NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 3.9928 8.0549 120.3894 62.0742 32.5792 175.0333 13 L 3.7077 8.5149 127.6094 54.1611 41.8773 175.1360 14 Q 3.9392 8.9920 126.3361 55.5211 30.6748 175.9403 15 K 3.8316 8.4443 126.6964 58.9478 32.6679 176.6226 16 R 3.9491 7.8684 120.5392 55.9842 29.7049 174.6206 17 P 4.8713 0.0000 0.0000 62.7347 32.3315 176.3965 18 V 4.3873 8.5521 116.5088 59.7412 34.2162 174.9450 19 I 4.8491 8.4139 125.5705 59.9771 38.4995 175.3572 20 V 5.0363 8.8641 120.4665 59.3988 36.2183 174.6660 21 K 4.5546 9.3200 125.2315 55.1933 33.8731 175.6559 22 V 4.3764 8.3072 127.7556 62.6615 31.2562 175.4560 23 L 4.4889 9.2115 130.0255 57.4376 42.3954 177.4084 24 S 4.8977 7.8363 110.7022 57.8177 65.8550 174.2246 25 T 5.4402 8.4363 110.3926 60.4725 71.9034 173.2316 26 T 4.5233 8.9143 113.7185 60.3965 70.5200 174.7665 27 K 4.1523 8.4528 121.3804 55.4297 32.8076 175.4450 28 P 4.6303 0.0000 0.0000 63.1367 31.9293 175.7673 29 F 5.0416 7.8870 116.0648 55.2073 41.7413 172.7649 30 E 4.7677 9.0208 121.6204 55.9644 30.5280 174.8670 31 Y 5.3425 8.9575 123.9867 54.1390 42.3037 173.5361 32 E 4.9535 9.1492 121.0351 54.8494 31.0140 175.4260 33 T 4.5973 8.4548 118.0291 58.9777 70.9527 173.3764 34 P 4.4666 0.0000 0.0000 62.0431 30.8113 175.9884 *37 E 4.1188 7.6312 117.5835 56.8899 31.8202 176.5965 38 K 4.8597 8.4906 122.3074 54.7333 34.2991 175.5810 39 K 4.5692 8.0978 122.9173 54.6811 36.9275 174.8725 40 I 5.3733 8.2025 120.5903 58.4888 40.7003 175.2720 *42 F 4.4292 8.3432 117.6741 57.1838 39.6588 173.5068 43 H 5.2550 8.8049 116.6498 54.9781 30.7911 174.2740 44 A 5.3784 9.2833 122.4734 50.7822 23.3182 174.9551 45 T 5.2262 9.2004 116.8706 61.9797 71.4722 174.0071 46 V 5.1980 9.1832 118.5889 59.7769 36.3328 174.4144 47 A 5.3024 9.2893 123.3745 51.2071 22.8802 176.8866 48 T 4.2657 8.4018 111.5997 60.7252 71.2647 174.6077 49 Q 4.0710 7.8652 118.8733 58.2847 28.8956 176.7265 50 T 4.4880 7.5380 106.0020 61.3138 70.6650 173.4035 51 Q 4.4847 7.4642 118.7184 55.1148 31.1104 172.3446 52 F 5.3995 8.0702 112.8933 55.0921 40.8434 174.6238 53 F 4.7097 9.1920 118.1654 56.0419 43.2336 173.8698 54 H 5.0567 8.6189 119.6555 55.5246 30.3849 174.3792 55 V 4.7760 9.1833 122.0838 61.1137 34.8954 174.2183 56 K 4.4089 8.9950 128.0541 55.3468 33.4005 176.0149 57 V 4.0480 7.7598 127.1751 61.2126 31.1097 175.3699 58 L 4.0218 8.7963 128.7488 55.5294 42.5681 176.8156 59 N 4.6727 7.7681 118.3146 51.7659 38.8084 175.0411 60 T 4.3316 8.2901 117.0845 63.6344 69.2641 176.2694 61 S 4.3694 8.0334 115.8941 59.8347 63.0515 175.0946 62 L 4.6497 7.8579 121.1961 54.4873 41.8196 177.5505 63 K 3.5697 8.0443 122.0528 59.9748 32.1144 178.2883 64 E 4.0090 8.2116 117.8586 59.4343 29.2166 179.4038 65 K 4.0962 7.9253 117.5153 58.5659 31.4172 178.3404 66 F 4.6451 7.9300 116.6834 57.0971 38.9208 177.1869 67 N 4.2689 7.8623 117.3348 54.0538 37.2852 176.2862 68 G 3.9094 7.6019 107.3254 45.9212 0.0000 174.5825 69 K 4.1791 9.0416 119.7665 57.4419 32.4340 176.9127 70 K 4.6448 7.4003 116.2083 54.3043 36.3035 175.3726 71 I 4.2640 7.9236 121.0866 60.8886 38.5104 175.2236 72 I 4.9337 8.4613 118.8802 59.1067 41.2991 174.1678 73 I 4.8560 8.9931 124.0544 59.7126 39.8908 174.5981 74 I 4.9490 8.5928 128.6642 59.5981 39.4093 175.1400 75 S 5.1792 8.8975 120.9410 56.0936 67.4398 173.0639 76 D 4.5196 8.5801 115.7649 54.5766 38.2733 172.8321 77 Y 5.1242 6.9523 115.2659 55.5219 41.6170 175.2801 78 L 4.8844 8.7466 120.2770 53.7080 44.1853 175.4540 79 E 5.2681 8.5252 122.2091 54.9904 32.2821 174.1862 80 Y 4.6498 8.6882 122.3201 57.4106 40.9311 173.9480 81 D 4.2518 9.8130 118.3927 55.3250 38.4959 174.1430 82 S 3.9608 8.6723 112.2640 59.1034 59.9261 169.5809 83 L 4.9109 7.8035 119.5679 54.6591 44.5352 174.1485 84 L 5.1152 8.7922 118.4697 52.8566 44.8652 175.5052 85 E 4.8544 9.2525 124.2350 54.5399 32.0585 174.5679 86 V 4.6100 8.6483 128.4027 61.5529 33.4530 174.2806 87 N 5.0545 8.5764 126.8509 51.2842 39.8904 174.4762 88 E 4.0642 8.7737 115.9675 59.4593 29.6369 177.8570 89 E 4.2205 8.1816 117.1001 57.8588 29.9684 177.0687 90 S 5.0701 7.7689 114.5637 58.1078 64.0836 173.7175 91 T 4.7191 8.8627 117.9860 61.8344 71.5789 173.4267 92 V 4.9807 8.5221 125.3862 61.1482 34.2259 174.5385 93 S 4.8341 9.0644 121.5838 56.2807 66.9947 172.9619 94 E 4.3862 8.6986 120.5200 56.0933 29.8349 176.8236 95 A 4.1660 8.7721 127.2342 51.4573 19.3911 177.7817 96 G 3.7705 8.7223 109.7512 44.5646 0.0000 172.8590 97 P 4.1766 0.0000 0.0000 65.6645 31.2378 177.4347 98 N 4.6828 8.0475 111.4955 53.8812 38.8556 175.2322 99 Q 4.6342 7.9093 116.9534 55.8883 29.0552 175.5798 100 T 4.1480 7.7047 115.0429 62.9536 69.3223 173.9005 101 F 5.0374 7.5564 118.7188 55.5180 41.2406 173.1134 102 E 4.7505 8.7412 119.9745 54.6310 31.4219 176.2843 103 V 4.2699 8.2658 116.1221 59.6095 33.2246 174.6315 104 P 4.4845 0.0000 0.0000 62.1918 32.1427 177.0767 105 N 4.3211 8.7243 118.8033 56.5844 38.8419 176.9430 106 K 3.8136 8.1462 120.7662 59.7921 32.0953 178.5614 107 I 3.8159 7.6488 119.2262 64.2045 36.9040 178.3109 108 I 3.6318 7.6573 119.1655 64.4135 37.2642 177.7124 109 N 4.3743 8.4371 117.5635 56.3417 38.4089 177.3487 110 R 3.9785 8.1469 121.0630 58.8095 29.9294 178.3530 111 A 2.0000 7.3916 119.0747 53.4193 18.2746 178.6274 112 K 4.1687 7.1442 114.5514 55.3809 33.3768 176.8017 113 E 4.0339 7.4389 120.6368 56.5032 30.0459 175.9385 114 T 4.5415 7.9311 118.5375 61.3480 71.2318 174.2171 115 L 4.2359 8.3219 125.6902 54.3039 42.6990 177.7907 116 K 4.4039 8.3933 121.5717 56.3612 34.1663 178.7513 117 I 3.8360 8.9906 123.8895 64.2628 36.7785 178.7370 118 D 4.4596 8.0798 119.2932 56.4324 39.5985 178.2296 119 I 3.8656 7.7423 120.7347 64.2308 37.3439 178.1002 120 L 4.0397 8.0862 119.7087 58.2535 41.2106 179.2359 121 H 4.3873 8.1947 114.7215 57.5420 28.7038 176.7166 122 K 4.4451 7.6256 118.2961 55.2598 33.1160 176.2682 123 Q 4.1616 7.2048 120.3909 55.0409 29.5779 175.3795 124 A 4.0808 8.4164 126.3854 51.8427 19.0303 177.1955 125 S 4.1565 8.5843 117.6849 59.8813 62.7618 174.3062 126 G 4.1332 9.2390 115.7181 45.2225 0.0000 173.7306 127 N 4.6591 7.8798 117.6159 53.3251 39.7197 174.5700 128 I 4.7166 8.3594 123.0963 60.9193 38.8098 175.4162 129 V 4.6664 9.1448 125.4597 61.4219 34.5434 173.7830 130 Y 5.1195 8.9051 124.5118 55.9843 41.2729 174.9977 131 G 3.6834 7.7830 108.9757 46.4026 0.0000 171.4320 132 V 4.6359 7.5703 120.0249 60.6027 32.7868 174.1189 133 F 4.6152 9.0704 130.8410 56.6195 43.4507 174.8155 *135 L 4.2306 8.4780 126.9208 56.7648 42.7735 176.6850 136 H 4.3610 9.5449 127.2518 58.2686 30.5105 174.9970 137 K 4.7577 7.7901 117.6988 54.9420 35.9205 174.0218 138 K 4.9210 8.5180 125.6450 55.0551 35.2775 175.2123 139 T 4.3976 8.7532 124.4995 61.8496 70.8040 173.6674 140 V 4.1225 8.3007 127.8236 62.0017 32.1226 174.9190 141 N 4.9713 8.2598 128.3748 52.0878 41.0211 174.7813 142 Q 4.1699 8.7677 116.8435 59.1244 29.0392 177.2381 143 K 4.2994 8.0055 114.8238 56.6503 34.5210 176.2207 144 T 5.0399 7.5594 107.0453 60.0458 72.4487 173.1056 145 T 4.8867 8.9702 119.6843 61.8832 71.8461 173.3788 146 I 4.6593 8.4139 127.1899 60.0585 39.0149 174.4519 147 Y 4.6868 8.8016 127.0728 56.7301 39.3858 175.0496 148 E 4.7040 9.4731 128.1398 55.2012 30.5740 175.3310 149 I 4.6316 8.1146 121.0692 60.1458 40.0964 174.3736 150 Q 5.1241 8.4020 123.2592 55.2169 32.4990 173.2770 151 D 4.8199 9.0306 122.7172 51.9501 42.4606 175.4120 152 D 4.5639 8.8006 117.3749 55.7191 39.2780 176.8551 153 R 4.4603 8.6810 117.2961 55.0749 31.8227 175.6954 154 G 3.9509 6.7527 104.2031 45.6545 0.0000 170.3254 155 K 5.5111 7.7724 117.3326 54.6468 36.2130 175.0587 *157 D 4.5613 8.4560 117.8672 54.3485 42.6348 174.9789 158 V 4.7065 8.7743 122.4053 61.1164 34.4649 174.2904 159 V 4.6435 9.3463 128.9617 61.5196 33.0927 174.2729 160 G 4.8756 9.6138 116.9929 44.1056 0.0000 171.8095 161 T 5.0192 8.7657 114.7743 59.1076 72.8084 176.1897 162 G 3.8695 8.8848 110.9968 46.7385 0.0000 177.2383 163 Q 4.2031 8.8792 122.6516 58.0950 28.2405 177.0032 164 C 4.6198 8.1207 115.8531 59.9577 28.8606 172.5724 165 H 4.7026 8.3388 121.1286 56.3994 30.1754 174.1863 166 N 4.0780 8.8102 124.8326 54.5499 37.6200 174.2936 167 I 3.9893 7.8652 117.6630 59.9914 37.8746 174.8161 168 P 4.3858 0.0000 0.0000 62.8524 31.6502 175.4047 169 C 4.8234 7.9957 115.7236 57.6401 31.8374 172.3799 170 E 4.7879 9.2458 118.4705 53.8277 32.3837 174.9972 171 E 4.2857 8.6038 119.1180 57.9723 29.8502 176.3298 172 G 4.1786 8.6809 112.1254 45.8695 0.0000 174.2266 173 D 4.5018 7.6626 118.5003 54.5983 41.7767 176.5466 174 K 4.5769 8.5910 121.3887 55.2750 34.2483 175.2519 175 L 4.9144 8.9651 125.4658 53.0677 44.2204 175.1791 176 Q 4.7158 9.4699 126.6796 54.7489 30.6235 173.9732 177 L 5.0726 8.9959 127.6656 53.1458 44.2834 175.5939 178 F 4.4370 9.3619 122.3960 55.7801 41.7301 175.1645 179 C 3.1140 6.3651 124.1932 60.1972 29.3751 172.4067 180 F 4.4922 8.1078 117.4022 56.3463 41.4172 176.0674 181 R 4.7705 8.6190 122.4259 54.7517 31.7687 175.0606 182 L 4.6442 8.9658 130.0483 54.9795 43.5076 175.3936 183 R 4.7919 9.2199 126.9273 54.4343 33.1846 173.5475 184 K 4.6529 8.8811 128.7299 54.8169 33.1900 175.6999 185 K 4.4646 8.1486 127.8900 55.8791 35.3981 175.3636 186 N 4.0535 9.5151 122.9915 54.7660 36.1804 173.9027 187 Q 3.3695 7.8359 110.1481 56.9801 25.7805 174.5638 *189 S 4.6176 7.6127 111.6407 58.6995 64.6489 175.1787 190 K 4.7412 8.6930 121.5217 55.1643 37.4846 174.7227 191 L 5.0899 8.4982 121.8161 53.5572 43.6929 175.7603 192 I 4.9922 8.8292 125.2768 59.1704 39.6989 175.5763 193 S 3.3339 9.1823 122.6546 59.9088 63.7539 172.5664 194 E 4.2412 9.2440 118.4114 57.6496 30.1620 177.0958 *196 H 4.5190 9.1812 119.5743 55.7633 31.3181 173.6621 197 S 4.6314 7.8168 115.9446 58.8657 63.5085 173.4312 198 F 4.9643 8.9594 122.7539 57.0748 43.0647 172.9975 199 I 5.0416 7.4281 124.8408 59.4071 40.0931 174.6249 200 Q 4.4760 8.6102 123.4754 53.8875 32.5482 174.4869 201 I 4.2177 8.1766 121.0400 60.9333 37.9471 176.1381 202 K 4.2007 8.9665 127.4902 56.7546 31.6323 176.4318 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 12 V 8.05 3.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.92 0.00 0.00 13 L 8.51 3.71 0.00 1.69 1.53 0.90 0.65 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 14 Q 8.99 3.94 0.00 1.67 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 15 K 8.44 3.83 0.00 1.67 1.76 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.49 7.81 16 R 7.87 3.95 0.00 1.90 1.99 0.00 3.30 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 17 P 0.00 4.87 0.00 1.98 2.04 0.00 3.69 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 2.06 2.17 0.00 18 V 8.55 4.39 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.45 0.00 0.00 19 I 8.41 4.85 2.01 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 1.39 0.61 1.09 0.00 0.00 20 V 8.86 5.04 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 0.76 0.00 0.00 0.94 0.00 0.00 21 K 9.32 4.55 0.00 1.58 1.76 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.32 7.81 22 V 8.31 4.38 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 1.13 0.00 0.00 0.84 0.00 0.00 23 L 9.21 4.49 0.00 1.67 1.75 0.96 0.91 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 24 S 7.84 4.90 0.00 3.99 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 25 T 8.44 5.44 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 26 T 8.91 4.52 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 0.78 0.00 0.00 27 K 8.45 4.15 0.00 1.81 1.80 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.46 7.81 28 P 0.00 4.63 0.00 1.92 1.99 0.00 3.59 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 29 F 7.89 5.04 0.00 3.06 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 30 E 9.02 4.77 0.00 2.05 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 2.27 2.26 0.00 31 Y 8.96 5.34 0.00 3.16 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 32 E 9.15 4.95 0.00 2.04 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 2.21 2.28 0.00 33 T 8.45 4.60 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 1.13 0.00 0.00 34 P 0.00 4.47 0.00 2.20 2.14 0.00 3.82 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 1.98 1.98 0.00 *37 E 7.63 4.12 0.00 1.92 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 2.32 0.00 38 K 8.49 4.86 0.00 1.54 1.62 0.00 1.94 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.39 7.81 39 K 8.10 4.57 0.00 0.79 1.40 0.00 1.51 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.15 1.03 7.81 40 I 8.20 5.37 1.83 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 0.96 1.87 0.85 0.00 0.00 *42 F 8.34 4.43 0.00 3.14 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 43 H 8.80 5.26 0.00 2.94 3.41 0.00 5.56 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.28 5.38 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 9.20 5.23 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 1.31 0.00 0.00 46 V 9.18 5.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.10 0.00 0.00 47 A 9.29 5.30 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 48 T 8.40 4.27 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 49 Q 7.87 4.07 0.00 1.75 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.88 0.00 0.00 0.00 0.00 0.00 2.45 1.58 0.00 50 T 7.54 4.49 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 1.13 0.00 0.00 51 Q 7.46 4.48 0.00 1.84 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.83 0.00 0.00 0.00 0.00 0.00 2.03 1.36 0.00 52 F 8.07 5.40 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 53 F 9.19 4.71 0.00 2.79 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 54 H 8.62 5.06 0.00 3.00 3.08 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 9.18 4.78 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 1.01 0.00 0.00 0.99 0.00 0.00 56 K 9.00 4.41 0.00 1.60 1.49 0.00 1.72 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.44 7.81 57 V 7.76 4.05 0.67 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 0.11 0.00 0.00 -0.23 0.00 0.00 58 L 8.80 4.02 0.00 1.43 1.66 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 59 N 7.77 4.67 0.00 2.68 2.69 0.00 0.00 6.98 7.22 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 60 T 8.29 4.33 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 1.26 0.00 0.00 61 S 8.03 4.37 0.00 4.00 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 62 L 7.86 4.65 0.00 1.97 2.11 1.00 1.01 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 63 K 8.04 3.57 0.00 1.73 1.92 0.00 1.50 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.26 7.81 64 E 8.21 4.01 0.00 2.07 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 2.40 2.41 0.00 65 K 7.93 4.10 0.00 1.95 1.75 0.00 1.75 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.49 7.81 66 F 7.93 4.65 0.00 3.39 3.20 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 67 N 7.86 4.27 0.00 2.83 2.94 0.00 0.00 6.92 6.74 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 68 G 7.60 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 69 K 9.04 4.18 0.00 1.81 1.85 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.39 7.81 70 K 7.40 4.64 0.00 1.60 1.58 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.33 7.81 71 I 7.92 4.26 1.65 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 0.58 0.38 0.78 0.00 0.00 72 I 8.46 4.93 1.73 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.85 0.74 0.00 0.00 73 I 8.99 4.86 1.87 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 1.24 0.80 0.93 0.00 0.00 74 I 8.59 4.95 1.62 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.73 0.84 0.00 0.00 75 S 8.90 5.18 0.00 3.87 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 76 D 8.58 4.52 0.00 2.89 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 77 Y 6.95 5.12 0.00 3.19 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 78 L 8.75 4.88 0.00 1.86 1.91 1.07 0.72 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 79 E 8.53 5.27 0.00 2.12 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.52 0.00 80 Y 8.69 4.65 0.00 3.25 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 81 D 9.81 4.25 0.00 2.84 2.87 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 82 S 8.67 3.96 0.00 4.08 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 83 L 7.80 4.91 0.00 1.92 1.77 0.44 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.79 5.12 0.00 1.42 1.44 -0.09 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 85 E 9.25 4.85 0.00 2.05 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 2.22 2.20 0.00 86 V 8.65 4.61 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 0.91 0.00 0.00 0.97 0.00 0.00 87 N 8.58 5.05 0.00 2.95 2.89 0.00 0.00 6.56 7.22 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 88 E 8.77 4.06 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 89 E 8.18 4.22 0.00 2.17 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 2.28 0.00 90 S 7.77 5.07 0.00 3.94 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 91 T 8.86 4.72 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 92 V 8.52 4.98 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 0.73 0.00 0.00 1.09 0.00 0.00 93 S 9.06 4.83 0.00 3.85 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 94 E 8.70 4.39 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 95 A 8.77 4.17 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.72 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.18 0.00 2.04 2.15 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 98 N 8.05 4.68 0.00 2.72 2.86 0.00 0.00 6.81 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.91 4.63 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 100 T 7.70 4.15 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 101 F 7.56 5.04 0.00 3.17 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 0.00 102 E 8.74 4.75 0.00 2.03 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 2.22 2.32 0.00 103 V 8.27 4.27 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 1.05 0.00 0.00 1.00 0.00 0.00 104 P 0.00 4.48 0.00 2.18 1.97 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.07 0.00 105 N 8.72 4.32 0.00 2.75 2.80 0.00 0.00 6.59 6.75 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 0.00 106 K 8.15 3.81 0.00 1.85 1.80 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.54 7.81 107 I 7.65 3.82 2.01 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 1.54 0.43 0.94 0.00 0.00 108 I 7.66 3.63 1.85 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 1.64 0.48 0.88 0.00 0.00 109 N 8.44 4.37 0.00 2.84 2.80 0.00 0.00 6.69 7.22 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 0.00 110 R 8.15 3.98 0.00 1.98 1.96 0.00 3.19 0.00 0.00 3.39 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.52 0.00 111 A 7.39 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 K 7.14 4.17 0.00 1.77 1.74 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.54 7.81 113 E 7.44 4.03 0.00 2.08 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 2.25 2.38 0.00 114 T 7.93 4.54 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 1.41 1.62 7.81 123 Q 7.20 4.16 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 124 A 8.42 4.08 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 0.00 125 S 8.58 4.16 0.00 3.86 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 0.00 126 G 9.24 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 N 7.88 4.66 0.00 2.81 2.81 0.00 0.00 6.85 6.88 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 0.00 128 I 8.36 4.72 2.02 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 1.33 0.87 1.12 0.00 0.00 129 V 9.14 4.67 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 1.10 0.00 0.00 1.00 0.00 0.00 130 Y 8.91 5.12 0.00 2.72 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 0.00 131 G 7.78 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 0.00 132 V 7.57 4.64 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.75 0.00 0.00 133 F 9.07 4.62 0.00 2.85 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *135 L 8.48 4.23 0.00 1.82 1.72 1.16 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 0.00 136 H 9.54 4.36 0.00 3.18 3.46 0.00 5.80 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 0.00 137 K 7.79 4.76 0.00 2.00 1.75 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.76 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.45 7.81 138 K 8.52 4.92 0.00 1.77 1.60 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.71 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.14 1.11 7.81 139 T 8.75 4.40 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 1.17 0.00 0.00 140 V 8.30 4.12 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 0.82 0.00 0.00 0.88 0.00 0.00 141 N 8.26 4.97 0.00 2.97 2.77 0.00 0.00 7.09 7.78 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 0.00 142 Q 8.77 4.17 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 143 K 8.01 4.30 0.00 1.65 1.77 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.40 7.81 144 T 7.56 5.04 4.35 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 1.21 0.00 0.00 145 T 8.97 4.89 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 0.33 0.00 0.00 146 I 8.41 4.66 1.80 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 1.17 0.97 0.89 0.00 0.00 147 Y 8.80 4.69 0.00 2.88 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 9.47 4.70 0.00 1.98 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 2.22 2.21 0.00 149 I 8.11 4.63 1.83 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.30 0.80 0.00 0.00 150 Q 8.40 5.12 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 151 D 9.03 4.82 0.00 2.89 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 0.00 152 D 8.80 4.56 0.00 2.79 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 R 8.68 4.46 0.00 1.92 2.13 0.00 3.31 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 154 G 6.75 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 0.00 155 K 7.77 5.51 0.00 1.80 1.77 0.00 1.30 0.00 0.00 2.30 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.28 7.81 *157 D 8.46 4.56 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 0.00 158 V 8.77 4.71 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 0.83 0.00 0.00 0.69 0.00 0.00 159 V 9.35 4.64 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 0.97 0.00 0.00 0.97 0.00 0.00 160 G 9.61 4.88 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 0.00 161 T 8.77 5.02 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 1.24 0.00 0.00 162 G 8.88 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 0.00 163 Q 8.88 4.20 0.00 2.46 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.77 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 164 C 8.12 4.62 0.00 3.29 3.20 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 0.00 165 H 8.34 4.70 0.00 3.35 3.45 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 N 8.81 4.08 0.00 2.34 2.77 0.00 0.00 7.26 7.86 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 0.00 167 I 7.87 3.99 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.54 0.86 0.00 0.00 168 P 0.00 4.39 0.00 2.06 2.02 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 169 C 8.00 4.82 0.00 3.04 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 E 9.25 4.79 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 2.36 2.24 0.00 171 E 8.60 4.29 0.00 1.96 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 2.38 2.32 0.00 172 G 8.68 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 0.00 173 D 7.66 4.50 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 K 8.59 4.58 0.00 1.67 1.67 0.00 1.57 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.43 7.81 175 L 8.97 4.91 0.00 1.58 1.39 0.66 0.55 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 0.00 176 Q 9.47 4.72 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 1.54 2.01 0.00 177 L 9.00 5.07 0.00 1.45 1.18 0.14 0.48 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 0.00 178 F 9.36 4.44 0.00 2.87 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 0.00 179 C 6.37 3.11 0.00 2.91 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 F 8.11 4.49 0.00 3.09 2.94 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 0.00 181 R 8.62 4.77 0.00 2.01 1.94 0.00 3.18 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 182 L 8.97 4.64 0.00 1.96 1.56 1.02 0.77 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 0.00 183 R 9.22 4.79 0.00 1.92 1.73 0.00 3.20 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 184 K 8.88 4.65 0.00 1.82 1.72 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.39 7.81 185 K 8.15 4.46 0.00 1.70 1.61 0.00 1.99 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.45 7.81 186 N 9.52 4.05 0.00 2.91 2.87 0.00 0.00 7.13 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 7.84 3.37 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.51 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 *189 S 7.61 4.62 0.00 3.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 K 8.69 4.74 0.00 1.69 1.75 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.43 7.81 191 L 8.50 5.09 0.00 1.53 1.66 0.44 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 192 I 8.83 4.99 1.90 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 1.33 1.00 0.93 0.00 0.00 193 S 9.18 3.33 0.00 3.39 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 0.00 194 E 9.24 4.24 0.00 1.85 1.63 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 2.17 2.32 0.00 *196 H 9.18 4.52 0.00 3.14 3.25 0.00 5.72 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 S 7.82 4.63 0.00 3.30 2.87 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 0.00 198 F 8.96 4.96 0.00 2.46 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 I 7.43 5.04 1.56 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.87 0.56 0.00 0.00 200 Q 8.61 4.48 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 201 I 8.18 4.22 1.86 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 1.20 0.49 0.96 0.00 0.00 202 K 8.97 4.20 0.00 1.80 1.66 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.