NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4688 8.3049 120.3277 55.4600 33.5037 175.0070 2 E 3.8921 8.9682 123.1457 58.0297 30.4852 174.9520 3 T 3.2503 7.9106 109.5257 62.8540 67.6378 170.4857 4 I 4.9564 8.0208 119.3207 59.2636 40.8014 173.7426 5 A 5.0066 8.6430 123.5200 50.1992 22.2784 175.1429 6 K 4.9101 8.4451 117.6907 55.6157 36.4358 175.2272 7 H 4.8131 9.3865 121.7164 54.7804 31.7394 172.5981 8 R 4.6179 8.6371 124.9953 55.9414 31.4858 176.7027 9 H 4.2009 9.0272 118.4069 55.7407 26.3271 174.4801 10 A 3.5956 7.3085 120.7282 51.7002 18.9146 179.0790 11 R 4.3074 8.0639 123.1383 55.0865 28.0753 174.1639 12 S 4.6008 7.3119 115.0507 56.8378 67.0238 175.3839 13 S 3.9852 8.7597 115.5482 61.0856 62.4083 172.9169 14 A 4.3588 7.8250 129.4973 49.9808 16.0883 178.8818 15 Q 3.9948 7.7488 118.9524 58.8463 28.8415 179.7831 16 K 4.1200 8.5942 117.4185 59.5814 32.5411 179.6078 17 V 3.5841 7.8466 118.0751 65.9992 31.4850 175.9470 18 R 4.4445 8.9002 121.5418 55.8398 28.1398 176.5124 19 L 5.5370 7.9870 134.2141 55.9472 41.6264 175.8737 20 V 3.7203 6.8941 115.4776 66.0569 31.3571 177.7139 21 A 3.9685 8.2509 120.6701 55.4300 17.8924 179.1100 22 D 4.4172 8.0822 115.4741 56.7493 41.1148 178.3274 23 L 4.1469 7.9233 119.5934 57.4425 41.8743 178.7393 24 I 4.0808 7.5514 119.5128 61.9527 37.3663 176.3026 25 R 4.0174 7.5902 119.8113 57.8438 30.1428 176.5105 26 G 3.9283 8.8320 112.9820 45.6202 0.0000 173.4290 27 K 4.4143 7.6512 119.4650 54.6063 33.8157 176.1732 28 K 4.3582 8.4664 120.2999 56.5469 32.9102 178.2749 29 V 3.4911 8.6290 125.1170 66.8522 31.5346 177.2881 30 S 3.9072 8.3646 110.6400 62.8029 61.9511 175.9187 31 Q 3.9727 8.4904 121.3823 59.5723 29.1001 177.4987 32 A 3.7656 8.8790 119.7563 55.5036 18.2306 179.3602 33 L 3.8769 8.3821 114.7839 57.8149 41.9185 179.6140 34 D 4.4314 7.6408 116.7424 57.5378 40.9556 178.3956 35 I 3.8775 8.0690 120.0222 64.8174 37.1449 178.0929 36 L 3.9973 8.0138 119.2615 58.4928 41.3041 179.9125 37 T 3.8526 7.6907 113.9345 66.3604 68.4820 175.4501 38 Y 4.5269 7.6865 115.8828 58.0306 38.3607 175.4068 39 T 4.5245 7.5220 117.6824 62.2551 69.9224 175.7856 40 N 4.7508 8.4926 127.1209 51.4100 37.4731 174.0460 41 K 4.5963 7.4765 118.6292 53.2588 36.7414 177.4598 42 K 3.9588 9.0335 123.8837 59.8873 31.8083 178.4906 43 A 3.9566 8.0244 120.1786 54.9351 18.2675 178.9750 44 A 3.9547 8.3753 119.6235 55.6482 18.3368 180.3656 45 V 3.5431 7.7214 110.1166 64.3547 31.6330 178.2611 46 L 3.9954 7.6441 119.0768 58.2160 41.5266 180.1762 47 V 3.6731 7.9214 118.4753 64.1706 31.4743 178.2013 48 K 3.8505 8.3581 120.7132 59.5194 32.0750 178.6755 49 K 3.8170 8.2967 118.9329 59.4666 31.9023 179.3862 50 V 3.5792 7.2518 117.6283 65.5330 31.6269 177.4032 51 L 3.8627 8.3869 120.5585 58.6885 41.8371 178.8253 52 E 3.9951 8.4753 118.3461 59.5960 29.3868 179.5115 53 S 4.0636 8.0629 112.8943 61.0428 62.3286 175.9141 54 A 3.9146 8.5370 123.8165 55.4117 18.1205 179.3592 55 I 3.5336 8.1670 118.2910 65.4649 37.1948 177.4565 56 A 4.0147 8.5198 120.7959 54.2603 17.9415 180.0386 57 N 3.9714 8.4305 112.2509 55.3762 38.9223 176.9229 58 A 3.9686 8.9177 123.5900 55.3972 18.2341 179.3123 59 E 3.9466 8.2459 116.3255 59.8708 29.9933 178.4391 60 H 4.2701 8.5900 117.1203 58.3585 29.9793 175.8908 61 N 4.9351 8.1768 116.0686 54.8270 40.6213 174.4401 62 D 4.6119 8.0331 122.1666 53.2062 42.1491 174.9253 63 G 3.4802 8.1067 105.7655 46.9580 0.0000 177.1070 64 A 3.6769 7.5445 124.9195 50.5819 16.6315 177.3680 65 D 4.3229 8.6115 106.2063 55.4090 38.5707 174.9675 66 I 4.0666 7.7230 112.9728 61.9567 38.5662 178.0615 67 D 4.4678 7.9673 120.6880 57.1777 40.6943 177.0020 68 D 4.7694 7.6881 119.9533 51.0201 38.5222 173.4075 69 L 4.7692 7.7253 127.6273 54.6013 45.9934 173.9035 70 K 5.1186 9.5766 126.0150 54.5477 36.1914 176.1534 71 V 4.1688 8.7826 124.2777 60.9992 29.9209 176.5219 72 T 4.0986 8.2407 119.4861 64.7825 69.9853 175.2185 73 K 4.8013 8.1858 121.0182 54.7821 36.7590 175.5241 74 I 4.9732 8.2813 124.0155 60.0540 40.9879 173.5429 75 F 4.9426 8.0616 121.2601 55.9411 41.4704 173.1076 76 V 4.6135 8.6937 121.2206 60.1273 33.5298 174.4200 77 D 5.2442 8.7106 124.4656 52.1561 44.1449 175.0992 78 E 4.4852 8.7483 119.8833 56.0620 30.7550 176.6725 79 G 3.9168 8.6510 112.6577 43.7445 0.0000 171.0145 80 P 4.6602 0.0000 0.0000 63.1538 32.6623 175.2956 81 S 5.0892 8.2918 115.5996 56.8124 65.7308 173.9412 82 M 4.2545 8.8561 125.1678 55.2332 32.8589 175.3532 83 K 4.8722 8.6516 123.6293 55.1773 33.8651 175.8840 84 R 4.9248 8.3547 124.3975 54.4664 33.6291 174.6718 85 I 5.0768 8.1480 117.9615 59.2672 41.6823 175.0873 86 M 4.6680 8.3464 123.0785 53.0575 35.1519 172.6273 87 P 4.6635 0.0000 0.0000 62.9253 31.8790 175.7146 88 R 4.7749 9.0654 123.8177 53.5979 34.3485 174.0519 89 A 3.9876 8.6677 123.5528 53.8946 18.8300 177.4548 90 K 3.7521 9.4155 119.2862 57.6318 29.4445 178.1433 91 G 4.0356 7.8873 105.2822 45.7401 0.0000 175.1447 92 R 4.0885 7.6890 119.5962 56.4414 30.9448 175.5168 93 A 5.1023 8.6074 125.2666 50.6284 21.1220 175.7060 94 D 4.5808 8.6323 121.0713 53.1268 43.9518 175.7988 95 R 4.1330 8.7959 118.1255 54.9977 31.4171 172.2748 96 I 3.0780 7.5397 115.2876 60.2228 39.0847 172.2717 97 L 4.7582 8.3686 124.2173 52.6775 43.7312 176.4776 98 K 4.2526 9.1398 125.8663 56.0333 32.6457 176.8111 99 R 4.9790 8.5204 124.5312 55.0679 32.1900 176.1846 100 T 5.2134 7.9211 109.3257 59.0094 72.6197 172.7663 101 S 5.0022 9.0415 119.6406 57.2919 66.5082 173.3394 102 H 4.8808 9.2870 121.8392 54.6794 29.1435 173.8993 103 I 4.2774 8.7052 125.4474 60.9131 38.9387 175.2803 104 T 4.8166 8.0115 122.4621 61.6115 72.0427 172.9789 105 V 4.7002 8.7517 126.4908 60.9527 34.9263 174.3687 106 V 4.8985 9.1099 127.1050 61.0467 34.6128 174.3917 107 V 5.0129 8.6586 127.3606 60.3173 33.9493 175.1125 108 S 4.7885 8.6636 119.2126 57.4792 66.0216 173.5738 109 D 4.8753 8.9656 116.3489 53.1019 40.6899 175.3175 110 R 4.1598 7.6757 124.6844 56.6656 30.3511 174.4043 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 M 8.30 4.47 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 2 E 8.97 3.89 0.00 2.05 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 2.29 2.37 0.00 3 T 7.91 3.25 4.55 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 1.26 0.00 0.00 4 I 8.02 4.96 2.02 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 1.34 0.98 0.94 0.00 0.00 5 A 8.64 5.01 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 6 K 8.45 4.91 0.00 1.82 1.61 0.00 1.48 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.26 1.38 7.81 7 H 9.39 4.81 0.00 3.10 3.14 0.00 5.57 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.64 4.62 0.00 1.64 1.44 0.00 3.24 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.58 0.00 9 H 9.03 4.20 0.00 3.38 3.49 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.31 3.60 1.06 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 11 R 8.06 4.31 0.00 1.71 1.91 0.00 3.18 0.00 0.00 3.16 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 12 S 7.31 4.60 0.00 3.82 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 S 8.76 3.99 0.00 4.01 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 14 A 7.83 4.36 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 15 Q 7.75 3.99 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 16 K 8.59 4.12 0.00 1.85 1.83 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.37 7.81 17 V 7.85 3.58 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 1.06 0.00 0.00 0.91 0.00 0.00 18 R 8.90 4.44 0.00 2.12 1.91 0.00 3.38 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 19 L 7.99 5.54 0.00 1.79 1.85 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 20 V 6.89 3.72 2.23 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 1.04 0.00 0.00 0.97 0.00 0.00 21 A 8.25 3.97 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.08 4.42 0.00 2.67 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 23 L 7.92 4.15 0.00 1.78 1.74 0.97 1.13 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 24 I 7.55 4.08 2.02 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 1.42 1.08 0.92 0.00 0.00 25 R 7.59 4.02 0.00 1.79 1.88 0.00 3.32 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 26 G 8.83 3.93 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 0.00 27 K 7.65 4.41 0.00 1.94 1.74 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.69 1.55 7.81 28 K 8.47 4.36 0.00 1.80 1.75 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.50 7.81 29 V 8.63 3.49 2.27 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 1.00 0.00 0.00 0.94 0.00 0.00 30 S 8.36 3.91 0.00 3.93 3.81 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 31 Q 8.49 3.97 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.41 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 32 A 8.88 3.77 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 33 L 8.38 3.88 0.00 2.07 1.79 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.64 4.43 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 35 I 8.07 3.88 2.01 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 1.54 0.97 0.94 0.00 0.00 36 L 8.01 4.00 0.00 2.02 1.76 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.69 3.85 4.62 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 0.54 0.00 0.00 38 Y 7.69 4.53 0.00 2.87 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 39 T 7.52 4.52 4.52 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 1.22 0.00 0.00 40 N 8.49 4.75 0.00 2.72 2.78 0.00 0.00 6.93 7.61 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 41 K 7.48 4.60 0.00 1.72 1.63 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.36 7.81 42 K 9.03 3.96 0.00 1.85 1.84 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.60 7.81 43 A 8.02 3.96 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 A 8.38 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.72 3.54 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 0.89 0.00 0.00 0.93 0.00 0.00 46 L 7.64 4.00 0.00 1.82 1.76 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.92 3.67 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 0.90 0.00 0.00 0.91 0.00 0.00 48 K 8.36 3.85 0.00 2.02 1.94 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.62 7.81 49 K 8.30 3.82 0.00 2.08 1.84 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.45 7.81 50 V 7.25 3.58 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 0.76 0.00 0.00 0.93 0.00 0.00 51 L 8.39 3.86 0.00 1.74 1.83 0.92 1.25 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 52 E 8.48 4.00 0.00 2.22 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 2.55 0.00 53 S 8.06 4.06 0.00 4.02 3.93 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 54 A 8.54 3.91 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 55 I 8.17 3.53 1.99 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 1.46 0.92 0.92 0.00 0.00 56 A 8.52 4.01 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 57 N 8.43 3.97 0.00 2.98 2.85 0.00 0.00 7.08 7.40 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 58 A 8.92 3.97 1.37 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 59 E 8.25 3.95 0.00 1.97 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 2.33 2.32 0.00 60 H 8.59 4.27 0.00 3.16 3.31 0.00 5.76 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.18 4.94 0.00 3.03 2.84 0.00 0.00 6.78 7.60 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 62 D 8.03 4.61 0.00 2.69 2.44 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 63 G 8.11 3.48 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 0.00 64 A 7.54 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.61 4.32 0.00 2.85 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 66 I 7.72 4.07 1.88 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 1.42 0.98 0.92 0.00 0.00 67 D 7.97 4.47 0.00 2.88 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 68 D 7.69 4.77 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 69 L 7.73 4.77 0.00 1.85 1.51 0.93 0.76 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 70 K 9.58 5.12 0.00 1.72 1.76 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.39 7.81 71 V 8.78 4.17 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 0.92 0.00 0.00 0.98 0.00 0.00 72 T 8.24 4.10 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 1.27 0.00 0.00 73 K 8.19 4.80 0.00 1.83 1.84 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.59 7.81 74 I 8.28 4.97 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 1.58 0.43 0.95 0.00 0.00 75 F 8.06 4.94 0.00 3.11 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 76 V 8.69 4.61 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 0.77 0.00 0.00 0.93 0.00 0.00 77 D 8.71 5.24 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 78 E 8.75 4.49 0.00 1.94 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 0.00 2.26 2.30 0.00 79 G 8.65 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 80 P 0.00 4.66 0.00 2.14 2.24 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 81 S 8.29 5.09 0.00 3.73 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 82 M 8.86 4.25 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 83 K 8.65 4.87 0.00 1.63 1.73 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.57 7.81 84 R 8.35 4.92 0.00 1.67 1.84 0.00 3.27 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 85 I 8.15 5.08 1.87 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 1.21 1.26 0.94 0.00 0.00 86 M 8.35 4.67 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 87 P 0.00 4.66 0.00 1.97 1.98 0.00 3.67 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 2.02 2.08 0.00 88 R 9.07 4.77 0.00 1.88 1.73 0.00 3.17 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 89 A 8.67 3.99 1.26 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 90 K 9.42 3.75 0.00 1.99 1.90 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.42 7.81 91 G 7.89 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 92 R 7.69 4.09 0.00 1.92 1.88 0.00 3.28 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 93 A 8.61 5.10 1.20 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 94 D 8.63 4.58 0.00 2.63 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 95 R 8.80 4.13 0.00 1.74 1.83 0.00 3.44 0.00 0.00 3.28 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 96 I 7.54 3.08 1.87 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 1.41 0.33 0.91 0.00 0.00 97 L 8.37 4.76 0.00 1.51 1.63 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.14 4.25 0.00 1.68 1.76 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.42 7.81 99 R 8.52 4.98 0.00 1.68 1.83 0.00 3.14 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 100 T 7.92 5.21 4.49 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 1.28 0.00 0.00 101 S 9.04 5.00 0.00 3.69 3.74 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 0.00 0.00 0.00 102 H 9.29 4.88 0.00 3.13 3.18 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.71 4.28 1.84 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 1.19 0.35 0.83 0.00 0.00 104 T 8.01 4.82 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 0.93 0.00 0.00 105 V 8.75 4.70 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 0.92 0.00 0.00 0.88 0.00 0.00 106 V 9.11 4.90 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 0.99 0.00 0.00 1.01 0.00 0.00 107 V 8.66 5.01 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 0.79 0.00 0.00 1.00 0.00 0.00 108 S 8.66 4.79 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.97 4.88 0.00 2.73 3.06 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 0.00 110 R 7.68 4.16 0.00 1.86 1.77 0.00 3.29 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00