NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2050 8.2549 119.6875 56.5270 31.3818 175.4127 3 H 4.6090 8.7550 116.3863 55.1771 30.3040 171.5792 4 L 5.8098 9.3418 135.0000 55.8642 44.5499 173.8451 5 K 3.8482 7.9690 116.1964 56.6942 32.4144 175.9207 6 S 4.6417 7.6558 112.0291 56.5830 66.0654 173.3515 7 G 3.8523 8.3074 109.6701 44.4331 0.0000 173.4538 8 R 4.0033 8.3783 119.2740 55.4999 30.4835 176.4787 9 K 3.9711 8.3016 118.4198 57.6042 32.6651 176.7164 10 L 4.1563 7.7886 113.5274 54.5529 43.7387 173.9947 11 N 4.5296 8.5802 124.4041 53.3846 41.0411 174.8342 12 R 3.6214 12.0000 118.6787 56.2839 29.8163 175.1930 13 H 4.9146 7.6370 113.4471 54.2631 32.2726 174.8087 14 S 3.9743 8.5751 114.5322 62.2354 62.4411 176.7536 15 S 4.0745 8.0642 117.4666 60.8186 62.9129 175.6740 16 H 3.9720 8.0048 121.9917 58.5828 29.6108 176.5536 17 R 3.5853 8.0204 120.7772 59.3547 29.8001 178.0254 18 L 3.6805 7.7045 119.0856 58.2354 42.1704 178.5808 19 A 3.9226 8.4797 121.3598 55.8188 18.2910 178.6671 20 L 3.7834 8.4327 119.3055 58.0289 41.7452 178.3373 21 Y 4.2189 7.3620 117.8211 61.9186 38.2017 178.9013 22 R 4.0482 7.9914 118.3371 59.0790 30.2498 178.5026 23 N 4.1854 8.2944 115.2632 57.1096 38.7276 177.5397 24 Q 4.0638 8.3487 118.8394 58.5553 28.7092 178.6896 25 A 4.0425 8.4056 122.3207 55.1519 18.5016 179.4449 26 K 3.8578 8.2436 116.7084 60.1650 32.1239 179.3564 27 S 4.0924 8.0170 114.6024 61.4008 62.7112 176.5517 28 L 3.9980 8.2599 123.4496 58.1660 41.6606 178.9763 29 L 4.0335 8.3781 118.0462 58.0650 41.6241 179.3225 30 T 4.0042 7.9323 114.6495 66.4542 68.7787 175.5489 31 H 4.8799 8.3052 115.3015 54.7091 29.6924 177.1342 32 G 4.3484 8.8523 112.1537 45.9945 0.0000 173.9472 33 R 5.1653 8.3462 117.3939 54.4510 33.7191 174.8269 34 I 4.7842 8.6165 121.7903 59.7626 42.4715 173.6667 35 T 5.1482 8.4823 121.7523 62.3099 71.3083 173.3162 36 T 4.7222 8.4636 117.2991 60.7571 72.5011 173.2891 37 T 4.6616 8.4181 109.6602 60.8950 70.2297 175.2629 38 V 3.5508 8.6079 123.3126 66.1644 31.5628 176.1595 39 P 4.2099 0.0000 0.0000 66.1825 30.9684 178.5282 40 K 4.0406 7.9750 115.8557 59.9056 32.2676 178.7774 41 A 4.1026 8.6586 121.8215 54.2861 16.7251 179.7993 42 K 4.0370 8.5162 115.5704 59.4327 32.0331 178.8780 43 E 4.0563 8.1930 119.3303 58.9569 29.5749 178.3078 44 L 4.0148 8.3821 121.0401 58.0718 41.9930 178.7284 45 R 3.9730 7.4734 115.2272 59.8843 28.9952 179.0188 46 G 3.6545 7.9932 106.5696 46.8653 0.0000 175.0088 47 F 4.1517 7.7044 122.8394 60.3329 39.2493 177.3249 48 V 3.8449 7.9115 117.8937 65.2161 31.5934 177.2240 49 D 4.5614 8.3640 119.2826 57.9724 40.6739 178.4370 50 H 4.0995 7.9289 117.9648 59.4662 29.5414 177.0245 51 L 3.7918 6.9144 118.7374 58.1336 41.7784 178.9901 52 I 3.5043 8.0146 119.7601 64.5821 36.9964 177.5588 53 H 3.7758 8.6049 118.7401 59.6652 29.3306 177.1169 54 L 3.9071 8.1384 120.5420 57.7458 41.2417 179.2181 55 A 2.5800 7.4133 118.8063 53.2708 18.1518 179.2942 56 K 3.8079 7.3206 118.1259 58.7122 32.6534 177.7100 57 R 4.0931 6.6699 116.3135 56.3531 30.4687 176.7552 58 G 4.1846 8.4085 107.7346 45.5099 0.0000 174.3809 59 D 4.4217 8.1380 120.8996 53.8122 40.5828 176.9146 60 L 3.8342 8.7746 124.1760 58.8901 41.7831 178.2862 61 H 4.1028 8.5947 117.1989 59.4997 29.5975 176.7976 62 A 3.9637 8.2802 121.9386 55.8433 18.3429 178.7785 63 R 3.5463 7.9300 116.2036 60.1302 29.6570 178.4254 64 R 3.8824 8.3330 119.6649 59.4335 30.5176 178.4487 65 L 3.9772 8.2790 120.4018 58.4056 42.1089 179.1615 66 V 3.5745 8.3833 118.3325 66.0509 31.2349 178.0128 67 L 4.2454 8.0267 117.8675 57.1675 41.4214 179.1465 68 R 4.1228 7.9998 118.2563 59.0186 30.0808 176.6784 69 D 4.4972 8.1298 117.5866 55.1513 40.9507 176.8832 70 L 4.1544 8.2051 122.3508 55.9256 42.8859 177.0629 71 Q 4.4040 8.4481 120.1820 56.1790 31.1975 175.5614 72 D 4.5134 7.9570 117.5046 53.5239 41.7824 176.2390 73 V 3.5398 8.4238 127.3898 66.4485 31.5898 176.8560 74 K 3.7195 8.3827 118.1387 59.7827 31.7309 177.5716 75 L 3.8341 8.7804 119.6290 58.5492 42.0024 179.2931 76 V 3.6871 8.4411 117.9075 66.8173 31.4327 177.6832 77 R 4.1786 8.3225 117.1237 59.5713 29.8621 178.3274 78 K 3.8118 8.3359 118.5970 59.8271 32.2530 178.3839 79 L 3.9461 8.3015 120.4541 58.3166 41.8388 178.9915 80 F 3.8211 9.1088 117.3334 60.6416 39.0168 177.2796 81 D 4.5193 8.5464 117.1346 57.5075 40.9832 178.4682 82 E 4.1476 8.0012 117.1671 59.2573 30.0605 178.6080 83 I 3.9021 8.1025 119.8838 63.2125 37.3583 177.7407 84 A 3.8285 8.5154 121.5178 55.0353 18.0610 177.6441 85 P 4.0794 0.0000 0.0000 65.8950 31.5135 178.0746 86 R 3.8793 7.2721 115.4830 58.7610 31.6083 176.9358 87 Y 4.5409 7.6363 111.1149 57.1080 36.5667 176.8935 88 R 4.0834 9.4278 131.5110 58.6348 30.0872 175.4414 89 D 4.6886 7.9784 113.0038 54.1817 41.4032 175.7207 90 R 4.5030 7.8390 120.1922 54.5588 31.4689 175.6193 91 Q 4.2270 8.6753 127.0921 55.1117 27.9188 174.5202 92 G 3.2095 9.1479 116.2807 45.0338 0.0000 170.7928 93 G 3.5018 7.2321 103.5781 46.5596 0.0000 173.2594 94 Y 4.1573 6.2282 111.9971 57.6361 38.2094 176.1877 95 T 4.6781 7.1379 109.5160 62.1448 70.5896 172.0738 96 R 4.7351 9.0259 129.3300 54.4283 33.7562 174.2212 97 V 4.9727 8.3656 123.7482 61.1669 34.1229 174.4111 98 L 4.8249 8.5721 127.8087 52.5099 44.8384 176.2214 99 K 4.4565 8.7958 123.9274 56.5424 32.6543 176.3447 100 L 4.6255 8.4576 125.3790 53.1518 42.8317 176.8927 101 A 4.0689 8.4355 126.2512 53.0722 19.1840 175.7191 102 E 4.0977 8.9740 121.2802 56.9665 28.9536 174.8200 103 R 4.7579 8.0209 120.9877 53.7371 33.1691 176.0185 104 R 3.8866 8.1930 118.5919 57.1846 30.7598 178.2690 105 R 4.7012 8.4851 125.1175 53.9293 28.3898 175.6479 106 G 4.0701 7.0362 106.8514 45.9759 0.0000 171.6430 107 D 4.4981 8.5997 118.7633 52.7206 40.4313 176.8153 108 G 3.8084 8.7454 106.1072 46.1836 0.0000 174.0085 109 A 4.1827 8.1537 123.1396 51.1277 19.1863 175.9612 110 P 4.5512 0.0000 0.0000 63.2777 32.8578 175.4840 111 L 5.0623 8.2813 120.4674 53.3912 46.0392 174.6751 112 A 5.0641 8.5785 119.2437 50.9530 23.1465 175.9197 113 L 4.5122 8.8756 122.3004 54.7414 43.4142 176.5186 114 V 5.2058 9.1575 124.2340 60.4024 33.0244 174.1089 115 E 4.6156 8.4965 128.6820 55.5904 31.1629 176.4489 116 L 4.1271 8.6760 127.0350 58.7045 43.0137 175.4910 117 V 3.9054 7.5002 116.2150 60.4114 31.2845 169.7318 118 E 4.3074 8.6752 125.2892 56.2045 29.8506 174.8204 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 8.25 4.21 0.00 1.78 1.91 0.00 3.14 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 3 H 8.76 4.61 0.00 3.16 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.34 5.81 0.00 1.71 1.72 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.97 3.85 0.00 1.77 1.86 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.53 7.81 6 S 7.66 4.64 0.00 3.92 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 7 G 8.31 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 8 R 8.38 4.00 0.00 1.81 2.14 0.00 3.39 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 9 K 8.30 3.97 0.00 1.88 1.87 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.54 7.81 10 L 7.79 4.16 0.00 1.60 1.61 0.95 1.12 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 11 N 8.58 4.53 0.00 2.65 2.69 0.00 0.00 7.26 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 12 R 12.00 3.62 0.00 1.77 1.63 0.00 2.95 0.00 0.00 2.98 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.24 0.00 13 H 7.64 4.91 0.00 3.37 3.43 0.00 5.69 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.58 3.97 0.00 4.09 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 0.00 15 S 8.06 4.07 0.00 4.09 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 0.00 16 H 8.00 3.97 0.00 2.84 3.06 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.02 3.59 0.00 1.83 1.90 0.00 3.14 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.05 0.00 18 L 7.70 3.68 0.00 1.73 1.89 0.99 1.07 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 19 A 8.48 3.92 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 20 L 8.43 3.78 0.00 1.66 1.44 0.89 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.36 4.22 0.00 2.08 1.56 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 4.05 0.00 2.02 2.01 0.00 3.22 0.00 0.00 3.25 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.91 0.00 23 N 8.29 4.19 0.00 2.84 2.92 0.00 0.00 7.19 8.07 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 24 Q 8.35 4.06 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 25 A 8.41 4.04 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 0.00 0.00 0.00 0.00 0.00 26 K 8.24 3.86 0.00 2.01 1.94 0.00 1.70 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.64 7.81 27 S 8.02 4.09 0.00 4.06 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 L 8.26 4.00 0.00 1.94 1.71 0.97 0.63 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 29 L 8.38 4.03 0.00 1.76 1.75 0.97 1.12 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 30 T 7.93 4.00 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 0.98 0.00 0.00 31 H 8.31 4.88 0.00 3.30 3.27 0.00 5.72 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 32 G 8.85 4.35 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 0.00 33 R 8.35 5.17 0.00 1.63 1.81 0.00 3.13 0.00 0.00 3.49 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 34 I 8.62 4.78 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.37 0.94 0.00 0.00 35 T 8.48 5.15 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 36 T 8.46 4.72 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 1.29 0.00 0.00 37 T 8.42 4.66 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 1.21 0.00 0.00 38 V 8.61 3.55 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 1.06 0.00 0.00 1.03 0.00 0.00 39 P 0.00 4.21 0.00 2.20 2.12 0.00 3.57 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 2.13 2.22 0.00 40 K 7.98 4.04 0.00 1.91 1.91 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.48 7.81 41 A 8.66 4.10 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 42 K 8.52 4.04 0.00 2.01 1.88 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.63 7.81 43 E 8.19 4.06 0.00 2.23 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 0.00 2.32 1.79 0.00 44 L 8.38 4.01 0.00 1.96 1.67 0.97 0.91 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 45 R 7.47 3.97 0.00 2.08 2.18 0.00 2.79 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.85 0.00 46 G 7.99 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 47 F 7.70 4.15 0.00 3.01 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 48 V 7.91 3.84 2.15 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 1.13 0.00 0.00 1.13 0.00 0.00 49 D 8.36 4.56 0.00 2.87 2.74 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 50 H 7.93 4.10 0.00 3.09 3.32 0.00 5.79 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 51 L 6.91 3.79 0.00 1.66 1.66 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.01 3.50 1.77 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 1.65 0.97 0.24 0.00 0.00 53 H 8.60 3.78 0.00 3.41 3.41 0.00 5.59 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 54 L 8.14 3.91 0.00 1.79 1.64 0.82 0.62 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 55 A 7.41 2.58 0.30 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 56 K 7.32 3.81 0.00 1.59 1.65 0.00 1.65 0.00 0.00 1.32 0.00 0.00 2.81 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.39 7.81 57 R 6.67 4.09 0.00 1.84 1.94 0.00 3.20 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 58 G 8.41 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 59 D 8.14 4.42 0.00 2.95 2.88 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 60 L 8.77 3.83 0.00 1.68 1.73 0.89 0.95 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 61 H 8.59 4.10 0.00 3.24 3.57 0.00 5.78 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 62 A 8.28 3.96 1.67 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 0.00 0.00 63 R 7.93 3.55 0.00 1.46 1.88 0.00 2.83 0.00 0.00 2.95 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.05 0.00 64 R 8.33 3.88 0.00 1.81 1.99 0.00 3.26 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 65 L 8.28 3.98 0.00 1.88 1.65 0.85 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.38 3.57 2.40 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 1.08 0.00 0.00 0.98 0.00 0.00 67 L 8.03 4.25 0.00 1.75 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.00 4.12 0.00 1.95 2.03 0.00 3.17 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 69 D 8.13 4.50 0.00 2.74 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 70 L 8.21 4.15 0.00 1.69 1.69 0.99 0.91 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 71 Q 8.45 4.40 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.05 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 72 D 7.96 4.51 0.00 2.80 2.57 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 0.00 0.00 0.00 0.00 73 V 8.42 3.54 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 1.02 0.00 0.00 0.92 0.00 0.00 74 K 8.38 3.72 0.00 2.05 1.92 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.59 7.81 75 L 8.78 3.83 0.00 1.94 1.90 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.44 3.69 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 0.94 0.00 0.00 1.03 0.00 0.00 77 R 8.32 4.18 0.00 2.10 1.97 0.00 3.21 0.00 0.00 3.07 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 78 K 8.34 3.81 0.00 1.85 2.07 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 79 L 8.30 3.95 0.00 1.94 2.00 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 80 F 9.11 3.82 0.00 2.98 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.55 4.52 0.00 2.62 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 82 E 8.00 4.15 0.00 2.10 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 2.30 2.39 0.00 83 I 8.10 3.90 1.98 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 1.66 1.22 0.99 0.00 0.00 84 A 8.52 3.83 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 0.00 0.00 85 P 0.00 4.08 0.00 1.95 2.10 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.10 0.00 86 R 7.27 3.88 0.00 1.08 1.31 0.00 3.00 0.00 0.00 2.98 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.41 0.00 87 Y 7.64 4.54 0.00 2.81 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 0.00 0.00 0.00 0.00 88 R 9.43 4.08 0.00 1.89 2.13 0.00 3.39 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 89 D 7.98 4.69 0.00 2.73 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 90 R 7.84 4.50 0.00 1.97 2.16 0.00 3.34 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 91 Q 8.68 4.23 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.91 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 92 G 9.15 3.21 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 93 G 7.23 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 6.23 4.16 0.00 2.55 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.14 4.68 4.31 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 1.29 0.00 0.00 96 R 9.03 4.74 0.00 1.87 1.72 0.00 3.09 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 97 V 8.37 4.97 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 0.88 0.00 0.00 0.93 0.00 0.00 98 L 8.57 4.82 0.00 1.62 1.52 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.80 4.46 0.00 1.64 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.46 4.63 0.00 1.58 1.59 0.93 0.66 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 0.00 101 A 8.44 4.07 1.24 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 0.00 0.00 0.00 102 E 8.97 4.10 0.00 2.10 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 0.00 2.17 2.29 0.00 103 R 8.02 4.76 0.00 1.77 2.01 0.00 3.62 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 104 R 8.19 3.89 0.00 2.08 1.90 0.00 3.17 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 105 R 8.49 4.70 0.00 1.80 1.90 0.00 3.24 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 1.63 1.62 0.00 106 G 7.04 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 0.00 0.00 0.00 107 D 8.60 4.50 0.00 2.74 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 0.00 108 G 8.75 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 0.00 0.00 0.00 109 A 8.15 4.18 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 0.00 110 P 0.00 4.55 0.00 2.13 2.19 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 111 L 8.28 5.06 0.00 1.59 1.60 0.92 0.70 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 0.00 112 A 8.58 5.06 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 0.00 113 L 8.88 4.51 0.00 1.84 1.61 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.16 5.21 2.11 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 1.01 0.00 0.00 0.94 0.00 0.00 115 E 8.50 4.62 0.00 2.11 1.82 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 2.38 2.33 0.00 116 L 8.68 4.13 0.00 2.07 1.77 1.04 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.50 3.91 2.15 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 0.84 0.00 0.00 0.99 0.00 0.00 118 E 8.68 4.31 0.00 1.90 1.81 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 2.17 2.34 0.00