NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4935 8.3049 120.2714 55.3835 33.7675 174.9044 2 R 3.8177 7.8311 117.0368 55.8923 31.9343 174.4159 3 K 4.6708 9.3904 125.5437 55.5314 34.0184 175.4272 4 I 4.6343 8.0678 126.5668 59.0878 40.3255 175.6323 5 G 4.0650 9.0599 114.7747 45.8472 0.0000 172.4082 6 I 4.9604 8.7573 123.4114 59.0710 40.6598 174.4325 7 I 4.3590 8.6712 127.1495 59.1246 40.4696 174.6963 8 G 4.7085 8.5842 116.7289 44.7908 0.0000 172.3642 9 G 3.6826 7.9851 108.8677 45.9234 0.0000 174.0859 10 T 4.0287 8.2882 110.3057 62.5184 69.2783 174.6958 11 F 3.7647 7.3966 119.9800 58.8586 36.9317 175.0450 12 D 5.1682 7.8719 115.9447 52.1140 41.1793 171.8816 13 P 5.1132 0.0000 0.0000 59.4494 34.0166 174.2549 14 P 4.6941 0.0000 0.0000 63.3315 31.9154 174.7961 15 H 4.7824 8.2482 113.6502 53.7308 31.2787 173.7601 16 Y 4.5987 8.9466 116.7948 60.6892 37.4388 178.8542 17 G 3.7023 8.2045 106.9191 48.0454 0.0000 175.2732 18 H 4.3529 8.0299 118.4330 58.7673 28.7532 177.9445 19 L 4.2151 8.1871 120.2554 57.6601 41.4845 179.0649 20 L 4.1408 8.6543 120.6853 58.3655 42.0902 178.9860 21 I 3.7413 7.8718 119.1792 64.4905 37.1354 177.9829 22 A 3.8662 8.1738 121.6107 55.3847 18.0602 179.2736 23 N 4.6713 8.7955 115.5025 57.0262 39.1738 176.8763 24 E 4.0974 8.5935 120.2297 59.6327 29.5475 179.6905 25 V 3.6487 8.1259 118.2135 65.9162 31.6285 177.0413 26 Y 4.2219 8.2353 119.4921 61.4312 38.4340 178.2943 27 H 4.0048 8.4689 116.3388 58.5456 28.7175 177.4821 28 A 3.9586 8.3485 122.7251 55.0931 18.1780 178.3273 29 L 4.3128 7.9453 111.9419 53.7468 42.5188 175.9267 30 N 3.8642 7.3746 116.2140 54.4702 37.4031 173.5529 31 L 4.2141 7.4401 117.2467 54.5441 43.0992 177.4492 32 E 4.3990 8.8999 121.7650 58.7629 30.3171 176.1548 33 E 5.2068 8.0198 116.3278 54.9671 34.8643 174.2138 34 V 4.7817 9.2836 121.4879 61.0550 34.5101 174.1243 35 W 5.5200 9.1974 128.1055 55.2317 31.4160 175.1598 36 F 4.5557 9.7448 124.4755 56.8148 40.1488 174.5951 37 L 5.0812 9.2693 126.6503 51.1882 43.0938 172.4877 38 P 5.2009 0.0000 0.0000 62.9834 31.7891 175.9041 39 N 5.2514 9.2346 122.6372 52.1085 39.3412 175.5137 40 Q 4.1878 8.7188 120.5871 56.3322 29.5053 176.1691 41 I 4.5930 7.8603 119.6831 58.8925 40.0890 174.4996 42 P 4.0712 0.0000 0.0000 65.1855 31.3744 175.7332 *49 N 4.4199 7.8341 114.8805 53.2623 38.5377 172.7958 50 I 4.1604 7.9810 125.6120 60.3162 38.2490 176.5875 51 T 3.9965 8.4311 122.1235 63.2866 69.1800 175.1154 52 S 4.3307 8.4276 120.5548 58.1249 65.1261 175.6544 53 V 3.5511 8.3532 122.9238 66.1988 31.3976 177.6151 54 E 3.8430 8.2419 118.4981 59.9132 29.3384 179.0622 55 S 4.5320 8.4722 116.3632 61.2091 62.8678 177.1120 56 R 3.9044 8.0622 120.7278 59.0375 29.7983 178.8337 57 L 3.8268 8.2365 120.5643 58.3437 42.0928 179.1500 58 Q 3.8654 8.0353 117.9120 58.9559 28.4746 178.6532 59 M 3.5759 7.7329 119.8920 58.0489 32.0895 178.4036 60 L 3.6307 7.8680 120.7038 57.9259 42.1248 178.6890 61 E 3.7452 7.8889 119.1196 59.3035 29.3987 178.7897 62 L 3.8987 7.4338 117.3729 57.7622 41.6999 179.1506 63 A 4.0398 8.0030 120.4880 54.1757 18.6466 178.6565 64 T 4.4382 7.3382 105.5216 61.3135 69.4713 175.8793 65 E 3.8511 7.9928 120.0095 59.1541 29.4577 177.7226 66 A 4.2744 7.8333 120.0177 52.1050 19.3846 176.5296 67 E 4.4005 7.9914 114.4740 53.9862 31.0596 176.2802 68 E 4.0302 8.9645 124.8197 59.5188 29.8019 177.7658 69 H 4.7758 8.1227 112.3346 55.7380 29.9279 174.4532 70 F 5.8811 8.1947 119.1256 56.4873 40.6947 175.2693 71 S 4.8267 9.6197 118.6207 56.9393 67.7529 172.6703 72 I 4.7004 8.1145 121.8552 59.9899 38.6231 174.7381 73 C 4.5251 9.0650 127.6192 57.5560 33.7615 173.9621 74 L 4.6293 8.4159 124.6982 54.5450 41.9431 177.5045 75 E 3.8900 8.3972 120.7652 59.8500 29.6433 178.2199 76 E 4.1286 8.1658 118.2747 58.7709 29.3402 177.9971 77 L 4.2732 7.8487 117.8169 56.5163 41.8373 178.3174 78 S 4.4013 7.9884 113.8348 58.8369 63.1652 174.1578 79 R 4.6315 7.0522 119.7431 53.9579 33.2802 175.2101 80 K 4.0376 8.7646 124.4449 59.5000 32.9742 179.1038 81 G 3.8800 7.5459 107.9036 44.7070 0.0000 170.7900 82 P 4.4624 0.0000 0.0000 61.8729 32.2882 175.7020 83 S 4.4477 7.9950 115.0511 55.9721 65.5418 174.2715 84 Y 4.4520 8.0673 121.8826 57.5791 39.8126 176.7814 85 T 3.8974 8.5444 118.7854 67.1084 68.5022 175.9225 86 Y 4.1797 8.4063 120.8149 61.0291 38.7230 177.9505 87 D 4.2857 8.4156 118.8921 57.7076 41.0173 178.6134 88 T 3.8675 7.6445 115.9201 67.2340 68.4510 176.6537 89 M 3.9018 8.2343 120.5023 57.7820 31.8959 178.6149 90 L 3.7245 7.8260 121.0977 58.1771 42.1653 179.0423 91 Q 3.9897 7.9996 117.8494 59.0628 28.5904 178.9483 92 L 4.2618 8.0697 120.2848 57.9986 41.5772 179.6922 93 T 4.2440 8.2471 110.1503 64.6311 68.4837 176.9756 94 K 4.0919 7.9685 120.6849 59.3950 32.2059 179.2573 95 K 4.0888 8.3551 117.8261 58.0150 33.4005 177.0899 96 Y 4.8742 8.4346 116.8468 55.2579 38.2442 174.0722 97 P 4.5817 0.0000 0.0000 64.1129 32.2900 177.1593 98 D 4.7981 8.1866 116.6038 52.7797 39.6514 174.9420 99 V 4.4112 7.4961 119.8306 61.5271 33.3094 175.0288 100 Q 4.2583 8.9023 129.9639 54.8280 29.9255 174.3262 101 F 4.6912 8.5634 126.3412 57.4449 40.8489 174.6330 102 H 5.1033 9.5074 121.5572 54.0417 30.4677 173.2867 103 F 4.5223 9.0634 127.9615 57.4183 40.2079 174.3260 104 I 4.9182 7.9584 128.6136 60.5543 37.9598 175.5883 105 I 4.9145 9.2980 119.9528 58.7304 41.6537 175.3038 106 G 4.0505 8.8486 111.9142 45.3045 0.0000 175.1315 107 G 3.7167 8.6262 107.9918 47.6661 0.0000 175.9757 108 D 4.4366 8.1112 119.4605 56.7934 41.1689 177.5179 109 M 4.4271 8.1454 118.7151 57.6092 32.2359 177.9791 110 V 3.4367 7.3764 118.9621 65.9118 31.3493 177.3258 111 E 3.6901 7.9535 117.9051 58.7344 29.4602 176.7000 112 Y 4.9536 7.9379 114.3939 57.4806 38.8971 177.1626 113 L 3.0246 7.6115 122.1225 57.2149 41.7264 177.8370 114 P 4.5850 0.0000 0.0000 64.3225 31.3133 177.0895 115 K 4.4148 8.2292 116.2684 56.5466 32.5990 177.1980 116 W 4.4067 8.3954 120.8534 55.9560 29.6393 175.0631 117 Y 3.9627 8.6560 122.8461 59.2676 38.4163 175.5288 118 N 3.6339 8.2458 125.2824 53.9318 37.6773 175.6474 119 I 3.6346 7.3368 118.1775 63.8602 37.7010 176.3875 120 E 3.8089 7.8753 117.7074 59.5299 29.6728 178.8765 121 A 4.0959 7.6651 120.0498 54.8358 18.4525 179.2302 122 L 4.1426 8.0887 119.2799 58.3505 41.9584 179.1409 123 L 4.0415 7.8385 118.0002 57.4960 41.5655 178.5327 124 D 4.5650 7.6729 116.9079 55.7877 41.0516 177.8506 125 L 4.3989 7.7323 118.8385 55.3524 42.2919 176.6281 126 V 4.6739 6.8036 109.0466 59.8145 36.2603 175.1283 127 T 4.4308 8.5055 119.1896 61.9730 70.1901 174.5693 128 F 4.8613 8.7133 125.6920 57.3380 40.8821 174.6268 129 V 4.7682 9.4241 123.0752 61.2157 34.0191 174.3904 130 G 4.3117 9.4636 116.3408 45.0885 0.0000 172.3559 131 V 4.7350 8.7418 124.5990 61.6952 32.7047 174.5700 132 A 5.2257 8.7094 130.1124 49.9244 21.9764 176.0716 133 R 4.5066 8.6313 118.6137 55.4122 31.6387 174.8110 134 P 4.4845 0.0000 0.0000 64.5721 31.6768 176.9698 135 G 3.9955 9.2724 111.0828 45.2147 0.0000 172.2515 136 Y 4.9389 7.4930 120.0263 55.4604 40.7976 174.7278 137 K 4.1921 7.7901 125.4148 54.3683 33.9426 176.0116 138 L 3.9085 7.8666 123.5714 53.9863 42.5049 176.3329 139 R 4.3888 8.1206 122.2780 55.0452 31.2611 175.7207 140 T 4.2784 7.7171 114.5632 60.5901 69.9989 171.5092 141 P 4.1820 0.0000 0.0000 65.0387 31.7709 176.7091 142 Y 4.5652 7.1165 115.4224 56.2110 38.8100 173.4432 143 P 4.7954 0.0000 0.0000 62.2218 30.3358 175.2397 144 I 4.7363 7.8897 117.4838 59.5694 40.9363 174.8875 145 T 4.5652 8.6954 119.5511 62.8740 70.3668 173.9978 146 T 5.0516 8.4374 121.2169 61.7716 71.2234 173.7070 147 V 4.4444 8.6759 125.6690 61.0522 34.5779 174.0161 148 E 4.9615 8.8685 127.5290 55.9119 30.3418 176.0176 149 I 4.7417 8.7201 125.1840 58.7225 41.1414 173.7627 150 P 4.2990 0.0000 0.0000 62.5133 31.8275 175.7866 151 E 4.0773 8.6931 123.2664 56.1642 30.0379 176.2179 152 F 5.0439 8.6368 127.5798 56.4643 40.0897 174.2593 153 A 4.4131 8.5621 135.0000 51.9477 18.5803 177.7660 154 V 4.0647 7.1004 119.5672 61.8201 33.4665 175.8470 155 S 4.5340 7.7574 115.1239 55.8916 67.1157 175.2458 156 S 4.1230 8.6893 119.1389 61.9994 62.5827 177.2765 157 S 4.0322 7.9477 116.3082 61.2011 62.7229 175.9220 158 L 3.8757 7.6346 124.0253 57.9749 41.7081 179.0619 159 L 3.9119 7.8033 118.7471 57.7947 41.5496 179.6777 160 R 3.5566 8.0425 118.2318 58.9835 29.7238 178.3836 161 E 3.8693 7.9926 117.9746 59.6241 29.9019 178.6182 162 R 3.9910 8.1680 117.9381 59.9209 30.3460 178.4854 163 Y 4.1655 8.2572 116.3242 61.2139 37.6595 179.0293 164 K 4.3132 8.0546 119.7217 59.2282 32.3817 177.7900 165 E 4.3572 7.9977 116.0862 55.0068 29.9788 176.3575 166 K 3.8421 7.6398 116.9161 57.4940 30.3337 174.8390 167 K 4.5348 7.6048 116.9534 54.2357 34.5614 175.2699 168 T 3.8927 8.2899 118.2918 62.9145 67.9103 173.4372 169 C 4.7448 8.3087 123.2122 58.9619 29.5073 173.5557 170 K 3.9824 7.4367 121.7782 58.3009 31.8722 176.8263 171 Y 4.1416 8.6175 122.1798 58.2967 36.1075 169.8042 172 L 4.6661 8.2477 119.9729 55.9963 42.6108 176.4505 173 L 4.8713 7.6444 115.5984 51.9956 43.7318 174.5033 174 P 4.4172 0.0000 0.0000 62.0275 33.0704 177.4488 175 E 4.0273 8.9456 121.2073 59.6267 29.5018 179.6524 176 K 3.9094 8.1915 117.9295 59.7924 32.0193 179.2769 177 V 3.6296 7.6964 117.6783 65.9361 31.4537 177.8767 178 Q 4.2139 8.1747 119.2413 58.4551 28.5299 179.0133 179 V 3.5909 8.3848 119.5280 66.1209 31.5218 177.2970 180 Y 3.9466 8.1341 119.1932 60.7603 38.6091 178.2013 181 I 3.5737 8.1676 120.8809 64.5624 36.7899 178.3834 182 E 3.9619 8.3846 119.5789 59.4094 29.0403 179.7077 183 R 3.8932 8.0844 117.7155 58.7510 30.2465 177.8855 184 N 4.5182 8.0062 113.5996 51.8791 39.0198 175.0974 185 G 3.8577 7.4040 107.8333 46.3215 0.0000 174.5217 186 L 3.7303 7.3881 118.4466 55.3296 42.1292 177.1491 187 Y 4.0020 7.8725 116.4381 59.3199 35.4086 170.0889 188 E 4.3319 7.6011 125.1710 56.5818 29.7280 176.0224 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 M 8.30 4.49 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 2 R 7.83 3.82 0.00 1.59 1.83 0.00 3.16 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 3 K 9.39 4.67 0.00 1.59 1.56 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.59 1.40 7.81 4 I 8.07 4.63 0.94 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 0.68 0.15 -0.32 0.00 0.00 5 G 9.06 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 6 I 8.76 4.96 1.65 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.05 0.83 0.00 0.00 7 I 8.67 4.36 1.59 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 1.15 1.01 0.14 0.00 0.00 8 G 8.58 4.71 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 0.00 0.00 0.00 9 G 7.99 3.68 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 0.00 0.00 0.00 10 T 8.29 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 1.17 0.00 0.00 11 F 7.40 3.76 0.00 3.32 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 12 D 7.87 5.17 0.00 2.72 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 13 P 0.00 5.11 0.00 2.32 2.27 0.00 3.47 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 14 P 0.00 4.69 0.00 2.17 2.14 0.00 3.82 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.84 0.00 15 H 8.25 4.78 0.00 3.50 3.44 0.00 5.65 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 16 Y 8.95 4.60 0.00 3.49 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.20 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 0.00 0.00 0.00 18 H 8.03 4.35 0.00 3.54 3.82 0.00 5.65 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 19 L 8.19 4.22 0.00 2.06 2.08 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.65 4.14 0.00 2.06 2.15 1.08 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.87 3.74 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.56 0.93 0.00 0.00 22 A 8.17 3.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.80 4.67 0.00 3.21 3.21 0.00 0.00 7.26 8.04 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 24 E 8.59 4.10 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.57 0.00 25 V 8.13 3.65 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 1.09 0.00 0.00 1.03 0.00 0.00 26 Y 8.24 4.22 0.00 3.28 3.39 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 27 H 8.47 4.00 0.00 3.31 3.31 0.00 5.69 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 28 A 8.35 3.96 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 29 L 7.95 4.31 0.00 1.61 1.62 0.93 1.11 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 30 N 7.37 3.86 0.00 2.66 2.73 0.00 0.00 7.15 8.91 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 31 L 7.44 4.21 0.00 1.81 1.73 0.92 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.90 4.40 0.00 1.96 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 2.36 2.36 0.00 33 E 8.02 5.21 0.00 1.97 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 2.47 2.44 0.00 34 V 9.28 4.78 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 0.60 0.00 0.00 1.12 0.00 0.00 35 W 9.20 5.52 0.00 3.22 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 36 F 9.74 4.56 0.00 2.62 2.24 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 37 L 9.27 5.08 0.00 1.81 1.65 1.10 1.20 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 38 P 0.00 5.20 0.00 2.05 2.15 0.00 4.02 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 39 N 9.23 5.25 0.00 2.57 2.75 0.00 0.00 6.97 7.98 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 40 Q 8.72 4.19 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 41 I 7.86 4.59 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.63 0.92 0.00 0.00 42 P 0.00 4.07 0.00 2.02 2.09 0.00 3.70 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 2.04 0.00 *49 N 7.83 4.42 0.00 2.70 2.85 0.00 0.00 7.00 7.94 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 50 I 7.98 4.16 1.88 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 1.44 0.68 0.93 0.00 0.00 51 T 8.43 4.00 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 1.22 0.00 0.00 52 S 8.43 4.33 0.00 4.04 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 53 V 8.35 3.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.94 0.00 0.00 54 E 8.24 3.84 0.00 2.06 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 2.41 2.45 0.00 55 S 8.47 4.53 0.00 4.05 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 56 R 8.06 3.90 0.00 2.02 2.02 0.00 3.42 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 1.72 1.90 0.00 57 L 8.24 3.83 0.00 1.71 1.83 0.83 0.54 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 58 Q 8.04 3.87 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 59 M 7.73 3.58 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 60 L 7.87 3.63 0.00 1.74 1.59 -0.11 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.89 3.75 0.00 2.10 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 0.00 2.22 2.30 0.00 62 L 7.43 3.90 0.00 1.69 1.64 0.85 0.85 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 63 A 8.00 4.04 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.34 4.44 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 65 E 7.99 3.85 0.00 2.07 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 2.46 2.25 0.00 66 A 7.83 4.27 1.28 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 67 E 7.99 4.40 0.00 1.27 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.47 0.00 68 E 8.96 4.03 0.00 1.97 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 0.00 2.31 2.30 0.00 69 H 8.12 4.78 0.00 3.17 3.39 0.00 5.42 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 F 8.19 5.88 0.00 2.85 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 71 S 9.62 4.83 0.00 3.63 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.11 4.70 1.74 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.38 0.79 0.00 0.00 73 C 9.07 4.53 0.00 2.81 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 74 L 8.42 4.63 0.00 1.71 1.63 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.40 3.89 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 76 E 8.17 4.13 0.00 2.13 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 0.00 2.39 2.41 0.00 77 L 7.85 4.27 0.00 1.73 1.69 0.93 1.04 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 78 S 7.99 4.40 0.00 4.01 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 79 R 7.05 4.63 0.00 1.76 1.76 0.00 3.16 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 80 K 8.76 4.04 0.00 1.68 1.80 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.47 7.81 81 G 7.55 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 82 P 0.00 4.46 0.00 1.75 1.81 0.00 3.50 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.96 0.00 83 S 8.00 4.45 0.00 3.88 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 84 Y 8.07 4.45 0.00 3.23 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 85 T 8.54 3.90 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 0.91 0.00 0.00 86 Y 8.41 4.18 0.00 3.06 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.42 4.29 0.00 2.97 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.64 3.87 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 1.33 0.00 0.00 89 M 8.23 3.90 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.75 0.00 90 L 7.83 3.72 0.00 1.12 1.55 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.00 3.99 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 92 L 8.07 4.26 0.00 1.29 1.35 0.83 0.78 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 93 T 8.25 4.24 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 1.32 0.00 0.00 94 K 7.97 4.09 0.00 1.99 1.91 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.66 7.81 95 K 8.36 4.09 0.00 1.74 1.08 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.52 7.81 96 Y 8.43 4.87 0.00 3.45 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 97 P 0.00 4.58 0.00 2.08 2.16 0.00 3.78 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 98 D 8.19 4.80 0.00 2.85 2.89 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 99 V 7.50 4.41 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 -0.89 0.00 0.00 0.74 0.00 0.00 100 Q 8.90 4.26 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 101 F 8.56 4.69 0.00 3.07 2.90 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 0.00 102 H 9.51 5.10 0.00 3.01 3.26 0.00 5.80 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 9.06 4.52 0.00 3.02 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 0.00 104 I 7.96 4.92 1.84 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 1.28 0.79 0.92 0.00 0.00 105 I 9.30 4.91 2.11 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.88 1.49 0.00 0.00 106 G 8.85 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 0.00 0.00 0.00 107 G 8.63 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 0.00 108 D 8.11 4.44 0.00 2.73 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 0.00 109 M 8.15 4.43 0.00 2.47 2.27 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 3.06 0.00 110 V 7.38 3.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.95 0.00 0.00 111 E 7.95 3.69 0.00 1.60 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 1.80 2.11 0.00 112 Y 7.94 4.95 0.00 3.34 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 0.00 113 L 7.61 3.02 0.00 1.53 1.23 0.17 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.58 0.00 2.12 2.21 0.00 3.70 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 115 K 8.23 4.41 0.00 2.15 2.00 0.00 1.87 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.50 7.81 116 W 8.40 4.41 0.00 3.41 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 0.00 117 Y 8.66 3.96 0.00 2.23 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 0.00 118 N 8.25 3.63 0.00 1.44 1.83 0.00 0.00 6.81 7.87 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 0.00 119 I 7.34 3.63 2.05 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.52 0.92 0.00 0.00 120 E 7.88 3.81 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 121 A 7.67 4.10 1.07 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 0.00 122 L 8.09 4.14 0.00 2.04 1.91 0.92 0.85 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 0.00 123 L 7.84 4.04 0.00 1.80 1.70 0.27 0.89 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 0.00 124 D 7.67 4.57 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.73 4.40 0.00 1.73 1.68 0.79 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 126 V 6.80 4.67 1.91 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 0.62 0.00 0.00 0.14 0.00 0.00 127 T 8.51 4.43 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 1.19 0.00 0.00 128 F 8.71 4.86 0.00 3.06 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 0.00 129 V 9.42 4.77 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.02 0.00 0.00 130 G 9.46 4.31 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 0.00 131 V 8.74 4.73 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 0.99 0.00 0.00 1.04 0.00 0.00 132 A 8.71 5.23 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.63 4.51 0.00 1.81 1.89 0.00 3.03 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 134 P 0.00 4.48 0.00 2.06 2.03 0.00 3.70 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 2.05 2.13 0.00 135 G 9.27 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 0.00 136 Y 7.49 4.94 0.00 2.80 3.07 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 0.00 137 K 7.79 4.19 0.00 1.51 1.48 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 1.33 7.81 138 L 7.87 3.91 0.00 1.51 1.50 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.12 4.39 0.00 1.75 1.81 0.00 3.35 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 140 T 7.72 4.28 4.14 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 1.23 0.00 0.00 141 P 0.00 4.18 0.00 1.24 1.76 0.00 3.21 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.82 0.00 142 Y 7.12 4.57 0.00 3.00 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 0.00 143 P 0.00 4.80 0.00 2.22 2.14 0.00 3.89 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 2.05 2.01 0.00 144 I 7.89 4.74 2.11 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 1.35 0.76 1.02 0.00 0.00 145 T 8.70 4.57 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 146 T 8.44 5.05 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 1.19 0.00 0.00 147 V 8.68 4.44 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 1.03 0.00 0.00 0.96 0.00 0.00 148 E 8.87 4.96 0.00 1.92 1.91 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 2.33 2.36 0.00 149 I 8.72 4.74 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.81 1.00 0.00 0.00 150 P 0.00 4.30 0.00 2.03 1.99 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 151 E 8.69 4.08 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 152 F 8.64 5.04 0.00 2.90 2.90 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 0.00 153 A 8.56 4.41 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 0.00 154 V 7.10 4.06 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 0.57 0.00 0.00 155 S 7.76 4.53 0.00 3.96 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 0.00 156 S 8.69 4.12 0.00 3.86 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 0.00 157 S 7.95 4.03 0.00 4.01 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 0.00 158 L 7.63 3.88 0.00 1.67 1.81 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 L 7.80 3.91 0.00 1.88 1.78 0.95 0.92 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 0.00 160 R 8.04 3.56 0.00 1.85 1.84 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.48 0.00 161 E 7.99 3.87 0.00 2.04 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 0.00 2.32 2.37 0.00 162 R 8.17 3.99 0.00 1.98 1.70 0.00 3.13 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 163 Y 8.26 4.17 0.00 3.15 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 0.00 164 K 8.05 4.31 0.00 1.98 2.03 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.70 7.81 165 E 8.00 4.36 0.00 2.09 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 2.33 2.53 0.00 166 K 7.64 3.84 0.00 1.92 1.88 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.40 7.81 167 K 7.60 4.53 0.00 1.66 1.60 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.37 7.81 168 T 8.29 3.89 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 169 C 8.31 4.74 0.00 2.78 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 0.00 170 K 7.44 3.98 0.00 1.53 1.60 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.30 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 1.00 7.81 171 Y 8.62 4.14 0.00 3.30 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.25 4.67 0.00 1.92 1.71 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 173 L 7.64 4.87 0.00 1.63 1.62 1.11 0.79 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 0.00 174 P 0.00 4.42 0.00 2.03 1.89 0.00 3.60 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.14 0.00 175 E 8.95 4.03 0.00 2.06 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 2.49 2.50 0.00 176 K 8.19 3.91 0.00 1.79 1.88 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.56 1.54 7.81 177 V 7.70 3.63 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 1.19 0.00 0.00 0.83 0.00 0.00 178 Q 8.17 4.21 0.00 2.40 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 179 V 8.38 3.59 2.34 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 1.10 0.00 0.00 0.96 0.00 0.00 180 Y 8.13 3.95 0.00 3.20 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 0.00 181 I 8.17 3.57 1.84 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 1.54 0.66 0.21 0.00 0.00 182 E 8.38 3.96 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 2.43 2.43 0.00 183 R 8.08 3.89 0.00 1.70 1.85 0.00 3.13 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 184 N 8.01 4.52 0.00 2.21 2.53 0.00 0.00 7.01 7.34 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 0.00 185 G 7.40 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 7.39 3.73 0.00 1.02 0.13 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 187 Y 7.87 4.00 0.00 3.18 3.04 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 0.00 188 E 7.60 4.33 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 * Residues marked with a * may have inaccurate shift predictions.