NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2948 8.3144 122.1426 53.9979 34.5253 176.0978 3 N 4.4130 7.9444 116.8192 52.8817 40.1165 172.4111 4 P 4.2725 0.0000 0.0000 66.2487 31.9712 177.6146 5 Y 4.1410 8.0490 117.4804 60.6582 38.7625 177.8687 6 S 4.0235 8.1226 115.6363 61.6039 63.0081 176.0904 7 N 4.2506 8.1564 118.9868 56.5232 38.3678 177.1454 8 Q 3.9223 8.2614 120.9908 59.2441 29.0030 178.5824 9 I 3.5413 7.5045 120.6191 64.4465 37.1654 178.2474 10 E 3.9027 8.4369 119.8143 59.2360 29.1721 179.5437 11 R 3.8894 8.2611 121.2743 60.1986 30.1988 179.0372 12 E 4.0200 8.1503 118.0667 61.1607 29.6407 181.0128 13 E 4.1212 8.4524 119.5857 59.2744 29.3255 179.1914 14 L 4.0511 7.7454 119.2798 58.0719 42.2649 178.9347 15 I 4.0037 7.9965 122.2818 65.0800 37.0189 178.8745 16 L 4.0015 8.1159 123.3619 59.4599 40.4123 181.0009 17 K 3.9419 7.9601 119.4036 59.1160 32.2300 177.5572 18 Y 4.5102 7.4841 114.5623 57.8847 37.9203 177.2020 19 L 4.0261 7.6838 124.3568 57.7515 42.1255 177.2465 20 P 4.2582 0.0000 0.0000 65.0890 31.2103 178.2998 21 L 4.0151 7.8613 119.3153 58.1585 42.1266 179.2855 22 V 3.6866 7.7103 119.0379 64.4565 31.2292 178.4022 23 K 3.9010 7.7933 120.3125 59.3447 32.1148 178.7148 24 A 4.0180 8.1659 121.1484 55.1276 18.2169 179.7538 25 I 3.6508 8.2199 118.4928 64.5366 37.2240 178.5095 26 A 3.9721 8.1265 121.6298 55.5026 17.9441 179.8524 27 T 3.8159 7.7321 113.3821 66.6427 68.7895 176.2146 28 N 4.4642 8.2367 118.9888 56.8579 39.0739 177.0661 29 I 3.8860 8.0172 121.3721 64.2634 37.2529 178.3198 30 K 3.9619 8.3160 120.3756 59.1157 31.7236 178.8236 31 K 4.0603 7.8732 117.8602 58.5759 31.9707 177.1173 32 H 4.7820 8.0448 114.0153 55.4027 29.7936 174.5141 33 L 4.4006 7.3183 119.4698 52.3522 43.1003 174.8186 34 P 4.4695 0.0000 0.0000 63.0476 31.9095 178.4210 35 E 4.0477 8.8111 117.4503 59.0536 29.7255 178.2554 36 D 4.6059 8.1042 114.2135 53.9588 39.3752 175.7820 37 V 4.1128 7.2730 120.5157 61.1907 32.1064 174.9926 38 D 4.4372 8.5880 127.9953 53.9393 41.5795 176.7265 39 I 3.7368 8.4590 126.5641 64.0232 38.0031 177.8891 40 R 3.9121 8.4513 119.1084 58.9571 29.7559 178.7186 41 D 4.2540 8.1772 119.0957 57.2079 40.8833 178.5586 42 L 4.0441 7.9086 118.9384 58.0407 41.6948 179.5025 43 I 3.7305 7.9848 119.7775 64.3830 36.9871 178.3964 44 S 3.9632 7.8749 115.8113 62.1428 62.6974 176.6043 45 Y 4.0320 7.8935 119.1404 60.9147 37.5703 178.9061 46 G 3.6422 8.7047 107.2382 47.7355 0.0000 175.9923 47 V 3.6347 8.2593 120.9788 65.8011 31.6143 178.1933 48 I 3.7949 7.8196 119.8366 64.4014 36.9472 178.7092 49 G 3.6309 8.3433 106.5962 47.3708 0.0000 175.6586 50 L 3.9289 7.8696 122.6514 58.1563 42.0901 179.1270 51 I 3.7238 7.7703 119.7361 64.3541 37.0287 178.5830 52 K 3.9723 8.0546 118.9242 59.4220 31.6526 179.2532 53 A 4.1841 7.8372 120.0412 55.1296 18.5789 179.6004 54 V 3.7368 8.0416 116.8120 66.3905 31.4663 178.1274 55 D 4.4712 8.3286 117.5514 56.6381 40.6485 177.1964 56 N 4.7498 7.7917 115.4143 54.0510 39.0446 175.3280 57 L 3.8960 8.0152 123.5305 54.9332 42.2859 177.5416 58 S 3.9744 8.6418 121.5435 58.4873 61.3201 172.6670 59 T 4.5035 7.3592 117.5956 60.2548 71.6435 175.2023 60 E 4.6935 8.2979 125.2099 52.6895 33.8404 175.2447 61 N 4.2975 8.6894 118.2036 53.7475 39.8545 173.4243 62 P 4.3160 0.0000 0.0000 66.6441 31.3933 179.2002 63 K 4.2219 8.2610 124.1200 60.0410 31.8918 182.9843 64 R 4.2416 7.8979 120.5204 61.0750 29.2108 181.7672 65 A 4.1957 8.3630 121.2523 55.3231 18.4045 179.3162 66 E 3.4781 7.9854 117.4945 59.2139 29.6707 178.8713 67 A 3.9623 7.8425 120.4102 55.4258 18.5125 179.0484 68 Y 4.0545 8.1519 118.0265 60.7950 38.8179 178.2154 69 I 3.5264 7.9614 121.2794 63.9432 37.1451 178.2980 70 K 3.9422 8.2544 123.1597 59.9938 32.0102 179.4945 71 L 3.9988 7.8093 122.5807 59.6500 40.8431 181.3876 72 R 3.9903 7.6879 119.2132 58.8007 30.0164 179.3150 73 I 3.6925 7.7871 119.6724 64.4171 37.1168 178.6336 74 K 4.1385 8.1951 119.4385 59.2650 31.8055 179.6416 75 G 3.6852 8.3806 105.8634 47.9616 0.0000 175.5932 76 A 4.1492 8.1428 123.7743 54.7094 18.2515 179.9283 77 I 3.7168 7.7376 117.9647 64.8820 37.2721 178.2588 78 Y 4.1482 8.2769 117.9621 61.0819 37.4120 178.3803 79 D 4.4328 8.4503 119.5562 57.5387 41.2758 177.9891 80 Y 4.0214 7.7503 119.5214 60.6970 38.7508 177.9987 81 L 3.7868 8.0716 120.0768 57.6568 41.5098 179.3007 82 R 4.1845 8.4746 117.9068 58.3487 30.1274 177.1000 83 S 4.3768 7.6061 111.4848 59.1010 63.8353 174.4016 84 L 4.2497 7.3399 121.7353 54.1976 43.4508 176.0789 85 D 4.8138 7.6705 117.8698 54.0208 40.1476 178.9354 86 F 4.3872 8.1852 120.3187 61.7346 39.0340 177.0374 87 G 4.0730 7.9610 107.1383 45.7007 0.0000 174.4758 88 S 4.4082 7.4661 113.8479 57.4873 65.3027 174.3272 89 R 3.9514 8.4000 122.2618 59.4103 30.0005 178.5827 90 Q 4.0445 7.9855 117.2543 58.9945 28.7387 178.4453 91 V 3.6677 7.6909 120.0520 65.8389 31.6115 178.2930 92 R 4.0004 7.9603 117.5569 59.0019 29.8588 178.6299 93 E 3.9678 8.2464 119.3902 59.2070 29.5574 179.0655 94 K 4.0450 8.0403 118.2615 59.2093 32.0613 178.9769 95 E 4.0375 8.3399 122.2679 59.9882 29.6170 179.7620 96 R 4.0592 8.1517 123.0875 62.0843 29.4431 181.4915 97 R 4.1793 8.0077 121.4875 61.3266 29.3443 181.0193 98 I 3.9424 8.0672 120.9995 64.1906 37.1347 178.6647 99 K 4.0253 8.3909 121.8499 60.0391 31.7491 179.9292 100 E 3.9520 8.1701 118.4636 61.0989 29.6535 181.2893 101 V 3.7717 7.7134 119.7681 65.9468 31.5856 178.2583 102 V 3.6161 8.0241 117.9364 66.1211 31.3639 177.8848 103 E 4.0904 8.3855 120.8489 59.6434 29.2842 180.1149 104 K 3.9677 8.3579 124.0574 59.8738 31.8650 181.3620 105 L 4.1890 8.2139 121.0872 57.5542 41.5714 179.6518 106 K 4.3488 8.2481 123.1991 59.6581 31.8740 179.3937 107 E 4.0285 7.9338 117.6634 60.8031 29.7474 180.8127 108 K 4.2905 7.9766 119.7553 59.4126 32.4637 178.6744 109 L 4.2838 8.3049 117.9462 55.0262 41.7038 178.0225 110 G 3.9050 9.0679 106.1066 45.4851 0.0000 172.8260 111 R 4.4571 7.2097 114.4278 54.5126 31.8435 173.4562 112 E 4.0638 8.6090 120.0621 55.4417 29.9405 174.7592 113 P 4.6082 0.0000 0.0000 62.5380 32.4949 176.5333 114 T 4.3343 9.0731 111.3935 61.0642 71.1512 175.6999 115 D 4.4442 8.5628 120.7343 57.7383 40.8503 178.8323 116 E 4.0567 8.2551 118.4962 59.5268 29.5366 179.2425 117 E 3.9700 8.2042 118.6710 59.2033 29.4467 179.5023 118 V 3.5740 8.0001 118.1337 65.9862 31.7738 177.9803 119 A 4.0386 8.7003 123.3424 55.5339 18.1651 180.3805 120 K 3.9142 8.2333 122.2903 59.9914 31.5989 180.9703 121 E 4.1574 7.7573 118.6081 59.4889 29.5820 179.4987 122 L 4.2145 7.5897 116.2634 55.5319 41.6753 178.2874 123 G 3.8673 7.8834 106.8541 45.4489 0.0000 172.6985 124 I 4.5154 7.2772 111.7663 58.1467 40.5740 175.5650 125 S 4.5055 8.0650 115.4731 57.6432 65.5186 175.1642 126 T 3.4810 8.0915 113.1966 64.6355 68.3643 176.4510 127 E 3.8025 7.7901 121.1596 59.3289 29.5500 178.7118 128 E 3.9776 7.9439 118.8094 58.7754 29.6010 178.5889 129 L 3.9173 7.7168 120.6005 58.2463 42.2056 178.9911 130 F 4.6011 8.2764 118.1351 60.6468 38.8163 177.8644 131 K 4.1100 8.1140 117.7510 59.7773 31.8219 179.5991 132 T 3.9821 8.0544 116.0860 66.5996 68.2903 176.7917 133 L 4.1410 8.2806 121.0356 58.0470 41.5748 179.3957 134 D 4.4528 8.3597 118.9006 57.0954 40.6981 178.7497 135 K 4.3081 8.2892 120.3426 59.5592 31.7188 179.0014 136 I 3.8026 8.3773 120.5177 64.6933 37.0995 178.2458 137 N 4.6860 8.6728 117.5916 56.3972 38.3074 177.3234 138 F 3.8429 8.8138 122.3984 60.9106 39.2734 177.4003 139 S 4.0692 7.9986 114.8279 61.8076 62.5336 176.2446 140 Y 4.0320 7.5315 118.4732 60.9774 37.5023 178.5293 141 I 3.5696 7.7314 120.8154 64.2060 37.0218 178.4297 142 L 3.7118 8.0209 120.0466 57.8590 41.0496 179.7635 143 S 4.0626 8.2156 115.3667 61.6153 62.6499 176.6552 144 L 3.8606 8.2923 123.3281 57.9277 41.8067 178.5622 145 E 3.8008 8.2533 119.7866 58.9067 29.3937 178.6365 146 E 3.9187 7.8948 118.7058 59.4016 29.3177 179.4082 147 V 3.5439 7.0642 116.7180 66.0437 31.6708 177.7929 148 F 4.1182 8.0956 117.5062 60.0345 38.7530 177.7267 149 R 3.9787 8.0866 118.5881 59.1161 29.6617 177.9975 150 D 4.5285 8.2014 120.2418 56.9634 40.8942 178.1862 *151 F 4.5145 7.6656 120.1363 59.6390 38.6591 182.4074 152 A 4.4773 7.8603 117.7539 54.1348 18.4145 179.4138 153 R 4.1013 7.9603 119.2178 59.2905 30.3575 178.7531 154 D 4.6672 8.1409 121.6312 58.2973 40.1356 180.4521 *155 Y 4.4449 7.4457 119.1736 61.5762 37.1272 182.2263 156 S 4.5980 7.7900 115.2450 61.6601 64.0185 175.6656 157 E 4.3386 7.6651 118.6031 55.2032 28.4074 178.6060 158 L 4.6257 7.3337 123.4177 52.8051 43.4478 178.9932 159 I 3.7400 8.2241 120.4073 58.5477 35.0013 172.9311 160 P 4.1323 0.0000 0.0000 63.2271 30.8094 177.1639 161 S 4.6677 8.2411 119.5317 56.1193 64.0707 170.7384 162 S 4.2937 8.5506 112.6696 61.9045 62.6536 174.0536 163 T 4.6991 7.6807 117.6907 62.1143 71.5553 173.8769 164 N 4.9439 8.5031 122.3018 55.0212 38.2161 178.8540 165 V 3.8902 7.7857 127.5263 66.4531 31.2288 178.4932 166 E 4.0276 8.2274 120.9106 61.7315 29.6889 182.6182 167 E 4.2686 8.0447 119.2098 60.7603 29.8175 180.7233 168 E 4.1630 8.4175 119.0502 59.4223 29.5293 179.6586 169 V 3.5740 7.7675 118.2430 65.9875 31.6535 178.1146 170 I 3.7440 7.9909 122.0278 64.8948 36.9817 179.1144 171 K 3.9867 8.1814 124.5178 59.9960 31.5595 180.9287 172 R 4.1355 8.0113 120.2799 58.8520 30.0167 178.2801 173 E 3.8637 8.0660 119.3630 59.0627 29.6378 178.4832 174 L 3.8747 7.9319 120.2196 58.4960 42.1647 178.7768 175 T 3.8896 7.8964 115.5546 67.0662 68.4818 176.4588 176 E 4.1368 8.3727 122.4608 59.6599 28.8615 180.2893 177 K 4.0060 7.8520 123.8888 59.6332 31.8377 183.1847 178 V 3.8022 8.1684 120.0770 65.4723 31.4441 178.0851 179 K 3.9766 8.6186 122.4862 60.2009 31.8299 179.3289 180 E 3.9994 7.8398 116.8385 60.8954 29.8671 180.5662 181 A 4.2955 7.7099 120.5377 55.0740 18.4741 179.8357 182 V 3.5255 7.9226 117.1199 66.1966 31.3868 178.3847 183 S 4.3658 8.1446 115.0449 61.4879 62.7776 176.3962 184 K 4.2395 7.6371 125.2636 56.5197 32.1611 181.7970 185 L 4.4323 7.5013 118.8782 54.5319 42.5019 175.9141 186 P 4.4109 0.0000 0.0000 62.0796 33.3035 177.1906 187 E 3.9106 8.8519 122.2801 59.7470 29.1221 179.6828 188 R 3.9777 7.9807 115.2558 59.3308 29.4412 178.4295 189 E 4.0407 8.0070 118.7905 58.7438 29.5729 178.8002 190 K 3.9690 7.9978 120.0625 59.1406 32.2358 178.6267 191 L 3.9241 7.9202 120.7154 58.2004 42.0067 179.1642 192 V 3.6089 7.4657 117.6185 66.1951 31.4098 178.0748 193 I 3.9496 7.9866 119.5676 64.2963 36.8828 178.3374 194 Q 4.0681 8.3802 120.6324 59.2805 28.7499 178.1786 195 L 4.0886 7.8755 118.7743 57.7078 41.9523 179.4637 196 I 3.9612 7.9825 121.2053 63.6790 36.7127 178.2027 197 F 4.3813 8.4103 118.2633 59.9479 39.1004 177.8125 198 Y 3.9567 8.1173 117.8472 60.4791 38.8112 176.0800 199 E 4.0524 8.3037 116.3913 55.9825 30.5275 175.7256 200 E 3.8281 7.2905 117.5505 57.7117 26.9599 174.2986 201 L 4.7115 7.4978 118.0262 52.0644 45.2473 175.6844 202 P 4.2673 0.0000 0.0000 61.8119 33.4209 177.5748 203 A 3.9860 8.4905 123.6847 56.0844 18.2277 180.8840 204 K 3.7448 7.8406 121.5463 59.8718 31.6680 181.1653 205 E 4.1203 7.9373 118.8577 59.3794 29.4517 179.4265 206 V 3.5442 7.6847 117.7339 65.7916 31.5303 177.9892 207 A 4.0125 8.2842 123.2818 55.5669 18.1754 180.4481 208 K 3.9925 7.9546 122.3521 59.8700 31.5561 181.8539 209 I 4.0257 7.7567 120.1930 64.0333 37.1886 177.8528 210 L 4.2349 8.0139 116.8639 53.9572 42.5152 176.2039 211 E 3.7120 7.7905 116.1473 57.6004 27.0945 172.7138 212 T 4.6687 7.7606 111.4535 59.3847 71.4184 173.1831 213 S 4.5764 8.2385 117.5839 58.0032 65.2866 175.3831 214 V 3.6351 8.7788 116.0071 64.2711 31.1624 179.1818 215 S 4.2102 8.5013 115.3676 61.6111 62.7785 176.6919 216 R 3.9078 8.0771 121.4059 59.3303 29.7502 178.7626 217 V 3.6004 7.6291 117.8485 66.1145 31.4586 178.2280 218 S 4.2001 8.5207 115.4239 61.5392 62.5653 176.5010 219 Q 3.9521 8.1547 122.3464 59.2343 28.8015 178.3077 220 L 3.9723 7.8592 119.7685 57.3550 41.5620 179.4457 221 K 3.9286 8.4054 119.7865 59.4239 32.2409 178.7232 222 A 3.6226 8.2124 121.4169 54.8637 18.2874 179.3947 223 K 3.6508 8.0619 117.9631 59.6524 32.2186 178.8457 224 A 4.0699 8.0794 120.9966 55.0746 18.1933 179.6145 225 L 3.8935 8.0093 117.6323 57.8798 41.7044 179.3099 226 E 3.9738 7.9658 119.2406 59.1784 29.5506 178.8761 227 R 3.8286 7.9621 118.6472 59.5153 30.3362 178.4497 228 L 4.0041 8.2645 119.4567 57.8050 41.5627 179.7879 229 R 4.0359 8.4703 118.7718 59.7357 28.9618 179.4668 230 E 3.9786 8.2307 119.1609 61.2125 29.5626 181.7451 231 M 4.3990 7.9745 118.1835 57.1780 32.1335 178.1958 232 L 4.2260 7.4799 118.4859 56.7574 42.3366 178.8042 233 S 4.4092 8.0356 113.5872 60.0544 63.8536 174.5954 234 N 4.7791 7.2987 121.9973 48.5982 36.7087 172.5636 235 P 4.4712 0.0000 0.0000 63.9133 30.9522 176.7403 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 K 8.31 4.29 0.00 1.79 1.80 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 3 N 7.94 4.41 0.00 2.94 2.76 0.00 0.00 7.19 6.82 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 4 P 0.00 4.27 0.00 2.26 2.15 0.00 3.70 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 2.19 0.00 5 Y 8.05 4.14 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.12 4.02 0.00 4.11 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 7 N 8.16 4.25 0.00 2.92 2.87 0.00 0.00 6.72 7.30 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 8 Q 8.26 3.92 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 9 I 7.50 3.54 1.55 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 0.72 -0.20 0.76 0.00 0.00 10 E 8.44 3.90 0.00 2.08 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 2.30 2.50 0.00 11 R 8.26 3.89 0.00 1.99 2.11 0.00 3.10 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 12 E 8.15 4.02 0.00 2.03 1.95 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 2.25 2.23 0.00 13 E 8.45 4.12 0.00 2.08 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 2.42 2.42 0.00 14 L 7.75 4.05 0.00 1.87 1.93 1.14 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.00 4.00 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.14 0.93 0.00 0.00 16 L 8.12 4.00 0.00 1.64 1.69 0.92 0.85 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 17 K 7.96 3.94 0.00 1.67 1.86 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.35 1.11 7.81 18 Y 7.48 4.51 0.00 3.04 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 19 L 7.68 4.03 0.00 1.90 1.66 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.26 0.00 2.17 2.06 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 21 L 7.86 4.02 0.00 1.94 2.03 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.71 3.69 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 0.88 0.00 0.00 0.94 0.00 0.00 23 K 7.79 3.90 0.00 1.86 2.06 0.00 1.52 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.50 7.81 24 A 8.17 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.22 3.65 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.71 0.92 0.00 0.00 26 A 8.13 3.97 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 27 T 7.73 3.82 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 28 N 8.24 4.46 0.00 3.00 2.95 0.00 0.00 7.24 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 29 I 8.02 3.89 1.96 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.95 0.90 0.00 0.00 30 K 8.32 3.96 0.00 1.98 2.00 0.00 1.49 0.00 0.00 1.63 0.00 0.00 3.26 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.51 7.81 31 K 7.87 4.06 0.00 1.84 1.68 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.62 7.81 32 H 8.04 4.78 0.00 3.45 3.51 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.32 4.40 0.00 1.68 1.45 0.67 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.47 0.00 2.38 2.04 0.00 3.66 0.00 0.00 3.85 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 35 E 8.81 4.05 0.00 1.98 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 2.23 1.88 0.00 36 D 8.10 4.61 0.00 2.76 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 37 V 7.27 4.11 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 0.82 0.00 0.00 0.98 0.00 0.00 38 D 8.59 4.44 0.00 2.74 2.76 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 39 I 8.46 3.74 1.87 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 1.63 1.43 0.91 0.00 0.00 40 R 8.45 3.91 0.00 2.03 1.94 0.00 3.16 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 41 D 8.18 4.25 0.00 2.94 2.62 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 0.00 42 L 7.91 4.04 0.00 1.94 1.73 1.07 0.95 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 43 I 7.98 3.73 1.85 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 1.52 0.76 0.89 0.00 0.00 44 S 7.87 3.96 0.00 3.82 3.52 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 45 Y 7.89 4.03 0.00 3.03 3.01 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 0.00 0.00 0.00 46 G 8.70 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.26 3.63 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 1.00 0.00 0.00 0.97 0.00 0.00 48 I 7.82 3.79 2.03 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.99 0.92 0.00 0.00 49 G 8.34 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 0.00 0.00 0.00 50 L 7.87 3.93 0.00 1.87 1.90 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.77 3.72 1.87 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 1.53 0.69 0.92 0.00 0.00 52 K 8.05 3.97 0.00 1.99 1.89 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.65 7.81 53 A 7.84 4.18 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 54 V 8.04 3.74 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 1.06 0.00 0.00 1.01 0.00 0.00 55 D 8.33 4.47 0.00 2.83 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 56 N 7.79 4.75 0.00 2.96 2.99 0.00 0.00 7.13 7.90 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 57 L 8.02 3.90 0.00 1.99 1.57 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.64 3.97 0.00 3.86 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 59 T 7.36 4.50 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 60 E 8.30 4.69 0.00 1.84 1.81 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 2.13 2.30 0.00 61 N 8.69 4.30 0.00 2.79 2.71 0.00 0.00 6.83 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 62 P 0.00 4.32 0.00 2.22 2.17 0.00 3.66 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 63 K 8.26 4.22 0.00 1.76 1.81 0.00 1.79 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.06 7.81 64 R 7.90 4.24 0.00 1.81 1.96 0.00 3.24 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 65 A 8.36 4.20 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 66 E 7.99 3.48 0.00 2.08 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 2.34 2.31 0.00 67 A 7.84 3.96 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.15 4.05 0.00 3.13 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 69 I 7.96 3.53 1.56 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 1.30 0.60 0.60 0.00 0.00 70 K 8.25 3.94 0.00 1.85 1.93 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 71 L 7.81 4.00 0.00 1.71 1.66 0.92 0.87 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 72 R 7.69 3.99 0.00 1.66 1.94 0.00 3.00 0.00 0.00 2.85 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.03 0.00 73 I 7.79 3.69 1.98 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 1.66 1.27 0.92 0.00 0.00 74 K 8.20 4.14 0.00 2.03 2.12 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.66 7.81 75 G 8.38 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 76 A 8.14 4.15 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 0.00 0.00 0.00 0.00 0.00 77 I 7.74 3.72 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.79 0.75 0.00 0.00 78 Y 8.28 4.15 0.00 3.12 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 79 D 8.45 4.43 0.00 2.84 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 80 Y 7.75 4.02 0.00 1.99 2.76 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 81 L 8.07 3.79 0.00 1.99 1.81 0.75 0.91 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 82 R 8.47 4.18 0.00 2.00 2.16 0.00 3.27 0.00 0.00 3.31 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 83 S 7.61 4.38 0.00 3.99 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 84 L 7.34 4.25 0.00 1.60 1.00 0.46 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.67 4.81 0.00 2.69 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 86 F 8.19 4.39 0.00 3.16 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 87 G 7.96 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.47 4.41 0.00 4.09 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 89 R 8.40 3.95 0.00 1.89 1.96 0.00 3.18 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 90 Q 7.99 4.04 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 91 V 7.69 3.67 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.99 0.00 0.00 92 R 7.96 4.00 0.00 2.10 1.97 0.00 3.17 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 93 E 8.25 3.97 0.00 2.35 1.95 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 2.31 2.40 0.00 94 K 8.04 4.04 0.00 2.08 1.87 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.59 7.81 95 E 8.34 4.04 0.00 2.14 2.18 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 2.40 2.44 0.00 96 R 8.15 4.06 0.00 1.89 1.92 0.00 3.32 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 97 R 8.01 4.18 0.00 1.84 1.97 0.00 3.24 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 98 I 8.07 3.94 1.92 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 1.56 0.62 0.96 0.00 0.00 99 K 8.39 4.03 0.00 1.99 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.67 7.81 100 E 8.17 3.95 0.00 2.00 1.95 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 2.24 2.19 0.00 101 V 7.71 3.77 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.00 0.00 0.00 102 V 8.02 3.62 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.00 0.00 0.00 103 E 8.39 4.09 0.00 2.19 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 2.54 2.47 0.00 104 K 8.36 3.97 0.00 1.75 1.81 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 105 L 8.21 4.19 0.00 1.72 1.77 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.25 4.35 0.00 2.13 1.81 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.42 7.81 107 E 7.93 4.03 0.00 2.14 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.18 0.00 108 K 7.98 4.29 0.00 1.76 1.99 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 109 L 8.30 4.28 0.00 1.70 1.71 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 110 G 9.07 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 0.00 111 R 7.21 4.46 0.00 1.96 2.01 0.00 2.98 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 112 E 8.61 4.06 0.00 1.94 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 2.30 2.38 0.00 113 P 0.00 4.61 0.00 2.24 2.05 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 114 T 9.07 4.33 4.39 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 1.28 0.00 0.00 115 D 8.56 4.44 0.00 2.90 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 0.00 116 E 8.26 4.06 0.00 2.06 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 2.41 2.46 0.00 117 E 8.20 3.97 0.00 2.20 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 2.33 2.32 0.00 118 V 8.00 3.57 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.03 0.00 0.00 119 A 8.70 4.04 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 0.00 120 K 8.23 3.91 0.00 1.77 1.83 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.36 7.81 121 E 7.76 4.16 0.00 2.15 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 2.36 2.52 0.00 122 L 7.59 4.21 0.00 1.71 1.72 0.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 123 G 7.88 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 0.00 0.00 0.00 124 I 7.28 4.52 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 1.33 0.73 1.01 0.00 0.00 125 S 8.07 4.51 0.00 4.17 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 0.00 126 T 8.09 3.48 3.35 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 1.06 0.00 0.00 127 E 7.79 3.80 0.00 2.00 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 2.38 2.41 0.00 128 E 7.94 3.98 0.00 2.01 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 2.30 2.30 0.00 129 L 7.72 3.92 0.00 1.71 1.55 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.28 4.60 0.00 3.01 3.01 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 0.00 0.00 0.00 131 K 8.11 4.11 0.00 2.01 1.91 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.72 7.81 132 T 8.05 3.98 4.45 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 1.27 0.00 0.00 133 L 8.28 4.14 0.00 1.97 1.81 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.36 4.45 0.00 2.94 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 0.00 135 K 8.29 4.31 0.00 2.10 2.09 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.75 7.81 136 I 8.38 3.80 2.16 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.12 1.20 0.00 0.00 137 N 8.67 4.69 0.00 3.08 3.01 0.00 0.00 6.73 8.89 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 0.00 138 F 8.81 3.84 0.00 3.19 2.62 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 0.00 139 S 8.00 4.07 0.00 3.77 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 0.00 140 Y 7.53 4.03 0.00 3.25 2.99 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 0.00 141 I 7.73 3.57 1.15 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 1.59 0.86 0.48 0.00 0.00 142 L 8.02 3.71 0.00 1.69 1.66 1.05 1.22 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 0.00 143 S 8.22 4.06 0.00 3.95 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 0.00 144 L 8.29 3.86 0.00 1.74 1.81 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.25 3.80 0.00 1.67 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 1.77 1.47 0.00 146 E 7.89 3.92 0.00 2.14 1.95 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 2.30 2.46 0.00 147 V 7.06 3.54 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 0.60 0.00 0.00 0.88 0.00 0.00 148 F 8.10 4.12 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.09 3.98 0.00 2.15 2.02 0.00 3.10 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 150 D 8.20 4.53 0.00 2.84 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 *151 F 7.67 4.51 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.86 4.48 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.96 4.10 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 154 D 8.14 4.67 0.00 2.78 2.58 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 *155 Y 7.45 4.44 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 S 7.79 4.60 0.00 4.04 4.05 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 0.00 157 E 7.67 4.34 0.00 2.09 1.76 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 2.23 2.12 0.00 158 L 7.33 4.63 0.00 1.64 1.46 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.22 3.74 1.87 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 1.47 1.10 0.91 0.00 0.00 160 P 0.00 4.13 0.00 2.14 2.11 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 161 S 8.24 4.67 0.00 3.65 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 0.00 162 S 8.55 4.29 0.00 3.82 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 0.00 163 T 7.68 4.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 164 N 8.50 4.94 0.00 2.73 2.77 0.00 0.00 6.36 7.67 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 0.00 165 V 7.79 3.89 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 0.68 0.00 0.00 0.93 0.00 0.00 166 E 8.23 4.03 0.00 2.00 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 2.31 1.94 0.00 167 E 8.04 4.27 0.00 1.97 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 2.31 1.97 0.00 168 E 8.42 4.16 0.00 2.17 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 2.34 2.49 0.00 169 V 7.77 3.57 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 1.03 0.00 0.00 1.00 0.00 0.00 170 I 7.99 3.74 1.88 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 1.57 1.01 0.92 0.00 0.00 171 K 8.18 3.99 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.32 7.81 172 R 8.01 4.14 0.00 1.99 2.08 0.00 3.06 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 173 E 8.07 3.86 0.00 2.18 2.18 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 2.28 2.29 0.00 174 L 7.93 3.87 0.00 1.94 1.68 1.07 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 175 T 7.90 3.89 4.38 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 1.22 0.00 0.00 176 E 8.37 4.14 0.00 2.07 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 2.42 0.00 177 K 7.85 4.01 0.00 1.80 1.81 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.31 7.81 178 V 8.17 3.80 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 1.00 0.00 0.00 1.04 0.00 0.00 179 K 8.62 3.98 0.00 1.96 1.92 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 180 E 7.84 4.00 0.00 2.11 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 181 A 7.71 4.30 1.29 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 0.00 0.00 182 V 7.92 3.53 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.94 0.00 0.00 183 S 8.14 4.37 0.00 4.06 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 0.00 184 K 7.64 4.24 0.00 1.90 1.75 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.34 7.81 185 L 7.50 4.43 0.00 1.72 1.61 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 186 P 0.00 4.41 0.00 2.14 1.95 0.00 3.77 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 2.23 2.12 0.00 187 E 8.85 3.91 0.00 2.06 1.96 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 2.38 2.44 0.00 188 R 7.98 3.98 0.00 2.07 2.18 0.00 3.01 0.00 0.00 3.33 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 189 E 8.01 4.04 0.00 2.19 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 2.53 2.35 0.00 190 K 8.00 3.97 0.00 2.02 1.89 0.00 1.81 0.00 0.00 1.55 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 191 L 7.92 3.92 0.00 1.82 1.85 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 192 V 7.47 3.61 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.93 0.00 0.00 193 I 7.99 3.95 2.01 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.83 1.02 0.00 0.00 194 Q 8.38 4.07 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 195 L 7.88 4.09 0.00 1.68 1.72 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 196 I 7.98 3.96 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.60 0.14 0.00 0.00 197 F 8.41 4.38 0.00 3.25 3.10 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 0.00 0.00 0.00 198 Y 8.12 3.96 0.00 2.97 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 0.00 199 E 8.30 4.05 0.00 2.33 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 2.66 2.51 0.00 200 E 7.29 3.83 0.00 1.99 1.95 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 2.34 2.19 0.00 201 L 7.50 4.71 0.00 1.75 1.46 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 202 P 0.00 4.27 0.00 2.07 1.87 0.00 3.53 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 2.04 2.06 0.00 203 A 8.49 3.99 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 0.00 204 K 7.84 3.74 0.00 1.77 1.84 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.10 7.81 205 E 7.94 4.12 0.00 2.04 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 2.33 2.26 0.00 206 V 7.68 3.54 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 1.06 0.00 0.00 0.93 0.00 0.00 207 A 8.28 4.01 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 0.00 208 K 7.95 3.99 0.00 1.80 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.35 7.81 209 I 7.76 4.03 1.99 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 1.51 1.15 0.91 0.00 0.00 210 L 8.01 4.23 0.00 1.60 1.70 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 211 E 7.79 3.71 0.00 2.17 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 2.24 2.22 0.00 212 T 7.76 4.67 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 213 S 8.24 4.58 0.00 4.47 4.01 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 0.00 0.00 0.00 214 V 8.78 3.64 1.77 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 0.40 0.00 0.00 0.55 0.00 0.00 215 S 8.50 4.21 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 0.00 216 R 8.08 3.91 0.00 1.94 2.09 0.00 3.15 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 217 V 7.63 3.60 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 1.03 0.00 0.00 0.90 0.00 0.00 218 S 8.52 4.20 0.00 4.07 4.05 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 0.00 219 Q 8.15 3.95 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 220 L 7.86 3.97 0.00 1.91 1.69 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.41 3.93 0.00 1.92 2.00 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.59 7.81 222 A 8.21 3.62 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 0.00 223 K 8.06 3.65 0.00 1.85 1.93 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.41 7.81 224 A 8.08 4.07 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 L 8.01 3.89 0.00 1.74 1.77 1.07 0.60 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 0.00 226 E 7.97 3.97 0.00 1.84 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 2.34 2.36 0.00 227 R 7.96 3.83 0.00 2.07 1.99 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 228 L 8.26 4.00 0.00 1.84 1.69 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 229 R 8.47 4.04 0.00 2.03 2.30 0.00 2.78 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 230 E 8.23 3.98 0.00 2.02 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 2.24 2.22 0.00 231 M 7.97 4.40 0.00 1.96 2.12 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 2.75 2.55 0.00 232 L 7.48 4.23 0.00 1.59 1.49 0.71 0.60 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 0.00 233 S 8.04 4.41 0.00 3.98 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 0.00 234 N 7.30 4.78 0.00 2.81 2.83 0.00 0.00 7.07 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 0.00 235 P 0.00 4.47 0.00 2.16 2.07 0.00 3.81 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 1.97 1.96 0.00 * Residues marked with a * may have inaccurate shift predictions.