NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 G 3.9274 8.3549 109.7370 45.3587 0.0000 173.3728 -1 S 4.4429 7.5565 114.3976 56.1384 64.8147 173.1486 0 H 4.1312 9.5580 125.7364 56.7469 31.0341 174.0875 1 M 4.3235 8.1934 126.4769 54.7049 32.7303 175.5561 2 S 4.5488 8.0387 116.3071 56.7939 66.2945 173.3743 3 V 3.7545 8.1217 120.7307 62.3320 31.5484 175.6694 4 S 4.3732 8.4287 124.0291 61.1177 63.1638 174.9261 5 K 4.7860 7.6134 117.7343 54.4218 36.0464 175.0247 6 F 5.2522 8.8698 120.8686 55.8394 42.4330 174.4384 7 I 4.8193 9.1078 123.9269 59.3996 41.1321 174.0356 8 K 5.0189 9.6945 128.5909 54.8475 34.3997 174.2996 9 C 5.0923 9.3721 127.8088 57.5869 34.6122 172.4065 10 V 4.9224 8.0727 126.1248 61.4605 33.7474 174.1074 11 T 5.0968 8.9047 124.7488 62.1662 70.1034 174.2940 12 V 4.5025 9.3256 118.9121 57.8333 36.4040 174.6925 13 G 3.7962 6.8740 107.8610 43.3968 0.0000 172.7400 14 D 4.9206 8.4000 120.2920 54.0030 41.4290 176.8858 15 G 3.6906 8.7212 110.7042 47.3080 0.0000 173.7360 16 A 3.8516 8.8173 123.8103 52.2475 16.3902 179.3769 17 V 3.7416 7.4348 110.2533 62.8876 32.0074 177.0349 18 G 4.2723 8.4665 109.5000 45.7612 0.0000 176.0611 19 K 3.9633 8.5444 121.3226 59.5729 31.9852 179.2086 20 T 4.0257 7.8018 115.3842 66.8766 68.4425 176.4245 21 C 3.9527 8.0037 118.1645 62.9260 28.0718 175.7114 22 M 4.5914 8.0686 121.0043 58.2965 31.8501 178.3770 23 L 3.8677 7.8223 118.7485 57.6804 41.7913 179.5491 24 I 2.7790 7.5614 120.1289 64.0280 36.9552 178.0211 25 C 4.2308 8.2203 121.2201 62.0198 31.2105 174.8710 26 Y 4.1248 7.9960 120.3290 61.0152 38.4675 177.8960 27 T 3.6681 7.4964 108.7729 63.0885 69.0779 175.4036 28 S 4.4483 7.5381 112.7140 56.8408 64.7213 173.6963 29 N 4.4089 8.1253 116.7473 54.4294 36.4314 173.7108 30 K 4.4887 7.3773 117.8369 54.3636 34.7360 174.3727 31 F 4.8111 8.6025 127.6452 55.6751 40.1451 173.3183 32 P 4.2808 0.0000 0.0000 62.5794 31.5914 176.5006 33 T 4.4657 8.3762 111.8667 61.4080 71.1003 174.4456 34 D 4.8828 7.1502 118.6361 53.0104 38.8353 178.8756 35 Y 4.2364 8.4015 117.1860 57.5241 38.8819 174.7512 36 I 4.0843 7.5184 127.0489 58.2608 40.0060 173.8081 37 P 4.1418 0.0000 0.0000 62.4410 32.0802 176.4507 38 T 3.9970 8.6245 116.7691 66.2284 68.4974 175.0769 39 V 4.5975 7.3882 118.3252 60.6455 34.3808 174.6837 40 F 4.6597 9.5518 129.7465 57.7211 39.9506 174.6123 41 D 4.2174 7.4354 125.1589 54.1399 41.1433 176.2997 42 N 4.2015 8.1889 119.7826 53.8435 39.1926 174.1591 43 F 4.6209 8.9814 124.6313 56.3207 43.3366 173.3798 44 S 5.1285 7.9125 119.8054 56.7146 63.6378 172.6040 45 A 4.8351 9.2510 130.1470 50.6114 21.2935 175.0267 46 N 5.3614 8.6546 117.6834 51.7070 40.8316 174.9119 47 V 4.5988 8.8706 115.9192 59.4233 36.0275 174.4535 48 A 4.7320 8.6217 126.2628 51.1411 19.9313 177.1271 49 V 3.9240 8.8096 122.7998 61.9735 32.9078 175.7863 50 D 4.5440 7.3739 123.2971 54.3400 36.8573 175.6222 51 G 4.1268 8.1525 125.1752 46.2505 0.0000 171.2955 *52 Q 4.5217 8.3589 117.6206 53.1225 30.3606 176.9707 53 I 4.4967 8.0300 120.6357 61.0483 38.5989 174.8805 54 V 4.4909 8.7667 128.3205 61.1470 33.5614 173.9293 55 N 5.0493 8.8184 127.9746 52.5199 40.2455 173.2895 56 L 4.9595 9.4150 130.5593 53.6077 44.0696 175.1686 57 G 4.5138 9.4322 115.3150 44.9735 0.0000 171.8993 58 L 5.4714 9.4435 126.8063 52.9698 44.1199 175.4933 59 W 5.0035 9.3613 124.5654 54.9993 31.3684 175.4738 60 D 5.3247 8.8835 124.6111 53.7203 42.0472 175.0430 61 T 5.0590 8.4391 110.2274 59.8991 72.7073 172.4673 62 A 4.8773 8.6854 125.1371 50.1143 21.4650 176.7579 63 G 4.2269 8.7460 111.1266 45.5654 0.0000 172.0628 64 Q 4.6172 8.1921 117.7441 53.4772 32.2067 175.8964 65 E 4.0339 8.4838 119.4668 58.0896 29.9620 176.2751 66 D 4.7452 7.4618 116.8549 52.5742 43.7527 174.3122 67 Y 4.7126 8.4311 122.1963 57.7360 38.9172 176.7003 68 S 4.3805 8.6660 117.1641 60.9838 62.9811 175.5046 69 R 4.5618 7.7265 115.9894 54.8924 32.1679 175.4208 70 L 3.5809 8.0230 119.2565 55.5978 41.9978 176.1922 71 R 3.3945 8.1703 126.8635 53.6656 29.7952 174.2074 72 P 4.2053 0.0000 0.0000 61.7810 30.4296 177.1183 73 L 4.0747 8.2173 125.9756 57.2814 41.9624 179.8958 74 S 4.0978 8.1539 112.6143 61.3566 63.0956 175.2845 75 Y 4.4384 8.1412 118.5832 60.0947 37.9297 175.7614 76 R 4.0075 7.6003 120.9166 57.7502 30.2212 176.5275 77 G 3.7958 9.0029 112.3905 45.4827 0.0000 173.0846 78 A 3.7949 7.7690 122.9851 52.3567 18.5875 177.8822 79 D 4.6495 8.4191 122.3509 55.6824 42.1808 176.7984 80 I 4.3584 6.9443 115.5172 60.0659 41.4577 172.6754 81 F 5.0670 8.8611 127.1354 55.6956 42.0678 174.8412 82 V 4.4332 8.6503 123.4384 61.6520 32.8044 174.6025 83 L 4.8746 8.9175 132.1985 53.6805 42.6545 174.6656 84 A 5.3065 8.7688 129.5532 50.2900 21.5966 175.3858 85 F 4.9462 8.7029 115.1851 55.2120 42.4417 173.2789 86 S 5.3180 8.9805 114.7640 56.3658 63.3622 175.2131 87 L 4.3336 8.9048 127.1750 56.7893 41.5876 178.3745 88 I 4.3845 7.5419 110.4983 60.2940 37.9171 175.9653 89 S 4.5822 8.0968 115.6847 56.2798 64.2264 174.3176 90 K 4.0368 8.6808 129.9016 59.0745 31.8670 178.8844 91 A 4.0808 8.1990 121.1360 55.4578 18.0717 179.7189 92 S 5.0967 7.9498 112.4393 61.2452 63.2862 175.7721 93 Y 3.7734 8.1065 122.6307 60.5769 38.5922 177.9099 94 E 4.0462 8.6799 119.7317 59.6013 29.5076 179.1724 95 N 4.3896 8.5348 116.2507 55.7466 38.4771 177.3327 96 V 3.7927 7.6490 120.0127 66.1849 31.2500 178.0718 97 L 3.9307 7.5888 116.5332 57.7799 41.8454 179.0463 98 K 4.1275 7.9623 116.8464 57.9044 32.3229 177.5380 99 K 4.0644 7.4470 116.3644 57.5971 33.8221 177.9839 100 W 4.2100 7.9737 119.0365 59.9354 28.9921 178.6633 101 M 4.0289 8.2072 118.6586 57.9322 31.4224 176.9955 102 P 4.1740 0.0000 0.0000 65.5143 31.5416 178.1822 103 E 4.0138 8.0465 118.0480 59.4357 29.4941 178.9548 104 L 3.9687 8.2827 119.3128 57.5266 41.3642 179.4544 105 R 3.8360 8.1158 118.6981 59.3933 30.1325 178.5222 106 R 3.8158 7.8673 114.7400 58.3998 29.5907 177.8037 107 F 4.9211 8.0060 115.7214 57.2685 41.0534 176.1886 108 A 4.8641 8.3683 122.8111 49.9145 19.3717 174.3384 109 P 4.3035 0.0000 0.0000 64.3750 32.2607 176.2386 110 N 4.2531 8.7245 115.7887 54.1601 35.9632 173.6932 111 V 4.4355 7.2488 117.3511 60.6649 32.7801 174.2586 112 P 4.6128 0.0000 0.0000 63.1299 32.8916 174.9585 113 I 5.1104 8.2188 120.4447 59.6340 41.3181 174.3235 114 V 4.4843 8.8541 126.9460 61.1520 33.3153 174.2228 115 L 4.8484 8.9028 131.2606 54.4606 43.6202 175.3842 116 V 4.6792 8.9661 125.9213 61.0249 34.7908 174.0888 117 G 3.5346 8.6219 115.6256 44.8717 0.0000 173.4289 118 T 4.7108 8.3778 116.2639 59.7049 72.1786 174.2833 119 K 4.1760 8.2635 116.6157 56.2871 29.5023 177.8018 120 L 3.9003 7.9217 122.2586 58.3740 42.1416 177.3023 121 D 4.2424 7.9889 118.4008 55.9227 39.1321 178.2905 122 L 3.9994 7.6945 120.2897 57.0127 41.7870 178.8690 123 R 3.8101 7.6774 117.0131 59.1273 30.1808 177.2224 124 D 4.6968 7.9522 115.6854 53.3482 41.5737 175.9078 125 D 4.5718 7.5133 121.6033 53.5622 42.0636 177.3316 126 K 4.1407 8.8108 126.2066 59.3093 31.8782 179.7158 127 G 3.6066 8.1275 105.1895 47.7644 0.0000 174.7511 128 Y 3.9939 8.4578 121.9251 60.5193 38.6900 178.0111 129 L 4.0894 8.1740 118.5189 57.8856 41.7924 179.2161 130 A 4.1442 8.0973 119.6677 54.3869 18.2212 178.2452 131 D 4.9064 7.8162 116.0822 54.8481 41.8772 177.6244 132 H 4.1179 6.6847 120.0768 56.8962 27.4956 173.5517 133 T 3.9441 7.5354 121.6401 61.9759 65.7476 173.3324 134 N 3.8410 7.9597 111.7957 53.6834 35.4932 173.8245 135 V 4.7684 7.5252 117.5468 59.7238 36.3194 174.6533 136 I 4.4490 8.5786 124.6787 60.7220 38.0539 176.4364 137 T 4.3270 8.7998 117.8064 61.0749 70.2751 176.0991 138 S 5.0558 8.7414 119.1259 61.6626 62.6999 177.1304 139 T 3.9140 7.9421 118.0337 66.8051 68.2998 176.5804 140 Q 4.3754 7.6052 121.1737 58.3358 28.6826 179.0609 141 G 3.4774 8.0984 108.1933 46.8005 0.0000 175.5279 142 E 3.7423 8.0729 121.6334 59.0090 29.4032 178.7523 143 E 3.9213 8.2569 118.8809 59.1950 29.5661 179.0906 144 L 3.7931 7.8337 120.4139 57.8850 42.0546 178.8746 145 R 3.8046 7.7067 118.6368 59.3520 29.8529 178.5119 146 K 3.8750 8.0577 118.1141 59.7839 31.8856 179.2246 147 Q 3.9995 8.0277 117.1110 58.1958 28.7141 178.1344 148 I 4.2755 7.4700 110.7739 59.4499 38.4393 175.6073 149 G 3.8395 7.6769 108.2536 46.6635 0.0000 174.0617 150 A 4.2722 7.7164 120.0026 51.2866 18.7283 178.9318 151 A 4.2230 8.9617 122.2063 54.9131 19.1139 177.6711 152 A 4.6567 7.7127 114.6254 51.2318 23.0200 174.6173 153 Y 5.3364 8.5314 119.4116 56.0106 42.2112 174.1416 154 I 4.3275 8.3750 126.7081 59.3533 41.3752 174.0560 155 E 4.8461 8.2106 125.7960 54.9430 31.5829 174.8174 156 C 5.1870 8.9051 118.3609 56.8315 34.4708 172.7055 157 S 4.7221 8.7622 113.3076 56.7196 64.5813 175.0545 158 S 4.2626 8.8255 123.2432 60.8805 63.3111 176.5664 159 K 2.5184 7.6728 121.1746 58.7577 31.8551 177.5530 160 T 4.0931 7.5065 105.8888 61.1927 69.5700 175.6976 161 Q 3.6874 7.8324 120.1697 55.7892 27.6821 172.7604 162 Q 3.9271 7.5572 120.0447 57.6537 29.4220 176.5046 163 N 4.4865 9.0343 121.0785 54.1713 36.6929 176.3732 164 V 3.6527 7.8318 119.8304 65.9976 31.5741 177.8089 165 K 4.2225 8.2983 118.7289 59.8489 31.9738 178.3206 166 A 4.0832 7.7095 119.5023 54.7349 18.2016 179.6347 167 V 3.1927 7.3293 116.7284 66.3358 31.5112 178.2351 168 F 4.0253 7.5004 116.3539 59.8082 38.9190 177.4702 169 D 4.4547 8.5138 119.2366 57.8409 40.5625 179.1471 170 T 3.8207 8.0211 115.7732 66.3749 68.5727 176.4443 171 A 3.9398 7.8361 122.6984 55.3864 18.3226 179.7734 172 I 3.6759 7.7734 117.9193 64.5153 37.1949 178.7928 173 K 3.9225 8.0326 119.2784 59.4982 31.6617 179.4494 174 V 3.5687 7.8706 117.6455 66.1229 31.4942 177.9783 175 V 3.7445 7.4604 116.3269 65.9667 31.4463 177.7497 176 L 4.1644 7.9748 118.0631 56.7078 41.7060 177.8280 177 Q 4.3471 7.4617 116.5382 54.2463 29.6472 174.0686 178 P 4.4544 0.0000 0.0000 61.6312 31.9906 175.0562 179 P 4.4383 0.0000 0.0000 63.2332 31.7340 176.5046 180 R 4.4870 8.4355 117.8423 56.3739 31.4569 176.6678 181 R 4.1965 7.6685 118.9385 56.2800 29.5810 174.7433 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 G 8.35 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 S 7.56 4.44 0.00 3.95 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 H 9.56 4.13 0.00 3.09 3.25 0.00 5.92 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.19 4.32 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 2 S 8.04 4.55 0.00 3.97 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 3 V 8.12 3.75 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 -0.07 0.00 0.00 0.88 0.00 0.00 4 S 8.43 4.37 0.00 3.88 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 5 K 7.61 4.79 0.00 1.57 1.63 0.00 1.59 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.39 7.81 6 F 8.87 5.25 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 7 I 9.11 4.82 1.93 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 1.15 0.68 0.93 0.00 0.00 8 K 9.69 5.02 0.00 1.75 1.69 0.00 1.17 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.04 1.23 7.81 9 C 9.37 5.09 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 10 V 8.07 4.92 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 1.24 0.00 0.00 0.68 0.00 0.00 11 T 8.90 5.10 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 1.25 0.00 0.00 12 V 9.33 4.50 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 1.03 0.00 0.00 0.68 0.00 0.00 13 G 6.87 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 0.00 0.00 0.00 14 D 8.40 4.92 0.00 3.01 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 15 G 8.72 3.69 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 0.00 16 A 8.82 3.85 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 17 V 7.43 3.74 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 0.82 0.00 0.00 1.01 0.00 0.00 18 G 8.47 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 0.00 0.00 0.00 0.00 19 K 8.54 3.96 0.00 1.83 1.90 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.51 7.81 20 T 7.80 4.03 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 21 C 8.00 3.95 0.00 3.01 3.14 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 22 M 8.07 4.59 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.76 0.00 23 L 7.82 3.87 0.00 1.83 1.71 1.07 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.56 2.78 1.51 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 -0.02 0.66 0.00 0.00 25 C 8.22 4.23 0.00 3.07 3.17 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 26 Y 8.00 4.12 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.50 3.67 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 0.68 0.00 0.00 28 S 7.54 4.45 0.00 3.93 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 29 N 8.13 4.41 0.00 2.84 2.89 0.00 0.00 6.61 6.89 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 30 K 7.38 4.49 0.00 1.90 1.52 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 1.31 7.81 31 F 8.60 4.81 0.00 3.06 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 32 P 0.00 4.28 0.00 1.78 1.79 0.00 2.84 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 33 T 8.38 4.47 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 1.33 0.00 0.00 34 D 7.15 4.88 0.00 2.82 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 0.00 0.00 0.00 35 Y 8.40 4.24 0.00 2.94 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 36 I 7.52 4.08 1.64 0.00 0.00 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 1.17 0.57 0.70 0.00 0.00 37 P 0.00 4.14 0.00 2.40 2.10 0.00 3.53 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 38 T 8.62 4.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 39 V 7.39 4.60 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 40 F 9.55 4.66 0.00 2.86 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 41 D 7.44 4.22 0.00 2.00 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 0.00 0.00 0.00 0.00 42 N 8.19 4.20 0.00 2.15 2.07 0.00 0.00 6.66 7.45 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 43 F 8.98 4.62 0.00 2.97 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 44 S 7.91 5.13 0.00 3.77 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 9.25 4.84 1.50 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 46 N 8.65 5.36 0.00 2.58 2.71 0.00 0.00 6.74 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 47 V 8.87 4.60 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 0.85 0.00 0.00 1.03 0.00 0.00 48 A 8.62 4.73 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.81 3.92 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 1.02 0.00 0.00 0.94 0.00 0.00 50 D 7.37 4.54 0.00 2.87 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 51 G 8.15 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 0.00 0.00 0.00 *52 Q 8.36 4.52 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.93 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.18 0.00 53 I 8.03 4.50 1.95 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.90 0.85 0.00 0.00 54 V 8.77 4.49 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 0.98 0.00 0.00 0.90 0.00 0.00 55 N 8.82 5.05 0.00 2.58 2.51 0.00 0.00 6.30 6.21 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 56 L 9.42 4.96 0.00 1.87 1.67 1.03 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 57 G 9.43 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.44 5.47 0.00 1.71 1.70 0.80 0.71 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 59 W 9.36 5.00 0.00 3.30 3.29 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 60 D 8.88 5.32 0.00 2.84 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 61 T 8.44 5.06 4.47 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 1.53 0.00 0.00 62 A 8.69 4.88 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 63 G 8.75 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.19 4.62 0.00 1.33 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.96 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 65 E 8.48 4.03 0.00 1.89 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 2.24 2.27 0.00 66 D 7.46 4.75 0.00 2.52 2.36 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 67 Y 8.43 4.71 0.00 2.97 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.67 4.38 0.00 4.02 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 69 R 7.73 4.56 0.00 1.78 1.98 0.00 3.25 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 70 L 8.02 3.58 0.00 1.48 1.58 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.17 3.39 0.00 1.72 1.73 0.00 3.35 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.58 0.00 72 P 0.00 4.21 0.00 0.86 1.62 0.00 2.51 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.22 0.00 73 L 8.22 4.07 0.00 1.75 1.77 0.93 0.79 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 74 S 8.15 4.10 0.00 4.32 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 8.14 4.44 0.00 3.24 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.60 4.01 0.00 1.78 1.86 0.00 3.32 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 77 G 9.00 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 0.00 0.00 0.00 78 A 7.77 3.79 0.74 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 79 D 8.42 4.65 0.00 2.66 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 80 I 6.94 4.36 1.83 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 1.30 1.28 0.91 0.00 0.00 81 F 8.86 5.07 0.00 2.94 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 82 V 8.65 4.43 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 0.76 0.00 0.00 0.68 0.00 0.00 83 L 8.92 4.87 0.00 1.74 1.54 0.71 1.10 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 84 A 8.77 5.31 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 85 F 8.70 4.95 0.00 3.25 3.17 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 86 S 8.98 5.32 0.00 3.94 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 87 L 8.90 4.33 0.00 1.79 1.72 0.89 0.76 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 88 I 7.54 4.38 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.67 0.58 0.00 0.00 89 S 8.10 4.58 0.00 3.97 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 90 K 8.68 4.04 0.00 1.85 1.82 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.48 7.81 91 A 8.20 4.08 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 92 S 7.95 5.10 0.00 4.30 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.11 3.77 0.00 2.97 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 94 E 8.68 4.05 0.00 2.34 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 2.33 2.23 0.00 95 N 8.53 4.39 0.00 3.25 3.08 0.00 0.00 6.62 7.28 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 96 V 7.65 3.79 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 0.92 0.00 0.00 0.97 0.00 0.00 97 L 7.59 3.93 0.00 1.76 1.64 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.96 4.13 0.00 1.68 1.81 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.63 7.81 99 K 7.45 4.06 0.00 1.43 1.25 0.00 0.61 0.00 0.00 0.84 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.86 7.81 100 W 7.97 4.21 0.00 3.54 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 0.00 101 M 8.21 4.03 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.87 0.00 102 P 0.00 4.17 0.00 2.05 2.03 0.00 3.56 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.08 0.00 103 E 8.05 4.01 0.00 1.93 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 0.00 2.44 2.79 0.00 104 L 8.28 3.97 0.00 1.58 1.40 0.54 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.12 3.84 0.00 1.82 2.01 0.00 3.20 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 106 R 7.87 3.82 0.00 1.35 1.75 0.00 2.94 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.97 0.00 107 F 8.01 4.92 0.00 3.42 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 0.00 108 A 8.37 4.86 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 0.00 109 P 0.00 4.30 0.00 2.19 2.23 0.00 3.96 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 110 N 8.72 4.25 0.00 2.92 2.99 0.00 0.00 6.84 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 0.00 111 V 7.25 4.44 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 0.87 0.00 0.00 1.15 0.00 0.00 112 P 0.00 4.61 0.00 2.17 2.18 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.01 0.00 113 I 8.22 5.11 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.99 0.92 0.00 0.00 114 V 8.85 4.48 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 0.89 0.00 0.00 0.87 0.00 0.00 115 L 8.90 4.85 0.00 1.88 1.86 1.10 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.97 4.68 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 0.81 0.00 0.00 0.73 0.00 0.00 117 G 8.62 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.38 4.71 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 1.08 0.00 0.00 119 K 8.26 4.18 0.00 1.90 1.80 0.00 1.93 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.39 1.31 7.81 120 L 7.92 3.90 0.00 1.77 1.61 0.92 1.04 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 0.00 121 D 7.99 4.24 0.00 2.79 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 0.00 122 L 7.69 4.00 0.00 1.52 1.02 0.80 0.62 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 0.00 123 R 7.68 3.81 0.00 1.73 1.92 0.00 3.45 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 124 D 7.95 4.70 0.00 2.79 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 0.00 125 D 7.51 4.57 0.00 2.96 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 0.00 126 K 8.81 4.14 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.51 7.81 127 G 8.13 3.61 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 0.00 128 Y 8.46 3.99 0.00 3.17 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 0.00 129 L 8.17 4.09 0.00 1.82 1.68 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.10 4.14 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 0.00 131 D 7.82 4.91 0.00 2.43 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 0.00 132 H 6.68 4.12 0.00 3.08 3.25 0.00 5.90 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 T 7.54 3.94 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 0.38 0.00 0.00 134 N 7.96 3.84 0.00 2.84 3.04 0.00 0.00 7.00 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 0.00 135 V 7.53 4.77 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 1.02 0.00 0.00 1.05 0.00 0.00 136 I 8.58 4.45 2.15 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 1.09 -0.01 1.12 0.00 0.00 137 T 8.80 4.33 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 1.25 0.00 0.00 138 S 8.74 5.06 0.00 3.98 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 0.00 139 T 7.94 3.91 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 140 Q 7.61 4.38 0.00 2.25 2.04 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 2.33 2.22 0.00 141 G 8.10 3.48 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 0.00 142 E 8.07 3.74 0.00 2.16 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 2.33 2.38 0.00 143 E 8.26 3.92 0.00 2.27 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 2.32 2.30 0.00 144 L 7.83 3.79 0.00 1.21 1.44 0.39 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 145 R 7.71 3.80 0.00 1.85 2.02 0.00 3.30 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.87 0.00 146 K 8.06 3.87 0.00 2.00 1.82 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.73 7.81 147 Q 8.03 4.00 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 148 I 7.47 4.28 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.65 0.80 0.00 0.00 149 G 7.68 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 0.00 150 A 7.72 4.27 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.96 4.22 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 0.00 152 A 7.71 4.66 1.20 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 0.00 0.00 0.00 0.00 0.00 153 Y 8.53 5.34 0.00 3.03 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 0.00 154 I 8.38 4.33 1.63 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.48 0.71 0.00 0.00 155 E 8.21 4.85 0.00 1.73 1.71 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 2.16 1.67 0.00 156 C 8.91 5.19 0.00 2.98 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 0.00 157 S 8.76 4.72 0.00 3.83 3.58 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 0.00 158 S 8.83 4.26 0.00 4.11 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 0.00 159 K 7.67 2.52 0.00 0.79 1.39 0.00 1.47 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.07 0.68 7.81 160 T 7.51 4.09 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 1.09 0.00 0.00 161 Q 7.83 3.69 0.00 2.33 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 162 Q 7.56 3.93 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 5.86 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 163 N 9.03 4.49 0.00 2.97 2.84 0.00 0.00 6.74 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 0.00 164 V 7.83 3.65 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 1.22 0.00 0.00 0.97 0.00 0.00 165 K 8.30 4.22 0.00 2.00 1.89 0.00 1.84 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.83 1.80 7.81 166 A 7.71 4.08 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 0.00 167 V 7.33 3.19 1.55 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 -0.02 0.00 0.00 0.73 0.00 0.00 168 F 7.50 4.03 0.00 2.14 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 0.00 169 D 8.51 4.45 0.00 2.65 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 T 8.02 3.82 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 171 A 7.84 3.94 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 0.00 172 I 7.77 3.68 2.05 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 1.58 0.75 0.94 0.00 0.00 173 K 8.03 3.92 0.00 1.90 1.86 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.76 1.60 7.81 174 V 7.87 3.57 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 0.79 0.00 0.00 0.96 0.00 0.00 175 V 7.46 3.74 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 0.90 0.00 0.00 0.99 0.00 0.00 176 L 7.97 4.16 0.00 1.66 1.72 0.93 0.86 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 0.00 177 Q 7.46 4.35 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 178 P 0.00 4.45 0.00 2.04 1.99 0.00 3.68 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 2.03 2.07 0.00 179 P 0.00 4.44 0.00 2.32 2.06 0.00 3.74 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 1.99 1.99 0.00 180 R 8.44 4.49 0.00 1.81 2.00 0.00 3.32 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 181 R 7.67 4.20 0.00 1.84 1.82 0.00 3.06 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 1.49 1.60 0.00 * Residues marked with a * may have inaccurate shift predictions.