NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2265 8.3049 118.1488 55.0108 32.5172 174.2874 2 F 4.8771 8.7583 118.9570 54.0624 41.9153 173.5219 3 D 5.1035 9.1475 123.8167 50.8555 44.0757 176.2491 4 A 3.8755 8.4871 121.2615 55.6158 18.1319 180.1600 5 F 4.1332 8.0387 115.4954 61.0534 39.3462 178.1249 6 T 4.0946 9.2293 109.4634 64.2850 68.1488 176.4671 7 K 3.1109 8.1574 123.0607 59.1424 32.1510 178.9468 8 V 3.5006 7.2151 118.7894 65.8430 31.4712 178.0854 9 V 3.5764 7.6706 118.0430 66.1037 30.9234 178.0293 10 S 4.1235 8.4019 114.2503 61.7371 62.1487 176.5776 11 Q 3.9426 7.7167 120.7631 58.4422 28.4466 178.3468 12 A 4.2060 7.9991 122.0038 55.0183 18.2909 179.1620 13 D 4.2722 8.2867 116.9419 57.6789 41.1646 178.5101 14 T 3.7042 7.4973 108.0124 63.8617 68.6781 175.3277 15 R 4.5149 7.1902 119.4448 54.8162 30.7996 176.2769 16 G 3.9742 8.4681 107.1060 46.2616 0.0000 173.3845 17 E 4.7085 7.9095 117.6486 54.4065 32.0522 175.6094 18 M 4.4926 8.1308 119.8235 53.7199 33.5675 176.5570 19 L 4.2749 8.3226 121.3776 55.3386 42.6136 178.1026 20 S 4.5361 9.1169 117.8137 57.8925 65.4924 175.6802 21 T 3.8784 8.4737 113.3666 64.8405 68.2003 176.4825 22 A 3.9404 7.8924 123.1775 55.3116 18.5724 179.4020 23 Q 3.9433 7.9955 116.5108 59.2411 28.5118 179.2844 24 I 3.8204 7.7149 120.0321 64.2857 37.3664 177.9479 25 D 4.4730 8.3226 119.8042 57.1292 40.4515 178.3211 26 A 3.9818 8.2559 121.6763 55.5077 18.2453 179.8163 27 L 3.9054 7.9289 116.7027 57.3736 41.6167 179.7556 28 S 4.1754 8.1443 113.8477 61.2437 62.1450 175.7897 29 Q 3.9881 8.0737 119.3072 59.4055 28.6338 178.3124 30 M 4.1152 7.7337 118.8481 58.6494 32.1882 178.4665 31 V 3.6502 7.5898 118.2404 65.8836 31.5122 177.8545 32 A 4.1673 7.9522 119.3208 53.9898 18.3054 178.3548 33 E 4.5613 7.5811 116.0780 56.1639 29.9619 177.7994 34 S 4.1183 7.8602 117.2658 61.6849 62.8016 176.1425 35 N 4.3081 8.2074 119.4193 56.2190 38.3142 177.2421 36 K 3.9797 8.0108 119.1363 59.3357 32.1389 179.0634 37 R 3.9021 7.6662 119.0865 59.6940 29.9683 178.6557 38 L 4.1682 8.3575 118.9350 57.7889 41.5195 179.2971 39 D 4.3913 8.2122 119.1627 57.4040 40.7718 179.1420 40 V 3.7427 7.8853 113.0447 64.2682 31.4728 178.8682 41 V 3.6529 7.7500 117.7655 65.9502 31.3651 177.5943 42 N 4.3112 8.3988 116.8959 56.8582 38.6098 177.0665 43 R 3.9457 8.2200 118.5217 59.2734 30.5189 178.8984 44 I 3.9176 7.8990 119.5531 64.7062 37.2805 178.6138 45 T 3.8775 8.0686 116.6030 66.8460 68.1264 176.8326 46 S 4.3732 8.3605 115.4360 60.2980 62.9652 174.8027 47 N 4.8980 7.6859 117.8163 52.7767 39.1188 175.9967 48 A 3.9917 7.8496 121.7537 55.9471 18.3092 180.7789 49 S 4.0646 8.0422 111.2956 61.7203 62.9887 176.2537 50 T 4.1141 7.7310 117.2526 63.8315 67.3649 176.5150 51 I 3.7131 7.9445 122.1933 64.0994 37.0474 178.5685 52 V 3.5668 7.9926 119.3817 66.0498 31.0560 178.2468 53 S 4.1170 7.9578 113.9817 61.6619 62.7652 176.2022 54 N 4.3734 8.2371 119.9607 55.8368 38.2695 177.3479 55 A 3.9086 7.9266 121.7109 54.8241 18.3354 179.6520 56 A 3.3586 8.0492 119.4257 55.1128 18.3619 179.6001 57 R 3.8415 8.0119 117.5151 59.8761 30.0472 178.6516 58 S 4.0508 7.9479 112.7230 61.0346 62.2924 175.7625 59 L 3.8124 7.7105 123.0883 58.3111 41.9058 179.1238 60 F 4.5531 7.8567 117.2685 60.1313 38.5288 177.6380 61 A 4.1764 7.5559 120.3020 55.0284 18.3330 179.0345 62 E 4.2706 8.1078 115.6354 57.3941 31.1923 177.1898 63 Q 4.8526 8.4145 117.5565 52.0811 28.9605 174.2317 64 P 4.5691 0.0000 0.0000 64.5461 32.5506 179.6895 65 Q 4.0219 8.1630 117.4606 58.9959 28.8118 178.5101 66 L 4.0987 7.9810 119.1689 56.8141 41.7128 178.2777 67 I 4.2847 7.2934 108.8438 60.2279 38.2821 175.6842 68 A 4.1505 7.5027 124.6587 50.8399 19.0454 175.3096 69 P 2.9700 0.0000 0.0000 64.0309 31.5753 177.1786 70 G 4.0635 8.5267 111.0115 45.3055 0.0000 173.8492 71 G 4.4330 7.9241 114.5631 44.5546 0.0000 175.5490 *73 A 4.1418 8.6985 127.7999 51.1539 19.8253 176.4288 74 Y 4.2370 7.6358 118.2726 58.5638 39.8167 175.6609 75 T 3.0872 7.3237 112.3319 62.1001 69.0173 172.8731 76 S 4.0017 8.3926 119.1615 61.7437 62.7884 176.7303 77 R 3.8458 7.9070 120.7422 59.8573 29.7238 178.6098 78 R 3.9090 7.6345 117.5179 59.2264 29.9285 178.8480 79 M 3.9502 8.1609 117.8771 58.5954 32.2097 178.1057 80 A 3.9764 8.6358 121.0382 55.1213 18.4588 179.4288 81 A 3.9444 8.3247 119.5517 55.3306 18.4868 179.3591 82 C 4.0789 8.3286 117.2467 62.7144 31.7337 175.6945 83 L 4.0193 8.1918 120.6860 57.8854 41.1553 179.4498 84 R 3.9252 8.2856 118.7001 59.6457 29.9907 178.1507 85 D 4.4324 8.4078 118.7106 57.7639 40.8375 178.7318 86 M 4.0984 8.0560 118.9954 58.4592 31.9584 178.4219 87 E 3.9575 8.3381 119.3545 59.3134 29.8005 178.9857 88 I 3.7655 8.0235 120.0851 64.4834 37.1209 178.5316 89 I 3.8119 8.0055 120.7390 64.1962 36.9376 178.2184 90 L 3.8877 7.9690 121.2853 58.0590 42.0437 178.9532 91 R 3.4951 7.9618 118.5971 59.6789 29.9648 178.2081 92 Y 3.4771 7.7778 116.3044 60.5643 37.7840 178.4944 93 V 3.4146 7.9161 119.9494 66.0699 31.5182 178.2385 94 T 3.9168 7.7395 109.5375 64.8854 68.4807 176.1659 95 Y 4.3033 7.5219 119.0089 60.8265 37.8247 178.3299 96 A 4.0052 7.8913 123.0181 54.4761 18.1708 179.7405 97 V 3.7390 7.3529 115.3632 66.1633 31.6996 177.5937 98 F 4.2725 8.2581 118.7096 61.5431 39.5731 176.8194 99 A 4.1877 8.7436 120.6092 52.9828 17.8401 178.9069 100 G 4.0844 9.3476 104.8908 45.7640 0.0000 172.6751 101 D 4.7587 7.5037 116.7693 51.4738 44.3111 176.0126 102 A 3.9705 8.9084 126.9380 54.3024 18.4505 180.1028 103 S 4.1139 8.4658 114.0281 62.0037 62.8604 177.3973 104 V 3.5444 7.8820 122.7616 64.1305 30.9973 177.9089 105 L 3.9937 7.8303 120.3947 57.8346 42.0857 178.6312 106 E 3.9231 8.3696 118.6251 59.5317 29.2657 179.1164 107 D 4.2747 8.5489 117.7619 57.3536 41.1375 178.5232 108 R 4.2414 7.6032 114.9079 56.6128 30.4899 176.0887 109 C 4.2141 7.3568 115.9785 60.7488 33.5264 174.9922 110 L 3.9755 7.8751 118.9991 56.7931 41.4875 175.8365 111 N 4.2183 7.7777 116.8248 55.8348 38.5408 174.8350 112 G 4.4137 8.8184 114.8515 45.1755 0.0000 173.7481 113 L 3.6205 7.8549 121.9805 57.9214 41.8954 178.6802 114 R 3.9676 7.9092 118.0417 59.7650 30.1064 178.2060 115 E 3.9660 8.1250 117.6497 59.5271 29.4926 179.4308 116 T 3.7980 7.5980 115.6470 66.9426 68.4825 176.3944 117 Y 4.4448 7.8589 118.6391 60.9763 37.7248 178.4868 118 L 4.0215 8.3659 120.0434 57.9207 41.5523 179.5164 119 A 4.1419 7.9266 119.3928 54.9395 18.3693 179.2417 120 L 4.2576 7.7935 116.4836 55.5224 41.8445 177.9286 121 G 3.8625 7.7531 104.8807 46.2299 0.0000 172.9201 122 T 4.2935 7.8856 116.7634 60.9667 69.6202 173.7449 123 P 4.4416 0.0000 0.0000 62.5870 31.6429 177.0436 124 G 4.0450 8.9047 113.2176 47.3164 0.0000 173.8482 125 S 4.2014 8.0538 115.8601 61.2919 62.9880 176.6505 126 S 4.1805 7.9957 118.9404 61.1426 62.5873 176.7052 127 V 3.5150 7.4811 120.4935 65.8050 31.2748 177.7091 128 A 4.0417 8.3684 121.0291 55.1465 18.1942 179.7465 129 V 3.5951 7.7261 116.4876 66.1261 31.5923 178.5001 130 G 3.5732 7.9193 104.9911 47.7644 0.0000 175.8528 131 V 3.8115 7.9294 120.7452 65.7770 31.7142 178.4079 132 G 3.5533 8.3078 105.7321 47.6983 0.0000 175.8588 133 K 3.9958 8.0129 120.7142 59.3982 32.0428 179.4312 134 M 4.0264 7.9868 119.2011 57.8931 31.7969 178.6020 135 K 2.4800 7.6191 119.9251 58.8443 32.1789 178.4346 136 E 3.7602 7.7356 118.7943 59.2399 29.5769 178.6554 137 A 3.9331 7.7610 120.2013 54.9872 18.4139 179.5054 138 A 3.9625 8.2984 119.7318 55.4014 18.5324 179.9490 139 L 3.9795 8.0787 117.3567 57.6195 41.3769 179.6277 140 A 3.9873 7.5556 119.9047 55.2817 18.5214 179.4518 141 I 3.8111 7.6024 117.9256 64.5096 36.9307 178.9057 142 V 3.6787 7.8446 118.2537 65.4984 31.3802 176.8117 143 N 4.8842 7.7975 113.7545 51.8641 37.8487 174.3854 144 D 4.4524 7.5172 123.0755 53.4444 41.4398 175.3060 145 P 4.2347 0.0000 0.0000 64.4115 32.2543 176.6704 146 A 4.0419 7.5282 123.8510 53.1058 18.7710 177.5902 147 G 3.9504 8.8627 107.7392 46.0680 0.0000 173.0598 148 I 4.6683 7.1589 116.2675 58.6634 41.2698 175.0021 149 T 4.0145 8.3804 121.7238 62.6856 68.7371 172.9639 150 P 4.2634 0.0000 0.0000 62.8442 31.8489 175.7085 151 G 3.8444 7.9397 109.5505 45.5619 0.0000 171.7737 152 D 4.6692 8.6896 119.1140 53.3265 41.5050 175.3452 153 C 4.8448 8.4449 123.4248 59.5013 29.3387 176.0741 154 S 4.0755 8.5171 118.3329 61.6569 62.4116 176.2138 155 A 3.9680 7.9608 124.2211 54.6924 18.0677 179.2204 156 L 3.9412 7.8829 118.1455 58.0590 42.2288 178.8063 157 A 4.0151 8.2034 121.0938 55.2054 18.3040 179.8289 158 S 4.0320 8.2118 113.7423 61.5237 62.9834 176.4492 159 E 3.6590 7.9011 121.5625 59.3026 29.4402 178.8900 160 I 3.8006 7.9196 119.6617 64.4939 37.1492 178.3048 161 A 4.3403 8.3664 121.7593 54.9859 18.0943 179.8811 162 G 3.4724 7.9749 104.3039 48.2882 0.0000 175.5131 163 Y 4.3904 7.4201 119.2599 60.6935 37.7332 178.8669 164 F 4.1334 8.2100 118.1892 60.8418 39.0381 177.4249 165 D 4.4339 8.6893 118.9177 57.4461 40.4733 178.9905 166 R 3.9220 8.4100 119.1536 59.2807 29.8725 178.4743 167 A 4.0201 7.8347 119.4759 55.0064 18.5574 179.1711 168 A 4.1254 8.4498 119.3713 55.4270 18.3429 179.8449 169 A 4.0035 8.4818 119.1930 54.9263 18.1808 179.4435 170 A 3.9630 7.8247 118.0802 54.0136 18.9523 178.4406 171 V 4.3761 7.7083 109.5437 61.0416 33.0062 176.2535 172 S 4.3336 7.6593 119.8089 58.3364 62.8866 173.7602 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 4.23 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 2 F 8.76 4.88 0.00 3.26 2.93 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 3 D 9.15 5.10 0.00 3.12 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 4 A 8.49 3.88 0.98 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 0.00 0.00 5 F 8.04 4.13 0.00 3.26 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 6 T 9.23 4.09 4.54 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 1.35 0.00 0.00 7 K 8.16 3.11 0.00 1.89 1.75 0.00 1.17 0.00 0.00 1.04 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.33 7.81 8 V 7.22 3.50 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 0.92 0.00 0.00 0.93 0.00 0.00 9 V 7.67 3.58 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.02 0.00 0.00 10 S 8.40 4.12 0.00 4.04 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 11 Q 7.72 3.94 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 12 A 8.00 4.21 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.29 4.27 0.00 2.82 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.50 3.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 15 R 7.19 4.51 0.00 2.09 2.06 0.00 3.47 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 16 G 8.47 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 17 E 7.91 4.71 0.00 1.96 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 0.00 2.24 2.38 0.00 18 M 8.13 4.49 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 19 L 8.32 4.27 0.00 1.62 1.63 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 20 S 9.12 4.54 0.00 4.03 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.47 3.88 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 22 A 7.89 3.94 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 23 Q 8.00 3.94 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 24 I 7.71 3.82 2.03 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 1.55 0.62 0.94 0.00 0.00 25 D 8.32 4.47 0.00 2.87 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 26 A 8.26 3.98 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 27 L 7.93 3.91 0.00 1.96 1.89 1.05 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.14 4.18 0.00 4.14 3.85 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 29 Q 8.07 3.99 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 30 M 7.73 4.12 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 31 V 7.59 3.65 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.22 0.00 0.00 32 A 7.95 4.17 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 33 E 7.58 4.56 0.00 1.91 1.94 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 2.23 2.48 0.00 34 S 7.86 4.12 0.00 4.02 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 35 N 8.21 4.31 0.00 2.80 2.94 0.00 0.00 7.15 7.07 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 36 K 8.01 3.98 0.00 1.89 1.87 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.61 7.81 37 R 7.67 3.90 0.00 1.83 2.08 0.00 3.01 0.00 0.00 3.29 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 38 L 8.36 4.17 0.00 1.87 1.78 0.95 1.02 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 39 D 8.21 4.39 0.00 2.91 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 V 7.89 3.74 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.03 0.00 0.00 41 V 7.75 3.65 2.38 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 1.09 0.00 0.00 1.20 0.00 0.00 42 N 8.40 4.31 0.00 2.98 2.98 0.00 0.00 7.28 7.33 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 43 R 8.22 3.95 0.00 1.87 2.00 0.00 3.25 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 44 I 7.90 3.92 1.98 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.10 0.99 0.00 0.00 45 T 8.07 3.88 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 1.19 0.00 0.00 46 S 8.36 4.37 0.00 3.88 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 47 N 7.69 4.90 0.00 2.93 2.77 0.00 0.00 6.67 7.23 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 48 A 7.85 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 57 R 8.01 3.84 0.00 1.95 2.08 0.00 3.12 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 58 S 7.95 4.05 0.00 3.90 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 59 L 7.71 3.81 0.00 1.57 1.32 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 60 F 7.86 4.55 0.00 3.10 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 61 A 7.56 4.18 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 62 E 8.11 4.27 0.00 1.97 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 2.32 2.51 0.00 63 Q 8.41 4.85 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 64 P 0.00 4.57 0.00 2.22 2.34 0.00 3.94 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 2.08 1.93 0.00 65 Q 8.16 4.02 0.00 2.21 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 66 L 7.98 4.10 0.00 1.76 1.80 1.09 0.71 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 67 I 7.29 4.28 1.72 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 1.21 0.65 0.16 0.00 0.00 68 A 7.50 4.15 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 69 P 0.00 2.97 0.00 1.70 1.42 0.00 3.45 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.66 0.00 70 G 8.53 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 0.00 0.00 0.00 0.00 71 G 7.92 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 0.00 0.00 0.00 0.00 *73 A 8.70 4.14 1.17 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 74 Y 7.64 4.24 0.00 3.00 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 75 T 7.32 3.09 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 0.68 0.00 0.00 76 S 8.39 4.00 0.00 3.81 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 77 R 7.91 3.85 0.00 1.83 1.89 0.00 3.17 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 78 R 7.63 3.91 0.00 2.01 1.95 0.00 3.20 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 79 M 8.16 3.95 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 80 A 8.64 3.98 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 81 A 8.32 3.94 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 C 8.33 4.08 0.00 3.18 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.19 4.02 0.00 1.91 1.75 0.98 1.14 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 84 R 8.29 3.93 0.00 1.98 2.21 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 85 D 8.41 4.43 0.00 3.07 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 86 M 8.06 4.10 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 87 E 8.34 3.96 0.00 2.17 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 2.29 2.35 0.00 88 I 8.02 3.77 2.11 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 1.60 0.95 1.10 0.00 0.00 89 I 8.01 3.81 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.71 0.96 0.00 0.00 90 L 7.97 3.89 0.00 1.93 1.83 1.11 0.96 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 7.96 3.50 0.00 1.77 1.75 0.00 2.99 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 92 Y 7.78 3.48 0.00 3.01 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 93 V 7.92 3.41 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.60 0.00 0.00 94 T 7.74 3.92 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 95 Y 7.52 4.30 0.00 3.14 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 96 A 7.89 4.01 0.64 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 97 V 7.35 3.74 2.32 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 0.97 0.00 0.00 1.20 0.00 0.00 98 F 8.26 4.27 0.00 3.15 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.74 4.19 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.60 4.24 0.00 1.81 1.96 0.00 3.23 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 109 C 7.36 4.21 0.00 1.60 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 0.00 110 L 7.88 3.98 0.00 1.73 1.68 0.94 0.46 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 0.00 111 N 7.78 4.22 0.00 2.73 2.85 0.00 0.00 7.34 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 0.00 112 G 8.82 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 0.00 0.00 0.00 0.00 113 L 7.85 3.62 0.00 1.81 1.58 0.99 0.03 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 0.00 114 R 7.91 3.97 0.00 2.18 1.92 0.00 3.26 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 115 E 8.12 3.97 0.00 2.19 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 2.39 2.46 0.00 116 T 7.60 3.80 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 1.03 0.00 0.00 117 Y 7.86 4.44 0.00 3.16 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 0.00 118 L 8.37 4.02 0.00 1.96 1.75 0.95 1.05 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 0.00 119 A 7.93 4.14 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 0.00 120 L 7.79 4.26 0.00 1.94 1.82 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 121 G 7.75 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 0.00 122 T 7.89 4.29 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 123 P 0.00 4.44 0.00 2.23 2.22 0.00 3.65 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 124 G 8.90 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 0.00 0.00 0.00 0.00 125 S 8.05 4.20 0.00 4.06 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 0.00 126 S 8.00 4.18 0.00 4.09 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 0.00 127 V 7.48 3.51 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 1.06 0.00 0.00 0.45 0.00 0.00 128 A 8.37 4.04 1.47 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 0.00 0.00 129 V 7.73 3.60 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 0.97 0.00 0.00 0.95 0.00 0.00 130 G 7.92 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 V 7.93 3.81 2.33 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 1.35 0.00 0.00 1.08 0.00 0.00 132 G 8.31 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.01 4.00 0.00 1.89 1.78 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.54 7.81 134 M 7.99 4.03 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.55 0.00 135 K 7.62 2.48 0.00 0.90 1.62 0.00 1.53 0.00 0.00 1.44 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.11 1.14 7.81 136 E 7.74 3.76 0.00 2.15 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 137 A 7.76 3.93 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 0.00 138 A 8.30 3.96 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 0.00 139 L 8.08 3.98 0.00 1.65 1.71 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.56 3.99 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 0.00 141 I 7.60 3.81 2.05 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 1.41 1.06 0.97 0.00 0.00 142 V 7.84 3.68 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 0.87 0.00 0.00 1.04 0.00 0.00 143 N 7.80 4.88 0.00 2.86 2.82 0.00 0.00 6.99 7.47 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 0.00 144 D 7.52 4.45 0.00 2.78 2.56 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 0.00 0.00 0.00 0.00 145 P 0.00 4.23 0.00 2.22 2.16 0.00 3.82 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 146 A 7.53 4.04 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 0.00 147 G 8.86 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 0.00 148 I 7.16 4.67 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 1.31 1.00 1.01 0.00 0.00 149 T 8.38 4.01 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 0.00 150 P 0.00 4.26 0.00 2.04 1.99 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 151 G 7.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.69 4.67 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 C 8.44 4.84 0.00 3.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.52 4.08 0.00 4.06 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 A 7.96 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 0.00 156 L 7.88 3.94 0.00 1.78 1.87 0.96 1.04 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 0.00 157 A 8.20 4.02 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 0.00 158 S 8.21 4.03 0.00 4.01 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 7.90 3.66 0.00 1.92 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 0.00 1.83 2.06 0.00 160 I 7.92 3.80 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.02 1.20 0.00 0.00 161 A 8.37 4.34 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 0.00 162 G 7.97 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 Y 7.42 4.39 0.00 3.08 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 0.00 164 F 8.21 4.13 0.00 3.32 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 8.69 4.43 0.00 2.91 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 R 8.41 3.92 0.00 2.06 2.21 0.00 3.19 0.00 0.00 3.59 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 167 A 7.83 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 A 8.45 4.13 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 0.00 169 A 8.48 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 0.00 170 A 7.82 3.96 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 0.00 171 V 7.71 4.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.15 0.00 0.00 172 S 7.66 4.33 0.00 4.03 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 * Residues marked with a * may have inaccurate shift predictions.