NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7723 8.4249 118.2314 53.1483 37.5713 173.4539 3 L 4.3382 7.9628 128.3040 55.4261 42.5751 175.3647 4 I 4.2761 8.6843 121.3856 59.6034 39.3808 175.6795 5 K 4.5608 8.3414 125.0318 54.6442 33.7771 176.6369 6 E 4.3304 8.9230 120.2292 58.8782 29.6341 175.9429 7 D 5.4817 8.0624 117.4140 52.7875 43.1453 175.7899 8 M 5.0186 9.2033 121.8527 53.8232 37.0049 174.7959 9 R 5.1423 9.0123 120.0973 55.0497 33.3934 175.4874 10 V 5.1761 8.6661 119.3767 61.2876 35.4863 173.9813 11 K 5.2102 9.5418 127.9616 54.6814 35.7462 174.7671 12 V 4.8648 9.3253 126.6448 61.3346 35.0045 173.5406 13 H 5.3435 9.2472 127.0853 54.6297 33.0283 171.4384 14 M 5.1007 9.1368 126.1231 53.8489 34.9508 173.7853 15 E 4.6382 9.0029 126.6491 54.9900 31.4809 175.6497 16 G 3.4836 8.4923 111.1823 44.3302 0.0000 171.2390 17 N 5.4711 9.1320 120.0309 52.5077 42.5312 173.2926 18 V 4.8002 9.1265 127.2055 61.4780 34.2704 175.2815 19 N 4.3449 10.4758 126.9980 54.2451 36.7575 175.2236 20 G 3.9854 8.6096 106.7359 45.5897 0.0000 173.7615 21 H 4.4190 8.3575 120.1292 55.3713 29.8013 174.1210 22 A 4.9419 8.4058 129.2903 52.1071 19.4673 175.9893 23 F 5.0860 8.4067 113.3425 56.2142 42.0349 173.0766 24 V 4.9120 8.7634 119.5790 61.3128 34.7805 174.1340 25 I 5.1713 9.0376 128.3901 59.6411 40.4556 174.3537 26 E 5.2992 9.2763 125.8841 54.8159 32.8298 175.3062 27 G 4.7252 9.0162 108.8667 44.7590 0.0000 171.3509 28 E 5.2803 9.2576 120.6640 54.7354 33.2695 175.2885 29 G 4.2659 9.0941 108.7250 46.2575 0.0000 171.2746 30 K 5.1554 8.9060 117.3241 56.3920 36.4587 174.9479 31 G 4.0852 9.1766 107.8948 45.7328 0.0000 172.2439 32 K 5.4657 9.3598 119.7176 53.1383 33.0785 175.7950 33 P 3.9615 0.0000 0.0000 65.6879 31.3204 177.9545 34 Y 4.3363 7.7704 112.4715 59.4498 38.0747 175.8531 35 E 4.4439 8.1991 117.7719 55.6495 30.9824 176.5285 36 G 3.9821 8.4814 107.7688 45.7900 0.0000 172.7485 37 T 5.2368 7.7469 108.3053 58.7346 72.4073 172.4745 38 Q 4.7929 7.5536 118.8257 55.8757 31.8447 172.8255 39 T 5.2538 8.9127 116.3610 62.0187 73.2088 172.9470 40 A 5.0983 9.2916 126.5404 50.2772 23.2570 174.3989 41 N 5.3543 9.4266 118.5729 51.7105 40.8397 174.1314 42 L 5.4263 9.3510 124.0991 53.3530 45.3519 175.8117 43 T 5.1202 9.0425 118.4706 61.7456 72.6634 173.3449 44 V 4.1449 8.8160 127.6628 63.2711 31.2230 175.6414 45 K 4.4735 9.3864 128.7272 57.7774 33.3495 177.1462 46 E 4.6982 8.0807 117.6937 55.6241 33.9127 176.9604 47 G 4.0622 9.2967 110.1800 45.1530 0.0000 173.5774 48 A 4.1193 7.7360 123.1219 51.3113 18.9925 175.4173 49 P 4.8435 0.0000 0.0000 60.9877 33.0263 175.7587 50 L 3.6952 8.1329 121.3333 54.4697 41.7555 174.9625 51 P 4.6400 0.0000 0.0000 62.3288 31.5636 175.2038 52 F 4.8982 6.5831 111.8780 54.9049 40.8622 173.9948 53 S 3.7718 8.5630 116.4147 58.8456 62.4296 174.8200 54 Y 3.6705 8.1338 128.3106 60.6193 38.0857 177.4861 55 D 4.5561 7.8389 120.3939 57.3405 40.6129 178.6969 56 I 4.5086 7.4784 112.3163 63.5403 37.8766 177.5595 57 L 4.0105 8.0993 121.1841 56.4282 41.6101 178.8957 58 T 4.0673 7.8260 108.5855 64.9744 68.7402 176.2592 59 T 4.0913 8.1686 109.5623 62.8286 69.0969 174.8518 60 A 4.6822 8.1369 125.2793 54.7307 19.5788 178.5973 61 V 3.8468 7.3714 117.2723 62.0806 30.0632 176.6882 *65 N 4.7518 7.6172 118.9131 53.6469 39.0188 174.1958 66 R 3.8548 8.5478 121.8333 56.4682 29.9435 178.2993 67 V 3.4966 7.7300 119.3496 65.7001 31.9852 176.9186 68 F 4.4950 7.6932 120.3758 56.1132 37.2280 174.1009 69 T 4.8393 7.1546 116.6985 61.5126 73.2149 174.5309 70 K 4.2658 9.0014 127.8703 56.3868 32.9630 174.8914 71 Y 4.7141 8.5306 126.2034 55.3521 39.4702 174.5420 72 P 4.4575 0.0000 0.0000 62.2957 32.2180 176.7109 73 E 3.9615 8.9159 120.7366 59.1722 29.4961 177.3135 74 D 4.9027 8.0555 115.5410 52.7923 39.7447 175.6063 75 I 4.5301 7.5533 119.9719 59.0509 39.6334 173.7893 76 P 4.0744 0.0000 0.0000 63.0149 31.7611 175.9419 77 D 3.5287 8.1786 122.5747 52.3825 40.2936 175.7158 78 Y 3.6538 7.7264 127.4210 60.2682 38.8630 177.5504 79 F 3.8514 7.3045 117.8556 60.3303 39.1902 177.8999 80 K 4.1361 8.4335 118.1555 59.6716 31.6194 179.3742 81 Q 4.0025 7.8110 117.5447 58.8683 28.7719 178.9066 82 S 3.9976 7.6587 114.4678 59.5730 63.0302 174.3363 83 F 4.9176 7.1504 121.3138 55.7900 39.7744 174.2327 84 P 4.7183 0.0000 0.0000 65.3761 31.6462 177.6373 85 E 3.9573 8.1480 118.4617 57.5302 30.0923 177.7999 86 G 2.8323 9.4847 106.4028 44.7727 0.0000 170.8930 87 Y 5.1864 7.5144 115.7461 56.4622 41.9574 173.4156 88 S 5.2025 9.2003 113.9760 56.4926 67.2453 172.6910 89 W 5.9239 8.6460 116.0787 55.3222 32.0212 173.6498 90 E 5.3137 9.2062 119.8821 54.8988 33.0802 174.6453 91 R 5.0248 9.3860 124.3933 54.7802 34.3377 173.7278 92 T 4.8614 8.4172 121.3177 61.9733 71.5757 173.0103 93 M 4.3628 8.9921 126.3903 54.0090 34.2735 175.3830 94 T 4.6105 8.4537 122.5988 61.8331 70.1508 174.3151 95 F 4.8800 8.9715 126.4663 56.3675 40.0625 177.3519 96 E 4.1071 9.1397 120.9028 58.6487 29.3872 177.4988 97 D 4.9316 8.2493 118.1050 53.0898 39.7342 177.2061 98 K 4.0509 8.3771 117.5902 56.9568 30.7896 176.9126 99 G 3.2888 7.7992 106.9311 46.4930 0.0000 173.0791 100 I 5.2998 7.9855 122.9806 59.7231 41.8722 173.8918 101 C 5.3718 9.3178 124.5799 58.0125 31.7693 173.0362 102 T 4.8755 8.6463 112.4718 59.9656 71.3517 172.8303 103 I 4.9009 8.8307 126.3142 59.3509 41.5936 174.5564 104 R 4.7620 8.4525 124.0438 54.3267 33.8967 174.4112 105 S 4.5858 7.8793 117.3805 56.2485 66.0569 171.7343 106 D 4.8687 8.7035 126.8119 52.5650 43.4206 174.8098 107 I 4.9457 8.4295 127.5235 59.8777 39.0487 174.8241 108 S 5.4417 9.0162 121.7087 56.3101 66.7562 172.6875 109 L 5.1278 8.6496 121.2318 53.2797 44.8600 175.0835 110 E 4.5447 8.7066 126.4371 55.0717 32.8960 174.9313 111 G 3.6542 8.3280 116.1319 47.3369 0.0000 173.2926 112 D 4.5503 8.5672 124.5231 52.6968 39.6571 174.5445 113 C 5.2188 7.8493 121.0228 57.7775 34.1866 173.0887 114 F 4.9309 8.9355 126.2228 57.5225 40.0670 174.1205 115 F 5.4166 9.6111 126.6033 56.7813 41.4867 174.2059 116 Q 4.3973 8.9427 126.1710 54.3159 30.6235 174.3792 117 N 4.7986 8.3334 124.9842 51.9650 40.3409 173.6120 118 V 4.6486 8.8790 127.1131 60.9754 34.8472 174.4098 119 R 5.0036 8.9595 126.2256 54.3578 33.1327 174.1894 120 F 4.9162 9.1847 126.9261 56.0567 42.4192 173.7226 121 K 5.0624 8.3174 126.4098 54.6306 35.3767 174.9077 122 G 4.8305 9.5681 114.7866 44.8426 0.0000 171.5308 123 T 5.0089 8.4568 112.9636 60.5058 73.0154 173.6128 124 N 4.3435 8.8283 116.3910 54.1030 37.3624 173.4937 125 F 4.4013 7.7834 115.9669 56.2752 39.5228 173.7247 126 P 4.3669 0.0000 0.0000 62.3250 31.6932 175.7668 127 P 4.2667 0.0000 0.0000 65.2136 31.4413 176.9339 128 N 4.7490 8.0386 112.8367 52.9554 38.9621 175.7413 129 G 3.7926 7.8542 106.8014 43.3921 0.0000 173.1905 130 P 4.0399 0.0000 0.0000 65.4652 30.7489 179.0533 131 V 3.2377 7.0830 117.5987 66.2571 31.3741 177.8309 132 M 4.0441 7.6853 116.1312 57.5993 32.0055 177.5864 133 Q 4.2194 7.8928 115.9884 54.3274 30.4770 175.7103 134 K 3.6107 7.4490 118.2843 57.8307 29.4022 174.7490 135 K 4.5874 8.6986 115.2316 56.1730 34.1434 177.5275 136 T 4.5459 7.6723 110.5686 61.2816 69.8646 174.1890 137 L 4.5955 8.8649 124.2114 55.8812 42.8745 176.6670 138 K 4.5320 7.3764 115.1919 55.5042 35.7288 174.1593 139 W 4.8902 8.7251 121.1479 56.5087 29.6901 176.4452 140 E 4.4339 9.5031 123.9875 55.6636 29.6969 175.2374 141 P 4.6950 0.0000 0.0000 63.2099 32.4203 175.1072 142 S 4.8012 8.8735 114.4564 57.0448 67.2058 172.5928 143 T 4.9916 8.3632 116.1827 61.7954 71.0488 173.1375 144 E 4.7170 9.5175 128.0617 54.5662 31.9447 174.2142 145 K 4.7864 9.0620 128.4115 54.7624 34.5033 174.7674 146 L 5.4065 8.6019 127.4018 53.3057 45.1080 175.1947 147 H 5.0872 8.8329 117.1212 54.3255 32.7490 172.0096 148 V 4.4947 8.2188 119.0755 61.5848 32.7240 175.0284 149 R 4.4705 8.6328 127.7067 55.7092 32.5736 174.8541 150 D 4.2509 10.0237 126.0865 55.4468 38.4302 174.6398 151 G 4.0095 8.4967 106.1974 44.8835 0.0000 173.1078 152 L 4.8823 7.6292 118.8154 52.6122 45.7780 175.0770 153 L 4.5058 7.7917 123.1221 54.1143 43.6022 175.4201 154 V 4.8006 8.8133 126.4827 60.9959 34.4293 174.1622 155 G 5.1074 9.0862 115.0032 43.7948 0.0000 171.7335 156 N 5.7192 9.1899 120.9517 51.3642 42.4575 173.6680 157 I 4.7553 8.4954 122.7789 59.8006 41.9109 174.3726 158 N 5.0025 8.8478 124.4906 52.8444 38.3540 174.4909 159 M 4.4882 8.8261 124.0771 54.1277 34.8206 175.4447 160 A 5.2565 8.4647 121.4784 50.8581 23.0779 174.9181 161 L 4.7799 8.9532 123.3304 52.9927 43.7367 176.0694 162 L 4.3549 9.0364 127.3737 55.1246 43.3895 175.5235 163 L 5.0695 8.5502 125.9104 52.4978 44.4224 175.8145 164 E 4.0659 8.9179 124.2606 57.9316 29.8771 177.4184 165 G 3.8211 8.5211 114.0494 45.0245 0.0000 173.8921 166 G 3.8052 7.7106 105.7331 46.2219 0.0000 174.5305 167 G 3.9955 8.7366 105.9110 45.2219 0.0000 171.6235 168 H 5.4511 8.4133 114.4343 53.9719 32.1257 173.1601 169 Y 5.0135 9.0451 123.0684 56.1177 40.8165 174.5357 170 L 5.0899 9.0465 127.0838 53.8411 44.4462 175.3715 171 C 4.9231 8.8417 121.4480 58.1591 35.4425 172.1991 172 D 5.2417 9.2318 126.6335 53.1350 42.6167 175.2492 173 F 5.1360 9.2212 122.6331 55.6344 41.6853 174.6543 174 K 4.9934 8.5757 123.7340 54.9149 35.1331 174.7729 175 T 4.9230 8.9443 123.9339 61.8874 72.2314 173.0421 176 T 4.8109 8.5551 122.1035 62.0513 71.2664 172.5694 177 Y 5.3925 9.4644 125.5316 56.3800 40.6764 174.9332 178 K 4.9577 9.7113 124.7365 54.3761 35.0433 175.2951 179 A 4.3818 9.5251 130.3795 51.9647 18.8998 177.1551 180 K 4.3593 8.4165 119.4978 55.9102 32.3428 176.3062 181 K 4.5093 7.1982 117.2689 55.0143 35.4766 175.5683 182 V 3.6754 8.1562 119.4004 62.8538 31.6925 175.4443 183 V 4.3867 7.8083 119.6642 58.8760 34.9042 175.2050 184 Q 4.0078 8.7133 124.3956 56.2140 29.3390 175.7915 185 L 4.5343 8.3067 125.5404 52.9936 42.9638 174.8007 186 P 4.5583 0.0000 0.0000 62.1188 32.3945 175.6587 187 D 4.5955 8.4419 119.5182 53.2548 41.7245 175.8890 188 A 4.2806 8.4058 121.6179 53.6314 18.7173 176.6757 189 H 4.7155 8.6216 116.5614 54.6731 32.5901 171.9579 190 F 5.3348 9.1417 115.8347 55.8080 42.9456 174.7400 191 V 4.6042 8.6638 121.6905 61.2255 34.0877 173.9988 192 D 5.1330 8.9952 128.6671 53.8339 42.4374 175.3528 193 H 5.4069 9.2169 120.0715 54.0885 33.0315 173.2469 194 R 4.7368 9.0918 121.4286 55.2050 33.1097 173.2795 195 I 5.0561 8.5532 127.0398 59.4414 40.0896 174.5032 196 E 4.9141 9.4921 128.1281 54.6593 34.1265 174.6593 197 I 4.3454 8.6460 125.3153 61.6649 37.0766 175.9538 198 L 4.2741 8.8095 127.9856 56.8936 42.5396 177.1870 199 G 4.1483 7.6331 103.0349 45.8421 0.0000 172.1536 200 N 5.0166 8.1331 115.7040 51.6326 39.5595 173.9641 201 D 4.5679 8.2023 121.2901 52.5998 40.8617 177.4828 202 S 3.9192 8.5733 113.9388 61.4125 62.6724 174.9262 203 D 4.6465 8.0126 118.3138 53.7047 40.7571 176.2958 204 Y 3.8101 7.9909 115.7393 58.9117 36.1406 170.7424 205 N 4.5507 7.7845 120.0680 55.6377 39.9154 175.2402 206 K 5.0025 9.0310 118.7783 54.4312 35.1556 175.8279 207 V 4.6280 8.6125 124.2174 60.9228 35.1605 173.7180 208 K 4.9236 8.9165 129.4482 54.9982 33.9633 174.7778 209 L 5.4006 9.2327 129.0150 53.5531 45.8082 174.3481 210 Y 5.3493 9.3503 125.6021 55.9901 42.9464 173.4603 211 E 5.0758 8.0979 124.2497 54.6754 33.7803 173.3585 212 H 5.3255 9.0368 124.9163 54.3979 33.4149 172.1160 213 A 5.6244 8.9116 125.6649 50.6860 23.0936 175.1424 214 V 4.6589 8.1127 120.6555 61.0471 34.9223 174.2711 215 A 4.7875 8.5285 130.4094 51.4820 19.8262 176.1814 216 R 4.2465 8.4688 115.3065 56.0122 33.4499 173.6937 217 Y 5.2536 8.2336 117.8404 56.4065 40.2063 175.3151 218 S 4.0106 9.2379 114.3367 58.7787 62.5578 172.6453 219 P 4.4695 0.0000 0.0000 63.7743 31.7952 175.8048 220 L 4.5706 7.5097 120.5054 52.3851 42.8216 174.5715 221 P 4.4509 0.0000 0.0000 62.0963 32.2216 176.2132 222 S 4.2261 8.4671 115.8680 58.7952 62.8508 173.7791 223 Q 4.4464 8.5522 123.9675 55.7270 29.1540 175.5531 224 V 4.4345 7.4543 118.4283 60.3397 33.9169 175.0761 225 W 4.4316 8.8990 135.0000 57.7664 30.5701 175.4697 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 N 8.42 4.77 0.00 2.86 2.96 0.00 0.00 6.04 6.90 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 3 L 7.96 4.34 0.00 1.74 1.70 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.68 4.28 1.92 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 1.32 0.59 0.76 0.00 0.00 5 K 8.34 4.56 0.00 1.95 1.81 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.43 7.81 6 E 8.92 4.33 0.00 2.07 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 2.48 2.44 0.00 7 D 8.06 5.48 0.00 2.63 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 8 M 9.20 5.02 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.91 0.00 9 R 9.01 5.14 0.00 1.79 1.92 0.00 3.11 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 10 V 8.67 5.18 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 1.19 0.00 0.00 1.19 0.00 0.00 11 K 9.54 5.21 0.00 1.98 1.94 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.63 1.50 7.81 12 V 9.33 4.86 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 0.93 0.00 0.00 1.01 0.00 0.00 13 H 9.25 5.34 0.00 3.55 3.23 0.00 5.77 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 14 M 9.14 5.10 0.00 2.11 1.90 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 15 E 9.00 4.64 0.00 1.86 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 2.27 2.43 0.00 16 G 8.49 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.13 5.47 0.00 2.75 2.65 0.00 0.00 6.88 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.13 4.80 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 0.46 0.00 0.00 0.85 0.00 0.00 19 N 10.48 4.34 0.00 2.86 2.93 0.00 0.00 7.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.61 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 0.00 0.00 0.00 21 H 8.36 4.42 0.00 3.34 3.55 0.00 5.58 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.41 4.94 1.24 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 0.00 0.00 23 F 8.41 5.09 0.00 3.27 3.24 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 24 V 8.76 4.91 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 0.89 0.00 0.00 1.00 0.00 0.00 25 I 9.04 5.17 2.02 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 1.40 0.86 1.06 0.00 0.00 26 E 9.28 5.30 0.00 1.98 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 2.40 2.35 0.00 27 G 9.02 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.26 5.28 0.00 2.12 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 2.21 2.32 0.00 29 G 9.09 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 0.00 0.00 0.00 0.00 30 K 8.91 5.16 0.00 1.94 1.91 0.00 1.39 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.41 7.81 31 G 9.18 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 9.36 5.47 0.00 1.74 1.87 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.56 1.30 7.81 33 P 0.00 3.96 0.00 1.32 1.49 0.00 3.99 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.75 0.00 34 Y 7.77 4.34 0.00 3.04 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 35 E 8.20 4.44 0.00 2.02 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 2.31 2.40 0.00 36 G 8.48 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 0.00 0.00 0.00 37 T 7.75 5.24 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 1.01 0.00 0.00 38 Q 7.55 4.79 0.00 1.54 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 1.91 2.03 0.00 39 T 8.91 5.25 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 40 A 9.29 5.10 1.21 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 0.00 0.00 0.00 41 N 9.43 5.35 0.00 2.77 2.76 0.00 0.00 6.83 6.61 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 42 L 9.35 5.43 0.00 1.67 1.72 1.17 0.83 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 43 T 9.04 5.12 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 1.25 0.00 0.00 44 V 8.82 4.14 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 0.86 0.00 0.00 1.05 0.00 0.00 45 K 9.39 4.47 0.00 1.70 1.90 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.67 1.81 7.81 46 E 8.08 4.70 0.00 2.02 1.84 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 2.33 2.35 0.00 47 G 9.30 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.74 4.12 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 49 P 0.00 4.84 0.00 2.13 2.02 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.96 0.00 50 L 8.13 3.70 0.00 1.07 0.32 0.37 0.59 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 51 P 0.00 4.64 0.00 2.16 2.05 0.00 3.47 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.80 0.00 52 F 6.58 4.90 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 53 S 8.56 3.77 0.00 3.65 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.13 3.67 0.00 2.56 2.64 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 55 D 7.84 4.56 0.00 2.48 2.35 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 56 I 7.48 4.51 2.34 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.50 0.88 0.00 0.00 57 L 8.10 4.01 0.00 1.26 1.37 0.18 0.06 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 58 T 7.83 4.07 4.49 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 1.62 0.00 0.00 59 T 8.17 4.09 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 60 A 8.14 4.68 1.79 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 61 V 7.37 3.85 2.35 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 0.85 0.00 0.00 1.05 0.00 0.00 *65 N 7.62 4.75 0.00 3.04 2.98 0.00 0.00 7.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.55 3.85 0.00 0.67 0.66 0.00 3.17 0.00 0.00 2.69 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.00 67 V 7.73 3.50 1.05 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 0.07 0.00 0.00 0.82 0.00 0.00 68 F 7.69 4.49 0.00 3.06 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 69 T 7.15 4.84 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 70 K 9.00 4.27 0.00 1.96 1.70 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.72 7.81 71 Y 8.53 4.71 0.00 3.05 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.46 0.00 2.43 2.17 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.82 0.00 73 E 8.92 3.96 0.00 1.99 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 2.33 2.35 0.00 74 D 8.06 4.90 0.00 2.95 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 75 I 7.55 4.53 1.94 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 0.71 0.40 0.76 0.00 0.00 76 P 0.00 4.07 0.00 1.99 1.96 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 77 D 8.18 3.53 0.00 2.36 2.36 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 0.00 78 Y 7.73 3.65 0.00 2.43 1.67 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 79 F 7.30 3.85 0.00 2.92 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 80 K 8.43 4.14 0.00 1.75 1.87 0.00 1.62 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.30 1.61 7.81 81 Q 7.81 4.00 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 82 S 7.66 4.00 0.00 3.91 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 83 F 7.15 4.92 0.00 3.12 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.72 0.00 2.25 2.26 0.00 3.81 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 2.03 0.00 85 E 8.15 3.96 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 2.29 2.37 0.00 86 G 9.48 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 0.00 0.00 0.00 87 Y 7.51 5.19 0.00 3.18 2.88 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 88 S 9.20 5.20 0.00 3.88 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 89 W 8.65 5.92 0.00 3.25 3.38 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 90 E 9.21 5.31 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 91 R 9.39 5.02 0.00 1.77 1.88 0.00 2.67 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.39 0.00 92 T 8.42 4.86 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 1.15 0.00 0.00 93 M 8.99 4.36 0.00 1.49 1.86 0.00 0.00 0.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.91 0.00 94 T 8.45 4.61 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 1.19 0.00 0.00 95 F 8.97 4.88 0.00 3.25 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 9.14 4.11 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 97 D 8.25 4.93 0.00 2.92 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 98 K 8.38 4.05 0.00 2.00 2.05 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.41 7.81 99 G 7.80 3.29 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 0.00 100 I 7.99 5.30 1.75 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 1.18 0.70 0.83 0.00 0.00 101 C 9.32 5.37 0.00 2.81 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.65 4.88 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 1.11 0.00 0.00 103 I 8.83 4.90 2.08 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.98 0.00 0.00 104 R 8.45 4.76 0.00 1.55 1.57 0.00 2.99 0.00 0.00 3.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 105 S 7.88 4.59 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.70 4.87 0.00 2.61 2.39 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 0.00 107 I 8.43 4.95 1.45 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 0.76 0.38 1.22 0.00 0.00 108 S 9.02 5.44 0.00 4.04 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 0.00 109 L 8.65 5.13 0.00 1.56 1.73 -0.05 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.71 4.54 0.00 2.01 1.73 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 2.17 2.21 0.00 111 G 8.33 3.65 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 0.00 0.00 0.00 112 D 8.57 4.55 0.00 2.80 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 0.00 113 C 7.85 5.22 0.00 3.01 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 0.00 114 F 8.94 4.93 0.00 3.23 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 0.00 115 F 9.61 5.42 0.00 3.13 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 Q 8.94 4.40 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 117 N 8.33 4.80 0.00 2.43 2.55 0.00 0.00 6.32 7.27 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 0.00 118 V 8.88 4.65 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 0.90 0.00 0.00 0.86 0.00 0.00 119 R 8.96 5.00 0.00 1.61 1.71 0.00 3.06 0.00 0.00 3.05 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.43 0.00 120 F 9.18 4.92 0.00 3.17 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 0.00 121 K 8.32 5.06 0.00 1.80 1.47 0.00 1.50 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.39 7.81 122 G 9.57 4.83 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 0.00 0.00 0.00 123 T 8.46 5.01 4.20 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 1.20 0.00 0.00 124 N 8.83 4.34 0.00 2.77 2.92 0.00 0.00 6.99 7.02 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 0.00 125 F 7.78 4.40 0.00 3.17 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 0.00 126 P 0.00 4.37 0.00 2.20 2.02 0.00 3.78 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.18 0.00 127 P 0.00 4.27 0.00 2.05 2.13 0.00 3.68 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 2.14 0.00 128 N 8.04 4.75 0.00 2.69 2.80 0.00 0.00 6.88 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.85 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 0.00 130 P 0.00 4.04 0.00 1.68 2.02 0.00 3.41 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.55 0.00 131 V 7.08 3.24 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 0.29 0.00 0.00 0.42 0.00 0.00 132 M 7.69 4.04 0.00 2.01 2.31 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 133 Q 7.89 4.22 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 134 K 7.45 3.61 0.00 1.75 1.67 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.15 1.30 7.81 135 K 8.70 4.59 0.00 1.44 1.67 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.38 7.81 136 T 7.67 4.55 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 1.02 0.00 0.00 137 L 8.86 4.60 0.00 1.46 1.73 0.93 0.78 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 0.00 138 K 7.38 4.53 0.00 1.88 1.91 0.00 1.57 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.50 7.81 139 W 8.73 4.89 0.00 3.24 3.16 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 0.00 140 E 9.50 4.43 0.00 1.98 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 2.62 2.48 0.00 141 P 0.00 4.70 0.00 2.09 2.09 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 142 S 8.87 4.80 0.00 3.72 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 0.00 143 T 8.36 4.99 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 1.34 0.00 0.00 144 E 9.52 4.72 0.00 2.02 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 2.25 2.26 0.00 145 K 9.06 4.79 0.00 1.87 1.64 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.61 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.10 7.81 146 L 8.60 5.41 0.00 1.21 1.33 1.12 0.60 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 0.00 147 H 8.83 5.09 0.00 3.11 3.27 0.00 5.25 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.22 4.49 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 0.80 0.00 0.00 0.92 0.00 0.00 149 R 8.63 4.47 0.00 1.90 1.67 0.00 3.34 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 150 D 10.02 4.25 0.00 2.80 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 G 8.50 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 0.00 0.00 0.00 152 L 7.63 4.88 0.00 1.58 1.76 0.95 0.55 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 0.00 153 L 7.79 4.51 0.00 0.64 0.77 0.78 0.34 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 0.00 154 V 8.81 4.80 1.74 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 0.91 0.00 0.00 0.84 0.00 0.00 155 G 9.09 5.11 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 0.00 156 N 9.19 5.72 0.00 2.60 2.68 0.00 0.00 6.56 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 0.00 157 I 8.50 4.76 1.52 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.78 0.69 0.00 0.00 158 N 8.85 5.00 0.00 2.57 2.78 0.00 0.00 7.02 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 M 8.83 4.49 0.00 1.50 1.71 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.69 0.00 160 A 8.46 5.26 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 0.00 161 L 8.95 4.78 0.00 1.77 1.46 0.71 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 162 L 9.04 4.35 0.00 1.75 1.59 0.77 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.55 5.07 0.00 1.86 1.48 0.90 0.58 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 0.00 164 E 8.92 4.07 0.00 1.89 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 2.29 2.24 0.00 165 G 8.52 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 G 7.71 3.81 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 0.00 0.00 0.00 167 G 8.74 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 0.00 168 H 8.41 5.45 0.00 3.03 3.27 0.00 5.85 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 9.05 5.01 0.00 2.98 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 0.00 170 L 9.05 5.09 0.00 1.63 1.56 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 171 C 8.84 4.92 0.00 2.72 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 0.00 172 D 9.23 5.24 0.00 2.57 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 F 9.22 5.14 0.00 2.81 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 0.00 174 K 8.58 4.99 0.00 1.78 1.54 0.00 1.54 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.25 1.47 7.81 175 T 8.94 4.92 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 176 T 8.56 4.81 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 1.21 0.00 0.00 177 Y 9.46 5.39 0.00 2.77 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 0.00 178 K 9.71 4.96 0.00 1.89 1.78 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.47 7.81 179 A 9.53 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.42 4.36 0.00 1.88 1.80 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.36 7.81 181 K 7.20 4.51 0.00 1.75 1.69 0.00 1.51 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.30 7.81 182 V 8.16 3.68 2.04 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 0.79 0.00 0.00 0.91 0.00 0.00 183 V 7.81 4.39 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 0.55 0.00 0.00 0.31 0.00 0.00 184 Q 8.71 4.01 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 185 L 8.31 4.53 0.00 1.68 1.59 0.94 1.26 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 0.00 186 P 0.00 4.56 0.00 2.18 2.19 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 187 D 8.44 4.60 0.00 2.83 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 0.00 188 A 8.41 4.28 1.18 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 0.00 189 H 8.62 4.72 0.00 3.24 3.29 0.00 5.21 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 9.14 5.33 0.00 2.88 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 V 8.66 4.60 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 0.64 0.00 0.00 0.82 0.00 0.00 192 D 9.00 5.13 0.00 2.52 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 0.00 193 H 9.22 5.41 0.00 2.90 3.07 0.00 5.58 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 R 9.09 4.74 0.00 1.87 1.87 0.00 3.18 0.00 0.00 3.33 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 195 I 8.55 5.06 1.89 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 1.51 1.31 1.03 0.00 0.00 196 E 9.49 4.91 0.00 2.01 1.84 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 2.33 2.43 0.00 197 I 8.65 4.35 1.99 0.00 0.00 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 1.49 0.65 0.99 0.00 0.00 198 L 8.81 4.27 0.00 1.53 1.68 0.87 0.68 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 0.00 199 G 7.63 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 200 N 8.13 5.02 0.00 1.92 2.33 0.00 0.00 6.11 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 0.00 201 D 8.20 4.57 0.00 2.66 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 0.00 202 S 8.57 3.92 0.00 3.94 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 0.00 203 D 8.01 4.65 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Y 7.99 3.81 0.00 2.92 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 0.00 205 N 7.78 4.55 0.00 2.76 2.86 0.00 0.00 6.84 7.89 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 0.00 206 K 9.03 5.00 0.00 1.56 1.62 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.32 7.81 207 V 8.61 4.63 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 0.84 0.00 0.00 0.22 0.00 0.00 208 K 8.92 4.92 0.00 1.85 1.64 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.58 7.81 209 L 9.23 5.40 0.00 1.85 1.53 1.14 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 210 Y 9.35 5.35 0.00 3.05 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 0.00 211 E 8.10 5.08 0.00 1.99 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 2.13 2.22 0.00 212 H 9.04 5.33 0.00 3.24 3.10 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 0.00 213 A 8.91 5.62 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 0.00 214 V 8.11 4.66 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 0.98 0.00 0.00 0.90 0.00 0.00 215 A 8.53 4.79 0.05 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 0.00 216 R 8.47 4.25 0.00 1.82 1.92 0.00 2.69 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 217 Y 8.23 5.25 0.00 2.99 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 0.00 218 S 9.24 4.01 0.00 3.97 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 0.00 219 P 0.00 4.47 0.00 2.19 2.12 0.00 3.66 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 220 L 7.51 4.57 0.00 1.68 1.63 0.90 1.02 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 0.00 221 P 0.00 4.45 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 222 S 8.47 4.23 0.00 3.83 3.80 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 0.00 223 Q 8.55 4.45 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.45 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 224 V 7.45 4.43 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 0.77 0.00 0.00 0.94 0.00 0.00 225 W 8.90 4.43 0.00 3.26 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.