NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3623 8.4449 118.8015 55.2951 30.7268 175.4111 3 P 4.2295 0.0000 0.0000 61.4263 32.2502 175.4053 4 D 4.5342 10.5028 124.4486 53.2813 41.6523 176.6631 5 L 3.9454 7.6956 127.4699 56.9261 41.7564 178.6344 6 F 4.2179 7.4508 117.5816 60.8889 38.6409 176.4547 7 Y 4.2447 7.8541 117.8202 61.2292 38.6163 178.3882 8 I 3.5167 7.3558 118.5119 64.1195 37.0906 177.9711 9 L 4.3129 8.1492 118.6871 56.0516 41.2844 178.3099 10 G 3.9514 7.2713 104.8826 43.8111 0.0000 172.6286 11 N 4.9716 7.2788 118.3372 50.4584 42.1046 175.3503 12 K 3.9288 8.6013 125.4791 59.6362 32.3932 179.3781 13 V 3.5684 7.9559 118.6154 65.9080 31.4157 178.2787 14 R 3.8759 7.8730 117.4444 58.9752 29.8060 179.0076 15 R 3.8289 7.6966 117.5511 59.2949 30.0069 178.3755 16 D 4.3201 8.0186 117.6330 57.3906 41.1762 178.2585 17 L 4.1989 8.2121 120.8197 57.4074 41.2494 179.4834 18 L 4.0488 8.3041 119.3595 57.9080 41.3593 179.7622 19 S 4.3166 8.2408 113.0025 60.8893 63.3004 175.7507 20 H 4.0106 7.6989 120.3039 58.1457 28.7183 177.2693 21 L 4.2306 8.3034 119.0281 57.0115 41.4945 178.4304 22 T 4.2954 7.4256 110.7006 62.0908 68.1059 173.3298 23 C 4.6963 7.9861 120.2919 55.5413 46.7011 174.0009 *25 E 4.1658 8.7162 124.5445 56.0369 30.7255 176.7224 26 C 4.6270 8.1927 114.9849 56.3422 42.1845 173.4996 27 Y 4.9528 7.4480 116.1903 56.1784 40.5584 175.4062 28 F 4.5730 8.9570 120.4725 58.0536 40.0590 175.7580 29 S 4.8484 7.9876 113.1905 56.3576 65.1190 173.3200 30 L 4.3349 8.2241 121.9487 54.9136 42.0742 176.4357 31 L 4.8005 7.4137 117.7926 52.3978 45.3932 176.4536 32 S 4.5187 8.9417 117.8700 58.5183 63.5694 175.0761 33 S 4.3493 8.8134 116.6599 61.0873 63.4085 176.9313 34 K 3.8788 8.7392 120.3157 58.9396 31.9329 177.9014 35 V 3.6177 7.6275 117.9673 62.4917 31.9175 174.8652 36 S 4.5707 8.5550 122.0662 56.6636 62.5695 172.9700 37 V 4.4685 7.9435 127.2920 60.1926 34.2991 175.9515 38 S 4.3489 8.3845 121.4531 58.4099 64.9534 175.7018 39 S 4.1932 8.5513 118.7391 61.6974 62.9607 176.5686 40 T 3.8029 7.8954 116.2785 64.7788 67.1415 175.7345 41 A 4.0467 7.6852 122.7782 54.3653 18.5961 179.7832 42 V 3.4929 7.8600 116.8355 66.1394 31.6680 177.8326 43 A 4.0216 8.1476 120.9378 55.3100 18.0994 179.7997 44 K 3.9634 7.8953 116.7024 60.2575 32.4880 179.0556 45 H 4.1422 7.8768 116.6110 58.7139 28.7139 177.4221 46 L 3.9519 7.7074 119.2810 57.7349 41.7378 179.2610 47 K 4.1611 8.1223 118.3768 59.5028 31.8709 179.7693 48 I 3.9576 7.7825 117.0535 61.9272 36.6183 177.5074 *50 E 4.7501 8.0233 122.1815 56.5288 31.1004 178.1536 51 R 3.9643 8.0323 116.3698 58.9242 30.1748 177.4637 52 E 4.0689 7.9598 116.9149 56.8609 29.8355 176.9406 53 G 3.8666 7.7954 106.2234 46.5006 0.0000 174.3195 54 V 4.1418 7.7922 121.2140 63.0374 33.4531 175.0966 55 L 5.3170 7.8194 120.7296 53.0860 46.0771 174.9131 56 Q 4.7411 9.2590 124.7233 54.2652 32.3647 174.0872 57 S 4.6738 8.3836 119.9944 56.9058 65.4811 172.7814 58 Y 4.6780 8.4764 118.8647 56.2504 41.3376 174.7809 59 E 5.3475 8.7705 120.2109 53.4498 33.6524 176.0136 *69 K 4.2138 8.3390 120.4005 56.6140 34.1010 175.2862 70 K 5.3179 8.3381 117.4871 55.7930 33.7090 175.5719 71 Y 5.0897 7.8933 119.0066 55.6014 41.8191 173.4342 72 Y 5.2627 8.9739 116.8283 56.3829 41.8571 175.0525 73 K 4.7981 8.9246 121.5383 55.1320 36.2587 175.0708 74 I 4.5358 8.5233 128.3596 61.4397 37.1632 176.2458 75 S 4.5696 9.3214 124.2146 59.8780 63.3142 174.3487 76 I 4.7212 7.7530 111.6523 58.8948 41.0352 175.4238 77 A 4.6612 8.5263 124.3850 50.2292 20.7189 174.7037 78 K 5.0602 8.4316 118.2332 55.7293 36.7685 175.9861 79 S 4.9767 8.9875 119.0450 57.0528 66.1850 172.8229 80 Y 5.3234 8.8108 119.4092 56.3651 41.8422 174.9199 81 V 4.6687 8.7927 121.6095 61.3172 35.0778 174.2382 82 F 4.9179 8.0078 120.2548 56.1123 41.2484 173.3789 83 T 4.6955 8.5464 115.5413 61.8532 72.8795 173.2199 84 L 5.0005 8.7702 126.7189 53.6197 44.2562 175.1131 85 T 4.8338 8.3522 114.8255 59.0494 71.9885 172.1086 86 P 4.4172 0.0000 0.0000 64.5565 31.2754 177.2144 87 E 4.3953 8.0145 116.4941 56.2168 30.0101 175.4040 *89 F 5.2961 8.0622 120.6498 57.9645 40.2883 173.6434 90 W 4.8111 7.9979 123.3958 55.6278 31.2868 172.6868 91 Y 5.1263 7.7235 117.7899 55.8899 41.2715 174.1778 92 K 4.5998 9.4515 121.2606 55.4023 35.9777 174.9090 93 G 3.0972 8.5778 114.8154 44.7734 0.0000 172.7407 94 L 4.8292 8.4149 122.9012 52.6050 45.2888 175.4110 95 D 4.8094 8.7052 123.9276 53.8330 41.5925 176.1255 96 L 4.1078 8.8280 123.6298 53.2832 42.7991 176.9516 97 G 4.4930 8.2694 117.2160 46.5631 0.0000 171.9960 98 D 4.2649 7.6701 127.6000 54.3141 41.2464 177.4846 99 A 4.5631 8.1834 130.1239 50.7518 17.7124 176.3210 100 E 4.2573 7.8126 119.0804 54.6648 28.5467 175.7486 101 L 4.1851 8.1463 123.1259 54.3651 42.2320 176.9524 102 R 4.4820 7.9843 118.4334 54.9503 31.9143 174.0359 103 D 4.5317 8.2826 119.2168 53.9747 41.5536 176.0547 104 F 4.6875 8.6661 122.1340 55.5331 41.2276 175.0037 105 E 4.4428 8.6516 124.3095 54.4057 30.7602 175.1221 106 I 4.0642 8.3403 128.0900 60.3781 37.4486 176.2876 107 S 4.6313 8.5565 123.0398 57.1738 62.4297 173.8664 108 L 4.7299 8.1082 124.7896 54.3896 44.0464 179.3980 109 S 4.1206 8.3840 112.7654 60.9205 62.8467 174.8575 110 G 4.0265 7.9044 108.0630 45.2249 0.0000 172.4785 111 L 4.5261 7.3099 121.7056 52.7539 43.4527 175.3624 112 D 4.5696 8.5568 125.7536 54.1627 41.8169 175.9473 113 T 4.3508 8.4242 115.3113 62.3259 70.2518 174.2923 114 E 4.7668 7.9099 120.8359 54.6400 30.0943 174.0431 115 P 4.5251 0.0000 0.0000 62.9863 32.7267 176.6862 116 S 4.4348 8.7727 115.0112 59.9858 64.0586 174.6216 117 T 4.4233 7.4158 109.4867 59.4619 70.7650 173.9020 118 L 4.1535 8.3290 122.2438 57.9276 42.5905 178.2241 119 K 4.1490 7.9774 117.5857 59.3102 32.3557 178.3083 120 E 4.2166 8.3501 117.6787 57.0146 29.2316 178.8417 *122 I 4.1076 7.9279 121.3197 61.8743 39.3419 178.0930 123 T 3.9074 7.8252 116.4984 67.0069 68.1455 176.3695 124 D 4.3792 8.5916 121.0394 57.2161 40.7337 178.6378 125 F 3.8487 8.2059 120.7985 61.2195 39.5003 177.1877 126 I 3.7543 8.0543 119.4990 64.1854 36.7533 178.1635 127 K 3.8032 8.1468 119.3105 59.8874 32.0035 179.0864 128 A 3.9041 8.1365 120.5679 55.0164 18.2312 179.3943 129 N 4.1428 8.1755 115.3712 56.4310 38.2070 177.7697 130 K 4.1605 8.0693 119.8800 59.5103 32.1783 179.3461 131 E 4.0776 7.9627 118.9710 59.0448 29.2764 178.9953 132 L 3.9484 7.9715 120.6030 58.2303 42.0936 178.9274 133 E 3.9633 8.1357 118.4088 59.3100 29.2916 179.5284 134 K 4.0808 7.8162 117.4350 59.1775 32.1472 179.5698 135 V 3.4566 7.6815 118.4822 65.9344 31.4035 178.0738 136 L 4.1031 8.0829 118.7941 57.8670 41.4387 179.1923 137 E 3.8610 8.1287 118.9978 59.0598 29.4841 178.6487 138 A 3.2472 7.5860 121.1981 54.7120 18.3406 179.1851 139 F 4.2965 8.5520 119.4548 61.5126 39.6093 176.8621 140 K 3.5583 8.1207 119.1872 60.0457 31.8628 178.6932 141 T 3.8839 8.0117 115.5621 66.7288 68.3843 176.6130 142 I 3.7504 8.0215 120.8500 64.2707 37.9264 177.7459 143 E 3.9575 8.2426 119.3868 59.0277 29.2249 179.3690 144 S 4.0704 7.8708 114.9172 61.7492 62.9732 175.8620 145 Y 4.0588 8.0406 122.0418 61.0314 38.2870 178.5906 146 R 3.9207 8.1624 117.6719 59.1496 30.2149 178.7475 147 S 4.2004 7.9948 112.0611 61.4063 62.8086 175.9206 148 S 4.2743 7.8795 117.8384 61.4164 62.7055 178.4851 149 L 4.2650 7.4960 122.9960 54.8395 41.7847 178.7615 *151 R 4.2255 8.0122 118.6725 55.9266 32.1641 177.3348 152 K 3.9375 7.8900 116.6841 59.5896 31.9608 179.2791 153 I 3.9002 7.9142 118.8348 63.6607 37.8346 178.0016 154 K 3.8944 8.0176 119.1250 59.3943 32.0708 178.3985 155 E 3.8592 8.1028 119.1011 59.5251 29.5972 178.8209 156 A 4.0126 8.5783 120.8879 55.3111 18.3201 178.9783 157 Y 3.7341 8.5459 118.6050 60.2561 38.5797 177.7404 158 L 3.9302 7.6538 120.8151 58.0740 42.3467 178.9045 159 K 4.0855 7.6368 116.7037 59.5415 32.2090 178.9952 160 E 4.1552 7.7009 116.1124 58.0159 29.5432 177.2666 161 I 4.0181 7.0580 114.8259 60.8008 41.6423 176.0327 162 G 3.8652 8.2739 107.1283 45.2209 0.0000 172.7648 163 D 4.5797 7.5049 119.1506 53.6813 42.7941 176.4670 *165 T 4.2332 8.2299 115.9828 63.6552 70.5401 176.7157 166 Q 3.9935 7.9299 118.9796 58.7710 28.6343 178.6738 167 L 3.0871 7.3696 121.1387 57.6412 41.9954 178.7520 168 A 3.6549 7.5859 120.1360 55.1444 18.1737 179.1284 169 I 3.6385 7.3275 117.7717 64.7033 37.1741 178.2243 170 L 3.9010 7.7226 120.7015 58.4185 41.7356 178.3315 171 H 4.0267 8.6576 118.3864 59.5225 29.7073 176.5705 172 Y 3.9579 8.4228 121.4802 60.8199 38.7022 177.9630 173 L 4.0596 8.4024 120.1326 57.6531 41.4517 179.4924 174 L 4.0255 8.1356 118.8482 57.3374 41.5787 178.7856 175 L 4.2432 7.4361 117.8610 55.9842 42.3054 177.7139 176 N 4.7441 8.1428 114.0790 52.0332 39.6640 175.7112 177 G 4.2856 9.1978 111.6273 45.3710 0.0000 173.9547 178 R 5.0729 7.7891 112.7506 55.0363 32.9165 174.8883 179 A 4.8772 8.5707 120.9655 51.0421 23.1646 176.3398 180 T 4.4758 9.7833 113.4972 61.2766 70.2563 175.9496 181 V 3.5543 8.8023 122.8502 66.3312 31.3530 178.0264 182 E 3.8936 8.1128 118.1777 59.4190 29.5981 178.3375 183 E 3.9077 7.9087 118.2847 59.4654 29.4880 179.4984 184 L 3.8306 7.9087 119.1120 57.5493 41.6725 179.6498 185 S 4.0845 8.3811 114.6497 61.5593 62.9226 175.8109 186 D 4.4357 8.1935 123.7854 56.2727 40.6749 178.3694 187 R 3.9098 7.8588 117.6439 58.8841 30.1767 177.5090 188 L 4.6062 7.9830 115.5793 53.4651 42.8797 175.9245 189 N 4.2055 8.2649 115.3618 53.9429 36.0799 173.2576 190 L 4.7858 7.7937 116.6259 52.2487 46.2304 176.1463 191 K 4.2915 8.3215 122.1947 55.9069 34.1005 178.4113 192 E 3.9779 8.6729 121.5989 59.6629 29.4515 179.7390 193 R 3.9442 8.0536 117.5482 59.6662 30.1725 178.8147 194 E 4.0200 8.1065 117.5636 59.2081 29.5377 179.3644 195 V 3.6188 7.9524 118.4418 66.1244 31.7290 178.3808 196 R 3.9646 8.1790 117.8354 58.9145 29.7943 178.7103 197 E 3.9221 8.2270 119.2665 59.2246 29.5062 178.8618 198 K 3.9519 7.8772 116.9681 59.6545 32.2464 178.8460 199 I 3.8906 7.6164 118.4778 64.6891 37.1486 178.1046 200 S 4.3306 7.7663 111.9536 61.2012 62.2404 176.4811 201 E 4.2104 8.3729 118.9011 56.7143 29.3104 177.8004 *203 A 4.7482 7.8790 121.6531 52.0387 20.4107 178.5520 204 R 4.1339 7.8999 112.7665 56.6449 30.6716 176.9114 205 F 4.7748 8.0092 114.3321 57.1555 41.3626 175.5939 206 V 4.3336 7.6042 119.9715 60.2780 33.9968 171.7738 207 P 4.6173 0.0000 0.0000 63.2599 31.6963 175.7863 208 V 5.0332 8.2811 117.3872 59.4529 35.2872 174.5874 209 K 4.7398 9.0514 120.3601 55.9892 36.6397 174.8307 210 I 5.1345 8.2661 120.5159 59.4291 40.0721 175.1249 211 I 4.3370 8.6335 120.4821 59.8188 40.1049 175.6665 212 N 4.3789 9.6226 121.7066 54.5650 36.4309 175.6217 213 D 4.8710 8.3592 122.4534 54.9841 39.9149 175.3905 214 N 4.7821 8.2909 114.4359 53.6744 40.6024 174.8455 215 T 4.9139 7.7869 116.5113 61.6655 71.0747 173.5251 216 V 4.5410 9.2003 128.0054 61.7288 33.4986 174.8909 217 V 4.7294 8.4683 126.5568 61.0210 35.2537 174.0839 218 L 4.3125 8.6378 127.7027 54.9674 42.6361 177.6413 219 D 4.6110 9.4263 124.0541 53.0823 40.2878 176.6195 220 E 4.0225 8.4620 126.1798 58.8728 29.4601 178.1347 221 D 4.3904 8.1896 118.6917 57.6421 40.6761 178.8028 222 Q 3.9721 7.7594 118.2641 59.3185 29.2348 177.6741 223 I 3.8439 7.4909 119.3174 64.1789 37.1822 177.7603 224 L 4.3960 8.0599 118.8063 56.2863 41.9430 176.9480 225 R 4.1699 7.6449 119.4512 56.7060 29.4757 174.4036 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 E 8.44 4.36 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.39 0.00 3 P 0.00 4.23 0.00 2.14 2.18 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 4 D 10.50 4.53 0.00 2.66 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 5 L 7.70 3.95 0.00 0.93 1.33 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 6 F 7.45 4.22 0.00 3.12 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 7 Y 7.85 4.24 0.00 2.93 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 8 I 7.36 3.52 1.79 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 1.75 0.91 0.81 0.00 0.00 9 L 8.15 4.31 0.00 1.74 1.69 0.88 0.89 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 10 G 7.27 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 11 N 7.28 4.97 0.00 2.57 2.43 0.00 0.00 6.86 5.89 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 12 K 8.60 3.93 0.00 1.83 1.75 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.48 7.81 13 V 7.96 3.57 2.05 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 0.78 0.00 0.00 0.91 0.00 0.00 14 R 7.87 3.88 0.00 1.87 1.83 0.00 3.26 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.40 0.00 15 R 7.70 3.83 0.00 2.02 1.96 0.00 3.13 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 16 D 8.02 4.32 0.00 2.87 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 17 L 8.21 4.20 0.00 1.78 1.61 0.81 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.30 4.05 0.00 1.80 1.72 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.24 4.32 0.00 4.04 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 20 H 7.70 4.01 0.00 3.26 3.14 0.00 5.82 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 21 L 8.30 4.23 0.00 1.58 1.79 0.85 0.94 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 22 T 7.43 4.30 4.60 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 1.37 0.00 0.00 23 C 7.99 4.70 0.00 2.79 2.83 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 *25 E 8.72 4.17 0.00 1.92 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 2.14 2.28 0.00 26 C 8.19 4.63 0.00 2.20 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 27 Y 7.45 4.95 0.00 2.90 2.96 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 28 F 8.96 4.57 0.00 3.07 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 29 S 7.99 4.85 0.00 3.83 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 30 L 8.22 4.33 0.00 1.69 1.60 0.96 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.41 4.80 0.00 1.50 1.42 0.88 0.68 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 32 S 8.94 4.52 0.00 3.80 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 33 S 8.81 4.35 0.00 4.02 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 34 K 8.74 3.88 0.00 1.72 1.91 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.51 7.81 35 V 7.63 3.62 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 0.74 0.00 0.00 0.92 0.00 0.00 36 S 8.56 4.57 0.00 3.84 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 37 V 7.94 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 0.93 0.00 0.00 0.92 0.00 0.00 38 S 8.38 4.35 0.00 4.08 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 39 S 8.55 4.19 0.00 4.08 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 40 T 7.90 3.80 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 41 A 7.69 4.05 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 42 V 7.86 3.49 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 0.96 0.00 0.00 0.97 0.00 0.00 43 A 8.15 4.02 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 44 K 7.90 3.96 0.00 2.05 2.04 0.00 1.45 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.35 7.81 45 H 7.88 4.14 0.00 3.31 3.30 0.00 5.66 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.71 3.95 0.00 1.65 1.31 0.65 0.17 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 47 K 8.12 4.16 0.00 2.02 1.88 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.66 7.81 48 I 7.78 3.96 2.05 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 1.50 1.28 1.00 0.00 0.00 *50 E 8.02 4.75 0.00 2.25 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 2.28 2.47 0.00 51 R 8.03 3.96 0.00 2.02 2.00 0.00 3.22 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 52 E 7.96 4.07 0.00 2.15 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 0.00 2.40 2.33 0.00 53 G 7.80 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 54 V 7.79 4.14 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 0.78 0.00 0.00 0.93 0.00 0.00 55 L 7.82 5.32 0.00 1.76 1.49 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 9.26 4.74 0.00 2.02 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.53 0.00 0.00 0.00 0.00 0.00 1.91 1.74 0.00 57 S 8.38 4.67 0.00 3.30 3.54 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 58 Y 8.48 4.68 0.00 2.02 2.47 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 59 E 8.77 5.35 0.00 1.87 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 2.17 2.14 0.00 *69 K 8.34 4.21 0.00 2.04 2.10 0.00 1.37 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.55 7.81 70 K 8.34 5.32 0.00 1.73 1.38 0.00 1.74 0.00 0.00 2.41 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.23 1.32 7.81 71 Y 7.89 5.09 0.00 3.03 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 72 Y 8.97 5.26 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 73 K 8.92 4.80 0.00 2.22 1.70 0.00 1.75 0.00 0.00 1.97 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.62 7.81 74 I 8.52 4.54 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 1.03 0.00 0.00 75 S 9.32 4.57 0.00 3.86 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 76 I 7.75 4.72 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 1.30 0.69 0.94 0.00 0.00 77 A 8.53 4.66 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 78 K 8.43 5.06 0.00 1.70 1.79 0.00 1.77 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.49 7.81 79 S 8.99 4.98 0.00 3.42 3.36 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 80 Y 8.81 5.32 0.00 2.86 2.96 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 81 V 8.79 4.67 2.18 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 0.88 0.00 0.00 0.83 0.00 0.00 82 F 8.01 4.92 0.00 3.18 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 83 T 8.55 4.70 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 84 L 8.77 5.00 0.00 1.70 1.63 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.35 4.83 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 1.30 0.00 0.00 86 P 0.00 4.42 0.00 2.10 2.17 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 87 E 8.01 4.40 0.00 2.05 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 2.31 2.42 0.00 *89 F 8.06 5.30 0.00 3.05 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 90 W 8.00 4.81 0.00 3.34 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 91 Y 7.72 5.13 0.00 3.32 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 92 K 9.45 4.60 0.00 2.21 1.82 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.79 7.81 93 G 8.58 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 0.00 0.00 0.00 94 L 8.41 4.83 0.00 1.36 1.43 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.71 4.81 0.00 2.54 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.83 4.11 0.00 1.53 1.55 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.27 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 0.00 0.00 0.00 0.00 98 D 7.67 4.26 0.00 2.69 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 99 A 8.18 4.56 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 0.00 100 E 7.81 4.26 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 101 L 8.15 4.19 0.00 1.62 1.58 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.98 4.48 0.00 1.60 1.70 0.00 2.52 0.00 0.00 3.01 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.67 0.00 103 D 8.28 4.53 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.67 4.69 0.00 2.99 2.95 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 0.00 105 E 8.65 4.44 0.00 1.86 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 2.18 2.36 0.00 106 I 8.34 4.06 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.96 0.90 0.00 0.00 107 S 8.56 4.63 0.00 3.88 3.83 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 0.00 108 L 8.11 4.73 0.00 1.64 1.62 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.38 4.12 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.90 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 0.00 0.00 0.00 111 L 7.31 4.53 0.00 1.80 1.55 0.90 1.38 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 0.00 112 D 8.56 4.57 0.00 2.66 2.68 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 0.00 113 T 8.42 4.35 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 0.00 114 E 7.91 4.77 0.00 1.96 1.90 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 2.23 2.21 0.00 115 P 0.00 4.53 0.00 2.19 2.25 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 116 S 8.77 4.43 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 0.00 117 T 7.42 4.42 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 118 L 8.33 4.15 0.00 1.60 1.72 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 119 K 7.98 4.15 0.00 1.95 1.84 0.00 1.83 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.53 1.03 7.81 120 E 8.35 4.22 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 *122 I 7.93 4.11 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 1.36 0.96 0.90 0.00 0.00 123 T 7.83 3.91 4.41 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 1.22 0.00 0.00 124 D 8.59 4.38 0.00 2.70 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 0.00 125 F 8.21 3.85 0.00 3.16 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 0.00 126 I 8.05 3.75 1.91 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 1.55 0.60 0.92 0.00 0.00 127 K 8.15 3.80 0.00 2.07 1.87 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.37 7.81 128 A 8.14 3.90 1.11 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 0.00 129 N 8.18 4.14 0.00 2.90 2.81 0.00 0.00 6.96 7.38 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 0.00 130 K 8.07 4.16 0.00 1.91 1.85 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.61 7.81 131 E 7.96 4.08 0.00 1.91 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 2.50 2.61 0.00 132 L 7.97 3.95 0.00 1.79 1.79 1.04 0.40 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 0.00 133 E 8.14 3.96 0.00 2.26 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 2.30 2.39 0.00 134 K 7.82 4.08 0.00 2.03 2.08 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.68 7.81 135 V 7.68 3.46 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 0.86 0.00 0.00 0.92 0.00 0.00 136 L 8.08 4.10 0.00 1.91 1.77 1.11 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.13 3.86 0.00 2.18 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 2.54 2.57 0.00 138 A 7.59 3.25 0.69 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 0.00 0.00 139 F 8.55 4.30 0.00 3.01 3.22 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 0.00 140 K 8.12 3.56 0.00 1.85 2.04 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.44 7.81 141 T 8.01 3.88 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 1.36 0.00 0.00 142 I 8.02 3.75 1.91 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 1.59 1.55 1.10 0.00 0.00 143 E 8.24 3.96 0.00 1.71 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 1.99 1.72 0.00 144 S 7.87 4.07 0.00 4.07 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 0.00 145 Y 8.04 4.06 0.00 3.10 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 0.00 146 R 8.16 3.92 0.00 1.88 1.99 0.00 3.31 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.95 0.00 147 S 7.99 4.20 0.00 3.97 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 0.00 148 S 7.88 4.27 0.00 3.92 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 0.00 149 L 7.50 4.26 0.00 1.34 1.37 0.80 0.78 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 *151 R 8.01 4.23 0.00 1.89 2.14 0.00 3.23 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 152 K 7.89 3.94 0.00 2.00 1.82 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.55 7.81 153 I 7.91 3.90 1.91 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.96 0.00 0.00 154 K 8.02 3.89 0.00 2.00 1.82 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.50 7.81 155 E 8.10 3.86 0.00 2.18 2.14 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 2.30 2.33 0.00 156 A 8.58 4.01 1.36 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 0.00 157 Y 8.55 3.73 0.00 3.25 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 0.00 158 L 7.65 3.93 0.00 1.77 1.89 0.89 0.66 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 0.00 159 K 7.64 4.09 0.00 1.77 1.81 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.45 7.81 160 E 7.70 4.16 0.00 1.87 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 2.29 2.31 0.00 161 I 7.06 4.02 0.87 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.33 -0.26 0.00 0.00 162 G 8.27 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 0.00 163 D 7.50 4.58 0.00 2.69 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 *165 T 8.23 4.23 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 1.25 0.00 0.00 166 Q 7.93 3.99 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.44 0.00 167 L 7.37 3.09 0.00 1.24 1.38 0.63 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 168 A 7.59 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 I 7.33 3.64 2.01 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 1.39 0.72 0.93 0.00 0.00 170 L 7.72 3.90 0.00 1.64 1.58 0.95 0.96 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 0.00 171 H 8.66 4.03 0.00 3.20 3.47 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.42 3.96 0.00 3.27 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 0.00 173 L 8.40 4.06 0.00 1.76 1.74 0.97 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 174 L 8.14 4.03 0.00 1.66 1.69 0.91 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 0.00 175 L 7.44 4.24 0.00 1.33 1.58 0.81 0.98 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 0.00 176 N 8.14 4.74 0.00 2.22 2.52 0.00 0.00 6.89 7.34 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 0.00 177 G 9.20 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 R 7.79 5.07 0.00 1.84 1.89 0.00 3.12 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 179 A 8.57 4.88 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 0.00 180 T 9.78 4.48 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 1.23 0.00 0.00 181 V 8.80 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 1.04 0.00 0.00 1.01 0.00 0.00 182 E 8.11 3.89 0.00 2.07 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 2.37 2.67 0.00 183 E 7.91 3.91 0.00 2.12 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 2.34 2.36 0.00 184 L 7.91 3.83 0.00 1.82 1.66 0.91 0.48 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 0.00 185 S 8.38 4.08 0.00 4.15 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 D 8.19 4.44 0.00 2.78 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 0.00 187 R 7.86 3.91 0.00 1.90 2.05 0.00 3.05 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.74 0.00 188 L 7.98 4.61 0.00 1.72 1.80 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 189 N 8.26 4.21 0.00 2.87 2.87 0.00 0.00 6.68 7.85 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 0.00 190 L 7.79 4.79 0.00 1.72 1.48 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 191 K 8.32 4.29 0.00 1.84 1.70 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.46 7.81 192 E 8.67 3.98 0.00 2.01 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 0.00 2.40 2.40 0.00 193 R 8.05 3.94 0.00 1.94 2.00 0.00 3.24 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.31 0.00 194 E 8.11 4.02 0.00 2.13 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 2.39 2.36 0.00 195 V 7.95 3.62 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 1.03 0.00 0.00 1.02 0.00 0.00 196 R 8.18 3.96 0.00 2.13 1.97 0.00 3.19 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 197 E 8.23 3.92 0.00 2.11 2.14 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 2.32 2.52 0.00 198 K 7.88 3.95 0.00 1.93 1.90 0.00 1.84 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.76 1.67 7.81 199 I 7.62 3.89 1.90 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 1.44 0.59 0.94 0.00 0.00 200 S 7.77 4.33 0.00 3.99 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 0.00 201 E 8.37 4.21 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.65 0.00 *203 A 7.88 4.75 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 0.00 204 R 7.90 4.13 0.00 1.31 1.45 0.00 3.27 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.21 0.00 205 F 8.01 4.77 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 V 7.60 4.33 2.23 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 1.11 0.00 0.00 1.18 0.00 0.00 207 P 0.00 4.62 0.00 2.14 2.03 0.00 3.64 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 2.14 2.14 0.00 208 V 8.28 5.03 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 0.83 0.00 0.00 0.97 0.00 0.00 209 K 9.05 4.74 0.00 1.76 1.88 0.00 1.26 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.43 7.81 210 I 8.27 5.13 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 1.42 0.70 0.98 0.00 0.00 211 I 8.63 4.34 1.88 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 1.23 0.82 0.92 0.00 0.00 212 N 9.62 4.38 0.00 2.86 2.87 0.00 0.00 7.20 8.08 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 0.00 213 D 8.36 4.87 0.00 2.85 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 0.00 214 N 8.29 4.78 0.00 2.63 2.85 0.00 0.00 6.91 6.82 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 0.00 215 T 7.79 4.91 4.37 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 1.24 0.00 0.00 216 V 9.20 4.54 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 0.95 0.00 0.00 0.99 0.00 0.00 217 V 8.47 4.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.96 0.00 0.00 218 L 8.64 4.31 0.00 1.60 1.62 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 219 D 9.43 4.61 0.00 2.76 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 0.00 220 E 8.46 4.02 0.00 2.06 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 0.00 2.42 2.57 0.00 221 D 8.19 4.39 0.00 2.88 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 0.00 222 Q 7.76 3.97 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 223 I 7.49 3.84 1.89 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 1.55 0.79 0.94 0.00 0.00 224 L 8.06 4.40 0.00 1.67 1.73 0.93 1.15 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 0.00 225 R 7.64 4.17 0.00 1.83 1.83 0.00 3.21 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.