NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3716 0.0000 0.0000 61.8497 32.6295 175.9550 3 K 3.8487 8.7564 121.1835 56.0058 32.6244 175.0739 4 K 4.0463 9.0947 127.0987 56.8467 34.0011 175.5419 5 V 5.3899 8.2426 125.6032 60.4892 33.0133 174.2375 6 L 4.5981 8.0777 127.7200 53.3571 44.3282 175.5890 7 T 4.7367 8.1748 118.1675 62.0234 70.8755 173.8343 8 G 4.1655 8.7504 112.5146 45.7062 0.0000 171.4696 9 V 4.9044 8.6535 119.1395 59.7071 34.0017 175.3776 10 V 4.2350 8.3143 123.0948 62.9656 32.0740 176.5372 11 V 4.3573 8.4324 120.5579 61.2328 33.2276 175.8253 12 S 4.6708 7.5081 114.0115 56.9384 65.7704 174.5117 13 D 5.0033 8.5591 126.3499 53.3304 39.7553 176.0069 14 K 4.3804 7.8848 117.5369 57.7178 32.5488 176.6361 15 M 4.7117 7.5382 119.4676 53.0421 34.5026 175.0365 16 Q 4.1907 8.6784 122.3471 57.0377 29.1395 176.0802 17 K 4.7324 9.4846 121.3565 57.0022 30.3037 175.0423 18 T 5.2144 7.8147 113.5415 62.1107 72.7074 173.9371 19 V 5.1121 8.3794 117.7376 58.6597 35.7182 175.0245 20 T 4.5199 8.5764 122.3356 63.3687 69.9787 173.5014 21 V 4.6427 8.9078 126.8828 60.8635 34.1648 174.0978 22 L 4.6520 9.1213 131.6642 54.6247 43.4580 175.5417 23 V 4.6495 9.0024 125.8794 61.2680 34.5039 174.4943 24 E 5.2759 8.6736 126.8256 55.1804 32.0866 175.4639 25 R 4.6741 8.6379 115.2362 55.5999 32.9056 174.0847 26 Q 4.8885 8.5713 121.8443 54.5396 31.2506 174.7030 27 F 4.7507 8.1166 113.2743 55.5921 41.4497 171.3863 28 P 4.5941 0.0000 0.0000 62.7063 31.7910 175.5266 29 H 4.4486 8.8910 124.3893 55.2210 30.2899 174.3692 30 P 4.2815 0.0000 0.0000 65.2160 31.0479 176.6626 31 L 4.3864 7.9907 117.0753 55.5969 44.0585 176.1382 32 Y 4.5729 7.9802 113.0069 57.3382 37.9252 175.5395 33 G 4.1477 7.2543 114.0972 46.2264 0.0000 173.2222 34 K 4.3076 7.1573 118.7551 52.4238 33.7816 174.7026 35 V 3.9679 8.4401 128.4136 62.5424 31.2291 175.3794 36 I 4.0320 7.8701 122.7844 60.2014 39.8764 175.2369 37 K 4.7492 8.1513 123.0389 55.6306 33.5538 175.2234 38 R 4.8394 8.5185 126.4033 55.0045 33.1314 175.0919 39 S 5.0212 8.3172 113.8732 57.9862 66.2904 173.0034 40 K 4.6198 9.2113 119.8662 55.2782 35.8258 174.2287 41 K 5.0277 8.5506 125.4369 55.3557 33.7377 175.3441 42 Y 4.6665 9.1011 122.8251 56.0806 41.0012 174.9951 43 L 4.7531 8.7649 123.9484 54.0837 42.3707 176.1687 44 A 4.9635 8.7120 126.5085 50.8748 21.6724 174.9026 45 H 5.0239 9.0531 120.0124 55.3441 31.7748 173.9402 46 D 5.1091 9.2031 125.2714 51.3263 41.1828 173.7703 47 P 4.1950 0.0000 0.0000 64.4725 31.8485 177.8577 48 E 4.4400 8.1497 117.2916 55.2485 29.5802 176.9957 49 E 3.8003 8.1291 115.6321 57.0541 28.2752 175.6111 50 K 3.9693 8.1169 120.3027 59.3917 32.3206 176.0980 51 Y 4.3630 8.0441 115.2032 57.1533 38.9606 174.9158 52 K 4.5691 9.8664 123.2293 53.6927 35.2208 175.2864 53 L 4.0531 8.3610 121.9579 57.9250 41.9245 176.4796 54 G 4.0917 8.3673 113.0521 45.2483 0.0000 172.4276 55 D 4.8635 8.2489 120.7890 53.8500 42.6123 175.4591 56 V 4.6932 8.8572 123.4190 61.6448 33.3652 175.1290 57 V 4.8737 8.5880 119.9747 59.6840 36.5610 173.9670 58 E 4.8682 8.3979 121.3355 55.1679 31.2984 175.5623 59 I 4.8248 9.3657 125.2125 59.5501 40.5780 174.4971 60 I 5.2572 8.5505 124.3336 58.8758 41.7280 174.2907 61 E 3.5867 9.3601 127.8657 57.4606 29.6894 176.7635 62 S 4.7197 8.0216 118.9798 56.1475 67.4127 173.9926 63 R 3.8245 8.6371 122.0832 55.7999 30.2829 174.1212 64 P 4.1808 0.0000 0.0000 62.8974 31.2222 175.6918 65 I 3.9912 8.6502 125.8587 63.3782 37.8422 175.7686 66 S 4.5036 7.3244 112.4086 56.8517 65.3798 173.3729 67 K 4.1557 8.2776 121.5992 57.6933 32.2433 177.0061 68 R 4.0072 8.7634 123.5901 56.1288 29.9892 175.6478 69 K 4.6651 7.8980 118.3738 55.1450 32.5047 175.1671 70 R 4.8083 8.4244 125.0625 55.4124 32.4110 174.8602 71 F 5.3627 8.2277 116.0379 56.1536 43.9495 173.6543 72 R 5.1656 8.6988 118.6595 54.3132 34.4145 175.4100 73 V 3.9421 7.9513 122.2631 62.3627 30.8719 175.6537 74 L 4.2130 8.7297 131.4429 57.7780 41.9948 177.1023 75 R 4.7159 7.4155 112.5618 55.5147 32.5449 171.4461 76 L 4.7949 8.5634 120.8430 54.0746 43.2840 177.1680 77 V 4.0347 8.9914 127.5344 65.3170 32.5959 175.0355 78 E 4.9359 7.8430 116.2486 56.7325 32.4460 174.5079 79 S 4.7129 8.6884 113.5896 58.5282 65.5242 174.4321 80 G 3.9223 8.7648 106.5346 46.6087 0.0000 175.7467 81 R 4.4318 7.5090 122.4554 54.8503 27.5913 176.7905 82 M 4.3633 7.9984 121.3922 56.7268 32.1532 177.2997 83 D 4.4555 8.0618 120.0015 56.6319 39.4486 178.5858 84 L 4.0044 7.5326 119.3892 57.1939 41.5525 179.6065 85 V 3.6368 7.7789 117.6676 66.0166 31.4795 177.4417 86 E 3.9632 8.9929 119.2959 59.7392 29.4020 179.0368 87 K 3.8024 8.0022 117.9389 60.0867 32.3237 178.1181 88 Y 4.1710 8.1282 119.0351 61.1316 38.6762 178.5766 89 L 3.7586 8.1672 119.6738 57.8848 41.4857 179.7688 90 I 3.6517 7.8734 119.6093 64.1308 37.0050 178.0312 91 R 3.9029 7.7912 119.7186 59.8546 29.6312 178.3950 92 R 3.1691 7.2597 117.4909 59.0420 29.7163 178.2031 93 Q 3.9050 7.6981 118.7253 58.9846 29.1122 177.3375 94 N 4.4413 9.4757 116.8851 57.4613 39.3084 175.7220 95 Y 4.2074 8.6071 117.3853 61.9220 37.9543 178.8553 96 E 4.3617 8.3091 114.3262 57.1712 29.1457 177.9990 97 S 5.0901 8.3951 113.2941 57.9849 64.0390 173.9148 98 L 4.7996 7.3730 122.6968 55.4750 44.5492 175.2345 99 S 3.5176 8.5034 114.6158 60.7736 63.2920 172.1517 100 K 4.3058 8.5619 117.2931 57.4360 32.2766 177.0712 101 R 4.5453 7.4428 115.6050 55.6190 31.3847 177.6545 102 G 4.3925 8.0815 107.9855 47.6608 0.0000 172.3335 103 G 4.2621 8.1797 116.2890 46.5553 0.0000 173.7107 104 K 4.1733 7.9912 119.5462 54.8127 32.9737 176.9933 105 A 4.1612 8.5487 125.2455 52.5259 18.2842 177.0652 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 2 P 0.00 4.37 0.00 2.20 2.13 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 3 K 8.76 3.85 0.00 1.76 2.02 0.00 1.75 0.00 0.00 1.96 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.49 7.81 4 K 9.09 4.05 0.00 1.94 1.93 0.00 1.49 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.45 7.81 5 V 8.24 5.39 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 1.01 0.00 0.00 1.00 0.00 0.00 6 L 8.08 4.60 0.00 1.01 1.17 0.15 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.17 4.74 4.17 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 1.20 0.00 0.00 8 G 8.75 4.17 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 0.00 0.00 0.00 9 V 8.65 4.90 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 0.67 0.00 0.00 0.91 0.00 0.00 10 V 8.31 4.23 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 0.98 0.00 0.00 0.94 0.00 0.00 11 V 8.43 4.36 1.58 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 0.28 0.00 0.00 0.57 0.00 0.00 12 S 7.51 4.67 0.00 3.88 3.63 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 13 D 8.56 5.00 0.00 2.76 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 14 K 7.88 4.38 0.00 1.74 1.89 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.57 7.81 15 M 7.54 4.71 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 16 Q 8.68 4.19 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 17 K 9.48 4.73 0.00 2.01 1.91 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.37 7.81 18 T 7.81 5.21 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 1.33 0.00 0.00 19 V 8.38 5.11 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 1.15 0.00 0.00 0.89 0.00 0.00 20 T 8.58 4.52 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 21 V 8.91 4.64 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 0.79 0.00 0.00 0.89 0.00 0.00 22 L 9.12 4.65 0.00 1.49 1.38 0.95 0.77 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 23 V 9.00 4.65 2.09 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 0.95 0.00 0.00 0.74 0.00 0.00 24 E 8.67 5.28 0.00 1.89 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 2.26 2.30 0.00 25 R 8.64 4.67 0.00 1.97 2.04 0.00 2.74 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 1.59 1.85 0.00 26 Q 8.57 4.89 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.96 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 27 F 8.12 4.75 0.00 3.17 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 28 P 0.00 4.59 0.00 2.06 2.10 0.00 3.89 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 29 H 8.89 4.45 0.00 3.35 3.28 0.00 5.61 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.28 0.00 2.17 2.20 0.00 3.36 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 1.78 1.91 0.00 31 L 7.99 4.39 0.00 1.31 1.13 0.76 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.98 4.57 0.00 2.75 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 33 G 7.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.16 4.31 0.00 1.88 1.67 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.49 7.81 35 V 8.44 3.97 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 0.83 0.00 0.00 0.94 0.00 0.00 36 I 7.87 4.03 1.68 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.95 0.00 0.00 37 K 8.15 4.75 0.00 1.68 1.68 0.00 1.75 0.00 0.00 2.11 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.48 7.81 38 R 8.52 4.84 0.00 2.14 1.97 0.00 3.27 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 39 S 8.32 5.02 0.00 4.01 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 40 K 9.21 4.62 0.00 1.81 1.74 0.00 0.61 0.00 0.00 0.88 0.00 0.00 2.68 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.07 1.26 7.81 41 K 8.55 5.03 0.00 1.64 1.68 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.21 1.44 7.81 42 Y 9.10 4.67 0.00 2.62 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 43 L 8.76 4.75 0.00 1.77 1.69 0.94 0.82 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 44 A 8.71 4.96 1.23 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 45 H 9.05 5.02 0.00 3.27 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.20 5.11 0.00 2.79 2.51 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 47 P 0.00 4.19 0.00 2.24 2.25 0.00 3.80 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 48 E 8.15 4.44 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 49 E 8.13 3.80 0.00 2.08 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 2.22 2.22 0.00 50 K 8.12 3.97 0.00 1.46 1.46 0.00 1.09 0.00 0.00 1.36 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.64 1.14 7.81 51 Y 8.04 4.36 0.00 3.00 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 52 K 9.87 4.57 0.00 1.82 1.71 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.38 7.81 53 L 8.36 4.05 0.00 1.79 1.62 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.37 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 0.00 0.00 0.00 55 D 8.25 4.86 0.00 2.80 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 56 V 8.86 4.69 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 0.86 0.00 0.00 0.92 0.00 0.00 57 V 8.59 4.87 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 0.63 0.00 0.00 0.73 0.00 0.00 58 E 8.40 4.87 0.00 1.82 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 2.20 2.24 0.00 59 I 9.37 4.82 1.58 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.83 0.50 0.00 0.00 60 I 8.55 5.26 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.67 0.99 0.00 0.00 61 E 9.36 3.59 0.00 1.79 1.79 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 2.13 2.49 0.00 62 S 8.02 4.72 0.00 3.72 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 63 R 8.64 3.82 0.00 1.73 1.80 0.00 3.40 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 64 P 0.00 4.18 0.00 2.04 1.98 0.00 3.67 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 1.99 2.10 0.00 65 I 8.65 3.99 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.23 0.82 0.00 0.00 66 S 7.32 4.50 0.00 3.96 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 67 K 8.28 4.16 0.00 1.74 1.75 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.43 7.81 68 R 8.76 4.01 0.00 1.98 2.10 0.00 3.28 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 69 K 7.90 4.67 0.00 1.82 1.77 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.38 1.52 7.81 70 R 8.42 4.81 0.00 1.73 1.49 0.00 3.17 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.23 5.36 0.00 2.97 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 72 R 8.70 5.17 0.00 1.79 1.82 0.00 3.18 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 73 V 7.95 3.94 1.53 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 -0.36 0.00 0.00 0.67 0.00 0.00 74 L 8.73 4.21 0.00 1.74 1.67 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.42 4.72 0.00 1.94 2.05 0.00 2.98 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 76 L 8.56 4.79 0.00 1.84 1.66 1.21 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.99 4.03 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 0.81 0.00 0.00 0.91 0.00 0.00 78 E 7.84 4.94 0.00 2.02 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 2.15 2.19 0.00 79 S 8.69 4.71 0.00 4.01 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 80 G 8.76 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 81 R 7.51 4.43 0.00 1.90 2.09 0.00 3.34 0.00 0.00 3.32 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 82 M 8.00 4.36 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.71 0.00 83 D 8.06 4.46 0.00 2.87 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 84 L 7.53 4.00 0.00 1.77 1.76 0.91 0.81 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 85 V 7.78 3.64 2.25 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 1.22 0.00 0.00 1.00 0.00 0.00 86 E 8.99 3.96 0.00 2.20 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 2.57 2.52 0.00 87 K 8.00 3.80 0.00 2.07 1.92 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.66 7.81 88 Y 8.13 4.17 0.00 3.05 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 89 L 8.17 3.76 0.00 1.97 1.66 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.87 3.65 1.85 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 1.39 1.13 0.90 0.00 0.00 91 R 7.79 3.90 0.00 1.92 1.85 0.00 2.97 0.00 0.00 2.67 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 92 R 7.26 3.17 0.00 1.31 1.58 0.00 2.91 0.00 0.00 2.98 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.41 0.00 93 Q 7.70 3.90 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 94 N 9.48 4.44 0.00 3.01 3.15 0.00 0.00 7.25 7.42 0.00 0.00 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 Y 8.61 4.21 0.00 3.17 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 96 E 8.31 4.36 0.00 1.97 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 2.37 2.48 0.00 97 S 8.40 5.09 0.00 4.03 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 98 L 7.37 4.80 0.00 1.63 1.52 0.76 0.84 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 99 S 8.50 3.52 0.00 4.05 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 0.00 100 K 8.56 4.31 0.00 1.76 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.44 7.81 101 R 7.44 4.55 0.00 1.81 1.92 0.00 3.33 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 102 G 8.08 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 0.00 0.00 0.00 0.00 103 G 8.18 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 0.00 104 K 7.99 4.17 0.00 1.76 1.76 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.37 7.81 105 A 8.55 4.16 1.23 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