NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3083 8.2644 123.5827 52.1346 19.6599 176.2369 3 R 4.0426 7.6877 122.4786 57.3223 31.0513 175.6488 4 R 4.0375 8.4722 117.6798 57.6618 31.5194 176.9833 5 R 4.5525 7.4724 115.8053 54.7397 32.8805 177.3060 6 R 4.2468 8.3774 119.3154 55.3112 28.3565 173.6285 7 A 3.7116 7.1518 121.1987 49.4870 19.6019 177.1118 8 E 4.1790 8.5297 121.8057 55.0164 30.7939 176.5683 9 V 3.5679 8.2319 121.9088 62.7355 30.8114 175.2104 10 R 3.9021 8.4073 127.0419 56.9034 30.3571 175.6520 11 Q 4.5498 8.4461 123.1129 54.5089 30.4028 175.0182 12 L 4.7841 8.0128 120.7127 52.7053 44.5036 176.4495 13 Q 4.2513 8.2919 119.3742 54.8140 29.3819 174.7540 14 P 4.5226 0.0000 0.0000 62.3794 32.3189 175.6761 15 D 4.5328 8.6093 119.8100 54.2444 41.5080 177.4116 16 L 4.2696 8.7820 125.9896 56.6930 42.0942 177.5545 17 V 4.2203 8.6840 116.6067 64.0880 33.5164 175.7438 18 Y 4.4393 9.7814 115.7045 57.1962 39.3469 177.3539 19 G 4.1777 8.3998 109.1803 45.5690 0.0000 173.6478 20 D 4.7438 7.8042 118.4055 54.4737 42.0271 177.3232 21 V 4.0398 8.3956 117.8765 63.8256 31.9054 178.2478 22 L 3.9226 8.1877 119.7343 58.5029 41.7187 178.8427 23 V 3.0700 9.4725 118.7120 66.3013 31.3862 177.6516 24 T 3.6936 7.2818 114.3333 66.8914 68.4204 175.7071 25 A 3.9025 8.1813 122.3393 55.7355 18.0471 179.4524 26 F 4.1809 8.9867 118.8107 61.3697 39.2244 177.6181 27 I 3.4136 7.8367 119.9174 64.1782 36.6960 177.8865 28 N 4.2162 8.1720 116.3882 56.4209 38.4507 177.3183 29 K 4.0125 7.7921 118.5644 59.2416 32.0810 179.2796 30 I 3.7385 6.7271 118.2740 63.1697 37.4030 176.6623 31 M 3.9536 7.4702 118.8134 55.9664 32.6755 175.4340 32 R 4.6080 7.9521 120.7167 55.2307 32.7090 174.7498 33 D 4.2910 9.3558 116.5515 54.5468 38.9476 174.5800 34 G 4.0176 7.5240 104.3962 46.7668 0.0000 175.3887 35 K 4.5635 7.1242 118.9241 53.3689 33.3277 177.1242 36 K 3.8698 8.1670 123.0733 60.2017 32.3621 176.0075 37 N 4.3898 8.4605 116.8470 55.3135 38.6596 175.7718 38 L 3.7938 8.0588 121.1324 58.5591 42.4882 179.3055 39 A 3.9041 7.9554 120.1356 54.9276 18.3933 179.1219 40 A 3.8955 8.6995 119.4125 55.5011 18.4476 179.6271 41 R 4.0274 8.5976 116.7376 60.3180 30.1402 178.6406 42 I 3.6481 7.9390 118.8558 64.6221 36.8885 177.8605 43 F 3.9902 8.2095 122.1384 61.8095 39.4030 177.2428 44 Y 4.0356 7.8845 115.9695 61.1775 37.8699 177.5662 45 D 4.3871 8.4469 119.7363 57.3807 40.8512 179.0166 46 A 4.0259 8.1463 121.5321 55.2823 18.3387 179.3424 47 C 3.8904 7.6720 115.2117 62.9323 28.1203 176.5612 48 K 3.9976 7.9580 119.4213 59.6351 31.4856 179.3471 49 I 3.7275 7.5738 118.9504 64.3032 37.0678 178.2780 50 I 3.9388 7.6934 120.7587 63.9824 36.7547 178.4712 51 Q 4.1717 7.8228 118.8349 59.0525 28.5285 178.2699 52 E 4.1074 8.1244 117.6407 58.1887 29.7492 177.7653 53 K 4.6808 7.5216 115.8623 55.7177 34.1935 176.0153 54 T 4.6503 8.2046 109.5004 60.4567 71.5821 174.2812 55 G 3.9803 8.6993 112.0432 45.9796 0.0000 173.3631 56 Q 4.5928 7.2865 118.2456 53.8771 30.7494 176.0713 57 E 4.1812 8.5230 120.2720 55.7670 31.0230 176.5852 58 P 4.4364 0.0000 0.0000 65.9476 31.0868 178.6584 59 L 3.9979 8.1183 119.5056 57.8434 41.8087 178.1687 60 K 3.8499 8.3078 119.2651 60.4540 31.9220 177.7397 61 V 3.6525 8.7128 118.5591 65.8164 31.0692 177.8419 62 F 3.9147 8.5891 120.5059 61.5181 40.1233 178.0350 63 K 3.0740 9.1300 113.7850 59.6802 31.7665 178.4213 64 Q 3.7759 7.4963 119.7269 59.6552 29.6449 179.2661 65 A 4.0164 8.0219 121.6144 55.5103 18.4197 179.3703 66 V 3.2753 7.4660 116.2590 66.0429 31.3434 177.6496 67 E 3.9835 7.2564 119.8215 59.4094 29.4405 178.5416 68 N 4.5326 7.7082 115.4621 55.6547 38.9284 176.9546 69 V 4.1227 8.0089 118.5193 63.3005 31.8126 175.9921 70 K 3.9130 7.8190 117.9524 56.1475 32.0122 174.3952 71 P 4.8144 0.0000 0.0000 62.2410 32.1909 176.5567 72 R 4.2725 8.6618 118.5552 57.7296 30.5553 176.4316 73 M 5.1437 7.6762 118.5555 53.9747 36.6014 173.6351 74 E 5.0301 9.0468 120.1351 54.5995 34.2189 174.5225 75 V 4.7515 8.4027 119.7026 60.3391 32.9222 175.1340 76 R 4.6163 8.5147 125.2118 54.1493 32.1642 176.1293 77 S 4.6511 8.6797 118.2890 58.6896 63.3454 174.0646 78 R 4.5285 9.0164 126.4166 55.0723 32.4012 173.8569 79 R 4.2235 8.5051 127.2298 56.1065 30.4626 175.9199 80 V 4.1050 8.0478 125.1405 61.9235 34.4899 174.2826 81 G 3.9597 8.6267 117.0824 44.3088 0.0000 174.9802 82 G 4.3235 7.1945 108.5331 44.0095 0.0000 172.3459 83 A 4.2585 7.1481 120.7470 51.0002 22.2110 176.7336 84 N 4.8605 8.2180 118.1980 51.9806 38.1374 174.5230 85 Y 4.4796 7.7763 120.8966 57.8515 39.6137 175.3688 86 Q 4.9312 8.7629 122.5842 54.7412 28.7236 174.1426 87 V 4.1439 8.5911 124.5546 61.7277 32.7873 172.8867 88 P 5.2202 0.0000 0.0000 62.7321 32.3313 175.3545 89 M 4.9379 9.0860 120.5989 53.2871 35.1643 174.0916 90 E 4.3575 8.8749 119.0688 57.0912 30.6789 176.8495 91 V 4.4082 8.0422 120.5488 60.7220 33.8506 175.4810 92 S 4.2036 8.8053 122.9175 58.0119 63.5356 173.4298 93 P 4.3849 0.0000 0.0000 65.7153 30.7330 178.4399 94 R 3.7725 8.0641 118.1601 59.2197 29.6408 177.9746 95 R 3.8931 7.7336 117.4707 58.7285 29.6057 178.2180 96 Q 3.9160 8.0619 118.3304 58.9856 28.7314 178.7941 97 Q 3.8638 8.1204 120.3669 59.1701 29.0920 178.2780 98 S 3.9815 7.4892 116.0861 61.6077 62.8623 176.7364 99 L 3.1597 8.3233 122.1933 58.0266 41.1979 178.7277 100 A 3.9721 7.9999 120.4991 55.0976 18.1959 179.1788 101 L 4.0494 8.1573 115.2242 57.9138 42.0288 179.7824 102 R 3.8720 7.7925 118.0550 59.6463 29.8670 178.2887 103 W 4.5803 8.6512 118.6924 60.5212 28.9737 177.8160 104 L 4.2700 8.7842 119.2415 57.6526 41.0203 179.2678 105 V 3.4186 8.3466 117.3096 67.0648 31.3052 178.0821 106 Q 4.0389 8.3253 116.6559 58.7173 28.9775 178.0443 107 A 4.1535 9.2054 121.8420 55.3839 18.5335 179.2508 108 A 4.1593 8.8355 120.0474 55.6754 18.2003 179.9682 109 N 4.7423 8.0533 109.4433 54.2439 38.2880 176.3850 110 Q 4.4618 7.9727 122.0815 56.3852 30.5307 176.5305 111 R 4.1155 6.7998 116.7332 55.7990 30.7439 174.9843 112 P 4.3908 0.0000 0.0000 64.8557 31.8790 176.8486 113 E 3.9801 8.2444 117.1805 56.5480 29.5426 177.0789 114 R 4.0179 8.7380 122.9837 59.0138 30.7961 178.1060 115 R 4.1526 7.8955 117.3626 55.4274 31.4483 176.3129 116 A 3.9329 8.8375 126.0696 55.8775 18.2786 179.4456 117 A 3.9887 7.9984 117.7262 54.9830 18.3090 180.0308 118 V 3.3657 7.6309 116.4464 66.2279 31.7114 178.0824 119 R 3.9587 7.7546 117.3829 59.4735 29.9428 179.1191 120 I 3.8085 7.8210 119.1057 64.2862 37.0733 178.3582 121 A 4.0216 8.2684 121.7688 55.7479 18.2275 179.5253 122 H 4.1732 9.0343 115.7583 58.9081 28.6844 177.7267 123 E 4.0204 8.6122 121.5550 58.9324 29.4388 178.8718 124 L 4.0387 8.1164 119.2516 58.4676 41.6832 178.6788 125 M 4.0540 8.8814 119.0270 58.5572 31.9014 178.2279 126 D 4.3768 8.8324 119.2147 57.9529 41.1577 178.7937 127 A 3.9903 8.0768 121.3828 54.8209 18.1516 179.1338 128 A 3.9450 8.1959 118.9190 55.3095 18.6260 179.2315 129 E 4.1091 8.1271 116.2822 60.2405 29.6708 178.0657 130 G 3.9976 7.3624 104.0760 45.0001 0.0000 172.8273 131 K 4.5666 8.6783 119.5303 54.2782 35.5287 176.0934 132 G 3.9750 8.9918 104.7687 45.6565 0.0000 174.5808 133 G 3.8083 8.9830 108.4500 48.5442 0.0000 174.9191 134 A 3.9503 8.3876 122.3485 54.7594 18.2722 179.3653 135 V 3.4946 7.7647 114.0326 65.8563 31.5917 178.2019 136 K 3.7153 8.0550 119.0650 59.7684 31.9456 178.2325 137 K 3.6187 7.8286 118.2086 59.6014 31.9829 178.8888 138 K 3.8317 7.3336 119.1341 59.5304 31.8221 178.3719 139 E 3.9942 7.9089 118.3743 59.2184 29.6119 178.3548 140 D 4.3048 8.4009 118.1819 57.8883 41.0665 178.6791 141 V 3.7038 8.3973 119.5455 65.1443 31.0681 177.4968 142 E 4.3347 8.2827 119.1519 59.0654 29.3755 180.1135 143 R 3.7679 8.2677 118.0078 59.3621 29.5655 178.6042 144 M 4.0270 8.4122 118.6873 57.8575 32.0195 177.0177 145 A 4.3530 7.0374 118.8224 52.6966 19.2460 175.8279 146 E 3.9591 8.7907 120.4651 57.9168 27.7138 176.8536 147 A 4.2201 7.7024 118.5818 53.8806 18.5464 177.7501 148 N 4.9031 7.8728 112.0253 53.0352 41.5175 176.3235 149 R 3.8437 9.0002 121.8764 59.5001 30.3799 178.4800 150 A 3.7404 7.8473 118.9112 55.4352 18.0237 177.4619 151 Y 4.4667 8.0098 111.9774 58.2361 37.8025 176.8768 152 A 4.1462 8.1620 123.6192 53.6481 18.6733 179.2392 153 H 4.7842 7.6398 110.2868 56.0770 28.7104 175.5188 154 Y 5.1306 7.2874 117.9925 58.2564 38.3001 178.1383 155 R 3.8751 8.1765 120.3406 57.4421 30.8055 176.7636 156 W 3.7552 7.9711 131.1729 57.7040 32.2018 173.3982 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 A 8.26 4.31 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 7.69 4.04 0.00 1.86 1.96 0.00 3.24 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 4 R 8.47 4.04 0.00 1.84 1.91 0.00 3.23 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 7.47 4.55 0.00 1.78 1.86 0.00 3.19 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 6 R 8.38 4.25 0.00 1.76 1.85 0.00 3.27 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 7 A 7.15 3.71 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 8 E 8.53 4.18 0.00 2.06 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 2.25 2.34 0.00 9 V 8.23 3.57 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 0.76 0.00 0.00 0.91 0.00 0.00 10 R 8.41 3.90 0.00 1.79 1.83 0.00 3.26 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 1.61 1.67 0.00 11 Q 8.45 4.55 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 12 L 8.01 4.78 0.00 1.58 1.55 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.29 4.25 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 14 P 0.00 4.52 0.00 2.23 2.09 0.00 3.79 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 2.02 1.98 0.00 15 D 8.61 4.53 0.00 3.11 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 16 L 8.78 4.27 0.00 1.77 1.76 0.97 0.98 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 17 V 8.68 4.22 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 0.75 0.00 0.00 0.53 0.00 0.00 18 Y 9.78 4.44 0.00 3.24 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 19 G 8.40 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.80 4.74 0.00 2.83 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 21 V 8.40 4.04 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 0.80 0.00 0.00 0.95 0.00 0.00 22 L 8.19 3.92 0.00 1.78 2.16 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 23 V 9.47 3.07 2.18 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 0.53 0.00 0.00 0.78 0.00 0.00 24 T 7.28 3.69 4.37 0.00 0.00 0.00 0.00 0.00 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 25 A 8.18 3.90 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 26 F 8.99 4.18 0.00 3.27 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 27 I 7.84 3.41 1.86 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.21 0.78 0.00 0.00 28 N 8.17 4.22 0.00 2.73 2.83 0.00 0.00 7.12 7.58 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 29 K 7.79 4.01 0.00 1.72 1.77 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.62 7.81 30 I 6.73 3.74 1.80 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.03 0.80 0.00 0.00 31 M 7.47 3.95 0.00 2.06 1.95 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 2.67 2.47 0.00 32 R 7.95 4.61 0.00 1.95 1.93 0.00 3.16 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 33 D 9.36 4.29 0.00 2.81 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 34 G 7.52 4.02 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 0.00 35 K 7.12 4.56 0.00 1.76 1.69 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.55 7.81 36 K 8.17 3.87 0.00 1.81 1.83 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.50 7.81 37 N 8.46 4.39 0.00 2.84 2.67 0.00 0.00 6.80 6.66 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 38 L 8.06 3.79 0.00 1.79 1.70 0.92 0.89 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 39 A 7.96 3.90 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.70 3.90 1.60 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 0.00 0.00 41 R 8.60 4.03 0.00 2.04 2.07 0.00 3.17 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 42 I 7.94 3.65 2.02 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 1.41 0.89 0.93 0.00 0.00 43 F 8.21 3.99 0.00 2.78 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 44 Y 7.88 4.04 0.00 3.33 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 45 D 8.45 4.39 0.00 2.88 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 46 A 8.15 4.03 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.67 3.89 0.00 3.10 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 48 K 7.96 4.00 0.00 1.92 1.86 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.49 7.81 49 I 7.57 3.73 2.01 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 1.51 0.69 0.91 0.00 0.00 50 I 7.69 3.94 2.03 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 1.55 0.85 0.94 0.00 0.00 51 Q 7.82 4.17 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 52 E 8.12 4.11 0.00 1.94 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 0.00 2.36 2.55 0.00 53 K 7.52 4.68 0.00 1.68 1.78 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.36 7.81 54 T 8.20 4.65 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 1.23 0.00 0.00 55 G 8.70 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 56 Q 7.29 4.59 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 57 E 8.52 4.18 0.00 2.05 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 2.44 2.37 0.00 58 P 0.00 4.44 0.00 2.27 2.55 0.00 3.84 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 2.48 2.26 0.00 59 L 8.12 4.00 0.00 2.18 1.93 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.31 3.85 0.00 1.96 2.10 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.62 7.81 61 V 8.71 3.65 2.32 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 0.98 0.00 0.00 1.04 0.00 0.00 62 F 8.59 3.91 0.00 3.10 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 63 K 9.13 3.07 0.00 1.91 1.61 0.00 1.75 0.00 0.00 1.53 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.79 1.68 7.81 64 Q 7.50 3.78 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 65 A 8.02 4.02 1.36 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 0.00 0.00 66 V 7.47 3.28 1.80 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 0.79 0.00 0.00 0.15 0.00 0.00 67 E 7.26 3.98 0.00 1.93 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 2.30 2.40 0.00 68 N 7.71 4.53 0.00 3.05 2.85 0.00 0.00 6.92 7.72 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 69 V 8.01 4.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.01 0.00 0.00 70 K 7.82 3.91 0.00 1.78 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.38 1.55 7.81 71 P 0.00 4.81 0.00 2.37 2.46 0.00 3.71 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 72 R 8.66 4.27 0.00 1.98 2.10 0.00 3.06 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.61 0.00 73 M 7.68 5.14 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 74 E 9.05 5.03 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 75 V 8.40 4.75 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 0.85 0.00 0.00 1.16 0.00 0.00 76 R 8.51 4.62 0.00 1.55 1.54 0.00 2.91 0.00 0.00 2.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.43 0.00 77 S 8.68 4.65 0.00 3.95 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 78 R 9.02 4.53 0.00 2.47 1.96 0.00 2.80 0.00 0.00 3.08 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.14 0.00 79 R 8.51 4.22 0.00 1.75 1.75 0.00 3.18 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 80 V 8.05 4.11 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.59 0.00 0.00 81 G 8.63 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 82 G 7.19 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.15 4.26 0.95 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 84 N 8.22 4.86 0.00 2.68 2.79 0.00 0.00 7.00 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 7.78 4.48 0.00 2.91 2.41 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 86 Q 8.76 4.93 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 87 V 8.59 4.14 2.50 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 1.32 0.00 0.00 1.39 0.00 0.00 88 P 0.00 5.22 0.00 2.15 2.09 0.00 3.93 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 89 M 9.09 4.94 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 90 E 8.87 4.36 0.00 1.87 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 2.34 2.35 0.00 91 V 8.04 4.41 2.18 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 0.84 0.00 0.00 0.98 0.00 0.00 92 S 8.81 4.20 0.00 4.00 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 93 P 0.00 4.38 0.00 2.25 2.33 0.00 3.86 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 2.04 1.87 0.00 94 R 8.06 3.77 0.00 1.90 1.95 0.00 3.17 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 95 R 7.73 3.89 0.00 1.85 1.96 0.00 3.07 0.00 0.00 3.12 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 96 Q 8.06 3.92 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 97 Q 8.12 3.86 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 98 S 7.49 3.98 0.00 3.90 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.32 3.16 0.00 1.04 0.13 0.71 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.00 3.97 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 0.00 101 L 8.16 4.05 0.00 1.74 1.95 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.79 3.87 0.00 1.92 1.87 0.00 3.04 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 103 W 8.65 4.58 0.00 3.62 3.11 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 0.00 104 L 8.78 4.27 0.00 2.21 2.00 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.35 3.42 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 0.97 0.00 0.00 0.69 0.00 0.00 106 Q 8.33 4.04 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.67 0.00 0.00 0.00 0.00 0.00 2.48 2.74 0.00 107 A 9.21 4.15 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 0.00 0.00 108 A 8.84 4.16 1.49 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 0.00 0.00 109 N 8.05 4.74 0.00 2.99 2.87 0.00 0.00 7.03 7.25 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 0.00 110 Q 7.97 4.46 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.84 0.00 0.00 0.00 0.00 0.00 2.60 2.52 0.00 111 R 6.80 4.12 0.00 1.94 2.24 0.00 3.38 0.00 0.00 3.42 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 112 P 0.00 4.39 0.00 2.19 2.19 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 2.00 1.96 0.00 113 E 8.24 3.98 0.00 2.10 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 2.31 2.33 0.00 114 R 8.74 4.02 0.00 1.83 2.04 0.00 3.21 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 115 R 7.90 4.15 0.00 1.84 1.84 0.00 3.15 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 116 A 8.84 3.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.00 3.99 1.36 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 0.00 0.00 118 V 7.63 3.37 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 0.81 0.00 0.00 0.89 0.00 0.00 119 R 7.75 3.96 0.00 2.13 2.20 0.00 3.42 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 120 I 7.82 3.81 2.08 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 1.70 1.08 1.24 0.00 0.00 121 A 8.27 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 H 9.03 4.17 0.00 3.21 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.61 4.02 0.00 2.27 2.19 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 2.49 2.49 0.00 124 L 8.12 4.04 0.00 2.02 1.78 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.88 4.05 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.63 0.00 126 D 8.83 4.38 0.00 2.89 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 0.00 127 A 8.08 3.99 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.20 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.13 4.11 0.00 2.08 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 0.00 2.52 2.49 0.00 130 G 7.36 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 0.00 131 K 8.68 4.57 0.00 1.77 1.81 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.43 1.34 7.81 132 G 8.99 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 0.00 133 G 8.98 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 0.00 134 A 8.39 3.95 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.76 3.49 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.94 0.00 0.00 136 K 8.06 3.72 0.00 1.89 1.83 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.60 7.81 137 K 7.83 3.62 0.00 0.96 0.74 0.00 1.18 0.00 0.00 1.02 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.13 1.40 7.81 138 K 7.33 3.83 0.00 2.06 2.05 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.33 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.59 1.87 7.81 139 E 7.91 3.99 0.00 2.17 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 2.55 0.00 140 D 8.40 4.30 0.00 2.53 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 0.00 141 V 8.40 3.70 2.29 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 1.13 0.00 0.00 0.86 0.00 0.00 142 E 8.28 4.33 0.00 2.06 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 0.00 2.38 2.55 0.00 143 R 8.27 3.77 0.00 2.04 1.96 0.00 3.11 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 144 M 8.41 4.03 0.00 2.01 2.33 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 2.64 2.89 0.00 145 A 7.04 4.35 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 0.00 146 E 8.79 3.96 0.00 2.17 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 2.28 2.23 0.00 147 A 7.70 4.22 1.36 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 0.00 0.00 148 N 7.87 4.90 0.00 3.02 2.98 0.00 0.00 6.92 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 9.00 3.84 0.00 1.85 1.94 0.00 3.27 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 150 A 7.85 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.01 4.47 0.00 3.10 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 0.00 152 A 8.16 4.15 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 0.00 153 H 7.64 4.78 0.00 3.12 3.31 0.00 5.51 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.29 5.13 0.00 3.08 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 0.00 155 R 8.18 3.88 0.00 1.91 2.14 0.00 3.53 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.68 0.00 156 W 7.97 3.76 0.00 3.80 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00