NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.4548 8.1749 110.9538 61.1491 70.1091 173.0949 4 T 3.6800 8.4465 118.7376 63.1562 68.1661 173.2828 5 N 4.5338 10.2026 128.4062 52.0730 38.3978 174.6359 6 H 4.2713 8.5311 117.7479 56.9781 28.8076 175.7856 7 D 4.8345 8.0735 118.2845 54.3679 41.5941 175.7217 8 H 5.2537 8.9308 117.3929 54.6945 31.1534 173.8236 9 H 4.8886 9.6319 120.0150 54.7398 34.0189 171.8643 10 I 4.7549 8.0949 125.2654 59.7603 39.6460 173.9714 11 Y 4.8767 9.5013 126.0110 56.2063 40.5026 174.7766 12 V 4.6348 8.2799 124.9834 61.3587 33.7073 174.7005 13 L 5.0648 9.2966 129.6953 54.5088 42.3988 176.1507 14 M 5.6366 10.0551 122.1005 52.7098 34.4450 174.5848 15 G 4.6104 8.1558 105.6068 43.2972 0.0000 173.7733 16 V 4.0939 7.8160 114.7633 60.3329 32.3215 175.9511 17 S 4.2688 8.9571 117.1798 60.3756 62.2160 174.8048 18 G 4.0783 9.0417 115.7503 45.4468 0.0000 174.9250 19 S 3.9486 7.7118 113.1269 59.4515 63.3896 175.2504 20 G 3.8961 7.9760 110.0125 46.1180 0.0000 175.3024 21 K 3.8545 8.2924 119.7249 60.0325 32.1096 179.0231 22 S 4.3617 8.1489 114.0110 61.3052 62.8257 176.6693 23 A 3.9203 7.7835 123.2497 55.0581 18.3355 179.3965 24 V 3.4093 7.9311 116.4369 66.2190 31.6131 177.9504 25 A 3.7579 8.4036 120.5664 55.0606 18.2530 179.3081 26 S 3.2925 7.3473 111.0159 61.4858 62.2051 176.2244 27 E 3.8928 7.6531 120.1305 59.0611 29.6810 178.3452 28 V 3.6236 8.2728 118.4707 66.1002 31.5490 177.9601 29 A 3.9992 7.9703 120.3387 55.1251 17.9716 178.8730 30 H 4.3167 7.9791 115.2497 58.3190 29.9666 176.3446 31 Q 4.4458 7.4539 118.0114 55.5925 28.8019 175.8298 32 L 4.5543 7.0311 116.4808 53.8790 44.6378 176.1246 33 H 3.9243 7.7361 114.1872 56.9651 26.0710 173.6508 34 A 4.9461 7.7081 119.3813 49.7129 22.0937 178.0898 35 A 4.2383 8.3123 122.1972 52.0280 19.7016 176.5984 36 F 5.7010 8.7809 123.3902 56.3811 42.6006 173.7960 37 L 4.2352 9.3015 127.3189 53.1223 45.7120 174.6971 38 D 4.5799 7.9515 126.1109 53.0655 41.2382 176.7091 39 G 3.8583 8.6709 113.9632 46.3253 0.0000 174.0767 40 D 4.6575 8.1931 121.6319 56.9428 40.6444 177.8053 41 F 4.9168 7.6057 116.0625 58.8357 38.9127 175.6451 42 L 4.7104 7.4570 117.5683 54.6435 41.8118 176.4447 43 H 4.4783 7.6878 115.3628 54.9504 28.7718 174.2421 44 P 4.5574 0.0000 0.0000 62.1079 32.8209 177.6766 45 R 3.9433 8.5095 118.4484 59.7058 29.7821 178.7849 46 R 3.8984 7.8856 117.2999 59.4567 30.2592 178.2555 47 N 4.2074 8.2688 115.6870 56.5816 38.2067 177.2871 48 I 3.6109 7.1419 118.9529 64.4514 37.6618 178.0294 49 E 4.0928 7.7770 118.5650 59.4792 29.2751 179.6813 50 K 3.9975 8.4356 118.7069 59.5349 32.1182 179.1319 51 M 4.2695 8.2582 120.0575 56.7952 31.7859 177.5926 52 A 4.4036 7.5514 118.3445 53.0342 19.1327 178.5522 53 S 4.3985 7.3462 112.5101 58.4578 63.3785 174.8451 54 G 4.0840 7.5500 107.9714 45.1466 0.0000 173.8701 55 E 4.3738 7.9638 118.1605 54.6228 30.9871 173.9557 56 P 4.4827 0.0000 0.0000 61.7802 32.2358 176.2272 57 L 4.2673 8.1958 122.1797 54.7010 42.4550 175.6720 58 N 5.1506 10.9700 117.0159 50.6605 41.2860 174.8374 59 D 4.5290 8.7276 119.2272 57.7557 40.4727 178.6046 60 D 4.4119 8.2264 117.0644 56.8293 41.2650 177.6412 61 D 4.5034 8.8062 120.2150 57.4393 40.8950 178.8278 62 R 4.2433 7.9873 118.3571 58.7805 29.9894 178.5884 63 K 3.8247 7.7969 119.8877 59.5826 32.1962 177.0023 64 P 4.3648 0.0000 0.0000 64.7568 31.3204 178.6786 65 W 4.2141 7.6753 128.0965 60.5538 30.6550 178.0981 66 L 3.4788 8.3647 119.3970 57.5723 40.9415 179.2749 67 Q 3.9095 8.0305 119.2133 58.9073 28.8442 178.3025 68 A 3.9104 7.7839 121.3562 55.1081 18.4546 179.3208 69 L 3.7220 7.5720 117.5434 58.1382 41.6299 179.4492 70 N 4.2291 8.2993 117.0472 56.6096 38.7875 176.6652 71 D 4.3493 8.5436 120.3757 57.4982 40.9710 178.5972 72 A 3.9982 8.7313 121.7612 55.0237 18.3354 179.6659 73 A 3.8572 8.1771 119.4549 55.3116 18.2936 179.5451 74 F 3.9974 8.1832 117.7969 61.4207 39.4779 176.9088 75 A 3.9858 8.4106 120.7971 55.2683 18.0649 179.5101 76 M 4.0027 8.4290 117.9835 58.3069 31.8426 178.2957 77 Q 4.2269 7.5474 114.6934 57.6280 29.1250 177.8727 78 R 4.0522 7.4175 120.4707 58.3638 30.2542 176.9247 79 T 4.6050 7.6493 104.3958 60.7348 70.0923 173.0767 80 N 4.9568 7.6903 119.6184 51.2777 41.7535 174.3437 81 K 3.9916 8.7451 122.6354 59.0759 33.0412 176.8249 82 V 5.0602 7.7662 118.8274 61.1512 35.0548 174.0070 83 S 5.0175 9.2361 122.0759 56.7721 67.1958 172.7371 84 L 5.4087 9.7745 124.8662 53.1039 44.3591 175.3726 85 I 4.9672 8.9416 124.8962 59.4810 40.4473 174.6266 86 V 4.5485 8.8005 127.6336 61.8232 33.3835 174.5007 87 C 5.0537 8.8324 127.8987 58.3392 34.5741 174.3842 88 S 4.8618 9.9429 121.6439 59.1311 63.3796 174.4249 89 A 4.1214 7.9090 120.9818 53.3798 15.4976 176.4224 90 L 4.1399 7.7289 122.5141 55.3501 43.0531 177.6138 91 K 4.6744 7.1894 118.5302 53.5837 35.7913 176.2684 92 K 3.8017 9.3005 126.2806 60.0654 32.2111 177.9266 93 H 4.1200 8.1876 117.7215 59.8265 29.6735 176.5635 94 Y 4.2527 7.5749 117.7631 61.0920 37.5492 178.2771 95 R 4.0249 7.8371 118.2694 59.4967 30.3968 178.5139 96 D 4.5653 8.2906 118.5469 57.1213 40.6782 178.6984 97 L 4.0086 7.8791 118.8170 57.8237 41.6188 179.2847 98 L 4.1121 7.8141 118.1291 57.3801 41.8879 179.0786 99 R 4.3386 8.0377 117.8296 56.9771 29.9386 175.4532 100 E 4.0509 7.8737 118.9125 59.2988 29.3760 175.6947 101 G 3.9866 9.1514 115.6570 44.9931 0.0000 172.2236 102 N 4.8611 7.8196 117.5887 50.7726 38.3251 173.0439 103 P 4.4809 0.0000 0.0000 63.9232 32.3640 177.0367 104 N 4.7108 7.9163 116.8886 52.7114 38.6109 173.5284 105 L 4.7964 7.3498 121.2118 53.8671 43.8670 175.4879 106 S 4.7605 8.2222 119.1945 56.7751 67.2899 172.3083 107 F 5.4237 10.1201 118.5874 55.7944 42.4605 175.2527 108 I 4.8972 9.1725 122.2651 59.9258 39.6819 174.2221 109 Y 5.1695 9.8318 131.3031 56.5316 39.8945 174.4266 110 L 4.8688 8.4555 128.0621 54.1350 42.4032 176.4476 111 K 4.0135 9.0179 126.2847 54.4558 35.2088 174.9876 112 G 4.5516 8.1947 111.0928 45.3619 0.0000 172.6496 113 D 4.9138 8.6175 121.1976 52.1105 40.9020 176.9391 114 F 3.1671 8.4648 121.7227 61.7401 38.5157 177.2354 115 D 4.5774 8.2106 117.6657 57.2492 40.4592 178.5730 116 V 3.6096 8.4247 118.2141 66.2526 31.9604 177.9111 117 I 3.8409 7.5538 119.3605 64.2751 36.9412 177.5872 118 E 3.6041 7.8148 120.3205 59.5424 28.5291 178.9339 119 S 3.9947 7.7263 113.3517 61.8153 62.5794 176.6928 120 R 4.0750 7.5309 119.7393 58.3515 29.7974 178.6415 121 L 4.2744 7.8297 118.7441 56.9658 41.8160 177.0043 122 K 4.0210 6.7566 121.1020 56.1425 32.8160 174.9380 *127 H 4.6647 9.0690 127.7682 54.6655 30.3906 174.5654 128 F 5.1090 9.1295 118.2872 57.6600 41.9612 171.4913 129 F 4.2203 6.8914 128.0862 57.6670 39.9039 175.4165 130 K 4.0242 7.3580 127.3801 54.5475 31.8184 176.7354 131 T 3.6394 7.6372 119.9456 67.2519 68.4023 175.6527 132 Q 4.0727 7.9448 120.4108 59.0565 29.1255 178.2465 133 M 3.9514 7.7194 119.1549 58.4755 32.3510 177.6061 134 L 3.9411 7.8283 119.9900 58.2752 42.2048 178.6716 135 V 3.9507 7.9410 117.9097 66.8752 31.3131 178.1766 136 T 4.0144 8.3301 115.3170 66.5633 68.1449 176.7666 137 Q 4.0090 8.2094 120.2634 59.0546 28.5758 178.5825 138 F 3.9501 8.1969 117.5128 60.5032 38.9831 177.3219 139 E 4.2343 8.1010 117.1559 59.4671 29.3248 179.0132 140 T 4.1572 7.5544 115.2868 64.8775 68.8022 175.1815 141 L 4.0334 7.3259 123.4850 55.5216 42.6163 177.1362 142 Q 4.4778 9.1386 126.9507 53.5974 29.2890 174.8211 143 E 3.7706 8.6021 122.8542 55.6403 30.3168 175.5289 144 P 4.4825 0.0000 0.0000 62.3493 31.9733 176.8694 145 G 3.9973 8.7245 111.2524 43.4268 0.0000 173.8419 146 A 4.0810 8.5012 121.4576 55.0542 18.0892 178.8649 147 D 4.4073 8.1566 114.6959 55.4708 39.7438 175.6687 148 E 4.4225 8.3253 121.6248 55.3019 28.2767 176.1738 149 T 4.3409 8.1506 112.9185 62.4130 69.7642 175.3508 150 D 4.8903 8.0693 122.3179 53.5438 40.8873 175.3188 151 V 5.2920 7.8666 119.1050 61.9033 33.0664 174.7143 152 L 4.8498 9.5714 128.9961 53.3198 44.1615 175.6168 153 V 4.9147 8.3721 121.2603 61.2337 33.9367 174.7983 154 V 4.4965 9.5194 127.2605 61.0889 35.4710 173.5678 155 D 5.1956 8.5165 125.4363 52.5953 41.6509 176.1120 156 I 3.8887 8.3712 120.6508 61.9905 38.2742 176.7796 157 D 4.6715 7.8505 124.9781 53.0759 39.5792 174.3913 158 Q 4.5357 7.2338 115.5575 53.2209 32.1143 173.2887 159 P 4.4788 0.0000 0.0000 62.2358 33.0570 176.8691 160 L 3.9201 8.3238 118.7282 58.6434 42.0910 178.5676 161 E 4.0217 8.3272 117.3849 59.7540 29.1771 179.4353 162 G 3.5049 7.9368 106.1023 47.3668 0.0000 175.7069 163 V 3.7219 7.6000 120.4903 65.5338 31.4421 178.4208 164 V 3.5059 8.1091 118.2687 65.9321 31.5195 177.9026 165 A 3.9875 8.3279 120.8232 55.1567 18.2028 179.3909 166 S 4.2963 8.6622 113.1287 60.8498 63.0272 176.8850 167 T 3.9264 7.7265 118.7005 66.2469 68.2313 176.8191 168 I 3.5651 7.5685 121.6671 64.2935 36.9934 177.8450 169 E 3.8270 7.9401 119.7889 59.4230 29.2342 178.8256 170 V 3.7005 7.4964 116.5548 66.4218 31.5981 177.8416 171 I 3.5268 7.8457 118.2416 63.8406 37.1943 178.4260 172 K 4.1076 8.4892 120.2020 59.1669 31.7895 179.1256 173 K 3.9865 8.6964 119.1754 59.7755 32.2011 177.2911 174 G 3.8902 7.5440 108.8887 44.5359 0.0000 173.1284 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 T 8.17 4.45 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 1.26 0.00 0.00 4 T 8.45 3.68 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 0.87 0.00 0.00 5 N 10.20 4.53 0.00 2.47 2.55 0.00 0.00 6.76 8.00 0.00 0.00 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 H 8.53 4.27 0.00 3.17 3.33 0.00 5.72 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.07 4.83 0.00 2.79 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 8 H 8.93 5.25 0.00 2.91 3.29 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 H 9.63 4.89 0.00 3.13 3.05 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.09 4.75 1.63 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.81 0.80 0.00 0.00 11 Y 9.50 4.88 0.00 3.01 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 12 V 8.28 4.63 1.86 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 0.97 0.00 0.00 0.64 0.00 0.00 13 L 9.30 5.06 0.00 1.68 1.68 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 14 M 10.06 5.64 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 15 G 8.16 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 7.82 4.09 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 0.25 0.00 0.00 0.78 0.00 0.00 17 S 8.96 4.27 0.00 3.92 3.79 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 18 G 9.04 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 0.00 0.00 0.00 19 S 7.71 3.95 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 20 G 7.98 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.29 3.85 0.00 1.86 1.97 0.00 1.95 0.00 0.00 1.97 0.00 0.00 3.06 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.61 1.62 7.81 22 S 8.15 4.36 0.00 3.92 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 23 A 7.78 3.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.93 3.41 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 0.95 0.00 0.00 0.94 0.00 0.00 25 A 8.40 3.76 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.35 3.29 0.00 4.13 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 27 E 7.65 3.89 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 28 V 8.27 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 0.84 0.00 0.00 0.84 0.00 0.00 29 A 7.97 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 30 H 7.98 4.32 0.00 3.16 3.43 0.00 5.74 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 7.45 4.45 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 32 L 7.03 4.55 0.00 1.52 1.56 0.83 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 33 H 7.74 3.92 0.00 3.19 3.29 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.71 4.95 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.31 4.24 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 36 F 8.78 5.70 0.00 2.87 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 9.30 4.24 0.00 1.60 1.34 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.95 4.58 0.00 2.13 1.54 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 39 G 8.67 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 40 D 8.19 4.66 0.00 2.72 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 41 F 7.61 4.92 0.00 3.03 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.46 4.71 0.00 1.77 1.75 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 43 H 7.69 4.48 0.00 3.16 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.56 0.00 2.18 2.02 0.00 3.69 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 2.17 2.21 0.00 45 R 8.51 3.94 0.00 1.92 1.94 0.00 3.22 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 46 R 7.89 3.90 0.00 1.88 1.94 0.00 3.21 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 1.72 1.72 0.00 47 N 8.27 4.21 0.00 2.76 2.64 0.00 0.00 7.04 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.14 3.61 2.04 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 1.69 0.75 0.90 0.00 0.00 49 E 7.78 4.09 0.00 2.09 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 2.45 2.48 0.00 50 K 8.44 4.00 0.00 1.83 1.82 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.58 7.81 51 M 8.26 4.27 0.00 1.99 2.17 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.27 0.00 52 A 7.55 4.40 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 53 S 7.35 4.40 0.00 3.96 3.91 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 54 G 7.55 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 0.00 0.00 0.00 55 E 7.96 4.37 0.00 2.14 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 2.30 2.49 0.00 56 P 0.00 4.48 0.00 2.05 1.99 0.00 3.67 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 2.01 2.08 0.00 57 L 8.20 4.27 0.00 1.54 1.77 0.55 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 58 N 10.97 5.15 0.00 2.98 2.92 0.00 0.00 7.41 7.95 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 59 D 8.73 4.53 0.00 2.87 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.23 4.41 0.00 2.68 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 61 D 8.81 4.50 0.00 2.76 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 62 R 7.99 4.24 0.00 1.98 1.93 0.00 2.67 0.00 0.00 2.94 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 63 K 7.80 3.82 0.00 1.84 1.86 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.54 7.81 64 P 0.00 4.36 0.00 2.27 2.12 0.00 4.04 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 2.15 2.17 0.00 65 W 7.68 4.21 0.00 3.41 3.34 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 66 L 8.36 3.48 0.00 1.56 1.50 0.65 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 8.03 3.91 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 68 A 7.78 3.91 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 69 L 7.57 3.72 0.00 1.51 1.47 -0.04 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 70 N 8.30 4.23 0.00 2.72 2.92 0.00 0.00 7.27 8.06 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 71 D 8.54 4.35 0.00 2.86 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 72 A 8.73 4.00 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 73 A 8.18 3.86 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 74 F 8.18 4.00 0.00 3.09 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.41 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 76 M 8.43 4.00 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.53 0.00 77 Q 7.55 4.23 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.02 0.00 0.00 0.00 0.00 0.00 2.21 2.45 0.00 78 R 7.42 4.05 0.00 1.79 1.93 0.00 3.14 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.61 0.00 79 T 7.65 4.61 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 80 N 7.69 4.96 0.00 2.70 2.83 0.00 0.00 6.95 8.56 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 81 K 8.75 3.99 0.00 1.70 1.86 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.39 7.81 82 V 7.77 5.06 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 1.28 0.00 0.00 1.01 0.00 0.00 83 S 9.24 5.02 0.00 3.76 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 9.77 5.41 0.00 1.62 1.66 0.84 0.71 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 I 8.94 4.97 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.65 0.85 0.00 0.00 86 V 8.80 4.55 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 0.99 0.00 0.00 1.23 0.00 0.00 87 C 8.83 5.05 0.00 2.93 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 88 S 9.94 4.86 0.00 4.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.91 4.12 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.73 4.14 0.00 1.76 1.67 1.02 0.86 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 91 K 7.19 4.67 0.00 0.79 1.14 0.00 1.39 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.14 1.01 7.81 92 K 9.30 3.80 0.00 1.85 1.74 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.56 7.81 93 H 8.19 4.12 0.00 3.17 3.24 0.00 5.73 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 94 Y 7.57 4.25 0.00 3.03 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 95 R 7.84 4.02 0.00 1.72 1.66 0.00 2.21 0.00 0.00 2.56 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.50 0.00 96 D 8.29 4.57 0.00 2.83 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 97 L 7.88 4.01 0.00 1.85 1.69 0.85 0.86 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 98 L 7.81 4.11 0.00 1.97 1.68 0.93 0.60 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 99 R 8.04 4.34 0.00 1.91 1.99 0.00 3.46 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.04 0.00 100 E 7.87 4.05 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 101 G 9.15 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 7.82 4.86 0.00 2.68 2.68 0.00 0.00 6.61 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 0.00 103 P 0.00 4.48 0.00 2.21 2.18 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 104 N 7.92 4.71 0.00 2.75 2.94 0.00 0.00 5.77 6.67 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 0.00 105 L 7.35 4.80 0.00 1.46 1.58 0.70 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 106 S 8.22 4.76 0.00 4.12 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 0.00 107 F 10.12 5.42 0.00 2.86 3.03 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 0.00 108 I 9.17 4.90 1.98 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.15 0.96 0.00 0.00 109 Y 9.83 5.17 0.00 2.81 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 0.00 110 L 8.46 4.87 0.00 1.56 1.58 0.93 1.28 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 0.00 111 K 9.02 4.01 0.00 0.79 1.35 0.00 1.44 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.12 0.94 7.81 112 G 8.19 4.55 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 0.00 113 D 8.62 4.91 0.00 2.93 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 0.00 114 F 8.46 3.17 0.00 1.89 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 0.00 115 D 8.21 4.58 0.00 2.89 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 0.00 116 V 8.42 3.61 2.41 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 0.83 0.00 0.00 0.96 0.00 0.00 117 I 7.55 3.84 1.90 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.00 0.94 0.00 0.00 118 E 7.81 3.60 0.00 1.95 2.03 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 1.73 1.47 0.00 119 S 7.73 3.99 0.00 4.03 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 0.00 120 R 7.53 4.08 0.00 1.98 2.00 0.00 3.31 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 121 L 7.83 4.27 0.00 1.62 1.75 1.16 0.71 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 0.00 122 K 6.76 4.02 0.00 1.60 1.83 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.41 7.81 *127 H 9.07 4.66 0.00 3.35 3.18 0.00 5.94 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 9.13 5.11 0.00 3.03 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 6.89 4.22 0.00 2.70 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 K 7.36 4.02 0.00 1.57 1.54 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.49 7.81 131 T 7.64 3.64 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 1.39 0.00 0.00 132 Q 7.94 4.07 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 133 M 7.72 3.95 0.00 2.02 1.98 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 2.58 2.52 0.00 134 L 7.83 3.94 0.00 1.78 1.66 1.02 0.11 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 0.00 135 V 7.94 3.95 2.35 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 1.15 0.00 0.00 1.30 0.00 0.00 136 T 8.33 4.01 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 1.24 0.00 0.00 137 Q 8.21 4.01 0.00 2.24 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 138 F 8.20 3.95 0.00 3.22 3.30 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 0.00 139 E 8.10 4.23 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.72 0.00 140 T 7.55 4.16 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 141 L 7.33 4.03 0.00 1.58 1.67 0.72 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 142 Q 9.14 4.48 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.54 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 143 E 8.60 3.77 0.00 1.84 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 2.35 2.43 0.00 144 P 0.00 4.48 0.00 1.92 1.83 0.00 3.28 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 145 G 8.72 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 0.00 0.00 0.00 146 A 8.50 4.08 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 0.00 147 D 8.16 4.41 0.00 2.83 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.33 4.42 0.00 2.14 1.88 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 2.20 2.17 0.00 149 T 8.15 4.34 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 150 D 8.07 4.89 0.00 2.91 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 0.00 151 V 7.87 5.29 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 0.93 0.00 0.00 0.89 0.00 0.00 152 L 9.57 4.85 0.00 1.71 1.63 1.02 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 153 V 8.37 4.91 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 0.76 0.00 0.00 1.07 0.00 0.00 154 V 9.52 4.50 2.15 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 0.85 0.00 0.00 0.92 0.00 0.00 155 D 8.52 5.20 0.00 2.65 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.37 3.89 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.67 0.91 0.00 0.00 157 D 7.85 4.67 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 Q 7.23 4.54 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 159 P 0.00 4.48 0.00 2.16 2.05 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 160 L 8.32 3.92 0.00 1.74 1.63 0.89 0.79 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 0.00 161 E 8.33 4.02 0.00 2.21 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 0.00 2.35 2.39 0.00 162 G 7.94 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.60 3.72 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 0.96 0.00 0.00 0.99 0.00 0.00 164 V 8.11 3.51 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 0.91 0.00 0.00 0.89 0.00 0.00 165 A 8.33 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 0.00 166 S 8.66 4.30 0.00 3.79 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 7.73 3.93 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 1.13 0.00 0.00 168 I 7.57 3.57 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.83 0.85 0.00 0.00 169 E 7.94 3.83 0.00 2.08 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 2.29 2.35 0.00 170 V 7.50 3.70 2.31 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 0.86 0.00 0.00 0.96 0.00 0.00 171 I 7.85 3.53 1.74 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.25 0.56 0.00 0.00 172 K 8.49 4.11 0.00 1.82 1.82 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.55 7.81 173 K 8.70 3.99 0.00 1.76 2.15 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.74 1.51 7.81 174 G 7.54 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.