NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.5133 8.0600 117.2331 56.1513 31.5938 173.5702 3 V 4.5477 8.3392 120.5739 60.8953 34.2876 172.8632 4 D 4.8342 9.5550 129.1676 52.9388 42.9176 174.5198 5 Q 5.2617 8.6706 125.6996 54.5523 30.7184 174.7035 6 T 4.9198 8.8865 116.1342 59.2142 72.6860 172.0161 7 P 4.8461 0.0000 0.0000 62.2261 32.8280 176.2429 8 Q 4.4507 8.5233 117.0602 58.6394 29.6879 176.7105 9 R 5.2353 7.7672 115.2928 54.6745 34.6517 175.0241 10 I 4.6786 8.8359 122.2444 60.0568 41.5957 174.1718 11 T 5.1586 8.6446 122.9170 61.7881 71.0194 173.5635 12 K 4.8140 9.1166 124.4947 54.7038 37.3186 175.3488 13 E 4.6761 10.1714 122.5601 55.3750 31.3640 176.4978 14 T 4.0693 7.8497 119.2688 65.7911 68.9128 174.6105 15 G 3.9610 8.9001 114.8160 45.1416 0.0000 173.3075 16 E 4.4580 7.9015 119.2800 55.7100 31.8754 175.2461 17 S 5.3549 8.4324 115.1514 56.9930 66.8189 173.3867 18 L 4.9095 8.6166 120.5423 54.6626 44.2383 175.3241 19 T 4.9726 8.2184 115.0428 61.9972 72.5937 173.3910 20 I 4.6307 8.4071 125.8846 59.4012 40.7486 173.9702 21 N 5.5370 9.2926 124.8138 52.0354 42.0647 172.4462 22 C 5.4716 9.1954 122.2038 54.9638 41.1128 173.2804 23 V 4.8668 8.5096 122.4699 59.8059 34.0984 174.7688 24 V 4.2909 8.8515 125.9492 62.3290 31.7689 176.7780 25 R 4.4720 8.6943 130.6495 54.3581 28.1965 174.5912 26 D 4.6088 7.7163 118.9015 52.7538 44.4960 175.3121 27 S 4.3474 8.7537 120.9152 60.1161 63.9057 175.2623 28 R 4.2752 8.1787 119.2420 58.3611 30.7881 177.5155 29 C 4.5253 8.5788 114.6191 56.6270 40.8920 174.0441 30 V 4.1287 8.0310 116.0142 60.1721 32.8390 175.1894 31 L 4.4885 8.1589 122.9037 53.9133 42.9202 175.7022 32 S 4.4126 8.7546 122.9725 60.8932 63.7860 173.9742 33 T 4.2203 7.1181 111.3803 61.9142 70.4361 171.3294 34 G 3.2338 7.3661 107.0697 45.2944 0.0000 171.8896 35 Y 5.0535 8.4119 116.6533 55.8267 42.6128 174.8605 36 W 5.4428 8.4496 119.5381 55.3212 33.6881 174.0131 37 Y 5.3328 9.3324 119.6175 56.3075 42.2159 174.2021 38 R 4.6355 9.0612 122.7757 54.2909 33.3398 174.0231 39 K 4.9331 8.8372 128.2952 53.5733 33.5281 174.1147 40 P 4.6410 0.0000 0.0000 61.7086 32.7474 174.4116 41 P 4.4204 0.0000 0.0000 64.3520 31.6266 177.2997 42 G 3.9502 9.0408 110.2524 45.4517 0.0000 172.6091 43 S 4.7942 7.7843 112.7709 56.4214 65.9419 174.1467 44 R 4.2304 8.4027 118.0605 56.9036 30.6550 176.2815 45 N 4.9489 7.7150 116.2630 51.5412 40.2348 174.0086 46 E 4.7626 8.6571 121.8912 55.0722 31.8038 175.1659 47 E 4.9541 8.9769 120.3507 54.3551 34.0132 175.5205 48 S 4.5932 8.9742 118.0574 59.0939 63.7784 173.7639 49 I 4.5409 8.4546 123.8462 59.5976 39.9163 175.0797 50 S 5.4856 8.1627 118.8410 55.8306 66.2160 172.7624 51 D 4.5063 9.0820 119.6287 53.5641 41.2670 175.0388 52 G 4.3947 9.8289 120.8839 45.9199 0.0000 171.8448 53 G 3.8571 7.9858 113.4435 46.7667 0.0000 177.1618 54 R 3.9010 8.5019 126.2945 57.5910 30.2509 174.7831 55 Y 5.0424 7.8370 117.3076 56.4333 39.9194 174.8316 56 V 4.7856 9.1738 124.5245 61.2659 34.4744 173.9319 57 E 5.1754 9.8422 128.2203 55.3154 32.0847 175.4182 58 T 4.9250 9.0304 119.2589 61.8053 72.7453 172.9104 59 V 4.6718 8.6047 125.4789 61.1964 34.1222 174.5981 60 N 4.8088 9.3977 127.5313 51.6256 39.3445 174.8827 61 R 3.9516 8.6202 125.0655 58.8491 30.7044 179.7019 62 G 3.6266 8.1978 105.5248 48.4178 0.0000 174.2779 63 S 4.4099 8.4637 113.4646 57.7681 63.5843 173.9691 64 K 3.9151 7.9345 120.0381 57.7771 30.1186 174.4947 65 S 5.5912 8.0532 111.3922 56.8875 66.9880 173.1447 66 F 5.5345 8.9384 114.4256 56.2125 41.4239 173.2678 67 S 5.2908 9.8884 115.8324 56.9622 67.8134 172.6035 68 L 4.6504 8.0231 124.4808 53.0509 44.5181 174.8678 69 R 4.8809 8.8980 127.0160 54.5520 32.8122 174.4707 70 I 4.8663 8.5149 126.6492 59.7225 39.8744 174.7751 71 N 4.9396 8.6939 124.5695 50.8115 40.6446 174.3304 72 D 4.3167 8.4050 117.0405 55.1097 38.4363 174.5894 73 L 4.2826 7.9249 118.8415 55.4748 42.7479 177.1421 74 T 5.0367 8.8567 110.6413 59.6567 72.3816 175.1210 75 V 3.8486 8.4888 114.2659 64.6791 31.5113 178.9694 76 K 4.0664 7.5892 116.7132 58.8488 31.8767 177.3747 77 D 4.7940 8.2498 117.6218 54.8950 41.2202 177.0974 78 S 4.4617 8.0636 116.1322 58.1301 63.6214 174.8200 79 G 3.9686 7.5057 109.6177 45.1064 0.0000 170.8996 80 T 5.1410 8.0552 116.8817 62.1357 70.6112 173.6690 81 Y 5.2905 9.1140 124.2109 56.4662 40.7555 175.1279 82 R 5.4906 9.3223 121.6742 54.7063 34.7355 172.1714 83 C 4.7706 8.8782 115.9852 53.8591 45.7761 172.3839 84 K 4.8385 8.8147 121.2242 54.2612 34.9439 173.9603 85 P 4.3427 0.0000 0.0000 62.3794 32.9311 174.9994 86 E 4.5555 8.5831 121.6772 54.4872 32.4016 174.4738 87 S 4.8044 8.6830 121.2464 56.6069 64.0487 173.4946 88 R 3.9874 8.6644 126.4349 55.5673 30.9374 175.6990 89 Y 4.8004 6.9455 116.0217 55.9239 40.1641 175.0100 90 G 3.7802 8.3440 109.8442 46.9756 0.0000 174.5683 91 S 4.7599 7.5643 115.4106 55.5583 65.2646 173.3383 92 Y 4.1381 8.5092 122.4133 57.6647 39.0710 175.1715 93 D 4.2905 6.6543 124.7223 51.6057 43.8337 176.0445 94 A 3.5043 8.0000 129.7643 54.7202 18.4030 179.2152 95 V 3.3960 7.4262 116.6799 66.5612 31.4573 177.7872 96 C 4.3087 7.9478 113.9423 59.4631 34.8301 175.3109 97 A 4.3343 8.0634 124.1959 54.6700 17.9790 179.6284 98 A 3.9894 7.9713 119.0508 55.0306 18.3875 179.5011 99 L 3.9299 7.7985 118.6822 58.3881 41.9169 178.6554 100 N 4.6733 7.9311 114.5137 55.0136 38.5459 175.2503 101 D 4.6581 7.7190 118.8835 54.0528 41.9880 176.3811 102 Q 4.5215 7.7540 119.5351 54.8878 30.1203 174.3967 103 Y 4.9394 8.2097 117.5097 55.6148 41.3018 176.0148 104 G 3.8701 8.6324 111.6254 45.5596 0.0000 174.4176 105 G 3.6404 8.4978 108.2818 46.4678 0.0000 175.0029 106 G 4.1354 8.6794 105.6428 45.6395 0.0000 173.0984 107 T 4.7592 8.9561 116.1254 61.5543 72.4472 173.3723 108 V 4.4600 9.0898 128.0294 62.1151 32.8467 174.6405 109 V 4.8032 9.2287 129.4351 61.6346 33.5924 174.3881 110 T 4.8507 9.0808 125.1818 61.8279 70.9695 173.1889 111 V 4.7562 8.5745 127.5377 61.1167 33.0741 175.1448 112 N 4.7729 9.2080 126.0084 52.5646 39.8405 174.9276 113 A 4.3505 8.5648 123.2766 51.9151 19.3471 177.2723 114 A 4.1438 8.5289 121.9272 51.9459 19.4457 177.9559 115 A 4.3341 8.3170 121.0922 52.3453 19.3391 177.0792 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 R 8.06 4.51 0.00 1.92 2.14 0.00 3.04 0.00 0.00 3.30 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.49 0.00 3 V 8.34 4.55 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 0.80 0.00 0.00 0.95 0.00 0.00 4 D 9.55 4.83 0.00 2.58 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 5.26 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 6 T 8.89 4.92 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 1.22 0.00 0.00 7 P 0.00 4.85 0.00 2.35 2.10 0.00 3.75 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 1.98 1.96 0.00 8 Q 8.52 4.45 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 9 R 7.77 5.24 0.00 1.64 1.78 0.00 3.17 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 10 I 8.84 4.68 1.86 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 1.20 0.72 0.88 0.00 0.00 11 T 8.64 5.16 4.24 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 0.00 0.00 1.21 0.00 0.00 12 K 9.12 4.81 0.00 1.57 1.61 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.50 7.81 13 E 10.17 4.68 0.00 1.85 1.84 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 2.38 2.42 0.00 14 T 7.85 4.07 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 1.20 0.00 0.00 15 G 8.90 3.96 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 0.00 0.00 0.00 16 E 7.90 4.46 0.00 2.03 1.88 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 2.28 2.41 0.00 17 S 8.43 5.35 0.00 3.68 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 18 L 8.62 4.91 0.00 1.60 1.61 0.62 0.51 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 19 T 8.22 4.97 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 1.16 0.00 0.00 20 I 8.41 4.63 1.36 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.65 1.10 0.00 0.00 21 N 9.29 5.54 0.00 2.78 2.63 0.00 0.00 6.76 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 22 C 9.20 5.47 0.00 1.73 2.22 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 23 V 8.51 4.87 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 0.86 0.00 0.00 0.99 0.00 0.00 24 V 8.85 4.29 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 0.78 0.00 0.00 1.04 0.00 0.00 25 R 8.69 4.47 0.00 1.72 1.88 0.00 3.38 0.00 0.00 3.16 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 26 D 7.72 4.61 0.00 2.56 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 27 S 8.75 4.35 0.00 4.02 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 28 R 8.18 4.28 0.00 1.95 1.98 0.00 3.17 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 29 C 8.58 4.53 0.00 2.92 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 30 V 8.03 4.13 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 0.68 0.00 0.00 0.94 0.00 0.00 31 L 8.16 4.49 0.00 1.56 1.54 0.75 0.99 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 32 S 8.75 4.41 0.00 3.82 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 33 T 7.12 4.22 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 0.80 0.00 0.00 34 G 7.37 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 0.00 0.00 0.00 35 Y 8.41 5.05 0.00 2.88 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 36 W 8.45 5.44 0.00 3.40 3.16 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 0.00 37 Y 9.33 5.33 0.00 3.17 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 38 R 9.06 4.64 0.00 1.28 1.55 0.00 2.92 0.00 0.00 2.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 0.00 39 K 8.84 4.93 0.00 1.77 1.75 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.22 7.81 40 P 0.00 4.64 0.00 2.10 1.95 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 41 P 0.00 4.42 0.00 2.04 2.01 0.00 3.73 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 2.05 2.11 0.00 42 G 9.04 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 43 S 7.78 4.79 0.00 3.94 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 44 R 8.40 4.23 0.00 1.79 1.98 0.00 3.17 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 45 N 7.71 4.95 0.00 2.65 2.70 0.00 0.00 6.50 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.66 4.76 0.00 1.99 1.88 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 2.02 2.18 0.00 47 E 8.98 4.95 0.00 1.93 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 2.23 2.26 0.00 48 S 8.97 4.59 0.00 3.77 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 49 I 8.45 4.54 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.91 0.17 0.00 0.00 50 S 8.16 5.49 0.00 4.00 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 51 D 9.08 4.51 0.00 2.86 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 52 G 9.83 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 53 G 7.99 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 54 R 8.50 3.90 0.00 1.36 1.81 0.00 3.13 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.50 0.00 55 Y 7.84 5.04 0.00 3.25 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 56 V 9.17 4.79 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 1.02 0.00 0.00 0.92 0.00 0.00 57 E 9.84 5.18 0.00 1.97 1.96 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 2.33 2.32 0.00 58 T 9.03 4.92 4.29 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 1.25 0.00 0.00 59 V 8.60 4.67 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 0.72 0.00 0.00 0.89 0.00 0.00 60 N 9.40 4.81 0.00 2.77 2.72 0.00 0.00 6.82 7.67 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 61 R 8.62 3.95 0.00 1.91 1.95 0.00 3.16 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.61 0.00 62 G 8.20 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 0.00 0.00 0.00 63 S 8.46 4.41 0.00 3.91 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 64 K 7.93 3.92 0.00 2.02 1.90 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.37 7.81 65 S 8.05 5.59 0.00 4.01 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 66 F 8.94 5.53 0.00 3.39 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 67 S 9.89 5.29 0.00 3.72 3.69 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 68 L 8.02 4.65 0.00 0.27 0.13 0.68 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.90 4.88 0.00 1.79 1.78 0.00 3.03 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.61 0.00 70 I 8.51 4.87 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.42 0.75 0.00 0.00 71 N 8.69 4.94 0.00 2.50 2.66 0.00 0.00 7.01 7.87 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 72 D 8.40 4.32 0.00 2.73 2.67 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 0.00 0.00 0.00 0.00 73 L 7.92 4.28 0.00 1.70 1.58 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.86 5.04 4.24 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 0.00 0.00 1.25 0.00 0.00 75 V 8.49 3.85 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 0.82 0.00 0.00 0.94 0.00 0.00 76 K 7.59 4.07 0.00 1.81 1.92 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.44 7.81 77 D 8.25 4.79 0.00 2.82 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 78 S 8.06 4.46 0.00 3.97 3.91 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 79 G 7.51 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 0.00 0.00 0.00 80 T 8.06 5.14 4.24 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 0.00 0.00 1.32 0.00 0.00 81 Y 9.11 5.29 0.00 3.06 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 82 R 9.32 5.49 0.00 2.06 2.02 0.00 3.33 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 83 C 8.88 4.77 0.00 2.01 1.18 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 84 K 8.81 4.84 0.00 1.76 1.90 0.00 1.28 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.24 1.00 7.81 85 P 0.00 4.34 0.00 2.04 2.07 0.00 3.89 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 2.10 1.99 0.00 86 E 8.58 4.56 0.00 2.08 1.60 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 0.00 2.12 2.21 0.00 87 S 8.68 4.80 0.00 3.87 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 88 R 8.66 3.99 0.00 1.74 1.64 0.00 3.12 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 1.47 1.45 0.00 89 Y 6.95 4.80 0.00 3.29 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 90 G 8.34 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 0.00 0.00 0.00 91 S 7.56 4.76 0.00 4.06 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 92 Y 8.51 4.14 0.00 2.89 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 93 D 6.65 4.29 0.00 2.32 1.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.00 3.50 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.43 3.40 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 0.96 0.00 0.00 0.84 0.00 0.00 96 C 7.95 4.31 0.00 2.64 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 97 A 8.06 4.33 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 98 A 7.97 3.99 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.80 3.93 0.00 1.75 1.90 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.93 4.67 0.00 2.96 2.88 0.00 0.00 6.97 9.28 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 0.00 101 D 7.72 4.66 0.00 2.81 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 0.00 102 Q 7.75 4.52 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 103 Y 8.21 4.94 0.00 2.91 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 0.00 104 G 8.63 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 0.00 0.00 0.00 105 G 8.50 3.64 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 0.00 0.00 0.00 106 G 8.68 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 0.00 0.00 0.00 0.00 107 T 8.96 4.76 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 1.29 0.00 0.00 108 V 9.09 4.46 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 0.95 0.00 0.00 0.98 0.00 0.00 109 V 9.23 4.80 2.46 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 0.95 0.00 0.00 0.91 0.00 0.00 110 T 9.08 4.85 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 1.23 0.00 0.00 111 V 8.57 4.76 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 0.78 0.00 0.00 0.95 0.00 0.00 112 N 9.21 4.77 0.00 2.79 2.71 0.00 0.00 6.45 6.68 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 0.00 113 A 8.56 4.35 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 0.00 114 A 8.53 4.14 1.25 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 0.00 0.00 0.00 115 A 8.32 4.33 1.22 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