NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4506 8.1633 118.2846 55.2652 33.6432 173.5619 2 N 5.5776 8.5279 116.5089 50.9420 41.5474 172.3187 3 I 5.0992 9.7109 123.1182 59.3760 42.8150 173.4167 4 I 5.0036 8.2951 127.0456 59.3607 40.2879 174.2189 5 L 4.9590 9.2970 129.3520 53.2670 44.3798 174.8848 6 K 4.7363 9.5346 130.0901 55.1401 33.8522 175.1577 7 I 4.5255 8.7788 130.2065 59.7048 38.6439 175.6396 8 S 4.5169 9.0081 123.0430 58.4910 63.0941 175.7675 9 G 4.0100 9.1160 114.1359 48.4644 0.0000 175.8278 10 K 4.2883 8.3004 119.0327 58.8111 32.2943 178.6631 11 F 3.3437 8.0852 119.8989 60.7755 39.0172 175.7737 12 F 4.4797 8.1476 116.1883 57.7939 39.0026 175.9852 13 D 4.6391 8.6315 121.0353 54.8264 41.0417 176.3544 14 E 4.2810 7.6178 119.0306 55.6779 30.6564 175.5486 15 D 4.7681 8.3325 117.2411 54.1679 40.8579 176.1557 16 N 4.7901 7.4009 116.0422 52.9528 41.7771 174.2714 17 V 4.0463 8.0832 116.7303 60.6148 33.1179 177.0858 18 D 3.9913 8.7708 123.6994 57.5853 40.5780 178.5038 19 N 4.3357 8.1734 116.5440 56.4317 38.4544 176.9274 20 L 4.1623 8.8952 121.0429 57.6156 41.3682 179.5466 21 I 3.7488 8.0321 120.5745 64.2930 36.9990 178.5710 22 V 3.6140 7.6493 118.6964 65.7660 31.4021 177.4904 23 L 3.9976 7.8222 121.2703 57.5838 41.8325 178.4557 24 R 3.8779 8.1404 118.4128 60.0484 30.0059 178.0575 25 Q 3.9807 7.9520 118.5566 59.1588 28.7006 178.3308 26 S 4.1023 8.4438 116.6108 61.9951 62.9627 176.9235 27 I 3.7518 8.0990 122.4395 64.1767 36.7743 178.5023 28 K 3.9149 7.8893 118.8865 59.6412 31.9188 179.1493 29 E 3.9333 8.0745 118.1921 59.4634 29.3910 178.9224 30 L 3.7402 8.3391 120.5011 58.4134 41.9836 179.0498 31 A 4.9317 8.4315 121.9782 54.9891 18.1782 179.3711 32 D 4.7086 8.0993 115.9592 56.8257 40.8986 177.6736 33 N 4.8961 8.1874 115.4308 52.9899 38.8332 175.7664 34 G 3.9313 8.6264 109.2460 45.2529 0.0000 173.3079 35 F 4.9326 8.7885 119.1326 56.4075 40.8363 175.1480 36 R 5.0649 8.8734 121.6999 54.6283 32.8454 175.3687 37 V 5.2279 8.5079 120.9565 61.2728 35.1789 174.2050 38 G 4.6356 9.2142 114.2429 44.6316 0.0000 171.9526 39 I 5.2340 8.9763 123.2874 59.1687 41.2931 174.6629 40 V 4.8510 8.8465 125.9287 61.2482 34.2860 174.2169 41 T 4.9742 8.5451 118.2339 60.0278 70.8424 174.6060 42 G 3.8706 8.7501 111.6584 45.3720 0.0000 175.0112 43 G 3.6504 8.7644 108.0244 46.6802 0.0000 174.9959 44 G 4.0748 8.0639 109.0384 45.4799 0.0000 174.1752 45 S 4.2636 9.2142 113.5557 61.6976 62.9457 176.7603 46 T 4.0013 7.9976 119.0307 66.3523 68.2271 176.3022 47 A 4.0520 7.7237 121.2798 55.4125 18.4895 179.8693 48 R 3.9230 8.0042 116.4958 59.3983 30.1298 179.2864 49 R 3.8806 8.3988 118.7380 59.7616 30.0109 178.2783 50 Y 3.7982 8.2584 116.5302 60.9094 37.9074 178.1195 51 I 3.7907 8.1747 121.0084 64.2602 37.1508 178.4441 52 K 3.9651 8.1277 120.4915 59.3199 30.5554 178.6341 53 L 3.8718 7.8528 120.4101 58.1472 41.9951 178.8906 54 A 4.2304 8.3666 121.0489 55.1140 18.2801 179.5483 55 R 3.8715 8.5400 117.6958 59.6843 29.9650 178.5714 56 E 4.0308 8.3302 117.4854 58.3703 29.4318 178.2765 57 I 4.3862 7.1268 110.6253 60.3013 38.0232 176.1866 58 G 3.9268 8.0358 108.2652 45.8270 0.0000 174.0128 59 I 3.8366 7.5293 120.4847 60.5605 37.7494 177.1827 60 G 3.9657 8.6832 111.0657 44.6173 0.0000 174.0868 61 E 3.9620 8.8574 121.4301 59.1740 29.6098 179.1138 62 A 3.8440 7.9182 120.1145 55.5097 18.5573 179.0556 63 Y 4.1319 7.7409 114.1347 60.4896 38.1484 178.2709 64 L 4.1210 7.9427 120.6538 57.8901 41.6925 179.0342 65 D 4.3956 8.3516 119.0112 57.3611 40.6363 178.8450 66 L 3.9534 7.9771 119.5378 57.7709 41.6155 179.5926 67 L 4.2958 8.1114 119.1276 57.7317 41.5616 179.7741 68 G 3.6732 8.0797 105.5639 47.5960 0.0000 176.0246 69 I 3.5911 7.8986 122.3445 64.0202 37.1237 178.5444 70 W 4.1200 8.3527 119.8742 59.5817 28.7257 178.2996 71 A 3.9924 8.1851 121.0388 55.3597 17.8444 179.9258 72 S 4.2106 7.9296 113.7705 60.9285 62.9412 176.9250 73 R 3.8237 7.8510 121.9517 58.6655 29.7401 178.5724 74 L 4.0898 8.0500 120.3883 58.4138 42.1142 178.8913 75 N 3.9905 7.7670 116.0880 55.7818 38.1425 177.3483 76 A 3.7968 7.5636 122.3125 55.3466 18.4851 179.2598 77 Y 3.4723 7.8247 115.4226 60.6908 37.9374 178.5309 78 L 3.9626 7.7886 121.2513 58.3437 42.0306 179.2690 79 V 3.7012 7.5727 116.5949 66.1794 31.7406 177.2992 80 M 4.1986 8.3557 118.3530 58.8218 31.8963 178.2997 81 F 4.7148 8.5233 117.2318 60.3162 39.1471 177.0954 82 S 4.5340 8.0073 111.7416 59.5351 63.5259 175.1982 83 L 4.6231 7.6640 122.0131 53.9745 41.9314 175.4339 84 Q 3.8610 7.1401 116.9580 56.3384 28.9715 176.0850 85 D 5.0859 9.1731 122.2515 54.2434 39.4903 175.7853 86 L 4.2838 8.3382 117.8430 55.3057 42.3747 176.2051 87 A 5.1836 7.6149 120.0071 49.9488 21.4274 175.1685 88 Y 4.3793 8.6375 122.7114 57.7908 39.4872 177.0857 89 M 4.3365 7.9557 128.2155 53.0661 30.4704 174.1264 90 H 4.2788 7.3484 115.0482 55.1960 33.1597 173.3253 91 V 4.1235 8.1053 127.2285 60.1853 31.2808 173.5121 92 P 4.6847 0.0000 0.0000 63.2023 31.7976 176.2202 93 Q 4.6569 9.1240 119.1904 55.5089 29.3347 175.7671 94 S 3.5252 6.9321 112.3679 55.8301 66.7286 175.0716 95 L 3.6725 7.2406 123.4019 57.9582 41.8895 178.8333 96 E 3.9401 7.8271 118.1651 59.5492 29.4868 178.9674 97 E 4.0324 8.1080 118.5204 59.2943 29.4663 179.2542 98 F 4.1751 8.2326 120.7755 61.3750 39.2623 177.1909 99 I 3.7625 7.8281 118.4039 64.4243 37.0405 177.9297 100 Q 4.0720 7.9943 119.8910 59.2568 28.9677 177.9501 101 D 4.1576 8.2713 120.0783 57.0746 40.7806 178.5785 102 W 3.9977 8.3403 128.9643 59.9414 30.3722 177.4022 103 S 4.1929 7.4359 111.7220 60.1996 61.7081 174.4522 104 H 4.3573 7.8614 117.8780 55.7683 28.3823 176.5039 105 G 3.6293 7.3001 108.7905 45.4863 0.0000 173.3147 106 K 4.4606 6.7466 118.2636 53.7490 35.0583 175.6251 107 V 4.1703 7.9810 119.3658 62.6775 32.6876 175.0583 108 V 4.8180 8.7601 126.2791 61.1423 34.5218 173.8492 109 V 4.8861 8.6059 127.4462 61.5078 33.3338 174.3899 110 T 4.5735 9.2462 121.9489 60.5050 71.1831 173.0885 111 G 4.3349 8.1325 114.4372 44.3279 0.0000 173.0891 112 G 3.5860 7.9793 111.2050 45.5062 0.0000 172.5078 113 F 5.1452 8.3868 114.5289 58.4169 41.1075 175.8429 114 Q 4.5246 7.8008 118.6174 53.2124 32.0697 172.7648 115 P 4.2391 0.0000 0.0000 64.0007 31.8736 176.7266 116 G 3.9005 10.3860 109.0856 45.5621 0.0000 172.8004 117 Q 4.5310 7.4829 115.9217 54.8420 31.6459 172.9110 118 S 4.7292 8.2641 112.5405 56.3121 65.5922 174.8838 119 T 3.7935 8.1100 109.2063 64.0671 68.4076 176.2270 120 A 3.9308 7.5664 123.5401 55.0330 18.2561 179.3910 121 A 3.8570 7.6818 119.2912 55.0725 18.3757 179.9854 122 V 3.1888 7.4026 116.0175 65.9654 31.4983 177.7931 123 A 3.7259 8.2449 120.4902 55.1299 18.1289 179.4875 124 A 3.8206 7.9008 119.0655 55.2702 18.4333 179.8432 125 L 3.8560 7.9899 117.6967 57.9270 41.6836 180.0119 126 V 3.0514 7.7582 118.0633 65.3783 31.2690 177.9375 127 A 3.7868 7.9396 120.8462 55.0638 18.1050 179.1936 128 E 3.7891 8.2132 117.6219 59.4697 29.5219 178.9758 129 A 4.0708 7.9836 119.6783 54.1156 18.4582 178.6564 130 S 4.3029 7.6234 110.4823 57.3420 63.3768 174.2393 131 S 3.7668 7.5564 116.6971 59.9209 60.6451 171.8891 132 S 4.8898 8.1301 116.1789 57.8192 63.3643 174.7399 133 K 4.4056 8.5949 123.1275 57.3406 33.6717 176.2439 134 T 5.1464 7.7568 116.9102 61.4332 72.6433 172.3517 135 L 4.9931 8.9831 128.2121 53.2914 44.7515 174.8954 136 V 4.5784 9.0562 127.1549 61.3677 33.7679 174.5807 137 V 4.4652 8.9292 128.6355 61.1759 33.1287 173.9984 138 A 4.8689 8.7741 131.4063 51.6310 19.9232 175.8709 139 T 5.0319 9.1828 118.2843 60.1255 71.6397 173.4031 140 N 4.1461 8.3801 117.8516 52.3688 37.7017 174.7131 141 V 4.5109 7.0038 116.3484 62.2014 34.8986 175.1604 142 D 4.4038 9.0157 123.4675 56.2647 41.4337 176.6059 143 G 3.9553 7.0405 104.5010 45.8482 0.0000 172.0661 144 V 4.0109 7.8022 120.7092 62.7139 32.9648 176.2190 145 Y 5.0908 8.1199 122.6476 56.1983 42.2842 174.1740 *156 K 4.2524 8.4372 120.9066 56.3393 33.4280 174.6807 157 L 3.8678 8.5249 126.3286 54.1907 42.9197 176.5037 158 I 4.1082 7.8019 127.1368 59.5035 36.7397 174.6144 159 P 4.4091 0.0000 0.0000 65.0416 32.2083 176.1096 160 H 5.5206 7.6221 112.8699 54.1164 33.0684 172.7735 161 L 4.6503 8.6487 121.2194 55.3965 44.5566 173.4882 162 T 5.1673 9.5813 109.6304 59.4398 71.9377 175.4484 163 T 3.9129 8.4246 111.8998 64.8271 68.3477 176.4263 164 Q 4.0504 7.5386 120.3482 58.9537 29.3962 177.5690 165 D 4.5075 8.0618 120.3035 57.0329 40.6458 178.6521 166 L 4.0107 7.6799 118.3424 57.8056 41.8823 179.2528 167 R 4.0583 8.4167 116.7680 57.9729 31.3452 178.3006 168 K 4.3876 7.4269 119.7818 54.2433 28.8788 175.6183 169 I 4.2503 6.9051 118.5169 58.7526 40.9813 174.4168 *178 A 4.0895 8.3280 129.4048 53.1854 19.5600 176.7612 179 G 4.2261 8.9485 109.2751 46.0927 0.0000 174.9658 180 T 4.1599 7.8500 113.1416 63.5287 67.7815 175.6766 181 Y 4.0390 8.2535 121.4757 60.7975 38.3481 176.5520 182 E 3.8464 7.3934 119.0727 59.5748 29.9277 177.5923 183 L 4.3554 7.5433 119.2462 55.5916 42.4692 178.6042 184 L 4.2904 7.1144 118.8992 52.9634 39.8664 176.0876 185 D 4.4919 7.5444 118.5576 50.9794 44.6977 172.3306 186 P 4.2020 0.0000 0.0000 66.3319 30.9064 178.1066 187 L 3.8649 7.9038 119.2211 57.4996 42.0192 178.3922 188 A 3.9172 9.3462 121.9611 55.3257 18.2855 179.6894 189 I 3.5850 7.7365 118.0802 64.3574 37.1999 178.5030 190 K 3.8723 8.2549 120.7083 59.5586 31.9959 178.8797 191 I 3.6650 7.9508 120.0628 64.6367 37.0410 178.9075 192 V 3.6358 7.9476 113.3043 64.2997 31.1270 178.6984 193 E 3.9504 8.3597 118.7560 59.3931 29.1919 179.5510 194 R 3.9143 7.9866 114.1659 58.5442 29.6492 177.4372 195 S 4.4867 8.0916 111.8710 57.1500 63.7838 174.1398 196 K 3.7739 7.2192 118.8254 57.2966 29.3680 173.8072 197 I 4.5628 8.0496 118.4576 59.4392 39.2539 177.2319 198 R 4.2834 8.7659 126.8778 56.0096 31.6551 175.7160 199 V 4.6830 8.5190 123.2885 61.3371 33.9944 174.2963 200 I 4.6422 8.7059 130.1762 59.9607 38.8465 174.8942 201 V 4.7512 9.0732 129.1301 61.6756 33.1291 174.7618 202 M 5.3899 8.7582 124.2998 53.9827 35.6978 173.1756 203 N 5.0144 8.7888 116.6764 52.1338 39.8441 175.2541 204 Y 4.3875 8.4261 123.7775 59.4185 38.3968 177.8216 205 R 4.2972 8.6446 119.3276 57.9915 30.4226 177.1156 206 K 4.7796 7.8609 118.1956 56.0342 32.5410 178.1877 207 L 4.2072 7.6581 121.1423 56.9832 41.6269 178.5178 208 N 4.5464 8.1452 115.2980 54.7595 37.9179 175.2515 209 R 4.7181 7.7854 118.9386 55.3827 30.7557 177.7649 210 I 3.7584 7.8130 120.7428 64.4240 37.3507 177.9039 211 I 3.7689 7.5617 120.2855 64.3924 36.9097 178.0748 212 D 4.3243 7.9535 119.2053 57.2580 40.8342 178.5251 213 I 3.6639 8.0085 120.7027 64.6279 36.9674 178.3946 214 L 4.0380 8.8309 118.6574 57.9092 41.4668 179.5910 215 K 4.2450 7.7772 117.8684 58.1624 31.9869 178.1486 216 G 4.1673 7.7367 106.4593 45.7537 0.0000 173.8925 217 E 4.3909 8.2533 117.7422 55.8240 30.1504 175.3204 218 E 4.7081 7.5946 118.5073 53.4662 32.7663 175.1255 219 V 3.6875 8.2372 122.0042 62.5834 32.3068 175.0482 220 S 5.0703 7.3821 119.5997 58.6791 65.7119 175.2124 221 S 4.8008 8.3160 115.8967 56.7435 65.6205 173.5283 222 I 4.8019 8.6144 125.9419 59.5767 39.7810 174.6032 223 I 4.6997 8.9801 128.6850 60.1239 38.9363 174.4345 224 E 4.8359 9.3137 129.3349 54.2898 31.2726 173.3017 225 P 4.7533 0.0000 0.0000 62.6202 32.4576 176.6832 226 V 4.0116 8.0368 116.6365 61.5531 32.4160 175.3018 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 M 8.16 4.45 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.88 0.00 2 N 8.53 5.58 0.00 2.84 3.04 0.00 0.00 6.20 6.14 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 3 I 9.71 5.10 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.72 1.14 0.00 0.00 4 I 8.30 5.00 1.79 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.78 0.79 0.00 0.00 5 L 9.30 4.96 0.00 1.67 1.50 0.88 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 6 K 9.53 4.74 0.00 1.78 1.75 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.31 1.43 7.81 7 I 8.78 4.53 1.85 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.54 0.15 0.00 0.00 8 S 9.01 4.52 0.00 4.07 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 9 G 9.12 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 10 K 8.30 4.29 0.00 2.15 2.09 0.00 1.83 0.00 0.00 2.11 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.50 7.81 11 F 8.09 3.34 0.00 2.38 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 12 F 8.15 4.48 0.00 3.24 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 13 D 8.63 4.64 0.00 2.85 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 14 E 7.62 4.28 0.00 1.90 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 2.26 2.35 0.00 15 D 8.33 4.77 0.00 2.64 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 16 N 7.40 4.79 0.00 2.58 2.55 0.00 0.00 6.91 7.71 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 17 V 8.08 4.05 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 0.63 0.00 0.00 0.96 0.00 0.00 18 D 8.77 3.99 0.00 2.77 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 19 N 8.17 4.34 0.00 2.98 2.98 0.00 0.00 7.17 6.74 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 20 L 8.90 4.16 0.00 1.79 1.81 1.10 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.03 3.75 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.02 0.93 0.00 0.00 22 V 7.65 3.61 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 1.02 0.00 0.00 0.96 0.00 0.00 23 L 7.82 4.00 0.00 1.83 1.88 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.14 3.88 0.00 2.20 2.01 0.00 3.34 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 25 Q 7.95 3.98 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.52 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 26 S 8.44 4.10 0.00 4.00 3.89 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 27 I 8.10 3.75 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.80 0.95 0.00 0.00 28 K 7.89 3.91 0.00 2.00 1.88 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.51 7.81 29 E 8.07 3.93 0.00 2.03 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 2.33 2.32 0.00 30 L 8.34 3.74 0.00 1.87 1.83 0.12 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.43 4.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.10 4.71 0.00 2.86 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 33 N 8.19 4.90 0.00 3.15 3.21 0.00 0.00 7.15 7.21 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 34 G 8.63 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 0.00 0.00 0.00 35 F 8.79 4.93 0.00 3.12 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 36 R 8.87 5.06 0.00 2.28 1.87 0.00 2.86 0.00 0.00 3.08 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 37 V 8.51 5.23 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 1.11 0.00 0.00 1.06 0.00 0.00 38 G 9.21 4.64 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 39 I 8.98 5.23 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.76 0.94 0.00 0.00 40 V 8.85 4.85 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 0.66 0.00 0.00 0.70 0.00 0.00 41 T 8.55 4.97 4.04 0.00 0.00 0.00 0.00 0.00 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 42 G 8.75 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 43 G 8.76 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 44 G 8.06 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 45 S 9.21 4.26 0.00 4.10 4.42 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 46 T 8.00 4.00 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 1.31 0.00 0.00 47 A 7.72 4.05 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.00 3.92 0.00 1.96 2.05 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 49 R 8.40 3.88 0.00 2.04 2.16 0.00 3.07 0.00 0.00 2.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 50 Y 8.26 3.80 0.00 3.21 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 51 I 8.17 3.79 1.95 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 1.64 0.70 0.97 0.00 0.00 52 K 8.13 3.97 0.00 1.92 1.95 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.45 7.81 53 L 7.85 3.87 0.00 1.89 1.67 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.37 4.23 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.54 3.87 0.00 2.01 2.12 0.00 3.13 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 56 E 8.33 4.03 0.00 2.13 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 2.35 2.57 0.00 57 I 7.13 4.39 1.87 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 1.66 0.64 0.91 0.00 0.00 58 G 8.04 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 0.00 0.00 0.00 59 I 7.53 3.84 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 1.40 0.89 1.04 0.00 0.00 60 G 8.68 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 61 E 8.86 3.96 0.00 2.11 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 2.39 2.45 0.00 62 A 7.92 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 7.74 4.13 0.00 3.24 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 64 L 7.94 4.12 0.00 1.97 1.77 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.35 4.40 0.00 2.81 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 66 L 7.98 3.95 0.00 2.06 1.91 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.11 4.30 0.00 2.05 1.88 1.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.08 3.67 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 0.00 69 I 7.90 3.59 1.82 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 1.38 0.76 0.53 0.00 0.00 70 W 8.35 4.12 0.00 3.37 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 71 A 8.19 3.99 1.41 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 0.00 0.00 72 S 7.93 4.21 0.00 4.14 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 73 R 7.85 3.82 0.00 2.23 2.18 0.00 2.21 0.00 0.00 2.52 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 74 L 8.05 4.09 0.00 1.82 1.87 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.77 3.99 0.00 2.30 1.42 0.00 0.00 6.95 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 76 A 7.56 3.80 1.08 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 77 Y 7.82 3.47 0.00 2.93 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 0.00 0.00 0.00 0.00 78 L 7.79 3.96 0.00 1.85 1.94 1.07 1.25 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 79 V 7.57 3.70 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 0.88 0.00 0.00 1.21 0.00 0.00 80 M 8.36 4.20 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 81 F 8.52 4.71 0.00 3.23 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 82 S 8.01 4.53 0.00 4.15 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 0.00 83 L 7.66 4.62 0.00 1.92 1.76 0.97 0.98 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 84 Q 7.14 3.86 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 5.65 0.00 0.00 0.00 0.00 0.00 2.45 2.71 0.00 85 D 9.17 5.09 0.00 2.79 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 86 L 8.34 4.28 0.00 1.94 1.74 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.61 5.18 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 88 Y 8.64 4.38 0.00 2.77 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 89 M 7.96 4.34 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.48 0.00 90 H 7.35 4.28 0.00 2.68 2.76 0.00 5.71 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.11 4.12 1.58 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 0.61 0.00 0.00 -0.04 0.00 0.00 92 P 0.00 4.68 0.00 2.44 2.42 0.00 4.02 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 93 Q 9.12 4.66 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.67 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 94 S 6.93 3.53 0.00 3.69 3.70 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 95 L 7.24 3.67 0.00 1.67 1.56 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 96 E 7.83 3.94 0.00 1.98 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 2.36 2.33 0.00 97 E 8.11 4.03 0.00 2.10 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 0.00 2.40 2.33 0.00 98 F 8.23 4.18 0.00 3.33 3.32 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 0.00 99 I 7.83 3.76 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.01 0.94 0.00 0.00 100 Q 7.99 4.07 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 101 D 8.27 4.16 0.00 2.94 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 0.00 102 W 8.34 4.00 0.00 2.52 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 0.00 103 S 7.44 4.19 0.00 4.01 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 0.00 104 H 7.86 4.36 0.00 2.85 3.06 0.00 5.95 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 0.00 105 G 7.30 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 0.00 106 K 6.75 4.46 0.00 1.73 1.90 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.30 7.81 107 V 7.98 4.17 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 1.41 0.00 0.00 1.02 0.00 0.00 108 V 8.76 4.82 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 1.27 0.00 0.00 1.10 0.00 0.00 109 V 8.61 4.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00 110 T 9.25 4.57 4.43 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 1.09 0.00 0.00 111 G 8.13 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 0.00 0.00 0.00 112 G 7.98 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 0.00 113 F 8.39 5.15 0.00 3.06 2.81 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 0.00 114 Q 7.80 4.52 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.00 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 115 P 0.00 4.24 0.00 2.01 1.90 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 116 G 10.39 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 0.00 117 Q 7.48 4.53 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 118 S 8.26 4.73 0.00 3.91 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 0.00 119 T 8.11 3.79 4.06 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 0.00 0.00 1.08 0.00 0.00 120 A 7.57 3.93 1.27 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 0.00 0.00 121 A 7.68 3.86 1.29 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 0.00 0.00 0.00 122 V 7.40 3.19 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 -0.06 0.00 0.00 0.42 0.00 0.00 123 A 8.24 3.73 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 0.00 124 A 7.90 3.82 1.30 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 0.00 125 L 7.99 3.86 0.00 1.85 1.74 1.00 0.93 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 0.00 126 V 7.76 3.05 1.72 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 0.21 0.00 0.00 -0.43 0.00 0.00 127 A 7.94 3.79 1.30 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 0.00 128 E 8.21 3.79 0.00 1.99 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 0.00 2.27 2.29 0.00 129 A 7.98 4.07 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 0.00 130 S 7.62 4.30 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 0.00 131 S 7.56 3.77 0.00 4.03 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 0.00 132 S 8.13 4.89 0.00 3.86 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 0.00 133 K 8.59 4.41 0.00 1.72 1.83 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.46 7.81 134 T 7.76 5.15 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 1.23 0.00 0.00 135 L 8.98 4.99 0.00 1.66 1.45 0.85 0.78 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 0.00 136 V 9.06 4.58 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 0.91 0.00 0.00 0.94 0.00 0.00 137 V 8.93 4.47 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 0.90 0.00 0.00 0.90 0.00 0.00 138 A 8.77 4.87 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 0.00 139 T 9.18 5.03 4.28 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 1.28 0.00 0.00 140 N 8.38 4.15 0.00 2.78 2.89 0.00 0.00 5.61 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 0.00 141 V 7.00 4.51 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 1.36 0.00 0.00 0.96 0.00 0.00 142 D 9.02 4.40 0.00 2.87 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 0.00 143 G 7.04 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 0.00 144 V 7.80 4.01 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 0.91 0.00 0.00 0.87 0.00 0.00 145 Y 8.12 5.09 0.00 2.85 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 *156 K 8.44 4.25 0.00 1.85 1.81 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.50 7.81 157 L 8.52 3.87 0.00 1.48 1.48 0.74 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 158 I 7.80 4.11 1.77 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 1.30 0.95 0.87 0.00 0.00 159 P 0.00 4.41 0.00 2.01 2.24 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.83 0.00 160 H 7.62 5.52 0.00 3.07 3.16 0.00 5.68 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.65 4.65 0.00 1.84 1.73 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 162 T 9.58 5.17 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 1.21 0.00 0.00 163 T 8.42 3.91 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 1.19 0.00 0.00 164 Q 7.54 4.05 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 165 D 8.06 4.51 0.00 2.96 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 0.00 166 L 7.68 4.01 0.00 1.72 1.71 0.91 0.87 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 0.00 167 R 8.42 4.06 0.00 1.87 2.00 0.00 3.15 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 168 K 7.43 4.39 0.00 1.97 1.78 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.76 1.58 7.81 169 I 6.91 4.25 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 1.35 0.89 0.92 0.00 0.00 *178 A 8.33 4.09 1.32 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 0.00 0.00 0.00 179 G 8.95 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 0.00 0.00 0.00 0.00 180 T 7.85 4.16 4.27 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 1.35 0.00 0.00 181 Y 8.25 4.04 0.00 2.90 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 0.00 182 E 7.39 3.85 0.00 2.11 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 2.41 2.44 0.00 183 L 7.54 4.36 0.00 1.54 1.60 0.86 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.11 4.29 0.00 1.60 1.55 1.04 0.86 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 0.00 185 D 7.54 4.49 0.00 2.54 2.37 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 0.00 186 P 0.00 4.20 0.00 2.27 2.29 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 187 L 7.90 3.86 0.00 1.74 1.81 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 188 A 9.35 3.92 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 0.00 189 I 7.74 3.59 1.99 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 1.37 0.66 0.89 0.00 0.00 190 K 8.25 3.87 0.00 1.78 1.94 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 191 I 7.95 3.66 1.94 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 1.80 0.89 0.95 0.00 0.00 192 V 7.95 3.64 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 0.85 0.00 0.00 1.00 0.00 0.00 193 E 8.36 3.95 0.00 2.20 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 2.31 2.41 0.00 194 R 7.99 3.91 0.00 1.91 2.12 0.00 3.02 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.58 0.00 195 S 8.09 4.49 0.00 3.97 3.89 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 0.00 196 K 7.22 3.77 0.00 1.78 1.79 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.57 7.81 197 I 8.05 4.56 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.52 0.88 0.00 0.00 198 R 8.77 4.28 0.00 1.79 1.84 0.00 3.07 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.57 0.00 199 V 8.52 4.68 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 0.94 0.00 0.00 0.95 0.00 0.00 200 I 8.71 4.64 1.86 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 0.44 0.89 0.00 0.00 201 V 9.07 4.75 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 1.01 0.00 0.00 0.90 0.00 0.00 202 M 8.76 5.39 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 203 N 8.79 5.01 0.00 2.87 2.67 0.00 0.00 7.44 7.56 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 0.00 204 Y 8.43 4.39 0.00 3.18 3.25 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 0.00 205 R 8.64 4.30 0.00 1.92 2.09 0.00 3.13 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.86 0.00 206 K 7.86 4.78 0.00 1.93 1.78 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.38 7.81 207 L 7.66 4.21 0.00 1.63 1.75 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 208 N 8.15 4.55 0.00 2.81 2.97 0.00 0.00 5.85 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 0.00 209 R 7.79 4.72 0.00 1.86 1.94 0.00 3.20 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.55 0.00 210 I 7.81 3.76 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 1.62 0.95 0.86 0.00 0.00 211 I 7.56 3.77 1.79 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 1.28 0.43 0.84 0.00 0.00 212 D 7.95 4.32 0.00 2.81 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 0.00 213 I 8.01 3.66 1.98 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 1.71 1.34 0.90 0.00 0.00 214 L 8.83 4.04 0.00 1.75 1.80 0.84 0.95 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 0.00 215 K 7.78 4.24 0.00 1.96 1.88 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.69 7.81 216 G 7.74 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 0.00 0.00 0.00 0.00 217 E 8.25 4.39 0.00 1.96 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 2.27 2.23 0.00 218 E 7.59 4.71 0.00 1.85 1.78 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 2.16 2.29 0.00 219 V 8.24 3.69 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 0.84 0.00 0.00 0.92 0.00 0.00 220 S 7.38 5.07 0.00 4.06 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 0.00 221 S 8.32 4.80 0.00 3.64 3.67 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 0.00 222 I 8.61 4.80 1.88 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 1.20 0.72 1.04 0.00 0.00 223 I 8.98 4.70 1.85 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 1.09 0.72 0.88 0.00 0.00 224 E 9.31 4.84 0.00 2.17 1.79 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 2.24 2.28 0.00 225 P 0.00 4.75 0.00 2.10 2.02 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 226 V 8.04 4.01 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 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.