NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 P 4.3680 0.0000 0.0000 61.3625 32.6221 175.9078 23 P 3.8458 0.0000 0.0000 62.8806 31.0406 173.6815 24 G 4.2753 8.0357 108.3631 43.5116 0.0000 173.1572 25 H 4.8184 8.3546 118.7531 54.0772 32.7719 173.8785 26 F 4.2833 8.8107 122.0758 59.6894 37.5740 176.4082 27 K 4.1418 6.6171 118.0231 57.8988 33.0903 176.9373 28 D 4.4723 7.6080 120.4719 53.3457 41.2533 174.3732 29 P 4.6573 0.0000 0.0000 63.3815 32.4448 175.0759 30 K 4.8903 9.3725 119.4554 55.2753 37.4216 175.1717 31 R 5.1107 9.1738 120.0540 53.9699 33.0075 175.9058 32 L 5.1557 8.6118 122.3683 53.3703 43.9368 174.6212 33 Y 4.6769 9.2977 127.0861 56.9331 40.2945 173.5639 34 C 4.1835 8.6303 127.8570 57.4552 32.5145 174.4448 35 K 3.7099 8.3979 128.3523 59.0607 31.9288 176.0237 36 N 4.2268 7.5778 117.5361 54.2375 37.9802 175.2734 37 G 3.7818 8.6858 115.1404 44.3535 0.0000 171.9123 38 G 3.1474 6.8841 106.6023 47.3251 0.0000 173.4839 39 F 4.7861 7.2650 116.4238 55.6112 42.1359 175.7377 40 F 5.1449 9.3049 121.0507 56.1214 40.5706 175.2161 41 L 4.4561 9.2627 126.3712 55.3847 43.2337 175.5115 42 R 4.8955 9.4746 126.6022 54.5721 33.1832 174.0631 43 I 4.5046 8.4468 127.5276 59.6753 38.6533 175.4513 44 H 4.2979 9.0742 125.6786 54.6998 29.2447 175.4278 45 P 4.2380 0.0000 0.0000 65.4709 31.2424 176.9580 46 D 4.6026 8.0709 115.2167 53.0902 39.7553 177.2493 47 G 4.0042 8.5819 110.2038 45.5696 0.0000 174.1358 48 R 4.4305 7.7264 119.2804 55.8504 30.8506 175.4563 49 V 4.8960 8.3116 121.2372 61.1199 34.2473 174.1911 50 D 4.6499 8.6395 126.8573 52.8423 42.5030 173.9892 51 G 4.5242 8.5814 104.5395 45.3465 0.0000 172.6042 52 V 5.0997 8.8132 114.1752 59.9723 36.2389 176.4304 53 R 4.3630 8.9399 119.7102 56.7332 31.0410 176.6428 54 E 4.2412 8.1583 119.6511 55.0980 28.7753 176.8614 55 K 3.5181 8.7000 126.8989 59.4040 32.5921 178.1447 56 S 4.1920 8.1760 113.0501 59.5548 62.6390 173.7538 57 D 4.3672 7.7365 120.2352 54.2801 41.1031 174.6132 58 P 4.3345 0.0000 0.0000 64.8879 31.9542 176.3694 59 H 4.8292 9.4226 117.6604 55.6693 28.4858 176.0297 60 I 4.4872 7.3770 111.8277 59.6488 38.7020 174.6206 61 K 4.2913 7.7759 124.3894 56.3540 32.9481 175.4518 62 L 5.2422 9.2663 127.3669 52.8677 46.0650 175.2680 63 Q 4.7400 8.8202 121.7491 54.4448 31.4534 174.2666 64 L 5.0159 8.6099 126.5516 54.0584 43.5026 176.2226 65 Q 4.6389 8.8550 123.3343 54.6818 32.6668 173.6409 66 A 4.7887 8.8685 129.9678 52.0125 19.3397 176.4765 67 E 4.3080 8.9811 123.9497 57.3918 30.5940 175.0928 68 E 4.5606 7.5031 114.6533 54.9390 31.9330 174.0807 69 R 3.9240 8.5408 119.4290 58.0119 30.1921 176.5642 70 G 4.0332 9.0967 112.4230 45.6062 0.0000 172.2117 71 V 4.9564 7.9821 120.2530 61.0979 34.3534 174.8687 72 V 5.3934 9.2928 120.2194 59.7909 36.6325 174.2811 73 S 5.5094 9.2577 116.0294 55.8751 66.3611 173.2303 74 I 4.6713 8.4111 121.6169 59.6080 40.0772 174.0399 75 K 4.5399 8.7472 129.3985 54.0707 34.5708 175.2762 76 G 3.7347 8.7549 115.7085 46.1425 0.0000 174.1350 77 V 3.5724 8.3609 127.1142 65.9997 31.8804 177.3262 78 S 4.1848 8.1872 112.3042 61.3648 62.2774 175.4876 79 A 3.9972 7.9801 120.7267 53.0835 18.3427 176.4572 80 N 4.1098 8.0931 113.4839 54.8780 38.0743 173.7406 81 R 4.8828 7.4289 112.6056 54.3477 35.1661 174.1950 82 Y 4.8661 9.1702 119.6055 56.0949 40.1223 175.2842 83 L 4.6102 9.2702 126.7340 55.7957 43.5916 175.5436 84 A 5.1696 9.1964 125.3063 51.0984 23.2436 174.5989 85 M 5.1343 8.8004 122.8873 54.3179 34.3857 176.8504 86 K 4.4635 9.3081 130.7365 54.0741 32.9933 174.7362 87 E 3.3635 8.7958 113.3253 59.8360 29.4055 177.0078 88 D 4.7171 8.1046 115.0117 53.1399 39.8706 177.2636 89 G 3.5353 8.7149 110.9406 46.1527 0.0000 174.4162 90 R 4.3158 7.7675 120.2639 56.4385 30.6732 180.3038 91 L 5.0201 6.2757 121.7019 52.8729 44.0560 175.4257 92 L 4.4771 7.8745 120.6917 55.5482 44.0876 172.5611 93 A 5.8016 8.7720 120.2809 49.1443 21.9186 175.5571 94 S 4.7403 8.7562 119.2575 57.0675 65.5412 176.3533 95 K 4.2047 8.8394 122.6431 56.6300 31.9146 178.1761 96 S 4.8017 7.7148 111.3114 56.1679 64.4072 173.3917 97 V 3.3862 7.9494 127.0119 62.6203 31.8584 175.0220 98 T 4.7080 7.7770 115.8899 59.6338 71.7743 173.8205 99 D 4.7440 8.6107 119.2261 56.0772 40.9284 176.9330 100 E 4.2927 8.0590 118.7647 56.6085 29.7431 176.4213 101 C 4.8609 7.5457 116.0761 58.5682 29.5840 172.7992 102 F 5.1382 7.1631 118.3369 55.6498 41.5754 174.4851 103 F 5.2894 9.3099 121.0171 55.6016 43.7030 174.0453 104 F 4.8280 9.6696 122.6179 57.5659 39.8665 173.8962 105 E 4.7477 9.2967 126.2987 54.8384 30.7116 175.1626 106 R 4.6157 8.6630 126.7441 54.4308 33.8296 173.8209 107 L 4.8736 8.5038 128.0588 53.4937 42.7004 175.8126 108 E 4.3658 8.9435 127.0876 55.5587 30.2924 178.6957 109 S 4.1888 8.5485 114.7824 61.4036 63.0317 175.0394 110 N 4.5569 8.1412 115.5687 53.0155 37.3524 174.7282 111 N 4.3180 8.1810 115.2499 54.5597 36.5892 173.2771 112 Y 4.8098 8.1483 115.4703 56.6135 41.4653 174.4523 113 N 5.6930 9.9132 119.1928 52.1917 41.6041 174.4465 114 T 5.3007 8.6294 110.5344 60.3157 72.9863 172.6319 115 Y 5.0849 8.8948 119.9652 56.5873 41.2141 173.9905 116 R 4.9841 8.9187 125.7397 54.0708 32.3249 175.3543 117 S 4.3850 9.0385 121.6157 58.9089 62.7907 174.9932 118 R 3.8494 8.4780 128.0175 58.9240 29.9506 177.7587 119 K 3.7783 7.8445 119.1768 58.6840 32.6964 176.9351 120 Y 4.2853 7.2390 119.9896 55.6187 36.5713 176.4754 121 T 4.1774 8.1885 110.3385 62.2977 69.0477 175.4815 122 S 4.6448 7.6023 114.5822 57.7116 64.5916 173.4227 123 W 5.3864 8.0514 122.3922 55.7313 30.9828 174.8683 124 Y 5.4456 9.1713 121.7533 56.0382 40.4160 175.8205 125 V 4.0309 9.1213 122.4148 63.3351 32.8853 174.8292 126 A 5.2634 8.5136 126.7725 51.3048 22.6663 174.6818 127 L 5.2597 8.3026 118.4380 52.9218 45.1516 177.3168 128 K 4.2792 9.2889 125.0600 55.9579 33.1001 179.0813 129 R 4.1550 8.4095 118.8312 59.0784 29.3750 178.8192 130 T 4.0762 7.6761 105.0888 63.3195 69.3296 175.5368 131 G 2.7254 7.7545 109.8627 44.5089 0.0000 173.2234 132 Q 4.5747 7.2804 118.0962 54.0410 30.5493 174.7709 133 Y 4.7225 7.9997 117.3943 57.2516 39.0451 174.7227 134 K 4.6132 8.5938 121.7148 54.2019 34.3186 175.8312 135 L 4.0735 8.8017 126.3888 55.4655 42.2002 178.5698 136 G 3.5999 9.1701 113.2947 48.6310 0.0000 175.6698 137 S 2.8875 6.7170 112.6405 59.3556 62.9761 174.4922 138 K 4.3200 7.6904 121.3904 56.1578 32.1605 175.7587 139 T 5.1603 7.0263 107.4694 60.9379 70.3574 173.8668 140 G 4.2833 8.1074 109.0659 43.8520 0.0000 172.5587 141 P 3.9499 0.0000 0.0000 64.9529 31.1236 177.4246 142 G 3.9607 7.8441 105.1538 45.0946 0.0000 173.3593 143 Q 4.2277 7.5131 119.3855 54.8659 29.6205 177.2281 144 K 3.8350 8.4100 121.4687 58.9370 32.9079 178.9164 145 A 3.8855 7.8862 121.4593 54.0900 18.4444 178.2321 146 I 4.6473 6.8689 106.2297 60.1399 38.3659 175.4226 147 L 4.6531 7.2545 123.4505 54.0595 42.5661 175.7633 148 F 5.5122 9.7945 122.9372 55.5100 43.3173 174.2026 149 L 5.3914 9.5729 123.0963 52.6472 44.7294 173.8758 150 P 5.0947 0.0000 0.0000 63.2918 32.3563 175.5634 151 M 5.0030 9.4067 121.7664 53.1419 36.7720 174.5909 152 S 4.3495 8.8962 115.2964 58.8260 63.0496 173.6635 153 A 4.5160 8.5295 127.8146 51.8520 18.8035 176.7744 154 K 4.4414 7.8810 119.8338 57.1862 34.4100 177.4500 155 S 4.0842 8.6361 117.6056 58.7258 62.1654 170.9049 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 22 P 0.00 4.37 0.00 2.21 2.13 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 1.90 1.97 0.00 23 P 0.00 3.85 0.00 2.28 2.16 0.00 3.76 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 2.00 2.03 0.00 24 G 8.04 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 0.00 0.00 0.00 0.00 25 H 8.35 4.82 0.00 3.07 3.19 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.81 4.28 0.00 3.16 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 27 K 6.62 4.14 0.00 1.78 1.57 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.07 1.29 7.81 28 D 7.61 4.47 0.00 2.89 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 29 P 0.00 4.66 0.00 2.05 2.15 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 30 K 9.37 4.89 0.00 1.64 1.90 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.61 7.81 31 R 9.17 5.11 0.00 1.87 1.96 0.00 2.53 0.00 0.00 2.56 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 32 L 8.61 5.16 0.00 1.62 1.73 0.32 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 9.30 4.68 0.00 3.03 3.05 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 34 C 8.63 4.18 0.00 2.60 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 35 K 8.40 3.71 0.00 1.26 1.40 0.00 1.02 0.00 0.00 1.18 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.31 7.81 36 N 7.58 4.23 0.00 2.77 2.57 0.00 0.00 7.23 8.15 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 37 G 8.69 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 0.00 0.00 0.00 38 G 6.88 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 0.00 0.00 0.00 39 F 7.26 4.79 0.00 2.93 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 40 F 9.30 5.14 0.00 3.17 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 41 L 9.26 4.46 0.00 1.87 1.59 0.92 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 42 R 9.47 4.90 0.00 1.88 2.01 0.00 3.07 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.61 0.00 43 I 8.45 4.50 1.82 0.00 0.00 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 1.17 0.72 0.86 0.00 0.00 44 H 9.07 4.30 0.00 3.36 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.24 0.00 2.00 2.11 0.00 3.57 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 46 D 8.07 4.60 0.00 2.77 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 47 G 8.58 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 48 R 7.73 4.43 0.00 1.96 1.95 0.00 3.05 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 49 V 8.31 4.90 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 0.91 0.00 0.00 0.89 0.00 0.00 50 D 8.64 4.65 0.00 2.89 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 51 G 8.58 4.52 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 0.00 0.00 0.00 52 V 8.81 5.10 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 0.88 0.00 0.00 1.08 0.00 0.00 53 R 8.94 4.36 0.00 1.84 1.97 0.00 3.03 0.00 0.00 2.93 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.40 0.00 54 E 8.16 4.24 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 55 K 8.70 3.52 0.00 1.72 1.96 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.39 7.81 56 S 8.18 4.19 0.00 3.85 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 57 D 7.74 4.37 0.00 2.75 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 58 P 0.00 4.33 0.00 2.05 2.06 0.00 3.73 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 1.64 1.86 0.00 59 H 9.42 4.83 0.00 3.20 3.48 0.00 5.58 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.38 4.49 1.90 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 1.03 0.00 0.00 61 K 7.78 4.29 0.00 1.81 1.69 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.43 7.81 62 L 9.27 5.24 0.00 1.57 1.43 0.84 0.51 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 63 Q 8.82 4.74 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 64 L 8.61 5.02 0.00 1.66 1.68 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.85 4.64 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 66 A 8.87 4.79 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 67 E 8.98 4.31 0.00 1.95 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 1.47 1.93 0.00 68 E 7.50 4.56 0.00 2.08 1.90 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 2.07 2.19 0.00 69 R 8.54 3.92 0.00 1.79 1.92 0.00 3.32 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 70 G 9.10 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.98 4.96 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 0.85 0.00 0.00 0.70 0.00 0.00 72 V 9.29 5.39 2.33 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 0.90 0.00 0.00 1.22 0.00 0.00 73 S 9.26 5.51 0.00 3.81 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 74 I 8.41 4.67 1.71 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 1.00 0.93 0.70 0.00 0.00 75 K 8.75 4.54 0.00 1.31 1.40 0.00 0.71 0.00 0.00 1.35 0.00 0.00 2.61 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.93 0.40 7.81 76 G 8.75 3.73 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 77 V 8.36 3.57 2.11 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 0.72 0.00 0.00 0.88 0.00 0.00 78 S 8.19 4.18 0.00 3.86 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 79 A 7.98 4.00 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 80 N 8.09 4.11 0.00 2.76 2.84 0.00 0.00 6.95 7.81 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 81 R 7.43 4.88 0.00 1.70 1.65 0.00 3.24 0.00 0.00 3.49 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 82 Y 9.17 4.87 0.00 2.84 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 83 L 9.27 4.61 0.00 1.65 1.58 0.83 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 84 A 9.20 5.17 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 85 M 8.80 5.13 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.66 0.00 86 K 9.31 4.46 0.00 1.68 1.68 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.25 7.81 87 E 8.80 3.36 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.89 0.00 88 D 8.10 4.72 0.00 2.72 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 89 G 8.71 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.77 4.32 0.00 1.50 1.81 0.00 3.25 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 91 L 6.28 5.02 0.00 0.53 1.29 0.87 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.87 4.48 0.00 1.85 1.70 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.77 5.80 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 94 S 8.76 4.74 0.00 3.92 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 95 K 8.84 4.20 0.00 1.80 1.77 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 0.99 7.81 96 S 7.71 4.80 0.00 3.80 3.73 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 97 V 7.95 3.39 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 -0.43 0.00 0.00 98 T 7.78 4.71 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 1.22 0.00 0.00 99 D 8.61 4.74 0.00 2.64 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 0.00 100 E 8.06 4.29 0.00 2.05 2.23 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 2.27 2.25 0.00 101 C 7.55 4.86 0.00 2.23 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 0.00 102 F 7.16 5.14 0.00 2.70 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 0.00 103 F 9.31 5.29 0.00 3.08 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 0.00 104 F 9.67 4.83 0.00 3.08 2.97 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 0.00 105 E 9.30 4.75 0.00 2.08 1.91 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 2.14 1.73 0.00 106 R 8.66 4.62 0.00 1.97 1.75 0.00 3.20 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 107 L 8.50 4.87 0.00 1.69 1.61 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.94 4.37 0.00 2.41 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 2.52 2.44 0.00 109 S 8.55 4.19 0.00 3.99 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 0.00 110 N 8.14 4.56 0.00 3.03 3.07 0.00 0.00 6.11 8.04 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 0.00 111 N 8.18 4.32 0.00 2.82 2.87 0.00 0.00 6.79 6.76 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 0.00 112 Y 8.15 4.81 0.00 3.06 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 0.00 113 N 9.91 5.69 0.00 2.95 2.56 0.00 0.00 6.91 6.93 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 0.00 114 T 8.63 5.30 4.53 0.00 0.00 0.00 0.00 0.00 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 0.00 115 Y 8.89 5.08 0.00 2.75 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 0.00 116 R 8.92 4.98 0.00 1.65 1.89 0.00 3.05 0.00 0.00 2.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.07 0.00 117 S 9.04 4.38 0.00 4.22 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.48 3.85 0.00 1.16 1.63 0.00 3.05 0.00 0.00 2.60 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.20 0.00 119 K 7.84 3.78 0.00 1.47 1.00 0.00 1.37 0.00 0.00 1.44 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.57 0.30 7.81 120 Y 7.24 4.29 0.00 2.92 1.88 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 0.00 121 T 8.19 4.18 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 1.25 0.00 0.00 122 S 7.60 4.64 0.00 4.07 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 0.00 123 W 8.05 5.39 0.00 3.47 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 0.00 124 Y 9.17 5.45 0.00 2.93 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 0.00 125 V 9.12 4.03 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 0.59 0.00 0.00 0.50 0.00 0.00 126 A 8.51 5.26 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 0.00 127 L 8.30 5.26 0.00 1.50 1.49 1.06 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 128 K 9.29 4.28 0.00 1.75 1.65 0.00 1.59 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.32 7.81 129 R 8.41 4.16 0.00 1.83 1.86 0.00 3.26 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 130 T 7.68 4.08 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 131 G 7.75 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 0.00 0.00 0.00 132 Q 7.28 4.57 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 133 Y 8.00 4.72 0.00 3.04 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 0.00 134 K 8.59 4.61 0.00 1.80 1.79 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.37 7.81 135 L 8.80 4.07 0.00 1.54 1.41 0.85 0.95 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 0.00 136 G 9.17 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 0.00 0.00 0.00 137 S 6.72 2.89 0.00 3.62 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 0.00 138 K 7.69 4.32 0.00 1.62 1.88 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.31 7.81 139 T 7.03 5.16 4.45 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 1.47 0.00 0.00 140 G 8.11 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 0.00 0.00 0.00 0.00 141 P 0.00 3.95 0.00 2.20 2.31 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 142 G 7.84 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 0.00 143 Q 7.51 4.23 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 144 K 8.41 3.84 0.00 1.68 1.69 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.25 7.81 145 A 7.89 3.89 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 0.00 146 I 6.87 4.65 1.84 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.96 0.81 0.00 0.00 147 L 7.25 4.65 0.00 1.13 1.16 0.63 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 148 F 9.79 5.51 0.00 3.28 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 0.00 149 L 9.57 5.39 0.00 2.06 1.78 0.83 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 150 P 0.00 5.09 0.00 2.24 2.21 0.00 3.92 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 151 M 9.41 5.00 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.52 0.00 152 S 8.90 4.35 0.00 3.89 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 0.00 153 A 8.53 4.52 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 0.00 154 K 7.88 4.44 0.00 1.73 1.69 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.32 7.81 155 S 8.64 4.08 0.00 3.78 3.69 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