NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4465 8.2493 123.5825 52.5084 19.9251 176.2663 2 T 4.5859 8.4057 109.4908 60.6017 71.0976 172.0412 3 K 5.2793 8.3270 124.9958 54.8435 36.6237 175.6557 4 A 5.4851 9.3916 126.9985 50.5331 23.3519 175.0172 5 V 5.0095 8.7427 117.3443 60.7749 35.4782 173.3645 6 C 4.9847 9.1397 122.1059 57.9341 35.5765 172.6403 7 V 4.5979 8.4261 125.9904 61.5277 32.8856 174.3070 8 L 4.8168 8.8976 129.5257 54.0932 43.1272 176.0493 9 K 4.8957 8.9966 123.7177 55.6592 36.3213 175.5028 10 G 4.4369 7.9863 111.0636 44.7204 0.0000 172.0216 11 D 4.4904 8.8107 117.9474 56.1125 41.5884 177.0414 12 G 4.2481 7.6470 109.1713 44.1809 0.0000 171.6680 13 P 4.4737 0.0000 0.0000 63.1896 32.1780 175.6114 14 V 4.0813 7.5546 120.7867 63.0931 32.0145 175.0079 15 Q 4.8368 9.0044 125.3285 55.2101 32.3797 173.7477 16 G 4.3377 8.4175 106.2513 45.8974 0.0000 171.9265 17 I 5.1283 8.1397 120.4971 59.3198 40.5939 174.9359 18 I 4.6466 8.6564 127.3425 59.4619 40.4191 174.3688 19 N 4.9828 8.5748 124.0023 51.3563 41.3926 173.8518 20 F 5.3198 8.9261 120.0919 55.7252 43.1046 173.6574 21 E 5.1684 9.7121 123.8545 54.8033 32.0034 174.2973 22 Q 4.4803 9.6815 127.6610 54.1683 29.4645 175.2002 23 K 4.2773 8.7390 123.3506 57.7239 32.9672 177.2011 24 E 4.6905 7.5978 118.8701 53.8680 31.7680 175.6172 25 S 4.2439 8.7415 119.3892 60.5304 63.2239 174.5156 26 N 4.2198 8.9787 120.0151 53.6379 36.2248 174.4654 27 G 3.9856 8.0365 108.3411 43.6668 0.0000 171.7886 28 P 4.5912 0.0000 0.0000 62.6854 32.2337 176.4213 29 V 4.6035 8.8861 123.0165 61.2307 33.6220 174.8820 30 K 4.7844 9.3441 128.6473 56.1850 33.5897 176.0460 31 V 4.8169 9.3841 125.2694 60.7784 34.1459 174.2714 32 W 6.0414 7.7588 123.6567 55.0215 31.9966 175.4263 33 G 4.0024 7.7275 105.4796 46.0929 0.0000 170.6757 34 S 5.0581 7.7674 113.7869 56.9048 66.3917 174.1915 35 I 4.9474 8.9767 127.1319 59.3158 40.4889 174.7353 36 K 4.8296 9.3520 125.3819 55.4986 36.2552 176.9516 37 G 3.9398 8.8650 105.9791 46.6828 0.0000 173.3795 38 L 4.4891 7.5713 120.0191 52.9472 43.3072 176.1207 39 T 4.1784 8.0809 110.4924 60.8068 69.6759 174.2849 40 E 4.0770 8.6733 124.5984 57.6768 30.3402 175.1072 41 G 3.7815 8.3901 110.7898 43.9488 0.0000 172.2291 42 L 4.8126 8.2082 119.0344 54.7442 42.9280 176.5275 43 H 5.0192 9.1058 119.2949 53.6343 33.0854 173.2424 44 G 4.1131 9.2292 111.0776 46.9179 0.0000 172.0462 45 F 5.8119 9.4130 125.4124 56.5388 42.3505 173.7985 46 R 5.0798 8.8718 124.0327 54.8260 35.3554 174.0192 47 V 4.6027 8.6332 121.9204 61.5774 33.2936 175.1304 48 Q 4.7953 9.2797 127.6683 54.6355 30.4642 176.3419 49 E 3.6843 9.1040 123.3628 58.7611 30.0037 177.1454 50 F 4.8997 7.9959 116.5684 54.8170 41.3687 176.7478 51 G 4.4059 8.3309 111.2394 44.3811 0.0000 174.6684 52 D 4.7748 7.9190 118.3159 52.7880 41.8552 174.8829 53 N 5.5789 8.6015 125.5244 52.2349 39.3786 176.7550 54 T 3.9480 8.4853 111.3624 63.8087 69.4200 174.1702 55 A 4.7463 8.0433 125.6253 51.6307 20.3482 175.9642 56 G 3.7153 7.7614 113.7535 47.9046 0.0000 176.6129 57 C 4.5907 8.6240 118.5143 58.3389 40.6303 175.0445 58 T 4.0297 7.6580 110.1711 63.1106 68.2229 175.6656 59 S 4.6280 7.7485 115.9191 58.4318 63.6753 175.0376 60 A 4.1468 7.7048 123.8898 54.0087 18.2844 178.4828 61 G 4.1776 7.7223 105.6163 43.5837 0.0000 171.2238 62 P 4.7605 0.0000 0.0000 62.1315 32.9751 175.5159 63 H 4.7905 8.6908 116.0538 55.5930 29.4383 174.8767 64 F 4.3053 9.2958 124.2793 58.4224 40.0319 174.8600 65 N 4.8495 7.7917 121.8535 51.9212 40.1609 171.5444 66 P 4.0004 0.0000 0.0000 63.7127 31.9851 174.9971 67 L 3.7441 8.0882 126.7361 55.2575 40.0692 174.7397 *79 R 4.0473 7.3846 113.9179 55.9749 30.9058 174.9778 80 H 4.5062 8.0777 115.3145 55.3223 29.6165 176.7728 81 V 3.4789 8.4366 122.5206 66.2075 31.3219 177.6688 82 G 3.7402 8.2320 107.1001 46.9134 0.0000 172.6668 83 D 4.7099 7.8112 119.8339 53.9465 39.7120 174.8231 84 L 4.5961 8.4418 125.5556 54.1364 42.8787 179.0137 85 G 3.9205 8.5862 109.6439 47.0186 0.0000 174.3771 86 N 5.6261 8.7361 120.8210 51.4538 42.1484 173.6561 87 V 4.3521 8.4937 114.1667 60.1093 35.2802 175.0749 88 T 5.0444 8.1280 117.8053 61.8210 71.5078 173.1981 89 A 4.6875 9.0301 129.7597 51.3863 20.5577 177.2915 90 D 4.9592 8.6057 121.3168 52.0243 41.8954 176.8946 91 K 4.1347 8.4975 118.7928 59.6998 32.2401 178.0350 92 D 4.4256 8.2787 117.2306 55.2107 41.2045 177.2198 93 G 3.9518 8.5970 108.1775 44.1698 0.0000 172.2596 94 V 4.7639 7.9437 119.0985 60.6803 34.0528 174.1644 95 A 5.3312 9.2210 130.3360 49.4958 21.0780 174.7579 96 D 5.0032 8.6671 122.5344 54.0270 42.4261 176.3286 97 V 4.3104 8.9212 123.3184 61.2037 34.2140 174.7457 98 S 5.0500 8.5699 122.6872 57.7095 63.9071 172.7014 99 I 4.8311 9.5876 127.9035 59.2484 41.5273 173.9986 100 E 5.1442 8.8463 125.1066 54.5409 31.9604 174.5327 101 D 4.9230 9.2941 126.2192 52.5105 44.4026 175.6196 102 S 4.7605 8.9569 119.0046 58.1915 63.7393 174.3325 103 V 4.1320 8.0449 120.7567 64.7518 32.4235 176.2356 104 I 4.0784 8.1666 111.7236 61.2078 38.2659 174.4501 105 S 4.5782 8.1395 113.4413 57.9235 64.8826 174.2625 106 L 4.3947 9.0054 123.2465 54.2277 41.4641 176.2441 107 S 4.4213 7.9474 112.6362 58.2628 66.2830 175.1403 108 G 3.8852 8.4968 108.6889 44.8849 0.0000 173.5948 109 D 4.4076 8.7828 117.2828 57.3116 40.8856 177.0605 110 H 5.0263 8.0452 113.7232 55.4228 29.0070 174.2737 111 C 4.3020 8.1300 121.2351 59.7847 31.8506 173.4769 112 I 3.9276 8.1148 118.7150 60.2218 38.1192 175.5811 113 I 3.6651 7.3130 123.0207 62.9454 37.4113 176.3763 114 G 3.8010 9.1861 113.4150 45.4155 0.0000 173.0345 115 R 4.6944 7.3587 118.9894 54.9999 33.4397 174.7359 116 T 4.9611 7.8855 116.0220 62.0984 70.8284 174.0331 117 L 4.8742 8.6659 128.5155 54.0092 44.1308 175.4042 118 V 5.1942 8.8561 124.8702 61.1236 35.7697 174.0815 119 V 5.1608 8.6138 125.4113 60.4434 33.9718 174.6978 120 H 5.1903 9.2434 121.8451 54.2522 30.4112 174.9347 121 E 4.2017 9.0300 121.5219 59.0232 30.0395 176.3838 122 K 4.8141 8.4592 117.0071 53.7961 36.9150 175.8005 123 A 4.3975 8.3624 123.0215 51.9203 18.7465 175.7573 124 D 4.4790 9.4714 121.4765 54.9249 39.8834 176.4768 *139 N 4.6358 8.4580 122.3345 52.4931 40.6378 176.0485 140 A 4.1488 7.2833 119.9606 51.5067 19.4017 178.7504 141 G 3.8810 7.3097 105.0174 44.9658 0.0000 173.6816 142 S 4.4748 8.3306 114.5659 58.1812 64.9900 174.2044 143 R 4.4179 8.3521 120.1603 55.4417 29.6799 176.5858 144 L 4.2897 8.8983 125.9031 57.5519 42.9591 177.2183 145 A 4.9186 7.7829 117.8786 51.3778 22.7773 174.0494 146 C 5.6495 8.4990 113.0517 55.9874 46.7075 172.8463 147 G 4.8095 8.1885 104.8298 45.9864 0.0000 172.1803 148 V 4.3828 8.2054 120.8905 62.1514 32.6780 175.5467 149 I 4.0793 8.8621 129.7929 61.1561 37.8928 175.3889 150 G 4.4398 9.0107 114.8546 43.9461 0.0000 172.2555 151 I 4.2259 8.2959 121.6707 61.3173 37.0690 175.8262 152 A 4.6407 8.8517 128.0564 52.6495 21.7261 176.2204 153 Q 4.0693 7.7693 120.7054 56.7478 29.0638 173.6519 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 A 8.25 4.45 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 2 T 8.41 4.59 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 1.24 0.00 0.00 3 K 8.33 5.28 0.00 1.87 1.74 0.00 1.96 0.00 0.00 1.89 0.00 0.00 2.84 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.71 7.81 4 A 9.39 5.49 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.74 5.01 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 0.80 0.00 0.00 0.92 0.00 0.00 6 C 9.14 4.98 0.00 3.11 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 7 V 8.43 4.60 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 0.94 0.00 0.00 0.93 0.00 0.00 8 L 8.90 4.82 0.00 1.73 1.59 1.02 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.00 4.90 0.00 1.80 1.58 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.40 7.81 10 G 7.99 4.44 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 0.00 11 D 8.81 4.49 0.00 2.68 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 12 G 7.65 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 0.00 0.00 0.00 0.00 13 P 0.00 4.47 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.94 0.00 14 V 7.55 4.08 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 0.79 0.00 0.00 0.96 0.00 0.00 15 Q 9.00 4.84 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.40 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 16 G 8.42 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 0.00 0.00 0.00 0.00 17 I 8.14 5.13 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.63 0.84 0.00 0.00 18 I 8.66 4.65 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.20 0.43 0.00 0.00 19 N 8.57 4.98 0.00 1.44 1.46 0.00 0.00 6.45 8.72 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 20 F 8.93 5.32 0.00 2.85 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 21 E 9.71 5.17 0.00 2.41 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 2.34 2.56 0.00 22 Q 9.68 4.48 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 23 K 8.74 4.28 0.00 1.82 1.89 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.44 7.81 24 E 7.60 4.69 0.00 2.19 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 2.22 2.29 0.00 25 S 8.74 4.24 0.00 3.86 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 26 N 8.98 4.22 0.00 2.89 2.96 0.00 0.00 7.02 7.65 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 27 G 8.04 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 28 P 0.00 4.59 0.00 1.99 2.12 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.89 4.60 2.30 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 1.29 0.00 0.00 1.05 0.00 0.00 30 K 9.34 4.78 0.00 2.04 1.97 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.55 1.57 7.81 31 V 9.38 4.82 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 0.68 0.00 0.00 1.05 0.00 0.00 32 W 7.76 6.04 0.00 3.51 3.19 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 33 G 7.73 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 34 S 7.77 5.06 0.00 3.94 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.98 4.95 1.77 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 1.23 0.76 0.92 0.00 0.00 36 K 9.35 4.83 0.00 1.71 1.87 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.33 7.81 37 G 8.86 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 38 L 7.57 4.49 0.00 1.79 1.41 0.81 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.08 4.18 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 1.24 0.00 0.00 40 E 8.67 4.08 0.00 2.01 1.93 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 2.30 2.47 0.00 41 G 8.39 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.21 4.81 0.00 1.50 1.58 0.91 0.92 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 43 H 9.11 5.02 0.00 3.02 3.33 0.00 5.63 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 44 G 9.23 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 0.00 0.00 0.00 45 F 9.41 5.81 0.00 3.01 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 46 R 8.87 5.08 0.00 1.84 1.77 0.00 3.22 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 47 V 8.63 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 0.84 0.00 0.00 48 Q 9.28 4.80 0.00 1.95 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 49 E 9.10 3.68 0.00 1.78 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 1.47 1.89 0.00 50 F 8.00 4.90 0.00 3.12 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 51 G 8.33 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 52 D 7.92 4.77 0.00 2.61 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 53 N 8.60 5.58 0.00 2.72 2.77 0.00 0.00 7.30 7.54 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 54 T 8.49 3.95 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 1.24 0.00 0.00 55 A 8.04 4.75 1.26 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 0.00 0.00 56 G 7.76 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 0.00 0.00 0.00 57 C 8.62 4.59 0.00 3.01 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 58 T 7.66 4.03 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 1.25 0.00 0.00 59 S 7.75 4.63 0.00 4.16 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 60 A 7.70 4.15 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 61 G 7.72 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 0.00 0.00 0.00 62 P 0.00 4.76 0.00 2.15 2.20 0.00 3.59 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.14 0.00 63 H 8.69 4.79 0.00 3.21 3.38 0.00 5.53 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.30 4.31 0.00 2.94 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 65 N 7.79 4.85 0.00 2.41 2.36 0.00 0.00 7.23 7.69 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 66 P 0.00 4.00 0.00 1.91 1.89 0.00 3.17 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.43 0.00 67 L 8.09 3.74 0.00 1.75 1.75 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 *79 R 7.38 4.05 0.00 1.91 1.96 0.00 3.23 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 80 H 8.08 4.51 0.00 3.23 3.23 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.44 3.48 1.53 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 0.74 0.00 0.00 0.39 0.00 0.00 82 G 8.23 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 83 D 7.81 4.71 0.00 2.65 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 84 L 8.44 4.60 0.00 1.68 1.74 0.61 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.59 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 0.00 0.00 0.00 86 N 8.74 5.63 0.00 2.60 2.71 0.00 0.00 6.64 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 87 V 8.49 4.35 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.84 0.00 0.00 88 T 8.13 5.04 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 1.20 0.00 0.00 89 A 9.03 4.69 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 90 D 8.61 4.96 0.00 2.90 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 91 K 8.50 4.13 0.00 1.74 1.88 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.46 7.81 92 D 8.28 4.43 0.00 2.89 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 93 G 8.60 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 94 V 7.94 4.76 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 1.03 0.00 0.00 0.92 0.00 0.00 95 A 9.22 5.33 1.14 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 0.00 0.00 96 D 8.67 5.00 0.00 2.56 2.61 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 97 V 8.92 4.31 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 0.91 0.00 0.00 0.61 0.00 0.00 98 S 8.57 5.05 0.00 3.91 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 99 I 9.59 4.83 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.72 1.00 0.00 0.00 100 E 8.85 5.14 0.00 1.98 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 101 D 9.29 4.92 0.00 2.86 2.54 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 0.00 102 S 8.96 4.76 0.00 4.03 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 0.00 103 V 8.04 4.13 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 0.88 0.00 0.00 0.96 0.00 0.00 104 I 8.17 4.08 1.92 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.80 1.02 0.00 0.00 105 S 8.14 4.58 0.00 3.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.01 4.39 0.00 1.77 1.64 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.95 4.42 0.00 3.90 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 0.00 108 G 8.50 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 0.00 109 D 8.78 4.41 0.00 2.67 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 0.00 110 H 8.05 5.03 0.00 3.14 3.44 0.00 5.73 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.13 4.30 0.00 3.14 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 0.00 112 I 8.11 3.93 1.56 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.10 0.93 0.00 0.00 113 I 7.31 3.67 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.73 0.83 0.00 0.00 114 G 9.19 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 0.00 115 R 7.36 4.69 0.00 1.60 1.83 0.00 2.21 0.00 0.00 2.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.20 0.00 116 T 7.89 4.96 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 1.27 0.00 0.00 117 L 8.67 4.87 0.00 1.79 1.57 0.63 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.86 5.19 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 0.83 0.00 0.00 0.93 0.00 0.00 119 V 8.61 5.16 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 0.77 0.00 0.00 0.99 0.00 0.00 120 H 9.24 5.19 0.00 3.17 3.56 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.03 4.20 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 122 K 8.46 4.81 0.00 1.70 1.67 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.36 4.40 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 0.00 124 D 9.47 4.48 0.00 2.86 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *139 N 8.46 4.64 0.00 2.84 2.88 0.00 0.00 6.93 7.54 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 0.00 140 A 7.28 4.15 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 0.00 141 G 7.31 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 0.00 0.00 0.00 142 S 8.33 4.47 0.00 3.96 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.35 4.42 0.00 1.70 1.89 0.00 3.30 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.61 0.00 144 L 8.90 4.29 0.00 1.71 1.70 0.95 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.78 4.92 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 0.00 146 C 8.50 5.65 0.00 3.05 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 0.00 147 G 8.19 4.81 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 0.00 148 V 8.21 4.38 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 0.77 0.00 0.00 0.94 0.00 0.00 149 I 8.86 4.08 1.79 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.44 0.48 0.00 0.00 150 G 9.01 4.44 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 0.00 151 I 8.30 4.23 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 1.24 0.54 0.90 0.00 0.00 152 A 8.85 4.64 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 0.00 153 Q 7.77 4.07 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.