NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8990 8.3549 109.7439 45.8259 0.0000 172.7799 2 S 4.5109 8.3489 117.9659 55.8643 64.7171 170.9626 3 S 4.6737 8.2367 115.0493 57.9042 67.7409 175.3963 4 G 3.6766 9.0002 110.5311 46.0184 0.0000 176.5471 5 S 4.4709 8.9204 114.3859 55.8020 61.5495 171.8678 6 S 4.1536 8.1774 118.2063 58.2646 63.3899 174.6411 7 G 4.1132 8.1913 113.8374 44.5000 0.0000 173.9001 8 K 4.2572 7.4798 117.0724 55.7314 33.5922 178.2912 9 I 3.5962 7.5989 123.9616 64.2505 36.9891 176.1457 10 S 4.4989 6.9035 112.6845 57.9032 66.8597 173.3219 11 N 5.0811 8.4573 115.2545 52.6305 37.4542 176.2545 12 I 3.7438 7.9718 114.6052 64.3783 37.4218 176.4389 13 F 5.3657 7.6208 116.9495 56.9825 39.0098 174.9756 14 E 4.5332 8.7532 122.0049 57.4365 29.7922 176.4252 15 D 4.4134 8.7980 124.1162 54.6308 38.5855 173.8106 16 V 4.2366 7.7187 118.0391 62.0290 32.9976 174.5848 17 E 4.8260 8.5912 128.8436 56.4021 31.3357 175.1696 18 F 5.1492 9.3966 122.4785 56.2164 44.1793 173.1135 19 C 4.9863 8.8840 121.6554 57.7764 34.2000 172.5128 20 V 4.5928 8.5319 126.8009 62.2151 31.8061 175.0065 21 M 4.4214 8.6385 127.6250 57.2073 32.8280 176.6021 22 S 4.6068 7.8156 110.1302 57.2892 65.8197 173.5793 23 G 4.8488 8.3947 114.9483 44.6982 0.0000 170.9350 24 T 4.7022 8.3564 111.6141 59.4886 71.4107 173.2313 25 D 4.3732 8.3361 120.4008 57.5040 41.2520 178.1162 26 S 4.2567 8.1090 115.7850 61.2822 63.3478 175.2417 27 Q 4.5468 7.6244 119.1195 53.0091 30.9145 173.8430 28 P 4.7345 0.0000 0.0000 61.9492 32.1399 176.8377 29 K 3.8033 8.8063 120.2520 59.5776 31.8976 176.9442 30 P 5.0764 0.0000 0.0000 63.0113 30.6474 177.3378 31 D 4.3875 8.5584 120.4787 57.9928 41.2443 178.4110 32 L 4.0268 7.4313 119.2061 57.4661 41.1094 178.9872 33 E 3.9203 8.2816 118.3186 59.7639 29.1602 179.2796 34 N 4.3180 7.9119 114.0049 56.7047 38.9909 177.0126 35 R 3.7823 7.5964 118.5572 59.3833 29.9958 179.0368 36 I 3.7099 8.4774 118.8620 64.6163 37.1434 177.6638 37 A 4.8538 7.6707 121.5250 55.0366 18.1929 179.5863 38 E 3.9628 8.5085 116.6442 58.8834 29.1337 178.3566 39 F 4.6532 8.9716 117.6252 57.1825 39.6164 175.8475 40 G 3.7416 8.4945 107.5679 47.2184 0.0000 173.8612 41 G 4.8605 8.0131 104.3003 44.3633 0.0000 171.7305 42 Y 5.0549 9.4088 122.2029 55.7818 41.1502 174.3603 43 I 5.0690 7.8884 126.4353 59.9336 39.6207 175.1716 44 V 4.5594 8.6793 121.0863 60.2159 34.3065 174.9797 45 Q 4.4148 8.8768 117.8323 57.3858 30.0100 175.7714 46 N 5.0352 7.8105 114.2680 50.5043 41.4043 171.9583 47 P 4.5301 0.0000 0.0000 62.8346 31.5012 176.1423 48 G 4.0806 8.9776 110.6887 44.2007 0.0000 171.1144 49 P 4.4239 0.0000 0.0000 64.8316 31.8311 176.1607 50 D 4.9768 7.2774 116.4239 54.2265 41.3138 175.9639 51 T 4.6660 7.6100 113.8100 61.5732 71.6858 173.5623 52 Y 4.3023 8.1006 128.7282 59.5455 39.0841 175.5438 53 C 4.8657 7.7763 110.8843 58.0454 33.0608 171.5637 54 V 4.8267 8.2886 118.5629 61.2941 34.2993 174.5821 55 I 5.0704 8.8617 126.2038 59.6056 39.7166 174.5954 56 A 4.9475 9.3112 129.4453 50.1899 20.9822 176.2331 57 G 3.7407 8.6466 110.0357 48.7428 0.0000 172.8737 58 S 4.6221 7.6419 112.4508 57.1998 65.5019 171.8265 59 E 4.4236 8.5483 120.7026 55.2618 30.0860 175.4587 60 N 5.0973 8.2314 119.7409 50.5747 42.5893 174.5690 61 I 3.6656 8.0174 118.6752 65.0231 36.6620 178.4439 62 R 3.9109 7.8685 118.6287 59.5734 30.3167 178.5668 63 V 3.6939 7.8261 117.1557 66.4089 31.3678 177.2353 64 K 3.7539 8.2934 118.8287 59.9448 31.9914 177.9665 65 N 4.1369 7.9721 116.2665 56.7536 38.4055 177.3657 66 I 3.7119 7.2375 119.4694 64.3099 37.3217 178.4126 67 I 3.6899 8.2031 120.9535 64.2324 36.7377 178.1439 68 L 3.9306 7.8676 117.9637 58.3025 41.5677 179.5273 69 S 4.1594 7.7935 112.7119 59.2921 63.1317 173.8512 70 N 4.2736 8.0514 118.8329 54.8863 37.8514 174.5219 71 K 4.3582 8.3003 115.4540 57.7156 34.2675 176.6290 72 H 4.8131 8.0326 113.8272 54.2290 31.0771 173.1961 73 D 5.1686 8.2926 118.5140 52.0305 42.3219 175.0697 74 V 4.6268 8.4865 121.6732 61.6426 33.7739 174.7237 75 V 4.7067 8.3543 125.6202 60.7656 35.1127 174.7801 76 K 4.7824 8.8794 125.6785 55.6957 32.5520 176.5828 77 P 4.1293 0.0000 0.0000 64.7326 32.1142 178.5638 78 A 3.7828 8.1617 121.7822 55.1499 18.1667 178.8241 79 W 3.2560 7.3295 126.5406 60.6201 30.4723 178.0905 80 L 2.8358 7.1559 118.1903 57.1102 40.9554 179.2808 81 L 3.9742 7.8717 119.2421 58.1397 41.6660 179.2571 82 E 4.0112 7.2578 118.0416 59.9748 29.2358 179.4603 83 C 4.1599 7.0951 117.5198 61.6095 27.9484 175.9770 84 F 4.2133 7.5504 119.0515 59.8988 38.5593 177.3086 85 K 4.2172 8.0012 118.4659 58.3556 32.3223 177.6953 86 T 4.3738 7.6168 106.8592 60.1626 69.9926 174.2137 87 K 4.1102 8.2615 120.6784 57.0809 30.3892 174.4409 88 S 4.5752 7.2626 111.1473 57.0934 67.1526 174.1322 89 F 4.4066 8.4866 124.6187 56.9907 37.5887 174.5497 90 V 3.9352 7.7891 126.0818 61.5155 32.1954 174.0553 91 P 4.7588 0.0000 0.0000 62.1375 31.9707 176.2657 92 W 4.5687 9.0731 121.6457 57.5577 29.7957 175.3226 93 Q 4.8879 8.4981 119.3492 53.2946 31.9789 174.6946 94 P 4.2122 0.0000 0.0000 64.6262 31.6455 177.4427 95 R 4.1211 7.4251 114.4353 57.3618 30.5665 177.6206 96 F 4.7108 7.5458 117.3294 60.0517 39.5837 175.9265 97 M 4.1498 7.5224 119.5346 55.3451 32.1253 176.1969 98 I 4.1464 8.3371 124.0445 62.4475 39.0326 176.0839 99 H 4.6816 7.5990 119.3372 54.7616 32.5646 171.5935 100 M 4.8652 8.0123 125.7254 52.9680 35.3708 174.9125 101 C 3.9393 8.6671 118.1610 57.4905 30.1123 173.0602 102 P 4.3450 0.0000 0.0000 64.6067 31.1423 177.0637 103 S 4.4399 7.9368 112.6792 59.8642 63.4266 175.0585 104 T 4.4076 7.7297 116.1690 65.2870 69.1589 176.3798 105 K 3.9854 8.3872 122.2225 59.5870 31.7116 178.2524 106 E 3.9466 8.3074 117.2759 59.9636 29.2120 178.5040 107 H 4.1324 8.2393 118.7656 59.0454 29.8930 177.2723 108 F 4.1860 8.4431 118.8457 60.3019 38.6067 176.9697 109 A 3.8506 8.0492 119.7295 55.4846 18.3756 179.6373 110 R 4.0265 7.6568 114.7689 59.5239 29.9684 178.8127 111 E 3.9542 7.4840 115.4613 59.9085 29.5805 178.6934 112 Y 4.1452 8.0765 115.1506 61.1499 38.1410 176.2461 113 D 4.5608 7.8864 121.3482 54.6478 41.3033 175.6980 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 G 8.35 3.90 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 0.00 0.00 0.00 2 S 8.35 4.51 0.00 3.96 3.82 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 3 S 8.24 4.67 0.00 3.94 3.82 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 4 G 9.00 3.68 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 0.00 0.00 0.00 5 S 8.92 4.47 0.00 3.83 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 6 S 8.18 4.15 0.00 3.87 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 7 G 8.19 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 0.00 0.00 0.00 0.00 8 K 7.48 4.26 0.00 1.71 1.82 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.43 7.81 9 I 7.60 3.60 0.61 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 1.01 0.10 0.59 0.00 0.00 10 S 6.90 4.50 0.00 3.76 3.71 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 11 N 8.46 5.08 0.00 2.93 2.98 0.00 0.00 5.66 7.74 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 12 I 7.97 3.74 1.77 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.36 0.87 0.00 0.00 13 F 7.62 5.37 0.00 3.48 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.75 4.53 0.00 2.07 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 2.39 2.29 0.00 15 D 8.80 4.41 0.00 2.92 2.79 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 16 V 7.72 4.24 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 1.04 0.00 0.00 17 E 8.59 4.83 0.00 2.14 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 2.47 2.60 0.00 18 F 9.40 5.15 0.00 3.15 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 19 C 8.88 4.99 0.00 3.11 2.84 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 0.00 0.00 0.00 20 V 8.53 4.59 2.29 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 0.95 0.00 0.00 0.98 0.00 0.00 21 M 8.64 4.42 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 22 S 7.82 4.61 0.00 3.81 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 23 G 8.39 4.85 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 24 T 8.36 4.70 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 25 D 8.34 4.37 0.00 2.67 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 26 S 8.11 4.26 0.00 3.86 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 27 Q 7.62 4.55 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 28 P 0.00 4.73 0.00 2.21 2.17 0.00 3.92 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 29 K 8.81 3.80 0.00 1.88 1.87 0.00 1.73 0.00 0.00 1.97 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.47 7.81 30 P 0.00 5.08 0.00 2.20 2.12 0.00 3.31 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 31 D 8.56 4.39 0.00 2.84 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 32 L 7.43 4.03 0.00 1.56 1.73 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 33 E 8.28 3.92 0.00 1.98 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 2.42 2.62 0.00 34 N 7.91 4.32 0.00 2.76 2.81 0.00 0.00 7.05 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 35 R 7.60 3.78 0.00 1.48 0.66 0.00 2.36 0.00 0.00 2.71 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.24 0.00 36 I 8.48 3.71 1.71 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.71 0.10 0.00 0.00 37 A 7.67 4.85 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.51 3.96 0.00 2.25 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 2.29 2.52 0.00 39 F 8.97 4.65 0.00 3.56 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 40 G 8.49 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 0.00 0.00 0.00 41 G 8.01 4.86 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 42 Y 9.41 5.05 0.00 3.20 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 43 I 7.89 5.07 1.80 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 1.36 1.26 0.93 0.00 0.00 44 V 8.68 4.56 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 0.99 0.00 0.00 1.09 0.00 0.00 45 Q 8.88 4.41 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 46 N 7.81 5.04 0.00 2.65 2.67 0.00 0.00 6.99 7.69 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 47 P 0.00 4.53 0.00 1.98 2.03 0.00 3.75 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 1.88 1.90 0.00 48 G 8.98 4.08 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 0.00 0.00 0.00 49 P 0.00 4.42 0.00 2.20 2.21 0.00 3.76 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 2.00 1.96 0.00 50 D 7.28 4.98 0.00 2.61 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 51 T 7.61 4.67 4.46 0.00 0.00 0.00 0.00 0.00 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 52 Y 8.10 4.30 0.00 2.86 2.93 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 53 C 7.78 4.87 0.00 3.31 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 54 V 8.29 4.83 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 1.02 0.00 0.00 0.97 0.00 0.00 55 I 8.86 5.07 1.95 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 1.37 0.99 1.03 0.00 0.00 56 A 9.31 4.95 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 57 G 8.65 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 0.00 0.00 0.00 58 S 7.64 4.62 0.00 3.78 3.73 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 59 E 8.55 4.42 0.00 1.98 1.85 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 2.24 2.30 0.00 60 N 8.23 5.10 0.00 2.76 2.68 0.00 0.00 7.12 7.25 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 61 I 8.02 3.67 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 1.63 1.15 0.91 0.00 0.00 62 R 7.87 3.91 0.00 1.77 2.01 0.00 3.25 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 63 V 7.83 3.69 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 0.96 0.00 0.00 1.02 0.00 0.00 64 K 8.29 3.75 0.00 2.08 1.87 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.49 7.81 65 N 7.97 4.14 0.00 2.92 2.87 0.00 0.00 7.16 6.92 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 66 I 7.24 3.71 2.03 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 1.48 0.28 0.87 0.00 0.00 67 I 8.20 3.69 1.94 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 1.35 0.77 0.72 0.00 0.00 68 L 7.87 3.93 0.00 1.71 1.74 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.79 4.16 0.00 4.02 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 70 N 8.05 4.27 0.00 2.79 2.85 0.00 0.00 7.07 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 71 K 8.30 4.36 0.00 1.87 1.87 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.40 7.81 72 H 8.03 4.81 0.00 3.09 3.29 0.00 5.83 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.29 5.17 0.00 2.59 2.66 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 74 V 8.49 4.63 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 0.78 0.00 0.00 0.90 0.00 0.00 75 V 8.35 4.71 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 0.45 0.00 0.00 0.38 0.00 0.00 76 K 8.88 4.78 0.00 1.90 1.80 0.00 1.97 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.67 7.81 77 P 0.00 4.13 0.00 2.23 2.32 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 78 A 8.16 3.78 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 79 W 7.33 3.26 0.00 2.36 3.14 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 0.00 80 L 7.16 2.84 0.00 1.52 1.19 0.82 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.87 3.97 0.00 1.75 1.71 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 82 E 7.26 4.01 0.00 1.78 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 2.31 2.66 0.00 83 C 7.10 4.16 0.00 2.19 2.49 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 84 F 7.55 4.21 0.00 2.97 2.92 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 85 K 8.00 4.22 0.00 1.77 1.82 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.51 7.81 86 T 7.62 4.37 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 1.25 0.00 0.00 87 K 8.26 4.11 0.00 1.94 2.05 0.00 2.05 0.00 0.00 2.22 0.00 0.00 3.31 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.49 1.61 7.81 88 S 7.26 4.58 0.00 3.83 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 89 F 8.49 4.41 0.00 3.05 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 90 V 7.79 3.94 2.13 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 1.28 0.00 0.00 0.94 0.00 0.00 91 P 0.00 4.76 0.00 2.44 2.23 0.00 4.08 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 92 W 9.07 4.57 0.00 3.46 3.23 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 93 Q 8.50 4.89 0.00 1.84 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.01 0.00 0.00 0.00 0.00 0.00 2.44 2.73 0.00 94 P 0.00 4.21 0.00 2.24 2.33 0.00 3.70 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 1.87 1.84 0.00 95 R 7.43 4.12 0.00 1.70 1.86 0.00 2.73 0.00 0.00 2.70 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.50 0.00 96 F 7.55 4.71 0.00 3.00 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 97 M 7.52 4.15 0.00 1.51 1.54 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.25 0.00 98 I 8.34 4.15 1.80 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 1.14 0.67 0.87 0.00 0.00 99 H 7.60 4.68 0.00 3.09 3.02 0.00 5.80 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 0.00 100 M 8.01 4.87 0.00 1.92 1.78 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 101 C 8.67 3.94 0.00 3.10 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 0.00 102 P 0.00 4.34 0.00 2.19 2.20 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 103 S 7.94 4.44 0.00 3.85 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 0.00 104 T 7.73 4.41 4.34 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 1.51 0.00 0.00 105 K 8.39 3.99 0.00 1.93 1.85 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.52 7.81 106 E 8.31 3.95 0.00 2.24 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 0.00 2.58 2.42 0.00 107 H 8.24 4.13 0.00 3.31 3.59 0.00 5.78 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 0.00 108 F 8.44 4.19 0.00 3.33 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 0.00 109 A 8.05 3.85 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 0.00 110 R 7.66 4.03 0.00 2.01 1.97 0.00 3.14 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 111 E 7.48 3.95 0.00 2.34 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 0.00 2.20 2.35 0.00 112 Y 8.08 4.15 0.00 3.15 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 0.00 113 D 7.89 4.56 0.00 2.66 2.79 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