NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4932 8.3049 118.1942 55.0075 32.5905 174.2781 2 L 4.5964 8.2546 119.1062 50.9261 44.8721 175.7526 3 D 4.8255 8.6687 124.2233 51.9553 43.6399 176.8794 4 A 3.9446 8.9403 120.7857 55.1676 18.0511 180.0017 5 F 3.9891 8.0832 115.6399 60.7999 39.1665 177.5126 6 A 4.0914 9.2262 120.6882 55.1414 18.1046 179.5881 7 K 3.9234 8.2523 118.2141 59.5823 32.2351 179.3199 8 V 3.5747 7.5651 118.4157 65.8498 31.3924 178.1394 9 V 3.5858 7.8888 117.8654 66.0486 31.4682 177.9084 10 A 4.0047 8.4330 120.8871 55.2073 17.7989 179.7058 11 Q 3.9328 8.1440 116.4030 58.9862 28.7632 178.7333 12 A 3.8475 8.4539 122.2943 55.1833 18.3641 179.1899 13 D 4.2005 8.5111 116.7719 57.4070 41.1021 178.3267 14 A 4.0162 7.7919 119.5681 54.2454 18.4132 178.6835 15 R 4.4333 7.2384 114.1093 54.9720 30.7626 176.4116 16 G 3.8637 8.0275 106.8637 46.7261 0.0000 173.5915 17 E 4.7533 8.2234 117.9851 53.9004 32.2226 176.3630 18 F 4.3546 8.5342 119.7967 56.6640 40.0149 175.9490 19 L 4.3555 8.3941 123.3976 54.8279 42.2936 177.9308 20 S 4.5691 9.7018 117.7662 57.8263 65.5265 175.2629 21 N 4.5016 8.6380 119.5744 56.7076 38.2154 177.9071 22 T 3.9121 7.8212 116.8640 66.7119 68.6829 176.6771 23 Q 4.0157 8.0745 120.0092 58.9595 28.6623 178.7378 24 L 4.0839 8.4652 120.4486 57.9253 41.6196 179.3804 25 D 4.3473 8.2032 118.7782 57.2073 40.7722 178.6327 26 A 4.0532 7.9601 121.3766 54.9522 18.2537 179.7584 27 L 3.8834 8.1727 117.5354 57.7621 41.6556 179.2398 28 A 4.0594 8.3249 120.9966 55.4110 18.3628 179.4189 29 N 4.2868 8.2814 114.7229 56.8996 38.4347 177.5858 30 M 4.1428 7.8132 118.6899 58.4164 32.2484 178.6153 31 I 3.9954 8.2012 120.1542 64.3150 37.0516 178.3185 32 A 4.1130 8.1261 120.9745 54.5790 18.5011 178.5013 33 E 4.4829 8.0244 115.1970 56.4306 29.6825 178.3851 34 G 3.7418 7.9371 108.1855 48.0945 0.0000 175.6957 35 N 4.3627 8.1623 118.6722 55.9871 38.6147 177.5077 36 K 3.9806 8.0176 119.3456 59.4490 32.1931 179.2678 37 R 3.9556 8.1508 119.0434 59.3878 29.9290 178.5986 38 L 4.0613 8.2506 119.2136 57.8102 41.5509 179.1383 39 D 4.3809 8.3676 119.1840 57.3543 40.8459 178.9582 40 I 3.7227 7.7765 120.2610 64.4522 37.1279 178.6583 41 V 3.6284 7.8219 119.1041 66.0380 31.2570 177.5372 42 N 4.3704 8.5722 117.1577 56.7142 38.5270 177.0901 43 R 3.9509 8.0083 118.8662 59.1353 30.3412 178.8752 44 I 3.9097 7.7332 119.2915 64.5874 36.9684 178.2300 45 N 4.3657 8.3077 116.2718 56.5145 38.4605 177.4287 46 S 4.4026 8.3808 115.4071 60.2607 63.0382 174.7327 47 N 4.9907 7.7796 117.7983 52.5064 39.6899 176.1123 48 A 3.9943 8.2506 122.5852 55.6574 18.3600 180.5387 49 S 4.0536 8.1305 112.7831 61.7255 62.8228 176.8266 50 A 3.9926 7.9039 122.8459 55.1454 18.0866 179.4925 51 I 3.6101 7.9650 118.5976 64.5461 37.0966 178.8295 52 V 3.6445 8.0188 119.0400 66.2516 31.4854 178.2854 53 S 4.1501 8.5106 115.2567 61.7175 62.6850 176.5982 54 N 4.4266 8.4688 119.4246 56.3896 38.2693 177.7402 55 S 4.0722 7.8763 116.4079 61.3216 62.7963 176.6031 56 A 3.5747 8.2431 123.9168 54.8553 18.1133 179.4912 57 R 3.9194 8.4284 117.4923 59.6763 30.1294 178.6177 58 A 3.9495 7.9324 120.4533 54.9275 18.2726 179.3606 59 L 3.7390 7.6168 118.8020 58.3920 41.9226 179.3447 60 F 4.4622 7.9018 117.5638 60.2150 38.5556 177.5934 61 A 4.1734 7.9187 120.2216 54.8713 18.2803 178.9655 62 E 4.2803 8.1109 115.7835 57.4829 31.3415 177.1644 63 Q 4.6907 8.1195 117.9831 52.5552 29.4192 173.9689 64 P 4.5907 0.0000 0.0000 64.9620 31.4799 178.5082 65 Q 4.2343 8.1466 117.0092 58.9401 28.1563 178.3825 66 L 4.0614 7.9449 121.0611 57.0032 41.7693 177.7649 67 I 4.1609 7.3667 109.6870 60.7911 38.6372 176.0184 68 Q 4.1132 7.7124 119.7905 54.7663 29.3292 173.4642 69 P 2.9700 0.0000 0.0000 64.1023 31.4686 177.1408 70 G 4.0655 8.7985 110.7412 45.4395 0.0000 173.7583 71 G 4.4685 8.3551 114.8727 44.5775 0.0000 175.3887 *73 A 4.1633 8.6643 127.2293 51.3300 19.6733 176.0401 74 Y 4.2915 7.7416 119.0529 59.2316 39.7749 175.9842 75 T 3.0648 7.5847 112.9452 62.0646 68.7440 172.6241 76 N 4.2705 8.3226 119.8817 56.0901 38.5326 177.8191 77 R 3.8282 7.7637 120.0302 59.5392 30.2496 178.6666 78 R 3.9641 7.6495 118.0085 59.2374 30.0219 178.5962 79 M 3.9308 8.3337 118.2556 58.5908 32.1265 178.1161 80 A 3.9760 8.5072 120.9840 55.1739 18.5060 179.4908 81 A 3.9700 8.1185 119.3204 55.2634 18.4289 179.5073 82 C 4.1310 8.3749 117.3442 62.7146 31.6562 175.7522 83 L 4.0736 8.2183 120.7733 57.7837 41.1916 179.4727 84 R 3.9119 8.3858 118.9332 59.6666 30.0062 178.2943 85 D 4.5298 8.6231 119.0480 57.7169 40.8097 178.7715 86 M 4.1220 8.2287 119.2505 58.3628 31.8891 178.4530 87 E 3.9852 8.4909 119.7716 59.1721 29.7089 178.8672 88 I 3.7577 8.2511 120.4080 64.4067 37.1250 178.5473 89 V 3.6544 8.0716 119.1158 65.9778 31.3954 177.8234 90 L 3.9588 8.1262 120.0869 58.0751 41.8532 179.1643 91 R 3.4557 8.1779 118.3649 59.3977 29.8914 178.6907 92 Y 3.5586 7.8206 116.6310 60.7242 37.7049 178.8802 93 V 3.3397 7.8845 119.7455 65.8771 31.5854 178.3045 94 S 4.0180 7.8445 113.9998 61.5480 62.7539 176.1279 95 Y 4.2703 7.7906 120.5837 60.8371 37.5844 178.1586 96 A 3.9493 8.0170 123.4040 54.3851 18.0813 179.3210 97 E 4.0175 7.9480 117.1863 59.5382 29.8487 178.6665 98 I 3.8966 7.7189 117.2634 63.6871 38.3642 177.2887 99 A 4.2722 8.3746 121.6161 52.4424 17.9900 178.3873 100 G 4.2115 8.2678 104.6704 45.6102 0.0000 172.9849 101 D 4.7370 7.5212 117.4121 51.6943 44.2024 175.6237 102 S 4.3044 8.8628 120.1690 58.7884 63.3537 176.0025 103 S 4.1178 8.4031 119.9494 62.1645 62.5165 176.8940 104 V 3.6520 7.8337 122.8305 64.0316 30.8485 177.9140 105 L 3.9446 7.8099 120.2728 58.0677 42.1418 178.5124 106 D 4.2964 8.2563 118.9836 57.4877 40.5724 178.5947 107 D 4.3060 8.1296 118.1895 57.2351 41.1398 178.1599 108 R 4.1274 7.7611 116.3908 57.5087 30.7895 176.5812 109 C 4.2265 7.6317 115.0362 60.5380 33.5126 174.7899 110 L 4.0920 8.0130 119.1586 56.5312 41.6409 176.3601 111 N 4.4062 7.8179 116.4182 54.8763 38.4180 175.4943 112 G 4.4182 8.9027 112.0734 45.4950 0.0000 174.3595 113 L 3.6376 7.8452 121.7855 58.2043 42.0973 178.6758 114 R 3.9651 7.9995 117.9926 59.6215 29.8527 178.2156 115 E 4.0088 7.9453 117.8331 59.4859 29.6164 178.9966 116 T 3.7923 7.9206 115.8838 67.0666 68.5343 176.2574 117 Y 4.4726 8.0121 118.5893 61.1279 37.6287 178.4710 118 Q 4.0478 7.9563 117.6294 59.0401 28.9425 178.4809 119 A 4.1517 8.1014 120.7023 54.9894 18.4373 179.2729 120 L 4.2474 7.8845 116.9292 55.6808 41.8131 178.3237 121 G 3.9392 8.1862 105.8764 45.6620 0.0000 172.9357 122 T 4.1468 7.6899 116.3747 61.4865 69.4383 172.7112 123 P 4.3212 0.0000 0.0000 62.4169 31.4058 177.2607 124 G 3.5899 8.7246 111.9941 47.5837 0.0000 174.4691 125 S 4.1948 7.9933 116.0061 61.4042 63.0466 176.6916 126 S 4.1076 7.8759 118.5905 61.2992 62.4981 176.7111 127 V 3.4857 7.6065 120.3808 65.7788 31.2372 177.8043 128 A 3.9965 7.9989 120.7124 54.9690 18.0927 179.7953 129 V 3.4753 7.6467 116.3782 65.9456 31.6224 178.0038 130 A 3.8750 7.9466 120.5321 55.3913 18.1427 179.7267 131 I 3.7452 7.9331 118.2999 64.4975 37.1244 178.3286 132 E 3.8564 8.6119 120.6452 59.1499 29.4361 179.0835 133 K 4.0739 8.2492 118.8805 59.6107 32.0161 179.3144 134 M 3.9781 7.9482 119.0975 57.8848 31.8466 178.6504 135 K 2.0000 7.6513 120.0893 58.9133 32.3221 178.6224 136 E 3.8519 8.0062 118.5820 59.4254 29.3659 179.3382 137 A 3.9677 7.8909 120.6938 55.0921 18.3921 179.9914 138 S 4.0862 7.9833 113.8851 61.7852 63.0240 177.0674 139 V 3.7464 8.2253 121.3206 65.8882 30.9658 178.0561 140 S 4.0928 7.7791 112.2908 61.4093 62.5313 175.5754 141 D 4.4761 8.1424 121.4588 57.3370 40.3539 178.6338 142 A 4.0950 8.2813 120.6703 54.8357 18.4653 178.5782 143 N 4.6637 7.9989 112.5703 52.9500 39.0284 174.6323 144 D 4.6066 7.4324 121.9441 53.2814 41.8065 176.3786 145 S 4.2551 8.6311 121.2363 59.9381 63.7610 173.9715 146 S 4.1667 8.5360 116.7907 60.3645 62.1931 173.6274 147 G 4.0925 9.3568 116.1817 45.0581 0.0000 172.9106 148 T 4.7126 7.5874 108.1716 58.6042 71.5586 172.0674 149 P 4.4082 0.0000 0.0000 62.2525 31.9791 176.9646 150 S 4.1914 8.6951 118.8335 58.6364 63.2954 173.7855 151 G 3.8671 7.8751 111.6030 45.5854 0.0000 171.6552 152 D 4.6772 8.6753 119.1094 53.3882 41.7892 175.4556 153 C 4.8760 8.5154 122.6589 59.2320 29.5742 175.5915 154 S 4.1059 8.7693 119.0421 61.9285 62.0060 176.8484 155 S 4.0838 8.0003 117.7963 61.4715 62.6413 176.4513 156 L 4.0088 7.8858 121.0389 58.0466 41.4033 179.7395 157 S 4.1533 8.4513 115.0616 61.2725 62.8103 176.5936 158 A 3.9571 8.1239 123.6263 55.1095 18.0365 179.1944 159 E 3.6277 8.4087 118.2297 59.2383 29.6316 178.8049 160 L 4.2707 8.3013 120.7407 58.2274 42.1842 179.1316 161 G 3.8131 8.2912 105.6611 48.2354 0.0000 175.7650 162 T 3.8704 7.7569 117.7650 66.5933 68.5188 176.4046 163 Y 4.3364 7.3534 118.1965 61.1953 37.8035 178.6256 164 F 4.2246 8.1636 118.3109 60.7000 39.0329 177.4427 165 D 4.4346 8.5282 118.6277 57.4665 40.6883 179.0456 166 R 3.9867 8.3792 118.5139 59.1472 29.9155 179.0275 167 A 4.0213 8.0172 120.0575 55.1439 18.2276 179.5388 168 A 4.0133 8.1587 118.3903 55.3513 18.7769 179.8674 169 S 4.2267 8.2886 113.5396 61.7680 62.7811 176.7157 170 A 4.0878 7.7558 121.8736 55.0341 18.1845 179.4143 171 V 4.0005 7.5422 108.9940 62.6265 31.9164 176.3525 172 S 4.3716 7.8204 118.0672 58.2234 62.3601 173.2673 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 8.30 4.49 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 2 L 8.25 4.60 0.00 1.62 1.59 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.67 4.83 0.00 3.25 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 4 A 8.94 3.94 1.13 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 0.00 0.00 5 F 8.08 3.99 0.00 3.25 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 6 A 9.23 4.09 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 7 K 8.25 3.92 0.00 1.94 1.95 0.00 1.80 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 8 V 7.57 3.57 2.22 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 0.94 0.00 0.00 0.94 0.00 0.00 9 V 7.89 3.59 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 1.04 0.00 0.00 0.98 0.00 0.00 10 A 8.43 4.00 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 11 Q 8.14 3.93 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 12 A 8.45 3.85 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 13 D 8.51 4.20 0.00 2.81 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 14 A 7.79 4.02 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 15 R 7.24 4.43 0.00 1.86 1.96 0.00 3.29 0.00 0.00 3.30 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 16 G 8.03 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 0.00 0.00 0.00 17 E 8.22 4.75 0.00 1.91 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 2.27 2.43 0.00 18 F 8.53 4.35 0.00 3.06 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 19 L 8.39 4.36 0.00 1.70 1.67 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 S 9.70 4.57 0.00 4.02 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 21 N 8.64 4.50 0.00 2.76 2.92 0.00 0.00 6.83 7.05 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 22 T 7.82 3.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 23 Q 8.07 4.02 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 24 L 8.47 4.08 0.00 1.84 1.76 0.95 1.09 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 25 D 8.20 4.35 0.00 2.91 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 26 A 7.96 4.05 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 27 L 8.17 3.88 0.00 1.96 1.98 1.10 0.32 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 28 A 8.32 4.06 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 29 N 8.28 4.29 0.00 2.95 2.89 0.00 0.00 7.04 6.99 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 30 M 7.81 4.14 0.00 1.98 2.21 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 31 I 8.20 4.00 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.89 0.95 0.00 0.00 32 A 8.13 4.11 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.02 4.48 0.00 2.18 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 2.38 2.47 0.00 34 G 7.94 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 0.00 0.00 0.00 35 N 8.16 4.36 0.00 2.76 2.90 0.00 0.00 7.09 8.21 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 36 K 8.02 3.98 0.00 1.99 1.88 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.51 7.81 37 R 8.15 3.96 0.00 2.03 2.14 0.00 3.17 0.00 0.00 3.52 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 38 L 8.25 4.06 0.00 1.93 1.72 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.37 4.38 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 40 I 7.78 3.72 2.09 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 1.31 0.98 0.00 0.00 41 V 7.82 3.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.02 0.00 0.00 42 N 8.57 4.37 0.00 2.97 2.95 0.00 0.00 7.23 7.87 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 43 R 8.01 3.95 0.00 2.05 2.00 0.00 3.24 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 44 I 7.73 3.91 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.94 0.00 0.00 45 N 8.31 4.37 0.00 2.67 2.89 0.00 0.00 7.16 7.15 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 46 S 8.38 4.40 0.00 3.88 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 47 N 7.78 4.99 0.00 2.84 2.76 0.00 0.00 6.69 8.69 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 48 A 8.25 3.99 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 49 S 8.13 4.05 0.00 3.89 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 50 A 7.90 3.99 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 51 I 7.96 3.61 2.03 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 1.41 0.81 0.93 0.00 0.00 52 V 8.02 3.64 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 1.15 0.00 0.00 0.96 0.00 0.00 53 S 8.51 4.15 0.00 3.88 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 54 N 8.47 4.43 0.00 2.82 2.84 0.00 0.00 7.04 8.53 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 55 S 7.88 4.07 0.00 3.94 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.24 3.57 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 57 R 8.43 3.92 0.00 1.98 2.09 0.00 3.12 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 1.66 1.72 0.00 58 A 7.93 3.95 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 59 L 7.62 3.74 0.00 1.50 1.20 0.81 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 60 F 7.90 4.46 0.00 3.13 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.92 4.17 1.40 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 0.00 0.00 62 E 8.11 4.28 0.00 1.93 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 2.31 2.52 0.00 63 Q 8.12 4.69 0.00 2.20 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 64 P 0.00 4.59 0.00 2.28 2.35 0.00 3.97 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.90 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.58 3.06 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 76 N 8.32 4.27 0.00 2.68 2.85 0.00 0.00 6.65 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 77 R 7.76 3.83 0.00 1.83 1.86 0.00 3.17 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 78 R 7.65 3.96 0.00 1.99 1.95 0.00 3.21 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 79 M 8.33 3.93 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 80 A 8.51 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 3.97 1.45 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 0.00 0.00 82 C 8.37 4.13 0.00 3.11 3.24 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 83 L 8.22 4.07 0.00 1.91 1.76 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.39 3.91 0.00 2.01 2.19 0.00 3.14 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 85 D 8.62 4.53 0.00 3.03 2.87 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 86 M 8.23 4.12 0.00 2.11 2.30 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.56 0.00 87 E 8.49 3.99 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 88 I 8.25 3.76 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.76 1.14 0.00 0.00 89 V 8.07 3.65 2.29 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 1.18 0.00 0.00 1.08 0.00 0.00 90 L 8.13 3.96 0.00 1.98 1.82 1.18 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.18 3.46 0.00 1.61 1.00 0.00 3.09 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.75 0.00 92 Y 7.82 3.56 0.00 3.07 2.98 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 93 V 7.88 3.34 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 0.21 0.00 0.00 0.54 0.00 0.00 94 S 7.84 4.02 0.00 4.03 4.13 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 95 Y 7.79 4.27 0.00 3.03 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 96 A 8.02 3.95 0.44 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 97 E 7.95 4.02 0.00 2.02 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 0.00 2.40 2.43 0.00 98 I 7.72 3.90 1.91 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 1.49 0.84 1.01 0.00 0.00 99 A 8.37 4.27 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 0.00 100 G 8.27 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.52 4.74 0.00 2.72 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 0.00 102 S 8.86 4.30 0.00 4.18 4.40 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 0.00 103 S 8.40 4.12 0.00 4.07 4.59 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 V 7.83 3.65 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 0.89 0.00 0.00 1.15 0.00 0.00 105 L 7.81 3.94 0.00 1.75 1.93 0.91 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.26 4.30 0.00 2.71 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 0.00 107 D 8.13 4.31 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.38 2.45 0.00 116 T 7.92 3.79 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 1.03 0.00 0.00 117 Y 8.01 4.47 0.00 3.02 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 0.00 118 Q 7.96 4.05 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 119 A 8.10 4.15 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 0.00 120 L 7.88 4.25 0.00 1.93 1.82 1.06 0.89 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 0.00 121 G 8.19 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 0.00 0.00 0.00 122 T 7.69 4.15 4.34 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 0.83 0.00 0.00 123 P 0.00 4.32 0.00 2.19 2.21 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 124 G 8.72 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 0.00 125 S 7.99 4.19 0.00 4.05 4.13 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 0.00 126 S 7.88 4.11 0.00 4.02 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 0.00 127 V 7.61 3.49 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 1.10 0.00 0.00 0.33 0.00 0.00 128 A 8.00 4.00 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 0.00 129 V 7.65 3.48 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 1.01 0.00 0.00 0.95 0.00 0.00 130 A 7.95 3.88 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 0.00 131 I 7.93 3.75 2.05 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 1.52 0.86 1.12 0.00 0.00 132 E 8.61 3.86 0.00 2.09 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 2.27 2.46 0.00 133 K 8.25 4.07 0.00 1.90 1.75 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.56 7.81 134 M 7.95 3.98 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.70 0.00 135 K 7.65 2.00 0.00 0.97 1.59 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.20 1.38 7.81 136 E 8.01 3.85 0.00 2.07 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 2.26 2.31 0.00 137 A 7.89 3.97 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 0.00 138 S 7.98 4.09 0.00 3.96 4.10 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 0.00 139 V 8.23 3.75 2.04 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 0.99 0.00 0.00 0.96 0.00 0.00 140 S 7.78 4.09 0.00 3.91 4.08 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 0.00 141 D 8.14 4.48 0.00 2.94 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 0.00 142 A 8.28 4.09 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 0.00 143 N 8.00 4.66 0.00 2.80 2.87 0.00 0.00 6.95 7.61 0.00 0.00 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 D 7.43 4.61 0.00 2.78 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 0.00 145 S 8.63 4.26 0.00 4.05 4.10 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 0.00 146 S 8.54 4.17 0.00 3.80 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 0.00 147 G 9.36 4.09 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 0.00 0.00 0.00 148 T 7.59 4.71 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 1.32 0.00 0.00 149 P 0.00 4.41 0.00 2.07 2.03 0.00 3.69 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 2.03 2.11 0.00 150 S 8.70 4.19 0.00 3.86 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.88 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 0.00 152 D 8.68 4.68 0.00 2.63 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 0.00 153 C 8.52 4.88 0.00 2.99 2.87 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 0.00 154 S 8.77 4.11 0.00 4.02 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 S 8.00 4.08 0.00 3.89 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 0.00 156 L 7.89 4.01 0.00 1.85 1.75 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 157 S 8.45 4.15 0.00 3.87 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 0.00 158 A 8.12 3.96 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 0.00 159 E 8.41 3.63 0.00 2.02 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 1.94 2.05 0.00 160 L 8.30 4.27 0.00 2.06 1.92 1.01 1.48 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 0.00 161 G 8.29 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 T 7.76 3.87 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 1.10 0.00 0.00 163 Y 7.35 4.34 0.00 3.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 F 8.16 4.22 0.00 3.25 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 0.00 165 D 8.53 4.43 0.00 2.88 2.76 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 0.00 166 R 8.38 3.99 0.00 2.14 2.04 0.00 3.24 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 167 A 8.02 4.02 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 0.00 168 A 8.16 4.01 1.40 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 0.00 0.00 169 S 8.29 4.23 0.00 3.93 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 0.00 170 A 7.76 4.09 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 0.00 171 V 7.54 4.00 2.29 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 1.00 0.00 0.00 1.08 0.00 0.00 172 S 7.82 4.37 0.00 3.84 3.72 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 * Residues marked with a * may have inaccurate shift predictions.