NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6113 8.4249 119.1969 53.6506 40.0072 174.1026 3 C 4.3321 8.1287 121.0880 53.8401 39.8267 171.1650 4 P 4.3479 0.0000 0.0000 62.3541 32.2315 177.7589 5 L 4.0274 8.4295 120.3406 57.4411 41.6685 177.9070 6 D 4.7562 8.1727 116.1831 52.6986 39.6227 175.6420 7 W 4.5731 7.7776 118.6731 55.0633 32.2175 175.0270 8 L 4.1909 8.6386 125.2830 53.2369 42.6134 173.8998 9 P 4.9155 0.0000 0.0000 62.5443 32.5915 176.2045 10 M 4.2883 9.6896 123.4167 55.7837 34.9458 174.3407 11 N 4.1400 10.0699 126.3853 54.3491 36.3730 175.1359 12 G 3.9877 8.5562 105.7544 44.7402 0.0000 172.9805 13 L 4.7958 7.8116 118.5675 53.0823 45.6319 174.5068 14 C 5.6206 8.7629 116.6481 55.6377 38.4572 173.3438 15 Y 5.8587 9.0479 120.1070 55.5445 41.8202 174.5896 16 K 4.9851 8.2949 120.8873 55.8696 35.5992 174.1279 17 I 4.3965 8.1141 121.0303 59.9269 39.2565 174.7249 18 F 4.2440 8.2646 125.1853 55.5697 40.3651 176.6402 19 N 4.4997 8.7786 120.7349 55.0003 38.9559 175.5375 20 Q 4.2091 7.8834 117.9544 56.0732 29.3369 175.9988 21 L 4.7309 8.6066 124.1793 54.4687 42.7102 176.2569 22 K 4.8808 9.3483 122.2901 55.0197 37.4227 175.9432 23 T 5.6296 8.4387 111.0419 60.5113 70.0335 175.3480 24 W 2.6887 8.3480 131.6895 60.2726 30.4098 177.4083 25 E 3.8023 8.3933 118.4483 59.7743 28.8868 178.6188 26 D 4.2462 7.7758 118.4039 56.9869 40.7547 178.5571 27 A 2.8469 7.7910 121.6651 54.6827 18.2159 179.1234 28 E 3.5025 7.6707 118.0653 59.8060 29.6330 179.1134 29 M 3.9664 7.8288 118.2819 57.8389 31.6986 178.6581 30 F 3.9358 8.0557 120.9757 61.2326 39.7774 176.2860 31 C 4.5731 8.5044 116.3022 60.4005 39.8975 176.1052 32 R 3.9027 7.7487 119.6394 58.0358 29.7554 178.1986 33 K 4.2873 7.4689 114.7202 56.3776 32.6315 177.4839 34 Y 3.7953 7.7722 121.3627 59.1294 39.1720 175.8778 35 K 4.1917 7.0151 113.9025 54.8633 34.7083 172.8265 36 P 4.0663 0.0000 0.0000 64.6435 31.4746 176.4178 37 G 3.8974 9.1362 110.3633 45.5218 0.0000 172.7984 38 C 5.4662 7.8497 115.2684 55.5757 41.2783 172.6648 39 H 4.8668 9.1603 117.8507 54.4023 33.7553 172.7625 40 L 4.6973 9.7086 120.5354 54.6959 42.1227 177.7701 41 A 4.5760 9.3024 124.9421 52.2646 19.5748 176.9004 42 S 3.2144 8.8127 114.8399 55.6455 65.4273 173.7063 43 F 4.8046 6.4612 119.5204 56.3569 41.6035 175.0104 44 H 5.3076 9.5570 118.8637 54.9657 31.0411 173.4805 45 R 3.7654 6.9221 113.7600 53.6917 31.6120 174.7293 46 Y 4.7052 7.8000 121.9039 60.3236 38.4730 178.8861 47 G 3.5951 8.0508 105.8719 47.9899 0.0000 175.2748 48 E 3.8471 7.9806 121.1094 59.0532 29.4370 179.5454 49 S 4.5625 8.1764 114.7134 61.8240 62.9479 176.7161 50 L 3.9048 7.7217 121.5213 57.5815 41.2797 179.1585 51 E 3.8963 8.2570 119.3251 59.3694 29.5563 178.9659 52 I 3.7574 8.1340 119.9631 64.2635 37.1985 178.1614 53 A 4.1648 8.5905 122.0482 55.4421 18.2226 179.3669 54 E 3.9734 8.4439 117.7786 59.3732 29.6608 178.3988 55 Y 4.2784 8.2541 119.7854 60.8568 38.8772 178.0788 56 I 3.1030 8.0133 121.0473 64.3712 36.9121 178.6134 57 S 4.2203 7.9047 114.7078 61.6446 62.6774 176.0658 58 D 4.3983 7.8097 120.2149 56.2265 40.9100 177.4453 59 Y 4.3451 7.6694 114.9841 57.2345 39.3634 175.6910 60 H 4.2439 8.0479 120.9307 56.0928 30.1007 175.6511 61 K 4.1882 9.6932 128.5459 53.8335 30.7281 176.9238 62 G 3.7558 6.6810 109.3697 45.5455 0.0000 169.5372 63 Q 4.5607 8.3738 119.7977 55.4046 30.7459 175.6931 64 E 4.3640 8.1443 115.5921 56.6742 30.6738 176.2376 65 N 4.8694 8.6508 118.8407 53.4552 40.0077 173.9441 66 V 4.8461 8.4441 119.9098 60.8312 34.4249 174.9815 67 W 5.0902 9.4479 128.6903 57.0345 30.5362 175.2466 68 I 5.1841 9.2168 116.1147 58.6612 41.4075 176.0631 69 G 4.2371 9.6995 106.6792 47.2606 0.0000 172.3831 70 L 4.8917 8.3341 124.0647 53.5653 43.4136 175.7393 71 R 4.8835 8.7883 121.5711 54.9143 33.3568 173.9645 72 D 4.5973 9.0837 122.8830 52.0967 39.0903 176.2478 73 K 3.5762 8.1359 123.5469 59.0361 31.1479 177.5196 74 K 4.0683 7.7962 114.9714 55.6407 32.3161 177.0222 75 K 3.7829 7.5174 117.5047 57.5569 29.8885 175.3291 76 D 4.8600 7.1673 112.6026 52.9045 39.7044 175.3433 77 F 2.9498 8.5771 116.3552 59.2725 36.3427 176.1307 78 S 4.6724 7.6736 117.0054 56.3021 61.9280 172.1491 79 W 4.6637 8.2347 126.8295 57.5429 29.9652 175.1706 80 E 4.8308 9.2620 123.5660 54.2753 33.6729 174.9026 81 W 5.4069 8.8152 123.0073 56.4573 30.1482 177.6317 82 T 4.1957 9.2826 115.2297 64.0956 68.7537 174.7106 83 D 4.2111 8.3531 120.3051 52.5720 39.4481 176.2510 84 R 3.9272 8.1295 115.6472 57.3268 28.5013 176.5316 85 S 4.5045 8.8738 112.5107 57.9177 63.7864 173.7917 86 C 4.6378 8.4399 118.6049 60.2745 28.7491 174.9329 87 T 4.9271 8.5233 120.8643 62.6248 66.5443 174.2145 88 D 5.1136 8.1979 119.7639 52.4288 40.5188 176.4259 89 Y 4.7986 7.8264 117.0772 57.5676 41.6207 172.9251 90 L 3.9973 7.5926 125.7299 53.3295 46.3551 176.5103 91 T 3.9159 5.7900 115.0512 59.7891 67.0927 172.9099 92 W 4.6070 7.0093 122.4886 56.7108 30.8209 177.0596 93 D 4.6713 9.6053 123.5885 53.1315 42.6704 175.1515 94 K 4.0155 8.4330 122.4553 57.5554 32.4212 176.0396 95 N 4.3822 9.0091 123.1325 54.0767 35.6760 173.6671 96 Q 4.6039 7.6982 115.5237 53.0800 32.5140 173.4708 97 P 4.3336 0.0000 0.0000 61.7636 31.9911 175.8144 98 D 4.8729 8.8771 117.9024 52.5844 40.7062 175.2055 99 H 3.9753 10.2779 116.8570 55.0290 27.1258 174.2789 100 Y 4.3372 8.3034 118.8415 59.5046 38.8867 175.7563 101 Q 3.1131 9.1528 124.2935 56.4741 26.4119 173.1699 102 N 4.1854 8.6396 112.1122 54.5197 36.8634 175.0238 103 K 4.6055 7.9678 114.0140 55.7350 33.3987 175.4228 104 E 4.7845 7.2401 119.5791 54.7733 31.2361 175.8230 105 F 5.0507 8.5526 119.5332 56.9015 41.9981 174.5963 106 C 4.8498 8.5471 117.4832 54.9043 41.2477 173.0709 107 V 4.8109 8.6586 123.6113 61.7129 33.0876 174.4669 108 E 5.4505 9.1576 124.4133 54.6548 33.6549 174.4183 109 L 4.8842 9.8128 121.7233 54.2281 43.5217 176.1943 110 V 4.2743 8.9056 125.0620 62.2332 32.2525 176.8233 111 S 2.8061 9.7418 123.9137 60.9550 62.4291 176.2339 112 L 3.9601 7.6854 118.9776 57.1335 41.3075 177.5420 113 T 4.2589 7.7801 107.8633 61.0494 68.8825 175.3920 114 G 3.5895 7.8727 108.4228 46.9415 0.0000 173.9299 115 Y 3.8428 7.4150 113.7697 58.8519 35.9061 171.1507 116 R 4.3226 7.8253 120.4159 57.9161 31.0223 176.9950 117 L 4.7275 7.8276 116.8143 53.1275 44.2458 176.1220 118 W 5.5060 8.4613 121.0592 55.5915 32.1123 174.8747 119 N 5.6067 8.9953 120.3751 52.0742 42.5529 173.1619 120 D 5.2977 9.0357 125.8438 53.5596 41.1663 174.9057 121 Q 4.9190 10.4100 122.8446 53.7630 33.6757 174.1943 122 V 4.6124 9.1448 123.5831 62.8771 32.0093 176.5182 123 C 4.1975 9.3350 125.6565 59.8888 40.2704 174.9022 124 E 4.3120 8.2240 116.5687 56.9285 29.6325 176.7161 125 S 4.6328 8.6510 116.5349 58.4075 64.5383 173.2611 126 K 5.0804 8.6431 121.9532 55.4763 33.1509 175.5397 127 D 4.9069 9.3319 124.0201 52.1165 45.8294 174.9564 128 A 5.1932 8.5714 122.3989 51.7873 20.4789 176.1822 129 F 5.5397 8.4565 112.5638 55.6516 42.0899 173.5108 130 L 5.0878 8.9265 122.5080 53.8684 43.8217 175.0694 131 C 5.3740 9.1580 124.4671 56.3670 41.2252 172.6797 132 Q 4.9203 9.4011 121.6505 54.8333 32.0531 173.2815 133 C 5.4347 9.7361 122.6311 55.2460 45.3450 172.8244 134 K 4.8057 8.0482 120.3576 54.7839 33.4205 176.8312 135 F 4.0685 8.7788 122.8263 57.4799 39.1430 175.6461 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 N 8.42 4.61 0.00 2.66 2.74 0.00 0.00 6.77 6.77 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 3 C 8.13 4.33 0.00 2.84 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 0.00 0.00 0.00 0.00 4 P 0.00 4.35 0.00 1.98 1.83 0.00 2.21 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.35 0.00 5 L 8.43 4.03 0.00 1.62 1.75 0.89 1.03 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 6 D 8.17 4.76 0.00 2.71 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 7 W 7.78 4.57 0.00 3.08 3.02 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 0.00 0.00 0.00 8 L 8.64 4.19 0.00 0.65 0.96 0.69 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.92 0.00 1.94 1.93 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 10 M 9.69 4.29 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 11 N 10.07 4.14 0.00 2.86 2.82 0.00 0.00 7.40 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 G 8.56 3.99 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 0.00 0.00 0.00 13 L 7.81 4.80 0.00 1.57 1.21 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.76 5.62 0.00 3.04 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 15 Y 9.05 5.86 0.00 2.67 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 16 K 8.29 4.99 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.30 0.46 7.81 17 I 8.11 4.40 1.51 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.10 0.61 0.00 0.00 18 F 8.26 4.24 0.00 1.51 2.28 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 19 N 8.78 4.50 0.00 2.68 2.86 0.00 0.00 7.14 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 20 Q 7.88 4.21 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 21 L 8.61 4.73 0.00 1.60 1.69 1.00 0.99 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 22 K 9.35 4.88 0.00 1.44 1.54 0.00 0.67 0.00 0.00 1.40 0.00 0.00 2.74 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.32 1.40 7.81 23 T 8.44 5.63 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 1.34 0.00 0.00 24 W 8.35 2.69 0.00 1.78 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 25 E 8.39 3.80 0.00 2.22 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 2.35 2.46 0.00 26 D 7.78 4.25 0.00 2.72 2.60 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 27 A 7.79 2.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.67 3.50 0.00 1.25 1.54 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 0.00 1.47 1.76 0.00 29 M 7.83 3.97 0.00 2.01 2.00 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 2.56 2.75 0.00 30 F 8.06 3.94 0.00 2.93 2.91 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 31 C 8.50 4.57 0.00 3.19 3.20 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 32 R 7.75 3.90 0.00 1.81 1.92 0.00 3.16 0.00 0.00 2.91 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 33 K 7.47 4.29 0.00 1.54 1.69 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.47 7.81 34 Y 7.77 3.80 0.00 2.89 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 35 K 7.02 4.19 0.00 1.64 1.63 0.00 1.19 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.02 7.81 36 P 0.00 4.07 0.00 2.10 2.03 0.00 3.59 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 37 G 9.14 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 38 C 7.85 5.47 0.00 2.96 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 0.00 39 H 9.16 4.87 0.00 3.09 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.71 4.70 0.00 1.66 1.80 0.19 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 A 9.30 4.58 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 42 S 8.81 3.21 0.00 2.72 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.46 4.80 0.00 3.62 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.56 5.31 0.00 3.13 3.30 0.00 5.69 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 6.92 3.77 0.00 1.78 1.83 0.00 2.95 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.43 0.00 46 Y 7.80 4.71 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.05 3.60 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 0.00 48 E 7.98 3.85 0.00 2.15 1.77 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 2.19 2.23 0.00 49 S 8.18 4.56 0.00 4.09 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 0.00 50 L 7.72 3.90 0.00 1.65 1.56 0.51 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.26 3.90 0.00 2.00 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 2.16 2.29 0.00 52 I 8.13 3.76 2.27 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.25 1.21 0.00 0.00 53 A 8.59 4.16 1.57 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 0.00 0.00 54 E 8.44 3.97 0.00 2.15 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 0.00 2.51 2.36 0.00 55 Y 8.25 4.28 0.00 3.04 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 56 I 8.01 3.10 1.52 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 1.17 0.70 -0.37 0.00 0.00 57 S 7.90 4.22 0.00 4.03 4.02 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 0.00 0.00 0.00 58 D 7.81 4.40 0.00 2.67 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 0.00 0.00 0.00 0.00 59 Y 7.67 4.35 0.00 2.38 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 60 H 8.05 4.24 0.00 2.65 3.16 0.00 5.93 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 9.69 4.19 0.00 1.64 1.68 0.00 1.85 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.47 7.81 62 G 6.68 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 0.00 0.00 0.00 63 Q 8.37 4.56 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 64 E 8.14 4.36 0.00 1.94 1.86 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 2.33 2.42 0.00 65 N 8.65 4.87 0.00 2.72 2.83 0.00 0.00 6.25 7.68 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 66 V 8.44 4.85 2.12 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 1.07 0.00 0.00 0.64 0.00 0.00 67 W 9.45 5.09 0.00 3.47 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 68 I 9.22 5.18 2.53 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 1.34 0.85 1.22 0.00 0.00 69 G 9.70 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 0.00 0.00 0.00 0.00 70 L 8.33 4.89 0.00 0.37 1.02 -0.10 -0.03 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 71 R 8.79 4.88 0.00 0.75 1.48 0.00 2.77 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.06 0.00 72 D 9.08 4.60 0.00 1.58 2.26 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 73 K 8.14 3.58 0.00 1.66 1.75 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.42 7.81 74 K 7.80 4.07 0.00 1.88 1.69 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.36 7.81 75 K 7.52 3.78 0.00 1.55 1.48 0.00 1.15 0.00 0.00 0.78 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.65 7.81 76 D 7.17 4.86 0.00 2.71 2.63 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 77 F 8.58 2.95 0.00 3.12 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 78 S 7.67 4.67 0.00 3.80 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 79 W 8.23 4.66 0.00 3.29 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 80 E 9.26 4.83 0.00 1.91 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 2.28 2.48 0.00 81 W 8.82 5.41 0.00 3.61 3.27 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 0.00 82 T 9.28 4.20 4.51 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 1.56 0.00 0.00 83 D 8.35 4.21 0.00 2.67 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 84 R 8.13 3.93 0.00 2.02 2.11 0.00 3.21 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 85 S 8.87 4.50 0.00 3.92 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 86 C 8.44 4.64 0.00 3.12 3.10 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 0.00 0.00 0.00 87 T 8.52 4.93 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 88 D 8.20 5.11 0.00 2.94 2.91 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 89 Y 7.83 4.80 0.00 3.25 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 90 L 7.59 4.00 0.00 1.42 1.03 1.16 0.99 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 91 T 5.79 3.92 3.46 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 -0.35 0.00 0.00 92 W 7.01 4.61 0.00 3.09 3.10 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 0.00 0.00 0.00 93 D 9.61 4.67 0.00 2.92 2.63 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 94 K 8.43 4.02 0.00 1.79 1.70 0.00 1.90 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.47 7.81 95 N 9.01 4.38 0.00 2.90 2.92 0.00 0.00 6.88 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 96 Q 7.70 4.60 0.00 2.26 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 97 P 0.00 4.33 0.00 2.06 0.49 0.00 2.51 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.77 0.00 98 D 8.88 4.87 0.00 2.81 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 99 H 10.28 3.98 0.00 3.30 3.10 0.00 5.68 0.00 0.00 0.00 0.00 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.30 4.34 0.00 3.11 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 0.00 101 Q 9.15 3.11 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.68 0.00 0.00 0.00 0.00 0.00 1.84 1.16 0.00 102 N 8.64 4.19 0.00 2.80 2.93 0.00 0.00 6.63 8.23 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 0.00 103 K 7.97 4.61 0.00 1.73 1.77 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.44 7.81 104 E 7.24 4.78 0.00 1.88 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 2.40 2.32 0.00 105 F 8.55 5.05 0.00 2.80 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 0.00 106 C 8.55 4.85 0.00 2.73 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 0.00 0.00 0.00 107 V 8.66 4.81 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 0.58 0.00 0.00 0.94 0.00 0.00 108 E 9.16 5.45 0.00 2.03 1.75 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 2.45 2.25 0.00 109 L 9.81 4.88 0.00 1.87 1.89 1.17 0.85 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 0.00 110 V 8.91 4.27 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 0.88 0.00 0.00 0.98 0.00 0.00 111 S 9.74 2.81 0.00 3.84 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 0.00 112 L 7.69 3.96 0.00 1.60 1.65 0.87 0.77 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 0.00 113 T 7.78 4.26 4.22 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 1.24 0.00 0.00 114 G 7.87 3.59 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 0.00 0.00 0.00 115 Y 7.41 3.84 0.00 3.25 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 0.00 116 R 7.83 4.32 0.00 1.94 2.02 0.00 3.17 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 117 L 7.83 4.73 0.00 1.61 1.61 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 118 W 8.46 5.51 0.00 2.72 2.54 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 0.00 0.00 0.00 0.00 119 N 9.00 5.61 0.00 2.92 2.69 0.00 0.00 7.20 8.64 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 0.00 120 D 9.04 5.30 0.00 3.02 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 0.00 121 Q 10.41 4.92 0.00 2.30 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 122 V 9.14 4.61 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 1.39 0.00 0.00 1.06 0.00 0.00 123 C 9.34 4.20 0.00 3.05 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 0.00 124 E 8.22 4.31 0.00 2.07 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 0.00 2.38 2.33 0.00 125 S 8.65 4.63 0.00 4.10 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 0.00 126 K 8.64 5.08 0.00 1.71 1.85 0.00 1.83 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.48 7.81 127 D 9.33 4.91 0.00 1.58 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 0.00 0.00 0.00 0.00 128 A 8.57 5.19 1.15 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 0.00 129 F 8.46 5.54 0.00 3.27 3.33 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 0.00 130 L 8.93 5.09 0.00 1.91 1.79 1.11 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 131 C 9.16 5.37 0.00 3.25 3.27 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 0.00 132 Q 9.40 4.92 0.00 1.72 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.04 1.66 0.00 133 C 9.74 5.43 0.00 2.58 2.31 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 0.00 134 K 8.05 4.81 0.00 1.46 1.66 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.70 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.31 7.81 135 F 8.78 4.07 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