NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 T 4.3338 8.0327 110.9424 61.0552 70.5051 174.2170 33 L 3.7624 8.4769 125.1459 57.5753 41.8579 175.9008 34 E 4.0432 9.1259 120.1518 59.7281 29.8499 178.0464 35 D 4.3922 8.0595 118.4148 57.6146 40.9104 178.6196 36 D 4.3681 8.2457 119.3624 57.3248 40.6980 178.8483 37 L 4.1509 8.6148 120.0369 57.3716 41.6133 178.9673 38 N 4.3689 8.5783 117.3510 56.7796 38.9838 176.7036 39 A 4.0432 8.2470 122.2767 55.4709 18.3328 179.8029 40 T 3.6027 8.0510 114.0599 66.9297 68.5799 176.7674 41 N 4.5620 8.5638 118.6629 56.2337 38.4644 177.2029 42 E 3.9402 8.2717 120.7535 59.3592 29.9080 177.9775 43 Y 4.0328 8.0704 119.5991 61.1836 38.7124 177.8626 44 Y 4.3377 8.1688 117.6275 61.1815 38.0399 179.0796 45 R 3.9434 8.2970 118.9393 59.4225 30.0548 178.8747 46 E 4.0061 8.3001 117.3624 59.0325 29.4993 178.7189 47 R 4.2877 7.5055 115.0024 54.8397 30.6262 176.3174 48 G 3.9189 7.6382 106.2964 46.9226 0.0000 175.3364 49 I 4.1324 8.0638 121.4342 62.5658 38.3983 176.5455 50 A 4.5865 7.4399 117.3382 51.0939 22.0855 176.7225 51 V 4.2889 8.6757 121.8809 61.1095 32.4147 173.6500 52 I 5.2032 8.1873 125.9895 59.5284 40.4166 174.4888 53 H 5.0688 9.0221 122.4793 53.6473 33.2384 172.6485 54 K 3.7207 8.6226 122.8514 55.8985 32.8384 176.5675 55 K 4.1605 8.5219 127.7132 55.3403 32.5949 175.5626 56 P 4.2792 0.0000 0.0000 62.4024 31.9556 176.4599 57 T 3.8939 8.4481 118.9682 63.3018 69.0404 172.2226 58 P 4.4677 0.0000 0.0000 62.8650 32.6932 175.3936 59 V 4.6459 8.1704 122.7979 61.0723 34.4343 174.2698 60 Q 4.3092 9.1660 130.6056 55.4169 29.8146 174.4803 61 I 4.2404 8.3072 128.3197 60.9595 37.4996 175.8387 62 V 4.2989 8.4953 126.7107 63.8444 33.6652 175.8552 63 R 4.7942 7.6307 118.6730 54.9057 33.8113 174.3470 64 V 4.9116 8.2478 117.3737 60.0785 35.6445 174.0941 65 D 4.9896 9.1885 125.3478 52.8816 43.6132 175.2170 66 Y 4.7877 8.5149 119.0545 55.9285 40.2458 173.6911 67 P 4.7200 0.0000 0.0000 61.7630 34.1476 174.4537 68 K 3.9785 8.4340 118.2632 59.0498 31.6137 178.2504 69 R 4.0918 8.4854 123.2601 59.1637 31.3484 177.4800 70 S 4.2094 7.8624 110.3520 57.8647 62.9727 173.2456 71 A 4.1820 8.2612 126.1287 51.2229 18.9118 177.1114 72 A 3.7068 8.2427 121.4286 52.3288 19.1208 177.1852 73 V 4.2418 8.4324 121.3242 60.9094 34.6219 174.6037 74 I 4.5004 8.2873 128.7808 61.2597 36.9402 175.4864 75 T 4.3729 8.5415 117.8073 62.1172 70.7352 174.7874 76 E 4.5604 7.7923 122.6646 54.5248 32.9980 173.7444 77 A 4.8605 7.8698 126.3184 51.1437 22.3456 174.5869 78 Y 4.5937 9.0501 117.1505 55.9423 41.8707 175.2812 79 F 4.9152 8.7441 120.3613 57.4946 39.9956 175.6035 80 R 4.6297 8.4115 121.7637 54.4392 32.1442 176.1971 81 Q 3.9555 8.5122 122.0749 55.9426 29.5928 175.6795 82 A 4.2272 8.4551 128.8618 52.0075 19.0960 177.3471 83 S 4.4876 8.5823 116.7720 59.0982 63.9233 173.4076 84 T 4.4760 7.2716 109.9861 59.4042 71.7411 173.0876 85 T 4.3256 7.9198 111.5202 61.7518 69.4929 174.0712 86 D 4.3891 8.7349 121.2340 55.8365 42.1739 176.0006 87 Y 4.8842 7.8300 116.7492 55.8993 41.6002 174.4415 88 N 5.6174 7.7550 119.4703 51.4859 41.6701 174.1529 89 G 4.1617 6.9403 103.8344 45.9617 0.0000 171.1444 90 V 4.9156 7.5880 118.5775 59.9784 34.1836 174.1190 91 Y 4.9329 8.9425 123.9174 57.1997 41.6495 175.1288 92 R 3.4572 9.2044 127.1908 57.2355 27.5877 177.2822 93 G 3.9976 8.2831 103.2251 45.4635 0.0000 173.6170 94 K 4.7121 8.0803 119.7755 54.2613 34.8129 174.6937 95 Y 4.6377 8.6045 123.7975 57.7643 40.1067 174.1409 96 I 4.9610 8.1474 127.4400 59.5282 40.7575 174.2011 97 D 5.1049 8.8484 125.7480 52.7582 44.9672 173.8720 98 F 5.6178 8.9115 119.5382 55.8311 41.8528 172.3721 99 E 5.1794 8.9937 120.1879 54.4265 32.3862 174.0766 100 A 5.3992 8.8761 127.5645 50.2492 21.3238 175.6323 101 K 4.8756 9.3848 121.7914 54.5111 36.6981 175.2796 102 E 5.4356 8.8257 119.5861 55.1369 32.9279 174.6243 103 T 4.4975 8.7667 114.3662 60.7812 71.0461 174.3397 104 K 4.3957 8.5103 123.4778 56.2217 33.0894 176.7968 105 N 4.4432 7.8187 117.9949 53.9556 39.2484 174.4051 106 K 4.5661 8.6223 121.4597 56.5982 34.1306 177.0122 107 T 4.5707 7.8050 107.3070 61.9206 71.3486 173.8166 108 A 5.0851 7.9818 121.0632 50.7647 22.5786 175.2467 109 F 4.4069 9.3015 123.3495 55.7974 41.1693 173.7164 110 P 4.7858 0.0000 0.0000 62.6458 31.7192 177.5641 111 L 4.6158 9.2499 124.8181 57.3340 41.7823 179.4241 112 K 4.2967 8.1695 116.7648 59.2065 32.5355 177.7166 113 N 4.3849 8.0757 116.2649 54.7929 38.6589 174.8263 114 F 4.9416 8.2781 117.2443 55.8779 41.4377 175.2420 115 H 5.1826 8.8854 122.0019 53.8950 31.8103 175.9491 116 A 3.7258 8.8781 125.6906 56.1460 18.1983 180.1400 117 H 4.0111 8.3065 113.6978 59.0001 28.5270 177.9821 118 Q 4.0393 7.9321 118.8953 58.7735 28.7270 178.1610 119 I 3.6053 7.0395 119.6329 64.1242 37.4285 178.1103 120 R 4.3252 7.8640 120.5304 58.8567 29.8729 179.2211 121 H 3.9362 7.8745 115.0797 57.3012 29.9079 176.3230 *123 E 4.2593 8.1460 120.4389 56.1077 31.6138 178.3183 124 Q 4.0704 7.9974 117.4128 58.7186 28.7518 178.6049 125 V 3.4373 7.7896 119.4043 66.0614 31.5571 178.1425 126 V 3.6016 7.8162 117.0897 66.1425 31.1788 177.7112 127 A 4.0799 7.7276 118.6022 54.7343 18.1782 178.2330 128 H 4.6287 7.8129 112.9161 55.4541 28.9960 176.2106 129 G 3.9161 7.9809 109.0448 45.2276 0.0000 174.3674 130 G 4.0899 7.7806 106.4309 45.8587 0.0000 173.7193 131 I 4.2746 8.9729 122.6124 60.1947 38.6682 174.7557 132 C 5.6903 8.8114 126.8577 56.6737 35.1421 172.6466 133 F 5.6716 8.0600 119.2797 56.0595 41.6386 172.2002 134 A 5.3157 9.6085 120.0537 50.3274 22.0254 175.4202 135 I 4.6812 8.9948 123.1309 60.0720 39.0767 174.8054 136 L 4.7955 8.9765 128.3668 52.9316 43.8941 175.4138 137 R 4.9609 9.1280 125.6931 54.7279 32.6125 175.1298 138 F 5.0206 9.2902 126.4243 56.4003 38.4650 176.5005 139 S 4.2776 9.0039 120.0062 60.8402 62.9490 175.9556 140 L 4.2308 8.1868 119.4609 56.5824 41.7768 177.3748 141 L 4.3256 8.0461 115.9314 53.9791 42.4163 175.4598 142 N 4.2112 8.0050 116.0486 54.9574 37.5357 173.1925 143 E 4.7790 8.1772 114.6632 54.7314 33.6875 176.3425 144 T 5.2203 7.9751 118.7719 62.1192 72.7080 172.4452 145 Y 5.2559 9.0950 122.9170 56.1019 42.5720 174.0552 146 L 4.9533 9.0398 124.7358 53.7383 44.3994 174.9808 147 L 5.0318 8.9609 127.8027 52.9052 44.9788 174.9898 148 D 4.9481 9.1544 125.7509 54.8977 41.8957 177.0529 149 A 4.0591 9.3112 127.0764 55.5446 18.2819 180.4019 150 S 4.1367 8.2804 112.2117 62.0805 62.9532 176.6422 151 H 4.3564 8.0513 119.9409 58.4922 28.4046 177.6034 152 L 4.0336 7.9326 121.7414 58.0815 42.0258 178.7952 153 I 3.7450 8.2953 120.0411 64.3138 37.1688 178.2709 154 A 3.9884 8.0481 121.3844 55.0282 18.0522 179.6450 155 W 3.9869 8.1841 116.0153 59.7020 29.3818 178.3544 156 W 4.2848 8.8416 128.6057 60.6752 30.1954 177.9070 157 N 4.7244 8.6903 116.1797 55.7945 38.0088 177.1153 158 K 3.9346 7.9222 120.4665 58.7286 32.2309 178.6199 159 Q 4.1103 7.7241 118.5671 59.1860 28.3268 178.2905 160 E 3.8369 7.3564 117.7897 59.5418 29.5960 178.9220 161 A 4.3618 8.3997 118.6374 53.0905 19.1159 176.4835 162 G 3.2165 7.4270 108.7498 45.0148 0.0000 173.9429 163 G 3.7879 7.3511 110.0520 44.9067 0.0000 174.0094 164 R 4.1629 8.3614 116.5319 56.4546 30.1871 176.3373 165 K 4.7020 8.5428 115.9447 56.2512 33.1346 176.0828 166 S 5.1010 7.8660 113.4181 57.1968 66.3413 173.5215 167 I 3.4002 8.8084 123.1762 59.2087 37.7331 174.2495 168 P 4.4922 0.0000 0.0000 62.3048 32.0906 177.5578 169 K 3.9167 8.5400 121.7755 59.3013 31.9414 179.3475 170 Q 3.8718 7.9783 118.2999 58.9130 28.6151 178.4187 171 E 3.7854 7.8949 119.5004 59.3147 29.6538 178.7592 172 I 3.4914 7.1030 119.2816 64.2662 36.8757 178.3048 173 E 3.7020 8.0991 118.5133 59.2427 29.3547 179.1589 174 R 3.9694 7.9845 117.7953 59.2503 30.3489 176.8770 175 H 4.7100 8.4540 112.6513 55.4961 30.1815 174.2630 176 G 4.1213 7.6238 107.0692 45.1006 0.0000 172.5591 177 H 4.9582 8.8785 116.4774 53.9879 32.8407 173.5660 178 S 4.2949 9.1512 118.8215 58.9736 62.8517 173.1675 179 I 4.5521 8.2009 128.3602 58.5907 38.9311 173.8492 180 P 4.3604 0.0000 0.0000 62.8845 32.3175 175.0961 181 L 5.1769 8.0508 123.1108 52.0853 44.5280 174.7480 182 G 4.0293 8.8973 116.6732 46.0412 0.0000 175.8824 183 Y 4.7671 8.1887 118.7771 55.9981 41.0820 174.1598 184 Q 2.5200 8.3213 118.7111 56.0543 25.6525 170.8458 185 P 4.0866 0.0000 0.0000 60.8165 34.0174 177.2683 186 R 4.3568 8.2880 116.1628 58.1804 29.9098 176.7871 187 L 4.8290 7.5422 119.7047 52.6857 42.8832 177.4017 188 D 4.6840 8.4764 128.5064 53.5167 37.6098 176.0152 189 Y 3.9271 7.5955 121.8677 59.8221 38.7750 177.9125 190 I 3.2038 6.9423 122.0231 63.9510 36.7726 178.4236 191 S 4.0449 7.7278 113.9670 61.2294 62.8239 176.8438 192 V 3.4978 7.2838 121.6206 65.6318 31.2156 177.9860 193 V 3.8200 7.9945 118.4223 66.3136 31.2867 177.5986 194 D 4.7178 8.4076 118.6521 57.8652 40.5246 178.7854 195 N 4.4269 7.8517 115.3936 55.7365 38.5164 177.0915 196 V 3.6954 7.6272 118.6885 64.6764 32.0696 176.6999 197 Y 4.5315 8.2774 113.5473 57.6724 38.8920 175.8024 198 F 4.3965 8.0630 123.2228 57.4905 39.6005 174.9069 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 32 T 8.03 4.33 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 1.22 0.00 0.00 33 L 8.48 3.76 0.00 1.81 1.86 0.94 0.67 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 34 E 9.13 4.04 0.00 2.14 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 2.46 2.53 0.00 35 D 8.06 4.39 0.00 2.94 2.72 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 36 D 8.25 4.37 0.00 2.87 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 37 L 8.61 4.15 0.00 1.93 1.74 0.79 0.55 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 38 N 8.58 4.37 0.00 2.83 3.04 0.00 0.00 7.00 9.10 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 39 A 8.25 4.04 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.05 3.60 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 41 N 8.56 4.56 0.00 2.88 3.24 0.00 0.00 6.74 8.38 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 42 E 8.27 3.94 0.00 2.18 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 2.35 2.35 0.00 43 Y 8.07 4.03 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 44 Y 8.17 4.34 0.00 3.19 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 45 R 8.30 3.94 0.00 2.01 2.00 0.00 3.17 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 46 E 8.30 4.01 0.00 1.82 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 2.35 2.57 0.00 47 R 7.51 4.29 0.00 1.52 1.74 0.00 3.32 0.00 0.00 3.09 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 48 G 7.64 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.06 4.13 1.87 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 1.24 0.77 0.67 0.00 0.00 50 A 7.44 4.59 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.68 4.29 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 1.06 0.00 0.00 0.98 0.00 0.00 52 I 8.19 5.20 2.15 0.00 0.00 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 1.50 0.93 1.26 0.00 0.00 53 H 9.02 5.07 0.00 3.04 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.62 3.72 0.00 1.54 1.54 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.56 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.01 0.43 7.81 55 K 8.52 4.16 0.00 1.47 1.63 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.28 7.81 56 P 0.00 4.28 0.00 2.01 1.96 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 57 T 8.45 3.89 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 1.42 0.00 0.00 58 P 0.00 4.47 0.00 2.13 2.19 0.00 3.67 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 2.11 1.96 0.00 59 V 8.17 4.65 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 0.68 0.00 0.00 0.83 0.00 0.00 60 Q 9.17 4.31 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 61 I 8.31 4.24 1.86 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 1.17 0.62 0.89 0.00 0.00 62 V 8.50 4.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.16 0.00 0.00 63 R 7.63 4.79 0.00 1.87 1.73 0.00 3.20 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 64 V 8.25 4.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 1.06 0.00 0.00 65 D 9.19 4.99 0.00 2.51 2.49 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 66 Y 8.51 4.79 0.00 2.81 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 67 P 0.00 4.72 0.00 2.16 2.09 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 68 K 8.43 3.98 0.00 1.76 1.69 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.53 7.81 69 R 8.49 4.09 0.00 1.80 1.98 0.00 3.39 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 70 S 7.86 4.21 0.00 3.81 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.26 4.18 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 72 A 8.24 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 V 8.43 4.24 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 0.72 0.00 0.00 0.84 0.00 0.00 74 I 8.29 4.50 1.77 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 1.32 0.57 0.79 0.00 0.00 75 T 8.54 4.37 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 76 E 7.79 4.56 0.00 1.93 1.70 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 1.97 2.15 0.00 77 A 7.87 4.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.05 4.59 0.00 2.82 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.74 4.92 0.00 2.99 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 80 R 8.41 4.63 0.00 1.76 1.87 0.00 3.35 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 81 Q 8.51 3.96 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 82 A 8.46 4.23 1.23 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 0.00 0.00 83 S 8.58 4.49 0.00 4.02 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 84 T 7.27 4.48 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 1.07 0.00 0.00 85 T 7.92 4.33 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 86 D 8.73 4.39 0.00 2.54 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 0.00 0.00 0.00 0.00 87 Y 7.83 4.88 0.00 1.43 1.78 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 88 N 7.75 5.62 0.00 2.35 2.74 0.00 0.00 6.63 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 6.94 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.59 4.92 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 0.80 0.00 0.00 1.04 0.00 0.00 91 Y 8.94 4.93 0.00 2.95 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 92 R 9.20 3.46 0.00 1.09 1.48 0.00 2.46 0.00 0.00 2.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.50 0.00 93 G 8.28 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 94 K 8.08 4.71 0.00 2.08 1.83 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.75 1.64 7.81 95 Y 8.60 4.64 0.00 3.16 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 96 I 8.15 4.96 1.92 0.00 0.00 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 1.33 0.96 1.13 0.00 0.00 97 D 8.85 5.10 0.00 2.61 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 8.91 5.62 0.00 2.59 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.99 5.18 0.00 2.22 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 2.49 2.47 0.00 100 A 8.88 5.40 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 9.38 4.88 0.00 1.63 1.81 0.00 1.37 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.09 0.46 7.81 102 E 8.83 5.44 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 103 T 8.77 4.50 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 0.47 0.00 0.00 104 K 8.51 4.40 0.00 1.74 1.82 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.72 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.38 7.81 105 N 7.82 4.44 0.00 2.60 2.89 0.00 0.00 7.01 5.99 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 0.00 106 K 8.62 4.57 0.00 1.75 1.82 0.00 1.66 0.00 0.00 1.93 0.00 0.00 3.14 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.49 7.81 107 T 7.81 4.57 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 1.20 0.00 0.00 108 A 7.98 5.09 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 0.00 109 F 9.30 4.41 0.00 3.18 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 0.00 110 P 0.00 4.79 0.00 2.11 1.94 0.00 2.80 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.00 0.00 111 L 9.25 4.62 0.00 1.89 1.90 1.22 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.17 4.30 0.00 1.94 2.01 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 113 N 8.08 4.38 0.00 2.81 2.56 0.00 0.00 6.81 8.62 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 0.00 114 F 8.28 4.94 0.00 3.23 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.99 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 0.00 133 F 8.06 5.67 0.00 3.35 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 9.61 5.32 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 0.00 135 I 8.99 4.68 1.84 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.65 0.87 0.00 0.00 136 L 8.98 4.80 0.00 1.51 0.96 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 137 R 9.13 4.96 0.00 1.89 1.83 0.00 3.11 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 138 F 9.29 5.02 0.00 3.14 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 0.00 139 S 9.00 4.28 0.00 3.91 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 0.00 140 L 8.19 4.23 0.00 1.70 1.81 0.94 1.02 0.00 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0.00 0.00 0.00 157 N 8.69 4.72 0.00 3.01 2.95 0.00 0.00 6.70 7.09 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 0.00 158 K 7.92 3.93 0.00 2.00 1.78 0.00 1.32 0.00 0.00 1.30 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.32 7.81 159 Q 7.72 4.11 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.49 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 160 E 7.36 3.84 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 2.23 2.38 0.00 161 A 8.40 4.36 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 G 7.43 3.22 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 0.00 163 G 7.35 3.79 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 0.00 0.00 0.00 164 R 8.36 4.16 0.00 2.04 2.06 0.00 3.20 0.00 0.00 3.61 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.18 0.00 165 K 8.54 4.70 0.00 1.80 1.88 0.00 1.56 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.46 7.81 166 S 7.87 5.10 0.00 3.96 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 0.00 167 I 8.81 3.40 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.50 0.02 0.00 0.00 168 P 0.00 4.49 0.00 2.07 1.93 0.00 2.50 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 169 K 8.54 3.92 0.00 1.67 1.58 0.00 0.61 0.00 0.00 1.13 0.00 0.00 2.50 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.07 0.88 7.81 170 Q 7.98 3.87 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 171 E 7.89 3.79 0.00 2.02 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 0.00 1.54 2.13 0.00 172 I 7.10 3.49 1.71 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.28 0.36 0.00 0.00 173 E 8.10 3.70 0.00 1.88 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 2.27 2.11 0.00 174 R 7.98 3.97 0.00 1.90 1.74 0.00 3.13 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 175 H 8.45 4.71 0.00 3.12 2.87 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 G 7.62 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 H 8.88 4.96 0.00 3.03 3.15 0.00 5.64 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 9.15 4.29 0.00 3.94 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 I 8.20 4.55 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.86 0.91 0.00 0.00 180 P 0.00 4.36 0.00 2.05 2.13 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 181 L 8.05 5.18 0.00 1.49 1.57 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 182 G 8.90 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Y 8.19 4.77 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 0.00 184 Q 8.32 2.52 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.14 0.00 185 P 0.00 4.09 0.00 1.72 1.42 0.00 3.52 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 186 R 8.29 4.36 0.00 1.86 2.00 0.00 3.52 0.00 0.00 3.30 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 187 L 7.54 4.83 0.00 1.69 1.64 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 188 D 8.48 4.68 0.00 2.73 2.52 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 0.00 189 Y 7.60 3.93 0.00 3.03 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 0.00 190 I 6.94 3.20 0.74 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.36 0.02 0.00 0.00 191 S 7.73 4.04 0.00 4.07 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 V 7.28 3.50 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 0.88 0.00 0.00 0.94 0.00 0.00 193 V 7.99 3.82 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 1.38 0.00 0.00 0.94 0.00 0.00 194 D 8.41 4.72 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 N 7.85 4.43 0.00 2.74 2.85 0.00 0.00 7.01 8.06 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 0.00 196 V 7.63 3.70 1.61 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 0.05 0.00 0.00 0.51 0.00 0.00 197 Y 8.28 4.53 0.00 3.05 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 0.00 198 F 8.06 4.40 0.00 3.31 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 * Residues marked with a * may have inaccurate shift predictions.