R 5.0323 9.1348 121.5173 54.6663 35.2090 173.8271 88 I 4.9741 8.9136 123.4080 59.9351 40.2376 174.1797 89 L 5.6180 9.4151 129.0155 53.1557 44.7529 175.0667 90 Y 5.6649 9.2131 121.5704 55.4919 41.5788 174.9716 91 S 4.1563 8.2794 117.6771 56.2629 65.1468 175.3530 92 S 3.4147 7.9725 115.1924 60.2070 62.7507 174.8019 93 D 4.6184 7.3390 118.8989 52.5269 39.3791 176.0902 94 W 3.6483 7.3695 118.4085 58.0295 26.9229 174.0730 95 L 4.5601 7.6824 117.8453 54.9640 42.6751 176.3147 96 I 5.4277 8.7099 121.7334 60.1094 40.7363 174.3398 97 Y 5.4231 9.8750 124.1810 56.0050 42.3739 174.3591 98 K 5.3064 9.3236 118.8258 55.7299 36.6104 175.1595 99 T 4.8167 9.0178 115.3005 60.3741 70.7670 174.0849 100 T 5.2782 8.6875 115.1322 60.3240 69.5412 173.3942 101 D 4.6671 7.0886 120.9974 53.4075 39.9703 174.8674 102 A 3.0292 8.5656 117.6728 54.8493 16.3464 178.8120 103 Y 3.4094 7.5001 115.3346 59.1591 36.5190 171.2098 104 Q 4.1610 7.6743 120.5813 58.4366 28.9687 176.5190 105 T 4.6997 8.0952 105.3842 59.7868 71.9516 172.7880 106 F 5.1881 8.4680 119.5095 56.2118 43.3706 174.2231 107 T 4.6909 8.9102 117.6488 61.3686 71.9218 173.3680 108 K 3.2717 8.6139 128.3066 56.1630 32.2458 176.2238 109 I 4.4976 8.5520 119.9530 60.7680 39.6627 175.8240 110 R 4.7262 7.5614 121.5419 54.6895 34.5375 174.9745 111 S 4.7570 8.7228 119.2884 57.9772 64.0694 173.9918 112 S 4.5772 8.9179 115.5464 58.4984 62.6644 173.9743 113 S 4.6025 8.7190 120.2077 58.2476 63.5372 173.7585 114 M 4.2982 7.7693 122.1153 57.3549 31.9976 176.7734 115 G 3.9375 9.0465 111.8944 45.0226 0.0000 173.2494 116 V 3.9519 7.6739 120.5211 61.5911 32.3504 173.6904 117 C 4.5901 8.5112 127.4448 54.3362 44.2107 171.4116 118 P 4.3822 0.0000 0.0000 62.5973 31.5645 177.1196 119 K 4.2776 8.1419 123.2076 55.2799 30.4472 174.7572 120 I 4.5587 7.3251 120.6464 58.6302 41.0935 174.8142 121 L 4.2730 8.5788 127.5527 54.6097 42.6394 175.7861 122 K 4.6679 8.5420 126.2755 55.1762 35.6129 175.1553 123 K 4.2457 8.5997 126.7776 56.5434 33.0432 174.9130 124 C 4.8215 8.6986 115.4355 55.0499 44.6719 174.6661 125 R 4.1248 9.2788 119.0352 56.5252 31.8356 176.1762 126 R 4.6914 7.5801 112.5451 54.4312 32.6292 175.4997 127 D 4.3801 8.6862 118.0278 57.4177 40.8371 178.8145 128 S 4.3216 7.8998 111.3558 59.8856 63.2620 174.5819 129 D 4.4711 8.0065 120.6594 55.9591 40.8876 175.4995 130 C 4.8780 7.6603 116.3971 54.5411 38.8870 173.5164 131 L 4.0901 8.0415 120.8326 54.1880 41.8794 176.7645 132 A 4.0189 7.9433 123.2978 54.1180 18.4840 178.2901 133 G 4.0594 8.9486 110.3334 46.0556 0.0000 173.8475 134 C 5.2134 7.5288 116.0823 55.3169 43.8311 173.6428 135 V 4.7082 8.7788 114.1709 59.5549 35.7062 173.8081 136 C 4.6856 9.5072 123.7256 56.2479 40.5699 173.7185 137 G 4.1796 8.6952 114.0930 44.0721 0.0000 172.3335 138 P 4.6061 0.0000 0.0000 64.2487 31.5022 176.6043 139 N 4.7858 8.2377 115.4334 53.0212 39.0537 175.0154 140 G 3.8564 8.4378 106.7039 46.6167 0.0000 173.0763 141 F 5.2299 7.7743 116.6691 55.2371 42.7881 175.4464 142 C 5.0325 9.1546 119.6945 57.5616 37.9085 173.2003 143 G 3.9756 8.6461 107.6687 45.7650 0.0000 173.9603 144 S 4.3933 8.6943 115.2214 58.9283 62.8361 174.6400 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 3 V 8.05 3.85 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 0.88 0.00 0.00 0.85 0.00 0.00 4 I 8.32 4.16 1.75 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 1.48 0.81 0.93 0.00 0.00 5 N 8.26 5.06 0.00 2.77 2.83 0.00 0.00 5.87 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 6 T 7.69 4.57 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 7 F 8.35 4.18 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 8 D 8.34 4.60 0.00 2.77 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 9 G 8.27 3.65 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 0.00 0.00 0.00 10 V 8.27 3.71 2.17 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 0.88 0.00 0.00 1.09 0.00 0.00 11 A 8.28 4.09 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.43 4.31 0.00 2.82 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 13 Y 8.29 3.97 0.00 3.27 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 14 L 8.49 4.17 0.00 1.96 1.86 0.60 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.05 3.88 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.70 0.00 16 T 7.56 3.62 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 -0.10 0.00 0.00 17 Y 7.72 4.35 0.00 2.66 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 18 H 8.24 3.48 0.00 3.03 3.28 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.32 4.75 0.00 1.95 1.87 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.66 1.69 7.81 20 L 8.32 4.15 0.00 1.68 1.49 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 3.86 0.00 2.15 1.09 0.00 3.59 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.51 0.00 22 D 8.30 4.64 0.00 2.64 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 23 N 7.90 4.63 0.00 2.68 2.88 0.00 0.00 6.12 7.57 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 24 Y 7.75 5.14 0.00 3.05 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 I 8.59 4.98 1.87 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 1.31 1.22 0.90 0.00 0.00 26 T 9.16 4.66 4.51 0.00 0.00 0.00 0.00 0.00 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 27 K 9.19 3.96 0.00 1.97 2.21 0.00 1.85 0.00 0.00 1.80 0.00 0.00 3.25 0.00 0.00 3.62 0.00 0.00 0.00 0.00 1.55 1.74 7.81 28 S 8.14 4.45 0.00 3.92 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 29 E 8.29 3.99 0.00 2.21 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 2.37 2.38 0.00 30 A 8.53 4.05 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 31 Q 9.14 4.49 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.79 0.00 32 A 8.22 4.09 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 33 L 7.77 4.31 0.00 1.85 1.76 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.82 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 0.00 0.00 0.00 0.00 35 W 8.77 4.49 0.00 3.33 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 36 V 8.81 3.82 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 0.76 0.00 0.00 0.89 0.00 0.00 37 A 7.74 3.57 0.97 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 38 S 7.75 4.54 0.00 4.04 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 0.00 39 K 8.00 4.11 0.00 1.84 1.87 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.34 7.81 40 G 7.53 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 0.00 0.00 0.00 41 N 7.99 5.09 0.00 2.90 3.02 0.00 0.00 6.36 6.67 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 42 L 8.25 3.88 0.00 1.24 1.59 0.43 0.30 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 43 A 8.04 4.31 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 44 D 8.07 4.41 0.00 2.91 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 45 V 7.72 3.82 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 0.73 0.00 0.00 1.11 0.00 0.00 46 A 8.20 4.64 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 47 P 0.00 4.54 0.00 2.03 2.00 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 48 G 8.80 3.85 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 0.00 0.00 0.00 49 K 7.72 4.73 0.00 1.67 1.61 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.60 1.49 7.81 50 S 8.34 4.58 0.00 2.96 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 51 I 7.94 4.23 1.67 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.12 0.83 0.00 0.00 52 G 9.40 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 53 G 9.63 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.07 4.75 0.00 2.70 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 55 I 8.37 4.22 1.87 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 1.22 0.72 0.93 0.00 0.00 56 F 9.12 4.88 0.00 3.10 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 S 8.09 3.97 0.00 3.80 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 58 N 5.77 3.70 0.00 2.80 2.70 0.00 0.00 7.02 7.53 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 59 R 7.77 3.82 0.00 1.68 1.90 0.00 3.14 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 60 E 8.11 4.07 0.00 2.08 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 2.40 2.32 0.00 61 G 7.90 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 62 K 7.45 4.11 0.00 1.93 2.08 0.00 1.97 0.00 0.00 2.01 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.48 7.81 63 L 7.16 3.86 0.00 0.75 0.13 -0.73 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.33 0.00 2.30 2.14 0.00 3.13 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 65 G 8.35 4.21 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 0.00 66 K 7.96 4.46 0.00 1.75 1.56 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.40 7.81 67 S 8.55 4.22 0.00 3.85 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 68 G 8.91 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 69 R 7.71 4.07 0.00 1.62 1.88 0.00 3.24 0.00 0.00 2.49 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.00 0.00 70 T 8.21 4.72 4.14 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 1.13 0.00 0.00 71 W 8.50 5.08 0.00 3.47 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 72 R 8.75 5.21 0.00 0.67 1.32 0.00 2.95 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.28 0.00 73 E 8.92 5.52 0.00 2.15 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 0.00 2.46 2.37 0.00 74 A 8.86 5.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.28 4.95 0.00 2.69 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 76 I 8.39 4.37 1.32 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.91 -0.10 0.00 0.00 77 N 8.79 4.60 0.00 2.80 2.88 0.00 0.00 6.92 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 78 Y 7.40 4.28 0.00 2.85 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 79 T 7.38 3.94 4.02 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 1.06 0.00 0.00 80 S 6.42 4.27 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 81 G 8.54 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 F 8.61 4.43 0.00 3.13 3.09 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 83 R 8.67 4.25 0.00 1.94 1.90 0.00 3.13 0.00 0.00 3.50 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.63 0.00 84 N 8.48 4.95 0.00 2.86 2.97 0.00 0.00 5.99 7.64 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 85 S 8.58 4.66 0.00 3.77 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 86 D 8.54 5.55 0.00 2.90 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 87 R 9.13 5.03 0.00 1.59 1.79 0.00 3.53 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.01 0.00 88 I 8.91 4.97 2.09 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 1.49 1.86 1.07 0.00 0.00 89 L 9.42 5.62 0.00 1.63 1.54 0.42 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 9.21 5.66 0.00 2.96 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 91 S 8.28 4.16 0.00 2.78 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 92 S 7.97 3.41 0.00 3.73 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 93 D 7.34 4.62 0.00 2.76 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 94 W 7.37 3.65 0.00 3.66 3.44 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 95 L 7.68 4.56 0.00 1.73 2.00 1.07 0.70 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 96 I 8.71 5.43 2.01 0.00 0.00 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 1.42 1.29 1.11 0.00 0.00 97 Y 9.87 5.42 0.00 2.75 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 98 K 9.32 5.31 0.00 1.28 1.66 0.00 0.63 0.00 0.00 1.23 0.00 0.00 2.25 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.09 7.81 99 T 9.02 4.82 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 1.00 0.00 0.00 100 T 8.69 5.28 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 0.00 101 D 7.09 4.67 0.00 2.79 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 0.00 102 A 8.57 3.03 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 0.00 103 Y 7.50 3.41 0.00 3.25 3.40 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 0.00 104 Q 7.67 4.16 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 105 T 8.10 4.70 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 1.17 0.00 0.00 106 F 8.47 5.19 0.00 2.90 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 0.00 107 T 8.91 4.69 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 1.13 0.00 0.00 108 K 8.61 3.27 0.00 0.93 1.40 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.14 0.75 7.81 109 I 8.55 4.50 1.85 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.90 0.84 0.00 0.00 110 R 7.56 4.73 0.00 1.79 1.85 0.00 3.32 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 111 S 8.72 4.76 0.00 3.78 3.85 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 0.00 112 S 8.92 4.58 0.00 3.90 3.83 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 0.00 113 S 8.72 4.60 0.00 4.00 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 0.00 114 M 7.77 4.30 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.75 0.00 115 G 9.05 3.94 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 0.00 116 V 7.67 3.95 2.17 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 0.88 0.00 0.00 0.92 0.00 0.00 117 C 8.51 4.59 0.00 3.14 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 0.00 118 P 0.00 4.38 0.00 1.90 1.76 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 119 K 8.14 4.28 0.00 1.66 1.70 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.49 7.81 120 I 7.33 4.56 1.83 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.71 0.94 0.00 0.00 121 L 8.58 4.27 0.00 1.60 1.64 0.69 0.54 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 0.00 122 K 8.54 4.67 0.00 1.91 1.61 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.51 7.81 123 K 8.60 4.25 0.00 1.48 1.37 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.46 1.18 7.81 124 C 8.70 4.82 0.00 3.06 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 0.00 125 R 9.28 4.12 0.00 1.73 1.96 0.00 3.12 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.47 0.00 126 R 7.58 4.69 0.00 1.92 1.97 0.00 2.96 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 127 D 8.69 4.38 0.00 2.72 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 0.00 128 S 7.90 4.32 0.00 3.97 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 0.00 129 D 8.01 4.47 0.00 2.81 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 0.00 130 C 7.66 4.88 0.00 3.03 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 0.00 131 L 8.04 4.09 0.00 1.57 1.38 0.74 0.88 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 0.00 132 A 7.94 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.95 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 0.00 134 C 7.53 5.21 0.00 2.94 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 0.00 135 V 8.78 4.71 2.18 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 0.68 0.00 0.00 0.98 0.00 0.00 136 C 9.51 4.69 0.00 2.99 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 0.00 137 G 8.70 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 0.00 138 P 0.00 4.61 0.00 2.21 2.19 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 139 N 8.24 4.79 0.00 2.82 3.03 0.00 0.00 7.05 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 0.00 140 G 8.44 3.86 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 0.00 0.00 0.00 141 F 7.77 5.23 0.00 3.00 2.90 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 0.00 0.00 0.00 0.00 142 C 9.15 5.03 0.00 2.89 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 0.00 143 G 8.65 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 0.00 0.00 0.00 144 S 8.69 4.39 0.00 3.86 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