NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.3275 8.4449 120.2254 56.0264 31.7613 176.4033 4 K 3.9319 7.9884 118.3988 55.9143 32.4820 174.3404 5 T 4.5984 8.7397 117.3128 59.5727 71.4467 172.8586 6 C 4.9198 8.4828 118.5791 57.6343 39.0730 173.1824 7 D 5.1217 9.0413 122.7263 52.6622 42.9363 175.8228 8 L 5.1915 8.3748 122.7526 52.2647 43.8927 176.9673 9 V 3.6556 8.2317 114.4393 62.7648 32.1295 176.7889 10 G 4.0454 8.7521 111.1681 44.8940 0.0000 173.2755 11 E 4.1558 8.5972 121.9743 54.9664 30.5071 176.1588 12 K 4.2427 8.4539 121.6038 58.5985 32.3123 177.6663 13 G 3.9933 9.5526 112.6364 45.3395 0.0000 173.9821 14 K 4.4863 8.1419 117.4439 55.9915 32.7922 176.3608 15 E 4.2313 7.8399 118.6739 55.5572 30.3433 177.1169 16 S 4.2019 8.4981 115.6878 58.6441 64.0208 175.2962 17 E 3.9874 8.8115 128.2318 59.3296 29.3443 179.6829 18 K 3.9826 7.9683 118.0864 59.6556 32.1678 179.1214 19 E 4.0778 8.3414 118.7815 59.3144 29.3869 179.4386 20 L 4.0112 8.2583 119.0577 57.7388 41.6847 179.4449 21 A 4.0102 8.1436 120.7783 55.0018 18.3075 179.4668 22 L 3.9083 8.0799 118.9545 58.0201 41.9318 178.8052 23 L 4.0423 8.0438 119.7405 58.2517 42.4189 178.6172 24 K 4.0851 8.0542 119.3550 59.5425 31.8939 178.7317 25 R 3.8979 7.7627 118.1160 59.1130 30.3190 177.8200 26 L 4.1822 7.9219 117.3043 55.7907 41.7897 178.7843 27 T 2.0000 7.1972 116.8620 65.5583 68.1977 173.8541 28 P 4.2609 0.0000 0.0000 64.7562 31.5596 177.3747 29 L 4.3655 8.0007 119.0372 56.2678 41.6897 178.4062 30 F 4.8083 7.9336 119.3602 59.9421 38.9940 176.6902 31 Q 4.0691 8.0208 113.7949 57.7973 28.8911 176.3043 32 K 4.1039 7.4551 118.3928 55.7873 33.0913 175.7524 33 S 4.3863 7.2619 113.5457 56.6431 65.5922 172.9368 34 F 5.0352 8.7617 123.7246 55.7870 42.7506 173.5901 35 E 5.9216 8.8609 121.2523 54.6815 33.1813 174.2983 36 S 4.8329 9.0113 118.2284 57.7465 66.1702 172.6545 37 T 5.2945 8.7585 123.6955 62.2207 70.3193 174.0354 38 V 4.4913 8.8692 118.3962 60.6999 37.0702 175.5152 39 G 4.1463 9.1428 108.0391 45.4769 0.0000 172.5805 40 Q 4.5787 7.8993 116.0293 53.2488 32.0312 175.7880 41 S 4.4387 8.5842 116.3558 58.3323 63.2338 171.9556 42 P 4.6727 0.0000 0.0000 63.5479 31.1143 175.9754 43 D 4.5124 7.8432 117.3366 54.6706 41.8303 175.4449 44 M 4.2144 7.7078 119.8076 55.4781 33.4566 174.4653 45 Y 5.3539 8.9386 123.3387 56.1941 42.5613 174.5508 46 S 5.1218 8.8844 116.6203 56.9922 65.0489 172.2463 47 Y 5.2056 9.3642 126.4464 56.8461 39.7621 174.8950 48 V 5.0141 8.9215 124.2119 61.0651 34.3855 173.9441 49 F 5.5699 9.1573 130.0083 56.6320 42.4988 173.8135 50 R 4.3869 8.4155 122.7611 54.3777 34.5504 175.1201 51 V 3.8999 8.0405 121.9433 62.6284 31.3553 176.4064 52 C 3.7804 9.2895 124.6393 57.3636 38.1354 173.1282 53 R 3.8397 6.6791 115.7170 53.6253 33.6891 174.5746 54 E 4.2448 8.6302 120.8813 56.9981 29.7254 176.5168 55 A 4.3637 9.0618 129.4586 52.4600 20.1875 176.8732 56 G 3.9858 7.8857 104.7653 44.9105 0.0000 173.6297 57 Q 4.5780 8.9922 115.9569 55.9393 28.9296 176.1224 58 H 4.9264 7.7308 112.2498 54.9796 30.0919 173.3292 59 S 3.8710 8.2153 113.0104 59.6716 60.2252 173.1289 60 S 4.3274 8.2478 112.1561 58.0815 63.5114 174.2776 61 G 3.4591 9.0051 109.9777 46.2295 0.0000 173.2586 62 A 4.1761 8.0109 122.7368 51.8028 19.2165 179.2295 63 G 3.8446 8.9751 109.4473 47.0195 0.0000 173.4785 64 L 5.3652 7.7015 122.3238 54.1218 45.6665 174.7052 65 V 4.9165 9.1669 119.2858 59.5215 36.0257 174.3342 66 Q 4.5849 9.1285 124.2348 54.4867 31.3216 174.1610 67 I 4.7257 8.4683 128.6820 59.6941 39.4389 174.9509 68 Q 4.5423 9.1305 129.8451 55.7357 29.0447 176.7294 69 K 4.4274 8.7168 127.8636 59.0772 31.9863 179.0486 70 S 4.3096 8.2202 114.1605 60.4808 63.1504 174.5641 71 N 4.8291 7.7766 114.1374 51.6635 38.9973 175.5491 72 G 4.0110 8.8735 107.3693 45.5686 0.0000 173.8591 73 K 4.0657 7.6505 121.9952 56.4825 33.3403 175.0194 74 E 4.9793 8.7831 127.9677 54.9686 31.3584 174.7110 75 T 4.6932 8.7103 123.9468 61.6392 71.6436 173.5298 76 V 4.0203 8.9303 127.2696 62.7111 32.0772 176.6830 77 V 3.6634 8.8933 128.9222 65.3588 32.8505 175.8940 78 G 4.3552 7.8238 104.6165 45.2447 0.0000 172.1868 79 R 4.9870 8.7790 121.8512 53.8255 32.6895 177.2892 80 F 4.2728 8.1173 117.2173 57.5157 38.1754 176.0729 81 N 4.7294 7.4386 118.2541 53.3845 37.9713 175.2190 82 E 4.8214 8.0308 117.0024 55.6320 29.4647 174.6140 83 T 5.3130 8.5563 117.9577 62.1220 71.8430 175.3498 84 Q 5.0635 9.0714 125.8556 54.4353 32.7280 173.9365 85 I 5.3401 9.3166 119.1386 59.6577 40.8679 174.0698 86 F 5.1970 8.6932 119.5824 55.8219 41.5247 173.1513 87 Q 4.2353 8.6069 116.7852 54.1692 31.7726 175.1495 88 G 3.4331 6.1503 109.1067 43.6203 0.0000 172.7912 89 S 4.2349 8.6628 113.2556 61.1508 63.2243 174.8100 90 N 5.3889 8.0597 117.9034 50.2743 38.0867 173.8081 91 W 5.5549 7.4961 114.1587 56.8589 31.9876 172.8929 92 I 4.8998 9.2547 121.1073 59.8365 41.2173 173.9117 93 M 4.9748 9.0153 126.5890 53.5326 34.7797 173.9410 94 L 5.1404 8.7656 127.9976 53.2664 45.4296 174.9398 95 I 5.0446 8.8349 126.1233 59.7644 41.1403 173.7365 96 Y 5.4574 9.1601 125.1453 56.7079 40.2714 175.7395 97 K 4.4569 9.0967 125.7191 55.1116 35.5217 177.5459 98 G 4.3130 8.8660 108.3330 46.8315 0.0000 174.1447 99 G 4.1051 7.8054 107.5832 44.2961 0.0000 173.8314 100 D 4.6724 8.8027 119.8402 54.1298 41.7846 176.7386 101 E 4.6480 8.6431 121.5088 56.6991 30.3517 176.5206 102 Y 4.2983 8.6874 120.0037 58.3402 38.9294 176.2540 103 D 4.6364 8.9913 120.4927 55.4190 42.1247 177.3772 104 N 4.9358 8.2931 112.6379 52.7689 40.9459 173.5519 105 H 4.7650 8.0295 114.5721 54.1375 31.8669 173.9463 106 C 4.9127 8.7475 113.6902 57.0040 37.6447 174.2830 107 G 3.7836 8.8328 102.6395 46.5151 0.0000 174.4595 108 R 4.3551 8.5382 114.9894 55.9721 27.8164 176.6609 109 E 4.4272 7.9950 115.3039 55.9909 31.4834 176.0447 110 Q 4.2639 8.6577 119.4993 55.9304 30.2334 176.4384 111 R 4.6703 8.5856 121.9432 56.8136 31.7736 175.4671 112 R 5.3862 8.7942 118.8638 55.0836 34.1031 173.0919 113 A 5.4870 9.4216 127.2234 50.2225 22.0067 175.2087 114 V 4.7026 9.3584 123.0423 61.0341 34.3728 174.3702 115 V 4.7684 8.9797 128.4377 61.3186 34.2319 173.7976 116 M 4.5477 9.1106 129.3839 54.4366 33.5883 174.7464 117 I 4.6836 9.0495 128.9176 60.1637 39.0468 175.2693 118 S 5.1013 8.8743 124.1970 56.8000 65.1392 173.2510 119 C 4.9157 8.6382 123.8995 57.1600 40.0579 172.9763 120 N 4.8633 8.5105 124.3749 52.8348 40.9006 174.8314 121 R 4.1697 8.8893 125.4276 57.9971 30.4150 177.0869 122 H 4.6937 8.6564 114.8753 56.2130 29.4707 174.8157 123 T 4.6410 7.2018 113.0359 60.6645 70.0844 173.8672 124 L 3.9511 8.6603 128.0961 57.5718 42.5946 176.7758 125 A 5.0001 7.5365 115.3803 52.3888 22.7114 174.6283 126 D 4.5339 8.4496 120.7593 54.3255 43.8927 174.1880 127 N 4.4289 8.6744 115.2245 53.9840 35.8613 174.6861 128 F 4.7326 8.4385 119.6669 58.3965 40.2452 173.4005 129 N 4.7411 8.8680 126.7184 51.2210 42.2809 171.5514 130 P 3.9851 0.0000 0.0000 62.7739 31.5879 175.9444 131 V 4.0167 8.0118 124.9834 63.9617 32.8162 175.5415 132 S 4.4419 6.7032 112.1138 57.8069 65.6742 174.3105 133 E 4.4110 8.4546 120.5828 54.1084 32.2134 174.2629 134 E 4.2387 8.5482 128.8901 54.1896 30.8893 175.5827 135 R 4.0938 8.2236 122.0676 55.6793 30.2533 175.8077 136 G 3.9503 8.3167 105.2276 45.5281 0.0000 173.9153 137 K 4.6452 7.4030 118.6615 54.0731 34.9608 177.5692 138 V 3.7932 8.2237 113.3143 63.6805 31.8001 176.1156 139 Q 4.6659 7.8182 114.5968 56.7805 30.8698 172.6513 140 D 4.4477 8.8382 114.9798 55.7853 37.9835 174.7068 141 C 4.9639 8.6072 115.6397 56.6080 39.5274 173.9279 142 F 5.1192 8.0885 113.1610 56.9976 41.2736 172.1584 143 Y 4.6957 9.0894 118.3896 56.4159 40.1241 174.4098 144 L 5.2815 8.6223 126.1811 53.4383 44.6731 175.1283 145 F 5.0989 9.4125 123.6785 55.8022 43.8121 173.4621 146 E 5.2452 8.8304 118.9808 55.4166 33.8599 174.4912 147 M 5.1279 8.5092 119.2294 55.8442 36.5361 172.9309 148 D 5.4533 8.7991 123.1205 53.1437 44.1122 175.5997 149 S 5.1632 8.7753 113.4185 58.3782 66.1714 176.4141 150 S 4.5712 9.0158 121.1901 60.1638 63.0984 176.2615 151 L 4.0118 7.7181 120.2280 56.9725 41.4453 177.4845 152 A 4.3631 7.9576 120.5406 52.2792 18.9985 175.9904 153 C 4.6603 7.7376 114.4627 56.1498 41.4503 174.1477 154 S 4.3554 8.4824 118.2593 58.7071 62.7457 174.1121 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 3 E 8.44 4.33 0.00 1.98 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 2.22 2.34 0.00 4 K 7.99 3.93 0.00 1.92 1.93 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.48 7.81 5 T 8.74 4.60 4.12 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 1.21 0.00 0.00 6 C 8.48 4.92 0.00 2.92 3.13 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 0.00 0.00 0.00 0.00 7 D 9.04 5.12 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 5.19 0.00 1.57 1.80 0.98 1.17 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 9 V 8.23 3.66 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 0.72 0.00 0.00 0.96 0.00 0.00 10 G 8.75 4.05 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 0.00 0.00 0.00 11 E 8.60 4.16 0.00 2.02 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 2.34 0.00 12 K 8.45 4.24 0.00 1.79 1.78 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 13 G 9.55 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 14 K 8.14 4.49 0.00 1.93 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.52 7.81 15 E 7.84 4.23 0.00 1.96 1.91 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 2.34 2.38 0.00 16 S 8.50 4.20 0.00 3.90 3.77 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 17 E 8.81 3.99 0.00 2.02 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 2.41 2.35 0.00 18 K 7.97 3.98 0.00 1.82 1.87 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.54 7.81 19 E 8.34 4.08 0.00 2.20 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 0.00 2.63 2.41 0.00 20 L 8.26 4.01 0.00 1.86 1.74 0.99 0.92 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 21 A 8.14 4.01 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 22 L 8.08 3.91 0.00 1.98 1.72 0.94 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.04 4.04 0.00 1.84 1.99 1.11 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.05 4.09 0.00 1.92 1.96 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.44 7.81 25 R 7.76 3.90 0.00 1.84 2.13 0.00 3.28 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 26 L 7.92 4.18 0.00 2.05 1.81 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.20 2.00 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 0.90 0.00 0.00 28 P 0.00 4.26 0.00 2.15 2.08 0.00 3.62 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 29 L 8.00 4.37 0.00 1.86 1.88 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.93 4.81 0.00 2.89 2.94 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 31 Q 8.02 4.07 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 32 K 7.46 4.10 0.00 1.71 1.06 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.30 7.81 33 S 7.26 4.39 0.00 3.58 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.76 5.04 0.00 2.43 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 35 E 8.86 5.92 0.00 2.00 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 2.46 2.17 0.00 36 S 9.01 4.83 0.00 4.29 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 37 T 8.76 5.29 4.32 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 1.26 0.00 0.00 38 V 8.87 4.49 2.19 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 0.83 0.00 0.00 1.28 0.00 0.00 39 G 9.14 4.15 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 0.00 40 Q 7.90 4.58 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 41 S 8.58 4.44 0.00 3.93 3.84 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 42 P 0.00 4.67 0.00 2.19 2.15 0.00 3.67 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 1.96 1.97 0.00 43 D 7.84 4.51 0.00 2.56 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 44 M 7.71 4.21 0.00 2.00 1.90 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 2.85 2.54 0.00 45 Y 8.94 5.35 0.00 2.63 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 0.00 0.00 0.00 46 S 8.88 5.12 0.00 3.91 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 47 Y 9.36 5.21 0.00 3.33 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 48 V 8.92 5.01 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 1.07 0.00 0.00 0.99 0.00 0.00 49 F 9.16 5.57 0.00 2.63 1.83 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.42 4.39 0.00 1.63 1.49 0.00 3.06 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.41 0.00 51 V 8.04 3.90 2.21 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 1.21 0.00 0.00 0.85 0.00 0.00 52 C 9.29 3.78 0.00 1.86 2.45 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 53 R 6.68 3.84 0.00 1.43 1.50 0.00 3.18 0.00 0.00 2.76 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.53 0.00 54 E 8.63 4.24 0.00 2.02 1.89 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 2.31 2.51 0.00 55 A 9.06 4.36 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 56 G 7.89 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 57 Q 8.99 4.58 0.00 1.72 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.24 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 58 H 7.73 4.93 0.00 3.08 3.20 0.00 5.85 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.22 3.87 0.00 3.97 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 60 S 8.25 4.33 0.00 3.92 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 61 G 9.01 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 0.00 0.00 0.00 0.00 62 A 8.01 4.18 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 63 G 8.98 3.84 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 0.00 0.00 0.00 64 L 7.70 5.37 0.00 2.05 1.59 -0.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 65 V 9.17 4.92 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 0.73 0.00 0.00 0.96 0.00 0.00 66 Q 9.13 4.58 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 1.67 1.16 0.00 67 I 8.47 4.73 1.96 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 1.11 0.49 0.98 0.00 0.00 68 Q 9.13 4.54 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 69 K 8.72 4.43 0.00 1.82 1.86 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.55 7.81 70 S 8.22 4.31 0.00 3.97 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 71 N 7.78 4.83 0.00 2.83 3.01 0.00 0.00 6.24 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 72 G 8.87 4.01 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 0.00 0.00 0.00 73 K 7.65 4.07 0.00 1.92 1.72 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.44 7.81 74 E 8.78 4.98 0.00 2.04 1.91 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 2.22 2.32 0.00 75 T 8.71 4.69 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 1.10 0.00 0.00 76 V 8.93 4.02 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 0.86 0.00 0.00 0.90 0.00 0.00 77 V 8.89 3.66 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 0.62 0.00 0.00 0.63 0.00 0.00 78 G 7.82 4.36 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 0.00 79 R 8.78 4.99 0.00 1.61 1.52 0.00 3.16 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 80 F 8.12 4.27 0.00 3.05 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 81 N 7.44 4.73 0.00 2.81 2.81 0.00 0.00 5.86 7.66 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 82 E 8.03 4.82 0.00 2.22 1.92 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 2.23 2.25 0.00 83 T 8.56 5.31 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 84 Q 9.07 5.06 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 85 I 9.32 5.34 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.80 0.96 0.00 0.00 86 F 8.69 5.20 0.00 3.07 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 87 Q 8.61 4.24 0.00 1.88 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 88 G 6.15 3.43 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 0.00 0.00 0.00 89 S 8.66 4.23 0.00 4.00 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 90 N 8.06 5.39 0.00 2.78 3.03 0.00 0.00 6.27 8.88 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 91 W 7.50 5.55 0.00 3.49 3.17 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 0.00 92 I 9.25 4.90 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.66 0.92 0.00 0.00 93 M 9.02 4.97 0.00 0.90 1.70 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 94 L 8.77 5.14 0.00 1.66 1.33 0.97 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.83 5.04 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 1.03 0.00 0.00 96 Y 9.16 5.46 0.00 2.94 2.78 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 97 K 9.10 4.46 0.00 1.88 1.84 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.49 7.81 98 G 8.87 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 0.00 0.00 0.00 0.00 99 G 7.81 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 0.00 100 D 8.80 4.67 0.00 2.49 2.55 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 0.00 101 E 8.64 4.65 0.00 1.88 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 2.45 2.37 0.00 102 Y 8.69 4.30 0.00 3.06 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 0.00 103 D 8.99 4.64 0.00 2.74 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 0.00 104 N 8.29 4.94 0.00 2.68 2.73 0.00 0.00 6.74 8.16 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 0.00 105 H 8.03 4.77 0.00 2.55 2.94 0.00 5.96 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 0.00 106 C 8.75 4.91 0.00 2.91 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 0.00 107 G 8.83 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 0.00 108 R 8.54 4.36 0.00 2.01 2.10 0.00 3.16 0.00 0.00 3.16 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.56 0.00 109 E 8.00 4.43 0.00 2.18 2.16 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 2.59 2.51 0.00 110 Q 8.66 4.26 0.00 2.10 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.99 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 111 R 8.59 4.67 0.00 1.81 1.99 0.00 3.10 0.00 0.00 2.98 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.47 0.00 112 R 8.79 5.39 0.00 2.02 2.11 0.00 3.27 0.00 0.00 3.41 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 113 A 9.42 5.49 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 0.00 114 V 9.36 4.70 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 0.91 0.00 0.00 0.82 0.00 0.00 115 V 8.98 4.77 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.27 0.00 0.00 116 M 9.11 4.55 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.42 0.00 117 I 9.05 4.68 2.00 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 1.25 0.57 0.98 0.00 0.00 118 S 8.87 5.10 0.00 3.79 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 0.00 119 C 8.64 4.92 0.00 3.18 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 0.00 120 N 8.51 4.86 0.00 2.80 2.66 0.00 0.00 7.23 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 0.00 121 R 8.89 4.17 0.00 1.73 1.89 0.00 3.22 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 122 H 8.66 4.69 0.00 3.27 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.20 4.64 4.30 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 1.27 0.00 0.00 124 L 8.66 3.95 0.00 1.78 1.68 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.54 5.00 1.46 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 0.00 0.00 126 D 8.45 4.53 0.00 2.72 2.55 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 0.00 127 N 8.67 4.43 0.00 2.99 2.89 0.00 0.00 6.44 8.13 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 0.00 128 F 8.44 4.73 0.00 2.90 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 0.00 129 N 8.87 4.74 0.00 2.67 2.47 0.00 0.00 6.79 7.59 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 0.00 130 P 0.00 3.99 0.00 1.83 1.37 0.00 3.62 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.98 0.00 131 V 8.01 4.02 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 0.66 0.00 0.00 0.84 0.00 0.00 132 S 6.70 4.44 0.00 3.67 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 0.00 133 E 8.45 4.41 0.00 1.49 1.51 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 1.59 1.47 0.00 134 E 8.55 4.24 0.00 1.39 1.12 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 2.06 2.08 0.00 135 R 8.22 4.09 0.00 1.35 1.78 0.00 2.60 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.37 0.00 136 G 8.32 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 0.00 137 K 7.40 4.65 0.00 1.88 1.69 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.40 1.38 7.81 138 V 8.22 3.79 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 0.71 0.00 0.00 0.93 0.00 0.00 139 Q 7.82 4.67 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.92 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 140 D 8.84 4.45 0.00 2.91 2.85 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 0.00 141 C 8.61 4.96 0.00 3.06 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 0.00 142 F 8.09 5.12 0.00 3.19 3.15 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 0.00 143 Y 9.09 4.70 0.00 3.19 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 0.00 144 L 8.62 5.28 0.00 1.86 1.33 1.04 0.81 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 0.00 145 F 9.41 5.10 0.00 2.79 2.55 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 0.00 146 E 8.83 5.25 0.00 1.79 1.74 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 2.16 2.14 0.00 147 M 8.51 5.13 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.25 0.00 148 D 8.80 5.45 0.00 2.77 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 0.00 149 S 8.78 5.16 0.00 3.88 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 0.00 150 S 9.02 4.57 0.00 4.03 4.33 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 0.00 151 L 7.72 4.01 0.00 1.70 1.76 0.90 0.69 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 0.00 152 A 7.96 4.36 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 0.00 153 C 7.74 4.66 0.00 3.09 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 0.00 154 S 8.48 4.36 0.00 3.86 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