NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.7192 8.4444 120.3763 55.9972 30.9474 172.1938 1 S 4.4042 8.1256 118.9568 54.4240 64.9549 172.2743 2 S 4.2894 8.7125 122.8903 57.8904 64.7493 174.5806 3 G 3.9472 8.2234 111.1061 44.6977 0.0000 172.9168 4 L 4.0542 8.2820 119.1395 54.7318 42.1127 176.8774 5 V 4.0016 8.1572 122.7236 60.9434 32.4990 173.9947 6 P 4.2537 0.0000 0.0000 62.5200 31.8095 175.7103 7 R 4.0331 8.3593 122.1787 58.0276 30.3195 176.8874 8 G 3.8720 8.8687 113.1772 45.0097 0.0000 172.7780 9 S 4.7989 7.3614 113.3387 56.8554 65.7991 172.8020 10 Y 4.9072 8.4970 116.3152 56.0398 42.1529 174.6483 11 L 5.0738 8.6717 122.4052 53.4740 45.1068 175.3930 12 F 5.2879 9.1482 125.9091 55.6169 41.2577 174.9197 13 K 4.7716 8.9402 126.4528 56.6025 33.3048 175.1111 14 Y 5.5103 9.4873 125.5277 56.2591 41.2211 174.7474 15 I 4.8671 8.4810 115.1713 59.2215 41.4085 174.6055 16 I 5.1075 8.8642 123.4905 59.8454 40.0896 174.7754 17 I 4.2002 9.6999 120.5904 58.6179 41.2367 174.5545 18 G 3.9914 6.4172 107.6647 43.2454 0.0000 172.8379 19 D 4.8544 8.2179 120.1326 54.0678 41.1767 176.5392 20 T 4.0564 8.4082 117.5731 65.4509 68.8346 175.6921 21 G 4.0665 8.9174 112.9612 45.7539 0.0000 174.6526 22 V 3.7335 7.2433 111.3403 62.3976 31.9258 177.1400 23 G 4.2698 8.4619 109.1189 45.5459 0.0000 175.6501 24 K 3.9515 8.4694 121.2708 59.5187 32.0144 179.2709 25 S 4.4199 7.9256 116.0753 61.3386 62.8020 176.3793 26 C 4.2883 8.1353 118.9594 62.6117 27.9029 176.0130 27 L 4.1423 8.4859 121.1764 57.6881 41.1908 178.9951 28 L 4.0972 8.0548 120.2426 58.6061 41.9617 179.2235 29 L 4.0062 8.1326 118.6135 57.5394 41.3926 179.2503 30 Q 4.2188 8.4620 121.4087 58.5564 28.7859 178.1941 31 F 4.0278 7.9718 120.8178 61.4718 39.4754 176.9559 32 T 3.7486 7.9548 108.3263 63.6705 68.9422 174.9592 33 D 4.6541 8.1168 118.7735 52.7158 42.6543 175.9877 34 K 4.2780 7.7420 116.8674 56.4281 29.9115 175.3358 35 R 4.7258 7.6315 114.6151 54.3596 34.2554 174.4412 36 F 4.9163 8.7136 121.7262 56.4766 41.4801 174.5587 37 Q 3.9206 7.9160 129.1895 53.4280 29.7696 171.2313 38 P 3.8852 0.0000 0.0000 62.9329 29.9026 176.1185 *44 I 3.9060 8.0490 116.3876 60.3912 39.0031 177.2171 45 G 3.9589 9.1459 108.4123 45.8423 0.0000 173.8290 46 V 4.4379 6.9385 110.6555 59.4570 35.8517 175.1019 47 E 4.1194 8.5103 121.7218 59.2610 29.6806 176.8015 48 F 5.2823 7.0646 110.6159 55.7171 40.8097 173.8969 49 G 4.3035 9.2153 107.0460 44.4964 0.0000 172.1929 50 A 5.5828 8.4546 123.2835 50.1738 22.2207 175.6049 51 R 4.5473 8.7126 119.4631 55.2378 34.1524 173.9839 52 M 4.7430 8.5979 125.8353 55.3522 32.9713 175.8919 53 V 4.5729 9.0484 116.0147 59.4559 36.5210 173.8539 54 N 5.3567 8.6743 120.0548 52.0276 40.9442 173.6340 55 I 4.2324 8.0317 127.0185 60.2648 39.4915 175.1803 56 D 4.3595 9.6080 125.4401 55.2343 39.3729 174.4095 57 G 3.9403 8.1038 104.0657 45.0113 0.0000 174.3373 58 K 4.5165 7.7181 119.5816 54.5676 34.2802 175.5462 59 Q 4.3835 8.4129 120.9053 55.6583 30.0003 174.9729 60 I 4.7817 8.4452 125.4309 59.1744 40.7010 174.6054 61 K 4.6760 8.8178 129.3600 55.5061 33.7404 175.1295 62 L 5.0166 8.9159 128.2063 53.4999 43.7901 175.4395 63 Q 5.1487 9.1085 123.1831 54.4378 31.4609 174.7656 64 I 5.1455 9.3154 126.8407 59.5513 39.1044 175.1538 65 W 5.2634 9.6196 128.6702 56.1534 30.3164 175.6633 66 D 5.2512 9.2329 124.4173 52.8966 42.7802 177.3396 67 T 3.4999 8.7077 113.7617 62.0719 69.1467 174.6593 68 A 3.5072 9.0867 124.2937 53.2725 16.7675 178.2188 69 G 4.0152 8.2898 104.9956 47.6241 0.0000 176.4853 70 Q 3.6649 7.9199 120.7745 58.5479 28.7439 178.5815 71 E 4.3108 8.0069 114.4412 58.3338 29.7464 177.9307 72 S 4.4547 8.2673 113.6146 59.7141 63.3559 174.7917 73 F 5.0041 7.6930 111.8795 56.3915 40.0051 173.4095 74 R 4.4541 7.3582 116.6899 54.8977 32.1898 174.4279 75 S 4.3248 8.1697 112.3857 57.8872 63.7319 173.9506 76 I 3.9073 8.2104 123.8473 61.0546 37.7668 176.3995 77 T 4.1857 8.3305 114.9693 61.4460 69.6644 175.6017 78 R 4.1530 8.7239 122.6150 59.4767 29.8572 179.3207 79 S 4.2502 8.2585 113.0035 61.7054 62.8101 175.5986 80 Y 4.3678 7.8135 121.8310 60.9793 38.7576 177.5203 81 Y 4.0933 8.0396 117.0226 59.5484 38.1415 176.1448 82 R 3.8134 7.2226 120.0263 57.4744 30.5281 176.6919 83 G 3.7900 8.8427 112.1122 45.4233 0.0000 173.2168 84 A 4.0348 7.3276 123.1315 51.9903 18.9676 177.8003 85 A 4.5717 9.1785 124.9514 53.2846 20.5861 177.4534 86 G 3.8954 7.7704 100.7200 44.2543 0.0000 171.7246 87 A 5.1135 8.6574 123.1635 49.8685 22.9229 174.9617 88 L 4.6724 8.6717 122.5578 53.2990 43.6984 175.4381 89 L 4.8433 9.0158 127.5709 53.5755 43.2493 175.0110 90 V 5.0289 8.6834 127.4455 61.1919 34.1115 173.9451 91 Y 4.8721 8.7997 124.8257 55.2694 42.3253 173.3519 92 D 5.1756 9.0111 119.5473 52.3178 42.5226 177.1665 93 I 4.0231 8.7724 120.8434 63.3932 37.7085 177.4373 94 T 4.4500 8.3186 109.7947 61.3875 69.3962 174.9800 95 R 4.4801 8.1111 121.5835 53.5974 32.1577 175.5174 96 R 3.9686 9.3633 125.1151 59.5120 29.7772 178.1118 97 E 3.9698 8.2182 117.3136 59.3420 29.8888 178.8606 98 T 4.7852 8.0746 111.4501 64.0583 69.0375 176.6554 99 F 3.9094 8.1150 123.2782 61.0054 39.2668 176.7353 100 N 4.3243 8.2287 115.2734 55.7654 38.5608 175.9675 101 H 4.7740 7.5139 115.0078 55.8175 28.9931 176.8890 102 L 4.0629 7.4834 122.9370 58.1179 41.2142 179.4666 103 T 4.0268 7.7875 115.1531 66.8083 68.5855 176.7461 104 S 4.0313 7.9725 116.5460 61.3236 62.8556 176.6362 105 W 4.2833 8.0605 121.6561 59.6593 28.8222 178.2819 106 L 4.0712 8.4776 120.6229 58.3139 41.5364 178.8657 107 E 3.9395 8.4646 118.6659 59.4873 29.3759 179.1472 108 D 4.1540 8.0609 118.3958 57.2371 40.9185 178.4934 109 A 3.7531 8.1661 121.2811 55.4066 18.1476 179.8828 110 R 3.9091 7.8663 115.1918 58.8935 30.2315 178.6518 111 Q 3.9463 7.8300 119.0842 58.3643 29.1243 176.1498 112 H 4.7341 7.7444 113.9371 55.3561 30.4099 173.9215 113 S 4.7902 7.5395 114.8400 56.0480 65.5528 173.9673 114 S 4.2233 8.1421 117.5270 58.3970 63.0042 176.1814 115 S 4.1201 8.4804 118.5199 60.9400 62.7645 174.9475 116 N 4.4130 7.7103 116.3848 53.5980 37.6913 174.8276 117 M 4.2340 7.5266 120.3403 56.2199 32.9364 175.5608 118 V 4.0113 8.6841 126.5793 62.2677 32.9590 174.4412 119 I 4.8615 8.3356 128.3181 59.6873 40.0588 173.8544 120 M 4.9117 8.7671 127.3503 53.5146 34.6900 174.3839 121 L 4.8964 9.3650 129.1372 54.9755 43.8987 175.3627 122 I 4.8383 9.1853 126.9055 59.4802 40.7932 174.6975 123 G 3.2570 8.5260 115.2818 44.6348 0.0000 172.6037 124 N 5.1147 8.6429 126.2777 51.4917 41.5945 174.4849 125 K 4.2087 8.5164 117.6246 57.4556 28.7632 178.7514 126 S 4.1672 8.2411 115.5938 60.7018 63.0124 175.1038 127 D 4.4086 7.9843 119.7594 55.3868 39.9328 176.4335 128 L 4.5396 7.7050 122.6573 53.8500 41.6803 177.7673 129 E 3.9340 8.1201 122.2800 59.3465 30.0991 178.5566 130 S 4.2547 8.0681 111.4682 60.3465 63.1470 174.7295 131 R 4.4660 7.9685 119.5584 55.4902 30.3259 175.6605 132 R 4.1042 7.7154 119.2930 57.1299 30.1954 175.5984 133 D 4.8307 9.3515 123.0350 53.4772 43.0284 175.5107 134 V 4.2956 7.5293 117.4458 60.9234 34.0870 175.0505 135 K 4.1986 8.8828 127.1632 55.9537 32.9669 177.8993 136 R 4.2999 9.1467 123.8857 59.1341 29.9128 178.5729 137 E 4.2609 8.2245 117.8927 58.9381 29.1869 179.0145 138 E 4.0494 8.2466 119.6518 59.0273 29.4608 179.3875 139 G 3.3789 7.7046 106.6071 47.1369 0.0000 175.2710 140 E 3.6452 7.6450 121.0055 58.9974 29.4876 179.4667 141 A 3.9843 8.0325 120.6130 55.0293 18.5833 179.3878 142 F 3.9145 8.3158 119.0161 61.3200 39.4417 177.1401 143 A 4.1461 8.2775 120.3704 55.3602 18.1016 179.7868 144 R 3.8504 8.0221 116.5019 59.4626 29.9360 178.8780 145 E 3.8156 8.0256 117.8133 58.7028 29.5499 177.6322 146 H 4.6747 7.4387 112.7360 54.0832 29.8112 174.5019 147 G 3.9074 7.7522 108.4321 47.1084 0.0000 173.5988 148 L 4.9171 8.0181 117.1913 52.5338 45.2025 177.7834 149 I 4.3079 7.9388 120.2617 61.1696 38.7643 174.9293 150 F 5.6058 8.6193 125.7092 57.1160 42.5013 173.6116 151 M 4.3756 8.2447 123.5328 53.6099 36.5996 173.6757 152 E 4.8854 8.1221 120.4524 55.2825 31.5977 175.2317 153 T 4.8349 8.7113 112.8680 59.9207 73.2630 172.7462 154 S 4.5478 8.7350 116.4460 56.3334 64.2939 174.6028 155 A 4.0888 8.6818 131.5669 55.0328 18.6039 178.7825 156 K 2.4800 7.6674 116.3948 59.1281 32.1760 177.8890 157 T 3.9795 7.5527 105.3444 61.2338 69.4428 175.3415 158 A 3.7079 8.0990 124.8663 52.2603 17.4312 176.9165 159 C 4.2077 7.6128 117.6590 60.9587 31.8788 174.0015 160 N 4.7256 9.0101 121.9214 53.9964 36.5561 176.3312 161 V 3.6871 7.9937 119.3081 66.0764 31.6719 177.3389 162 E 4.3137 8.4201 118.6116 59.8078 29.3089 178.5312 163 E 4.0987 8.3449 117.6025 59.2342 29.6095 179.0907 164 A 3.9442 8.1952 120.7966 55.2769 18.4895 179.8097 165 F 4.0337 8.1277 115.9403 60.6822 38.7937 178.2096 166 I 3.8802 8.4217 119.9264 64.5201 37.0139 178.3201 167 N 4.4095 8.7642 117.8298 56.4413 38.3225 177.6554 168 T 3.8089 7.8930 116.6123 66.5984 68.4599 176.5282 169 A 4.3291 8.3123 122.7028 55.2169 18.3410 179.8197 170 K 3.9894 8.5677 117.4850 59.5434 32.0986 179.2441 171 E 3.9181 8.1850 119.4402 59.2321 29.6014 178.8496 172 I 3.3718 7.7056 119.8695 64.4064 36.9686 177.7555 173 Y 3.8656 8.1661 120.4865 60.5509 38.7350 177.9567 174 R 3.8101 8.3102 119.8613 59.5200 30.0919 178.6390 175 K 3.9920 8.0651 118.1207 59.3592 31.9592 179.4210 176 I 3.6712 7.5384 120.0151 64.6023 36.8538 178.6212 177 Q 3.8969 7.7179 117.0484 58.0908 28.5124 177.7573 178 Q 4.4304 7.6204 116.7569 54.7232 29.1372 176.0488 179 G 3.9462 7.7702 107.7952 46.5247 0.0000 174.2984 180 L 4.4600 8.2426 117.3791 54.1259 41.8618 176.6817 181 F 4.3512 7.9959 126.7666 58.2032 39.4456 175.0209 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 0 H 8.44 4.72 0.00 3.04 2.34 0.00 5.66 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 1 S 8.13 4.40 0.00 3.92 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 0.00 2 S 8.71 4.29 0.00 4.04 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.22 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 4 L 8.28 4.05 0.00 1.64 1.62 0.93 0.84 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 5 V 8.16 4.00 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 0.79 0.00 0.00 0.98 0.00 0.00 6 P 0.00 4.25 0.00 2.17 1.95 0.00 3.64 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 2.10 2.08 0.00 7 R 8.36 4.03 0.00 1.74 1.81 0.00 3.24 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 8 G 8.87 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 9 S 7.36 4.80 0.00 3.97 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 10 Y 8.50 4.91 0.00 2.61 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.67 5.07 0.00 1.65 1.61 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 12 F 9.15 5.29 0.00 3.11 3.09 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 13 K 8.94 4.77 0.00 1.82 1.78 0.00 0.62 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 0.81 7.81 14 Y 9.49 5.51 0.00 2.98 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 15 I 8.48 4.87 1.67 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.77 0.03 0.00 0.00 16 I 8.86 5.11 1.99 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.88 0.98 0.00 0.00 17 I 9.70 4.20 1.40 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.90 0.98 0.00 0.00 18 G 6.42 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 19 D 8.22 4.85 0.00 2.96 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 20 T 8.41 4.06 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 21 G 8.92 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.24 3.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.04 0.00 0.00 23 G 8.46 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 24 K 8.47 3.95 0.00 1.81 1.89 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.49 7.81 25 S 7.93 4.42 0.00 3.89 3.93 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 26 C 8.14 4.29 0.00 3.26 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.49 4.14 0.00 2.02 2.03 0.93 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.05 4.10 0.00 1.92 2.02 1.13 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.13 4.01 0.00 1.78 1.70 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 8.46 4.22 0.00 2.36 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.82 0.00 0.00 0.00 0.00 0.00 2.50 2.35 0.00 31 F 7.97 4.03 0.00 2.32 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.95 3.75 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 1.26 0.00 0.00 33 D 8.12 4.65 0.00 2.74 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 34 K 7.74 4.28 0.00 1.85 1.84 0.00 1.53 0.00 0.00 1.50 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.20 7.81 35 R 7.63 4.73 0.00 1.80 1.76 0.00 3.03 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.78 0.00 36 F 8.71 4.92 0.00 2.89 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 37 Q 7.92 3.92 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.98 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 38 P 0.00 3.89 0.00 2.12 1.99 0.00 3.56 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 *44 I 8.05 3.91 1.84 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 1.35 0.58 0.91 0.00 0.00 45 G 9.15 3.96 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 0.00 0.00 0.00 46 V 6.94 4.44 1.75 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 0.59 0.00 0.00 0.80 0.00 0.00 47 E 8.51 4.12 0.00 1.95 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 2.35 2.23 0.00 48 F 7.06 5.28 0.00 3.09 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 49 G 9.22 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 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0.00 1.84 1.86 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.61 1.81 7.81 59 Q 8.41 4.38 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 60 I 8.45 4.78 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.71 -0.07 0.00 0.00 61 K 8.82 4.68 0.00 1.82 1.67 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 L 8.92 5.02 0.00 1.63 1.25 0.70 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.11 5.15 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 64 I 9.32 5.15 2.09 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 1.37 0.81 1.29 0.00 0.00 65 W 9.62 5.26 0.00 3.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 D 9.23 5.25 0.00 2.91 2.60 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.50 1.05 0.00 75 S 8.17 4.32 0.00 4.00 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 76 I 8.21 3.91 2.15 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.99 0.62 0.00 0.00 77 T 8.33 4.19 4.33 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 1.25 0.00 0.00 78 R 8.72 4.15 0.00 1.97 2.08 0.00 3.17 0.00 0.00 3.39 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 79 S 8.26 4.25 0.00 4.20 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 7.81 4.37 0.00 3.01 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 8.04 4.09 0.00 3.23 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 82 R 7.22 3.81 0.00 1.78 1.93 0.00 3.34 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 83 G 8.84 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 84 A 7.33 4.03 1.10 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 0.00 0.00 85 A 9.18 4.57 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 86 G 7.77 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 0.00 0.00 0.00 87 A 8.66 5.11 1.15 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 88 L 8.67 4.67 0.00 1.49 1.45 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 89 L 9.02 4.84 0.00 1.77 1.61 1.01 0.74 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 90 V 8.68 5.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.87 0.00 0.00 91 Y 8.80 4.87 0.00 3.17 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 9.01 5.18 0.00 2.79 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 93 I 8.77 4.02 1.95 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 1.52 0.68 0.90 0.00 0.00 94 T 8.32 4.45 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 95 R 8.11 4.48 0.00 1.93 1.93 0.00 3.19 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 96 R 9.36 3.97 0.00 1.93 1.98 0.00 3.10 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 97 E 8.22 3.97 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 98 T 8.07 4.79 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 1.33 0.00 0.00 99 F 8.11 3.91 0.00 2.78 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 0.00 100 N 8.23 4.32 0.00 2.77 2.80 0.00 0.00 7.02 7.91 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 0.00 101 H 7.51 4.77 0.00 3.51 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.48 4.06 0.00 0.76 0.99 -0.37 0.58 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 0.00 103 T 7.79 4.03 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 1.23 0.00 0.00 104 S 7.97 4.03 0.00 3.77 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 W 8.06 4.28 0.00 3.61 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 0.00 106 L 8.48 4.07 0.00 2.00 1.91 0.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.46 3.94 0.00 2.13 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 2.29 2.43 0.00 108 D 8.06 4.15 0.00 2.99 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 0.00 109 A 8.17 3.75 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 3.91 0.00 1.74 1.94 0.00 3.14 0.00 0.00 3.12 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 111 Q 7.83 3.95 0.00 1.95 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.72 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 112 H 7.74 4.73 0.00 2.59 3.22 0.00 5.67 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.54 4.79 0.00 3.98 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.14 4.22 0.00 3.79 3.61 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 0.00 115 S 8.48 4.12 0.00 3.90 3.93 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 0.00 116 N 7.71 4.41 0.00 2.45 2.66 0.00 0.00 5.97 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 0.00 117 M 7.53 4.23 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 118 V 8.68 4.01 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 0.89 0.00 0.00 0.89 0.00 0.00 119 I 8.34 4.86 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.08 0.95 0.00 0.00 120 M 8.77 4.91 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 121 L 9.36 4.90 0.00 2.04 2.03 1.11 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 122 I 9.19 4.84 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.82 0.76 0.00 0.00 123 G 8.53 3.26 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 0.00 124 N 8.64 5.11 0.00 2.72 2.75 0.00 0.00 7.12 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 0.00 125 K 8.52 4.21 0.00 2.03 1.94 0.00 2.02 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.41 7.81 126 S 8.24 4.17 0.00 3.92 3.94 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 0.00 127 D 7.98 4.41 0.00 2.75 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 0.00 128 L 7.71 4.54 0.00 1.83 1.68 0.94 0.72 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 0.00 129 E 8.12 3.93 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 130 S 8.07 4.25 0.00 4.02 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 0.00 131 R 7.97 4.47 0.00 2.01 1.97 0.00 3.16 0.00 0.00 3.11 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 132 R 7.72 4.10 0.00 1.86 1.90 0.00 3.21 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 133 D 9.35 4.83 0.00 2.65 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 0.00 134 V 7.53 4.30 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 0.08 0.00 0.00 0.80 0.00 0.00 135 K 8.88 4.20 0.00 1.78 1.69 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.32 7.81 136 R 9.15 4.30 0.00 1.98 2.03 0.00 3.38 0.00 0.00 3.44 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 137 E 8.22 4.26 0.00 2.22 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 0.00 2.34 2.25 0.00 138 E 8.25 4.05 0.00 1.76 1.62 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 2.22 2.18 0.00 139 G 7.70 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 0.00 0.00 0.00 140 E 7.65 3.65 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 141 A 8.03 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 F 8.32 3.91 0.00 3.31 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.28 4.15 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.02 3.85 0.00 1.99 1.97 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 145 E 8.03 3.82 0.00 1.78 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 1.71 2.10 0.00 146 H 7.44 4.67 0.00 3.03 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.75 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 0.00 148 L 8.02 4.92 0.00 1.60 1.81 1.16 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 149 I 7.94 4.31 1.89 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 1.13 0.68 0.94 0.00 0.00 150 F 8.62 5.61 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 0.00 151 M 8.24 4.38 0.00 1.75 1.63 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 152 E 8.12 4.89 0.00 1.79 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 0.00 2.28 2.20 0.00 153 T 8.71 4.83 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 154 S 8.73 4.55 0.00 3.80 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 0.00 155 A 8.68 4.09 1.44 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 0.00 0.00 0.00 156 K 7.67 2.48 0.00 0.79 1.38 0.00 1.58 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.05 0.62 7.81 157 T 7.55 3.98 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 1.11 0.00 0.00 158 A 8.10 3.71 1.47 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 0.00 0.00 159 C 7.61 4.21 0.00 2.91 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 0.00 160 N 9.01 4.73 0.00 3.01 2.88 0.00 0.00 7.26 7.68 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 0.00 161 V 7.99 3.69 2.30 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 1.31 0.00 0.00 1.05 0.00 0.00 162 E 8.42 4.31 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.65 0.00 163 E 8.34 4.10 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 164 A 8.20 3.94 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 0.00 165 F 8.13 4.03 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 8.42 3.88 2.04 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.14 0.97 0.00 0.00 167 N 8.76 4.41 0.00 2.87 2.88 0.00 0.00 7.04 6.94 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 0.00 168 T 7.89 3.81 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 0.82 0.00 0.00 169 A 8.31 4.33 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 K 8.57 3.99 0.00 2.00 1.92 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.71 7.81 171 E 8.19 3.92 0.00 2.11 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 2.28 2.36 0.00 172 I 7.71 3.37 1.25 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 1.16 0.51 -0.70 0.00 0.00 173 Y 8.17 3.87 0.00 3.21 3.15 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 0.00 174 R 8.31 3.81 0.00 2.08 2.08 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 175 K 8.07 3.99 0.00 1.99 1.95 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.18 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.66 7.81 176 I 7.54 3.67 1.59 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.83 0.00 0.00 177 Q 7.72 3.90 0.00 1.81 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 1.62 2.14 0.00 178 Q 7.62 4.43 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 179 G 7.77 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 0.00 180 L 8.24 4.46 0.00 1.77 1.71 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 181 F 8.00 4.35 0.00 2.81 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 * Residues marked with a * may have inaccurate shift predictions.