NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 N 4.7616 8.4249 119.6828 52.7115 41.1798 176.9351 27 K 4.4211 8.7530 115.2010 54.7286 34.9849 172.8894 28 W 4.8017 8.4750 122.5501 56.7259 30.2905 175.6432 29 K 4.9257 9.3029 122.7346 53.9520 36.2365 173.7596 30 P 4.5109 0.0000 0.0000 63.2421 31.4237 176.9023 31 L 3.6531 8.5689 126.6330 57.4139 42.2192 177.6369 32 F 4.9635 7.8112 114.8464 56.5075 39.6247 177.0922 33 G 4.2812 7.5662 110.8913 45.2700 0.0000 173.4766 34 K 4.3371 8.9274 118.4917 56.7388 33.0921 176.6167 35 N 4.4181 9.3235 117.3216 53.3281 36.3416 174.3761 36 L 3.8156 8.2107 113.5891 55.5562 39.3544 176.6267 37 E 4.0894 8.3470 119.3049 59.1775 29.7330 177.2852 38 N 5.1186 8.6433 115.7315 52.8250 39.7557 174.4018 39 A 5.2916 8.2139 119.9531 50.2687 22.2949 176.2918 40 N 4.9508 9.0009 118.0284 52.2298 40.2180 174.0960 41 Y 4.8912 7.8226 119.9871 56.3895 40.9634 173.1410 42 N 4.5625 8.6472 119.0762 51.9257 39.5041 174.0077 43 P 5.0122 0.0000 0.0000 64.1166 31.6219 176.9999 44 E 4.2476 8.7646 117.4156 57.5021 30.1647 177.1363 45 V 4.0680 8.3868 119.1586 63.8222 33.5593 175.2395 46 W 5.2624 8.1159 119.9603 54.9008 31.8739 174.8344 47 S 4.8369 9.0113 117.3068 57.4387 66.4473 173.1156 48 E 5.0284 8.7999 121.1884 55.5056 30.7475 175.4252 49 T 4.5260 8.9336 120.7160 62.7162 70.7887 173.9243 50 D 4.4997 9.9296 127.1408 55.4410 38.4666 174.8560 51 G 3.9124 8.6881 104.3362 45.2835 0.0000 173.7210 52 V 4.6834 7.8315 120.0863 60.7659 34.3361 174.2218 53 L 5.0237 9.7637 131.0744 54.8276 43.6915 175.6746 54 G 4.6264 9.2377 111.6072 45.3795 0.0000 171.0544 55 A 4.6489 7.7904 120.3975 49.8621 21.3085 176.5460 56 V 4.0961 8.2278 112.6987 61.1740 33.3164 175.3649 57 K 4.5831 7.2166 119.3172 54.5206 36.1190 176.1525 58 D 4.6348 8.3727 116.8715 54.9468 39.9416 176.1958 59 E 4.3579 7.9832 120.4181 56.3884 30.3696 176.6418 60 S 4.6763 8.7114 121.1129 58.1582 64.5599 172.9728 61 I 4.0772 7.1984 120.7397 58.7747 40.3520 174.2678 62 W 5.6091 8.5014 127.9419 54.6068 33.1873 175.0812 63 T 4.6756 9.3181 113.1899 62.2109 68.5027 174.7696 64 K 4.5407 8.8521 122.0839 58.2389 32.7216 176.8547 65 D 5.0386 8.3075 118.2173 52.2974 44.0988 174.9050 66 E 4.4538 7.8672 119.7210 55.5067 31.9189 174.8971 67 Y 5.0441 8.8062 119.6051 56.3324 42.1388 174.3267 68 E 5.2487 8.7256 119.1833 54.9456 33.2325 174.2925 69 N 4.2783 8.7135 115.7087 54.2970 35.9284 172.7278 70 F 5.6192 7.8014 113.2436 55.1657 43.0443 174.9427 71 E 5.2604 9.3492 117.5172 54.5045 32.4141 174.3401 72 L 5.3509 9.3984 126.0077 53.4657 44.5799 174.5360 73 D 5.4444 9.0620 126.3442 52.6760 43.8818 175.1668 74 L 5.0130 8.0037 119.7598 55.7178 43.8378 173.5350 75 D 5.5040 9.3020 121.4922 53.3568 43.2918 175.5172 76 F 5.7105 8.8961 115.6513 55.4171 42.2660 173.0110 77 K 4.4348 8.6195 121.3866 54.6898 35.0912 175.4211 78 T 4.8690 8.3840 116.6709 60.7267 71.8524 172.9208 79 D 5.2882 8.6791 122.4073 52.0831 44.3863 175.5912 80 V 3.8758 8.2163 121.1949 64.4230 31.5715 175.9688 81 G 3.9611 9.4418 115.7266 45.5311 0.0000 173.1503 82 T 3.8565 7.6284 116.4852 64.4021 69.6095 172.7342 83 N 5.1676 8.7140 123.6624 52.6479 41.5415 172.4679 84 S 4.4958 9.1557 123.2764 59.8038 66.3343 172.5584 85 G 4.3333 8.2235 103.2149 46.3557 0.0000 172.3666 86 V 4.3891 8.0872 122.0997 61.0483 33.7180 174.6200 87 V 4.9071 8.6027 128.1491 61.4334 33.6349 174.8865 88 V 4.8384 8.6539 120.2266 59.5765 36.5414 174.6757 89 Y 4.0165 8.7359 115.6262 59.3664 35.5104 169.7462 90 C 4.6213 8.4025 120.6256 59.1924 31.9987 173.5202 91 T 4.3973 8.2897 116.3758 61.5485 69.3314 174.4572 92 D 4.3429 7.5306 123.0089 53.8912 42.3312 175.4298 93 T 3.0318 8.0975 120.2217 63.8504 69.2707 177.0582 94 K 4.1259 8.0983 123.4938 57.3313 32.5829 182.8500 95 D 4.8150 8.3215 120.3540 52.4006 39.8549 176.2163 96 W 4.9408 7.6795 118.9514 58.3659 29.7056 179.5653 97 I 3.0203 7.2888 119.4062 63.5493 36.3697 175.2695 98 P 4.6389 0.0000 0.0000 63.8904 32.4374 175.5170 99 N 5.3094 7.7250 117.9035 51.9042 38.3043 173.1949 100 S 5.2458 7.6050 110.8503 58.8937 66.3382 175.6348 101 V 4.4526 8.5002 119.9588 60.9528 33.7339 173.6274 102 E 5.2040 8.9394 127.7025 54.5458 32.5207 174.3573 103 I 4.6534 8.8149 129.0203 60.0727 38.5515 175.2174 104 Q 4.3965 9.5045 130.2543 56.3042 30.4229 174.9363 105 I 4.8192 8.5985 126.2251 59.4364 40.1467 174.3990 106 A 5.0353 8.3804 126.9431 50.7738 22.6103 176.2166 107 D 4.6222 9.1736 121.0504 53.5237 39.5370 176.7861 108 D 4.5571 8.4358 124.5869 56.3870 41.1137 177.1832 109 H 4.5220 8.2419 115.0152 56.1811 29.1984 174.4315 110 C 4.5139 8.0216 123.3245 58.5252 32.5124 174.5786 111 E 4.6569 8.3902 124.4501 54.4361 28.9119 171.9729 112 K 3.9118 7.8322 122.9854 57.7647 32.9700 178.3621 113 W 4.9079 7.7036 117.4650 56.3205 30.1201 177.9941 114 G 3.8195 8.0636 107.4649 45.9517 0.0000 175.9686 115 N 3.8468 8.9731 117.0820 54.4717 38.7402 176.1065 116 G 4.0551 7.4907 105.1127 44.9108 0.0000 172.4140 117 K 4.4367 8.3253 117.4933 53.6451 33.9718 176.3594 118 P 4.2564 0.0000 0.0000 65.9416 31.6981 177.5578 119 Y 4.5559 7.5508 113.6006 57.9139 38.1831 176.0900 120 E 4.8478 8.0627 119.5341 56.7232 30.5185 176.4437 121 K 4.5354 7.7926 119.1639 55.3395 33.1011 175.8323 122 C 4.5767 8.9414 122.0407 60.9588 31.6718 174.2246 123 G 3.9616 9.3786 115.7842 45.2260 0.0000 173.3365 124 A 4.2503 7.9636 122.9044 51.8918 19.1812 177.1731 125 I 4.6548 8.3026 121.0793 59.8639 36.8074 175.4770 126 Y 4.7153 8.3304 127.5069 58.4040 38.9042 177.0305 127 G 2.0479 6.9940 113.7393 45.3749 0.0000 173.4325 128 H 5.3515 7.9123 113.4611 55.6534 31.9874 174.0783 129 L 4.6320 7.6171 120.0572 53.7544 44.8144 174.9155 130 G 4.0878 8.7376 114.8789 45.0533 0.0000 172.7631 131 A 4.6236 8.1092 121.9260 50.8234 19.4150 178.5226 132 V 3.9008 8.4572 113.9262 63.5041 31.9590 177.2264 133 Q 4.6422 7.8481 116.3604 53.8968 32.1970 173.8162 134 D 4.9155 8.3466 119.3470 51.7892 42.0251 175.7784 135 K 4.2968 8.3879 114.6718 57.4197 30.1158 177.4850 136 V 3.8077 7.3520 120.3484 65.3743 31.7660 177.1381 137 V 3.9118 7.6407 118.4544 61.3980 31.7629 175.9988 138 K 4.3514 8.8740 122.8333 55.4456 33.2225 176.9110 139 K 4.1271 8.1256 118.8185 55.1717 32.6601 175.0494 140 P 4.7478 0.0000 0.0000 63.9631 31.5183 177.2009 141 G 3.7328 9.0610 110.8094 45.2481 0.0000 173.0203 142 E 4.5397 7.3786 118.8689 54.1633 31.2840 175.7287 143 W 4.1589 8.5230 122.6288 56.6441 30.1082 175.3982 144 N 5.0719 9.2969 121.1635 51.8074 41.8774 172.6938 145 H 5.3988 8.9535 119.4564 53.2167 34.5334 171.6357 *147 R 4.6090 8.2726 118.6022 56.2262 31.5575 173.8489 148 I 4.7577 9.1723 126.9825 59.5521 40.2500 174.5029 149 K 4.7409 8.6207 126.9850 55.1004 34.3319 175.2932 150 C 4.5310 8.9265 123.9820 57.8321 29.8272 171.9860 151 A 4.6123 9.3342 127.2330 49.3326 18.9853 178.1036 152 G 3.6710 8.6422 113.6671 46.7017 0.0000 174.0617 153 Q 4.0891 8.7271 124.4682 57.1458 28.9251 174.6325 154 H 4.9896 8.3380 117.1525 54.3639 29.5728 174.1024 155 I 5.4929 7.8427 124.3737 58.3583 41.4972 174.3449 *157 V 4.0560 8.0219 121.1526 63.1949 32.7127 173.9112 158 I 4.9758 8.8436 129.0551 59.4508 39.3303 174.8561 159 L 4.8218 9.0131 129.5382 54.2871 43.9916 175.9633 160 N 4.2834 10.2835 124.9496 54.4971 36.6987 175.4222 161 G 3.9662 8.5810 103.0120 45.5033 0.0000 173.7294 162 K 4.4439 8.0385 120.2490 53.8756 33.9221 175.5204 163 K 4.5697 8.6809 124.9928 56.7831 31.5331 176.1750 164 V 4.2147 8.6727 121.0033 62.5632 32.8428 176.8661 165 T 4.9181 7.5124 115.3549 62.2333 72.3358 172.4959 166 E 5.1076 8.2904 123.0906 54.0613 34.0584 173.6617 *168 D 4.7390 8.4330 118.2240 54.4135 42.0968 175.4411 *170 S 4.5566 8.3837 112.3425 58.1922 64.6033 175.1425 171 K 4.1194 8.4534 119.5841 58.3629 32.4767 177.8743 172 W 4.3260 8.2921 121.6836 55.5535 27.4815 176.8357 173 T 4.1070 7.6730 109.9324 63.2099 69.4281 175.6920 174 S 4.6719 7.8310 116.4917 56.5919 63.6971 173.7110 175 G 4.4032 8.9053 114.4049 45.6532 0.0000 173.9081 176 T 4.3939 7.7399 109.3564 61.1104 70.9735 173.8558 177 K 4.8648 8.1159 122.3153 54.3328 35.1863 175.2856 178 N 4.5733 8.8561 123.5329 51.6605 39.6083 174.4492 179 P 3.9290 0.0000 0.0000 65.6267 31.3265 177.2312 180 D 4.4500 7.8505 114.6724 53.7207 39.6564 177.0150 181 G 3.9412 8.5287 109.9188 45.2722 0.0000 174.3645 182 S 4.3766 8.2797 115.0402 57.7240 63.9596 172.9913 183 D 4.9878 8.3019 121.8759 53.1421 40.3598 175.8444 184 I 3.8676 8.3792 123.5541 60.1199 37.9386 174.2554 185 P 3.6957 0.0000 0.0000 62.5989 31.4669 177.3816 186 S 3.9155 8.4987 117.7251 61.0687 62.3610 175.0678 187 W 4.5201 7.7302 114.2501 57.1250 28.7122 176.0325 188 L 4.8762 7.4046 118.5545 53.2524 41.2377 174.9296 189 P 4.5220 0.0000 0.0000 64.0577 32.5813 176.8187 190 K 4.4917 7.9315 119.5337 54.7531 32.7170 174.8671 191 P 4.4444 0.0000 0.0000 62.8848 32.0422 177.6038 192 F 4.4682 9.2436 121.5973 60.3088 39.1164 177.3266 193 A 4.2062 8.6608 123.3899 54.3740 18.1874 177.8263 194 E 4.6385 8.0579 112.8737 55.8994 30.4220 176.1803 195 L 4.1630 7.5344 119.9777 53.5709 42.1983 175.4565 196 P 4.3159 0.0000 0.0000 63.1757 31.7856 176.1911 197 T 3.0462 7.7836 109.5634 59.9130 69.2237 173.6551 198 K 4.7573 7.0219 121.1319 55.3903 35.6863 175.5080 199 G 4.0177 7.7849 110.9953 46.9169 0.0000 171.7425 200 F 4.8283 8.1441 118.1278 57.5558 40.6081 174.7761 201 I 5.1515 8.9968 121.8631 59.9281 39.6684 175.2101 202 G 4.1807 9.0329 112.1754 44.4847 0.0000 171.0670 203 L 4.7993 7.2903 118.5716 52.6528 45.3316 176.6919 204 Q 4.4144 7.9054 120.3180 55.0228 30.7340 175.1611 205 G 3.9454 8.3268 107.1144 44.5756 0.0000 172.6432 206 K 4.2413 8.4156 121.8773 55.7974 32.4766 177.1665 207 H 4.8450 8.5392 120.9068 55.8252 30.7634 174.9996 208 G 3.7624 7.0976 109.8024 45.5518 0.0000 173.2857 209 D 4.4217 8.6414 120.0951 55.9636 41.4937 176.6450 210 S 4.4197 7.7803 115.8468 57.9134 63.3853 173.9203 211 L 4.1374 8.6265 126.1509 53.7871 42.9811 175.8582 212 I 4.4480 6.9746 118.9001 59.2075 41.2467 173.9182 213 W 5.0298 8.6040 127.0298 54.9049 32.6225 174.4848 214 F 6.0499 9.4977 122.2959 56.3312 42.4692 174.2605 215 R 4.7523 9.5253 116.2588 55.1666 33.4453 173.8828 216 N 4.1175 8.4538 113.8837 54.2833 36.2717 174.9427 217 I 4.3635 7.4419 118.7343 60.6440 38.5161 176.4715 218 K 5.1681 9.0017 126.1187 55.5323 36.5845 174.9631 219 I 5.5045 9.0749 120.5793 59.8601 41.8477 173.7997 220 R 4.9078 8.7418 122.7621 54.6942 33.1267 174.4040 221 S 4.7926 8.4229 115.7743 58.2665 63.9733 174.6230 222 L 4.1176 8.4399 121.8945 55.1819 41.4128 177.0514 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 26 N 8.42 4.76 0.00 2.53 1.74 0.00 0.00 6.53 6.56 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 27 K 8.75 4.42 0.00 1.67 1.74 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.51 7.81 28 W 8.47 4.80 0.00 3.18 3.06 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 29 K 9.30 4.93 0.00 1.81 1.91 0.00 1.39 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.38 7.81 30 P 0.00 4.51 0.00 2.28 2.23 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 31 L 8.57 3.65 0.00 1.13 0.95 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 32 F 7.81 4.96 0.00 3.02 2.78 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 33 G 7.57 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 0.00 0.00 0.00 0.00 34 K 8.93 4.34 0.00 1.82 1.75 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.43 7.81 35 N 9.32 4.42 0.00 2.90 2.93 0.00 0.00 7.31 7.85 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 36 L 8.21 3.82 0.00 1.69 1.17 0.36 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.35 4.09 0.00 2.14 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 0.00 2.44 2.36 0.00 38 N 8.64 5.12 0.00 2.80 2.97 0.00 0.00 6.55 7.63 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 39 A 8.21 5.29 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 40 N 9.00 4.95 0.00 2.70 2.76 0.00 0.00 6.82 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 41 Y 7.82 4.89 0.00 2.93 2.57 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 42 N 8.65 4.56 0.00 2.90 2.85 0.00 0.00 6.90 7.71 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 43 P 0.00 5.01 0.00 2.14 2.27 0.00 3.71 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.84 0.00 44 E 8.76 4.25 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 45 V 8.39 4.07 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 0.71 0.00 0.00 0.95 0.00 0.00 46 W 8.12 5.26 0.00 3.30 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 47 S 9.01 4.84 0.00 3.93 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 48 E 8.80 5.03 0.00 2.10 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 2.42 2.34 0.00 49 T 8.93 4.53 4.36 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 1.28 0.00 0.00 50 D 9.93 4.50 0.00 2.84 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 51 G 8.69 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 0.00 0.00 0.00 52 V 7.83 4.68 2.43 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 1.53 0.00 0.00 1.04 0.00 0.00 53 L 9.76 5.02 0.00 1.98 1.99 1.09 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 9.24 4.63 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 0.00 0.00 0.00 55 A 7.79 4.65 -0.47 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 56 V 8.23 4.10 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 0.61 0.00 0.00 0.89 0.00 0.00 57 K 7.22 4.58 0.00 1.66 1.62 0.00 1.63 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.31 7.81 58 D 8.37 4.63 0.00 2.86 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.98 4.36 0.00 2.10 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 2.46 2.51 0.00 60 S 8.71 4.68 0.00 3.42 2.63 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 61 I 7.20 4.08 0.56 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.77 -0.90 0.00 0.00 62 W 8.50 5.61 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 63 T 9.32 4.68 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 64 K 8.85 4.54 0.00 1.82 2.00 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.70 1.49 7.81 65 D 8.31 5.04 0.00 2.45 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 0.00 0.00 0.00 0.00 66 E 7.87 4.45 0.00 1.58 1.52 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 1.47 1.51 0.00 67 Y 8.81 5.04 0.00 2.51 2.40 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 68 E 8.73 5.25 0.00 2.01 1.99 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 2.21 2.39 0.00 69 N 8.71 4.28 0.00 2.99 2.90 0.00 0.00 6.32 8.13 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 70 F 7.80 5.62 0.00 3.19 3.18 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 71 E 9.35 5.26 0.00 2.16 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 0.00 2.20 2.19 0.00 72 L 9.40 5.35 0.00 1.92 1.72 0.73 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 73 D 9.06 5.44 0.00 2.23 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 0.00 0.00 0.00 0.00 74 L 8.00 5.01 0.00 1.84 1.73 1.15 0.99 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 75 D 9.30 5.50 0.00 2.82 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 76 F 8.90 5.71 0.00 3.06 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 77 K 8.62 4.43 0.00 0.79 0.74 0.00 1.02 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 0.63 7.81 78 T 8.38 4.87 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 1.44 0.00 0.00 79 D 8.68 5.29 0.00 2.95 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 80 V 8.22 3.88 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 0.94 0.00 0.00 81 G 9.44 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 0.00 0.00 0.00 82 T 7.63 3.86 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 1.17 0.00 0.00 83 N 8.71 5.17 0.00 2.79 2.79 0.00 0.00 6.83 7.63 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 84 S 9.16 4.50 0.00 3.85 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.22 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 0.00 0.00 0.00 86 V 8.09 4.39 2.05 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 0.90 0.00 0.00 0.89 0.00 0.00 87 V 8.60 4.91 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 1.30 0.00 0.00 0.64 0.00 0.00 88 V 8.65 4.84 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.47 0.00 0.00 89 Y 8.74 4.02 0.00 3.11 2.97 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 90 C 8.40 4.62 0.00 3.25 3.11 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 91 T 8.29 4.40 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 1.20 0.00 0.00 92 D 7.53 4.34 0.00 2.67 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 93 T 8.10 3.03 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 -0.21 0.00 0.00 94 K 8.10 4.13 0.00 1.80 1.75 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.35 0.99 7.81 95 D 8.32 4.82 0.00 2.59 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 96 W 7.68 4.94 0.00 3.66 3.31 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 97 I 7.29 3.02 1.46 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 -0.36 0.87 0.00 0.00 98 P 0.00 4.64 0.00 2.24 2.23 0.00 3.83 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 99 N 7.72 5.31 0.00 2.84 2.85 0.00 0.00 6.46 6.96 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 0.00 100 S 7.61 5.25 0.00 4.23 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 0.00 101 V 8.50 4.45 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 0.92 0.00 0.00 0.39 0.00 0.00 102 E 8.94 5.20 0.00 2.36 2.05 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 2.41 2.42 0.00 103 I 8.81 4.65 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 1.11 0.37 0.94 0.00 0.00 104 Q 9.50 4.40 0.00 2.37 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.75 0.00 0.00 0.00 0.00 0.00 2.71 2.50 0.00 105 I 8.60 4.82 1.69 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.58 0.20 0.00 0.00 106 A 8.38 5.04 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 0.00 107 D 9.17 4.62 0.00 2.95 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.44 4.56 0.00 2.60 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 0.00 109 H 8.24 4.52 0.00 3.31 3.36 0.00 5.64 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 0.00 110 C 8.02 4.51 0.00 3.18 2.97 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 0.00 111 E 8.39 4.66 0.00 2.00 1.72 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 2.13 1.86 0.00 112 K 7.83 3.91 0.00 0.96 0.74 0.00 1.01 0.00 0.00 1.45 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.03 1.18 7.81 113 W 7.70 4.91 0.00 3.30 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 0.00 114 G 8.06 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 0.00 0.00 0.00 115 N 8.97 3.85 0.00 2.74 2.93 0.00 0.00 6.77 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 0.00 116 G 7.49 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 0.00 117 K 8.33 4.44 0.00 1.45 0.92 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.25 7.81 118 P 0.00 4.26 0.00 2.16 2.12 0.00 3.36 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 2.06 2.06 0.00 119 Y 7.55 4.56 0.00 3.15 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 0.00 120 E 8.06 4.85 0.00 2.25 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 0.00 2.75 2.40 0.00 121 K 7.79 4.54 0.00 1.93 1.94 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.66 1.56 7.81 122 C 8.94 4.58 0.00 3.34 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 0.00 123 G 9.38 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 0.00 0.00 0.00 124 A 7.96 4.25 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 8.30 4.65 1.82 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 1.19 0.79 0.94 0.00 0.00 126 Y 8.33 4.72 0.00 3.13 3.06 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 0.00 127 G 6.99 2.05 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 0.00 0.00 0.00 128 H 7.91 5.35 0.00 2.89 2.81 0.00 5.84 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.62 4.63 0.00 1.93 1.52 1.21 1.19 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 0.00 130 G 8.74 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.11 4.62 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 0.00 132 V 8.46 3.90 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 0.75 0.00 0.00 1.03 0.00 0.00 133 Q 7.85 4.64 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 134 D 8.35 4.92 0.00 3.04 2.82 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 0.00 135 K 8.39 4.30 0.00 1.90 1.92 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.20 1.32 7.81 136 V 7.35 3.81 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 0.97 0.00 0.00 137 V 7.64 3.91 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 0.94 0.00 0.00 1.16 0.00 0.00 138 K 8.87 4.35 0.00 1.78 1.77 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.40 7.81 139 K 8.13 4.13 0.00 1.72 1.63 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.10 1.24 7.81 140 P 0.00 4.75 0.00 2.02 2.02 0.00 3.72 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 141 G 9.06 3.73 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 0.00 0.00 0.00 142 E 7.38 4.54 0.00 2.00 1.82 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 2.30 2.35 0.00 143 W 8.52 4.16 0.00 3.12 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 N 9.30 5.07 0.00 1.44 2.03 0.00 0.00 6.18 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 0.00 145 H 8.95 5.40 0.00 3.14 3.13 0.00 5.66 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *147 R 8.27 4.61 0.00 2.16 1.92 0.00 3.30 0.00 0.00 3.69 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 148 I 9.17 4.76 1.92 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 1.25 0.56 0.85 0.00 0.00 149 K 8.62 4.74 0.00 1.67 1.68 0.00 1.64 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.48 1.48 7.81 150 C 8.93 4.53 0.00 1.23 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 0.00 151 A 9.33 4.61 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 0.00 152 G 8.64 3.67 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 0.00 0.00 0.00 153 Q 8.73 4.09 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 154 H 8.34 4.99 0.00 3.33 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 7.84 5.49 1.79 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.50 0.80 0.00 0.00 *157 V 8.02 4.06 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 1.04 0.00 0.00 0.95 0.00 0.00 158 I 8.84 4.98 1.94 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 1.16 0.83 0.97 0.00 0.00 159 L 9.01 4.82 0.00 1.75 1.57 1.21 0.60 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 0.00 160 N 10.28 4.28 0.00 2.85 2.87 0.00 0.00 7.13 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 G 8.58 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 0.00 162 K 8.04 4.44 0.00 1.89 1.75 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.51 7.81 163 K 8.68 4.57 0.00 1.75 1.80 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.50 7.81 164 V 8.67 4.21 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 0.80 0.00 0.00 1.07 0.00 0.00 165 T 7.51 4.92 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 0.00 166 E 8.29 5.11 0.00 1.95 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 2.25 2.28 0.00 *168 D 8.43 4.74 0.00 2.84 2.80 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 *170 S 8.38 4.56 0.00 4.10 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 0.00 171 K 8.45 4.12 0.00 1.81 1.61 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.51 7.81 172 W 8.29 4.33 0.00 3.56 3.12 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 0.00 173 T 7.67 4.11 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 1.28 0.00 0.00 174 S 7.83 4.67 0.00 3.80 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 0.00 175 G 8.91 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 T 7.74 4.39 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 1.18 0.00 0.00 177 K 8.12 4.86 0.00 1.61 1.59 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.26 1.32 7.81 178 N 8.86 4.57 0.00 2.99 2.75 0.00 0.00 6.72 7.58 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 0.00 179 P 0.00 3.93 0.00 1.52 1.66 0.00 2.81 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.99 0.00 180 D 7.85 4.45 0.00 2.79 2.80 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 0.00 181 G 8.53 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 0.00 182 S 8.28 4.38 0.00 4.01 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 0.00 183 D 8.30 4.99 0.00 2.64 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 0.00 184 I 8.38 3.87 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 1.08 0.38 0.54 0.00 0.00 185 P 0.00 3.70 0.00 0.49 0.49 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.54 0.00 186 S 8.50 3.92 0.00 3.81 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 0.00 187 W 7.73 4.52 0.00 3.35 3.26 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 0.00 188 L 7.40 4.88 0.00 1.33 1.61 0.80 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 189 P 0.00 4.52 0.00 2.23 2.29 0.00 3.74 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 190 K 7.93 4.49 0.00 1.92 1.90 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.53 7.81 191 P 0.00 4.44 0.00 2.27 2.26 0.00 3.67 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 192 F 9.24 4.47 0.00 2.99 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 0.00 193 A 8.66 4.21 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 0.00 194 E 8.06 4.64 0.00 2.00 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 2.31 2.43 0.00 195 L 7.53 4.16 0.00 1.75 1.44 0.98 0.19 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 0.00 196 P 0.00 4.32 0.00 1.93 1.89 0.00 3.58 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 2.03 0.00 197 T 7.78 3.05 3.71 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 1.06 0.00 0.00 198 K 7.02 4.76 0.00 1.76 1.52 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.37 7.81 199 G 7.78 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 0.00 0.00 0.00 200 F 8.14 4.83 0.00 2.91 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 0.00 201 I 9.00 5.15 1.77 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.65 0.75 0.00 0.00 202 G 9.03 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 0.00 203 L 7.29 4.80 0.00 0.76 1.06 -0.08 0.36 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 0.00 204 Q 7.91 4.41 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.83 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 205 G 8.33 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 0.00 206 K 8.42 4.24 0.00 1.51 1.60 0.00 1.37 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.22 7.81 207 H 8.54 4.85 0.00 3.25 3.38 0.00 5.61 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 0.00 208 G 7.10 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 D 8.64 4.42 0.00 2.65 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 0.00 210 S 7.78 4.42 0.00 3.79 3.75 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 0.00 211 L 8.63 4.14 0.00 0.27 0.43 0.81 0.42 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 0.00 212 I 6.97 4.45 1.62 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.68 0.70 0.00 0.00 213 W 8.60 5.03 0.00 3.01 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 F 9.50 6.05 0.00 3.11 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 0.00 215 R 9.53 4.75 0.00 1.77 2.00 0.00 2.41 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.48 0.00 216 N 8.45 4.12 0.00 2.92 2.74 0.00 0.00 6.81 7.32 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 0.00 217 I 7.44 4.36 1.66 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 1.42 0.79 0.58 0.00 0.00 218 K 9.00 5.17 0.00 1.92 1.74 0.00 0.81 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 0.63 7.81 219 I 9.07 5.50 1.57 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 1.11 1.75 0.74 0.00 0.00 220 R 8.74 4.91 0.00 1.56 1.48 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 221 S 8.42 4.79 0.00 3.76 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 0.00 222 L 8.44 4.12 0.00 1.61 1.55 0.94 1.05 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 * Residues marked with a * may have inaccurate shift predictions.