NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7151 8.4093 119.2162 53.0622 39.9289 173.9574 4 Q 4.4531 8.6367 124.3722 56.3226 29.4998 174.5214 5 Y 4.6308 9.3394 119.1664 58.1001 40.1805 175.0280 6 Y 5.6496 7.9940 121.2572 54.9945 42.0699 174.5347 7 G 4.3277 7.2617 110.8302 43.7422 0.0000 171.4467 8 T 4.4109 8.0712 119.2324 61.7533 69.4314 174.5388 9 G 4.0374 8.6598 115.1506 45.5684 0.0000 171.8495 10 R 5.3146 7.6030 121.3794 55.7381 33.2125 174.1241 11 R 4.3247 8.8650 124.3534 56.8823 33.2043 173.4012 12 K 3.8056 9.3206 127.6824 58.3357 29.9141 174.1056 13 S 3.7513 7.8184 107.6669 59.6945 61.7590 171.3718 14 S 5.7160 7.7549 112.1434 55.5999 66.5460 173.5196 15 A 5.2331 8.7225 123.2111 50.4082 22.6001 175.8787 16 A 5.4650 8.4310 121.6812 51.0857 22.3079 176.2571 17 R 4.8531 8.9052 122.6353 56.3840 31.3062 175.9734 18 V 4.6712 7.9871 124.3054 61.1718 33.3025 174.3664 19 F 6.1670 9.6545 127.3134 54.9538 42.0408 174.3924 20 I 5.0468 8.5714 122.8307 59.3783 41.4929 173.9261 21 K 4.9830 10.2369 127.8013 53.8826 37.2044 173.9264 22 P 4.6948 0.0000 0.0000 63.0810 32.1578 176.3081 23 G 4.1004 7.3851 113.1060 45.8846 0.0000 172.1025 24 N 4.4009 8.2948 121.2241 52.9397 38.6914 176.3977 25 G 4.4357 8.5449 115.5916 44.6542 0.0000 172.5751 26 K 4.8899 7.3544 116.4951 54.6907 35.8459 177.8729 27 I 3.8485 8.2927 123.6154 61.6453 38.4284 175.3356 28 V 4.9276 8.8418 126.4712 60.7719 32.0027 171.8786 29 I 4.9743 8.7644 123.1517 58.1875 39.1032 174.4702 30 N 4.1166 9.0691 129.3992 55.1268 35.3271 174.2816 31 Q 3.2655 7.6831 110.2043 56.7513 28.8987 174.4671 32 R 4.3640 7.2988 117.4416 54.7952 31.8360 176.0596 33 S 5.5943 7.9673 114.2675 55.9403 64.3016 173.9267 34 L 3.8770 8.0701 120.3779 58.7951 41.7606 177.6661 35 E 4.4653 7.9056 116.7908 56.3661 30.2553 177.2424 36 Q 4.2339 7.5586 119.5404 59.1439 28.7628 177.9523 37 Y 4.8794 8.0166 108.6659 57.1300 41.4874 174.8719 38 F 5.0754 7.5033 118.4516 57.1376 39.8989 175.9904 39 G 3.6048 8.0124 110.3885 45.7398 0.0000 170.4732 40 R 3.8856 8.4970 129.9817 55.5497 28.0441 176.7424 41 E 4.4136 8.5713 121.5092 56.8764 29.5542 178.2734 42 T 4.2476 8.8373 125.4352 64.2948 69.3759 173.3466 43 A 4.3228 7.0460 123.0222 52.3105 21.7869 175.5302 44 R 4.4174 7.6928 118.0161 57.2844 34.0918 176.1775 45 M 4.1901 7.8621 117.3044 57.9817 32.1964 178.4915 46 V 3.9749 7.8327 111.5176 64.0750 31.7295 177.4102 47 V 3.9769 7.5165 111.0578 62.2217 32.2410 177.4690 48 R 4.1797 7.7388 118.0285 58.5913 30.7437 177.6592 49 Q 4.1330 9.6467 117.4708 58.9327 28.6441 177.1318 50 P 3.5820 0.0000 0.0000 65.3258 31.7776 176.4784 51 L 4.4581 7.6534 115.3668 54.8655 41.9372 178.2941 52 E 4.1870 8.2183 115.6030 57.5310 28.7344 177.0714 53 L 4.5807 7.5360 118.8520 54.9448 42.2957 177.3788 54 V 4.0807 8.7299 106.9562 61.7237 35.6697 169.7912 55 D 4.2293 8.2469 125.9503 54.2609 39.5246 172.0219 56 M 4.7170 7.6598 127.5828 55.0011 33.0312 176.4915 57 V 4.1055 8.5702 115.7512 63.2067 30.1834 173.3605 58 E 4.7659 7.5438 121.1731 56.6530 33.7288 177.0553 59 K 3.9248 7.8117 121.9956 58.2121 32.4596 175.7173 60 L 5.0117 7.3517 116.4518 53.9547 44.4708 175.6726 61 D 5.6306 9.1523 120.4565 53.2660 41.0058 176.6760 62 L 4.6264 8.3688 115.6329 53.8775 43.9907 173.0439 63 Y 4.6849 8.9129 123.1381 56.0038 39.6993 173.4308 64 I 5.2021 8.7185 127.4527 59.6547 40.8149 174.9602 65 T 5.3989 9.0642 121.9427 62.0785 72.5382 173.3568 66 V 5.5016 8.5436 122.6261 61.1489 34.8739 173.5115 67 K 4.5126 8.8005 123.0663 56.3491 35.9492 172.1032 68 G 4.3911 8.8276 120.8454 46.0383 0.0000 170.6581 69 G 4.5074 8.0792 107.7189 44.3236 0.0000 175.2107 70 G 3.6604 9.2982 109.2318 46.4327 0.0000 176.5388 71 I 2.4193 8.1250 117.5914 61.2249 41.2381 176.3701 72 S 4.0871 8.4814 119.7834 60.8528 63.3928 176.4040 73 G 3.4605 8.8087 109.0919 47.8819 0.0000 175.4960 74 Q 3.9680 7.9779 120.5787 58.6002 28.3187 178.7036 75 A 3.9587 8.7326 122.4189 55.4641 18.3457 179.7934 76 G 3.7493 7.8929 103.3497 47.8950 0.0000 175.7287 77 A 3.9401 8.0617 122.9685 54.9570 18.5002 179.3804 78 I 3.7600 8.6802 119.3771 65.2530 37.2387 177.7422 79 R 3.6235 9.0670 119.2428 59.9387 29.6352 177.3935 80 H 4.0669 9.0590 117.7096 59.5733 29.6676 177.4139 81 G 3.4982 8.5783 107.0499 47.8018 0.0000 175.0755 82 I 3.7682 8.0529 123.5121 64.4593 37.2299 178.3100 83 T 3.7854 7.7493 113.2736 65.1422 67.2773 176.1270 84 R 3.9924 8.5208 119.5649 57.8077 29.7787 177.4514 85 A 5.4145 7.7522 120.2056 50.4470 19.9907 175.6858 86 L 4.7944 7.8754 120.0268 55.2161 42.6120 176.5653 87 M 4.8830 7.9944 111.0132 54.4836 32.9214 175.7513 88 E 4.2316 8.4442 120.4932 59.5678 30.3883 177.7942 89 Y 4.2747 8.7148 118.3362 60.1197 38.8031 175.9438 90 D 4.8408 7.9783 116.5640 52.5811 43.9902 174.1117 91 E 4.4334 9.0315 126.0662 56.5410 29.6165 176.2780 92 S 4.8434 9.2665 112.9756 58.6129 62.1269 174.6107 93 L 4.6244 7.8031 119.7060 55.9661 43.1205 178.9344 94 R 3.8050 7.8682 118.6445 59.2613 29.8770 178.2036 95 S 3.7985 8.1587 112.2522 61.7327 62.0603 175.4349 96 E 4.3758 7.5178 115.6704 57.2232 29.6755 177.5504 97 L 4.6521 8.6211 120.4165 55.5768 43.3945 178.8269 98 R 3.9172 7.9477 117.2529 58.9898 30.1671 178.4189 99 K 3.9519 7.4285 115.9227 60.1681 32.4361 178.6755 100 A 3.8255 7.5918 120.2503 52.1924 19.1401 176.9826 101 G 3.5281 7.8071 104.2806 46.9027 0.0000 173.7933 102 F 5.1626 7.7681 117.6840 59.0991 41.4677 178.6449 103 V 4.2390 7.8846 110.7751 61.8607 30.9806 175.5653 104 T 4.4574 7.9606 117.1057 61.6620 70.4538 174.3576 105 R 3.9666 8.5007 127.6358 54.8746 29.1010 175.5047 106 D 4.4997 8.3104 125.4010 53.5702 37.6141 176.8131 107 A 4.5213 8.0975 131.8378 53.0697 18.5116 179.4360 108 R 4.2134 7.8442 120.5037 57.4361 27.9025 176.4023 109 Q 4.3010 7.6563 122.4203 54.7757 30.6085 175.5293 110 V 3.9251 7.9167 113.8320 60.7636 32.3851 175.4289 111 E 4.4123 8.3701 122.8149 54.4756 30.2254 176.2222 112 R 3.9871 8.4317 122.9414 55.6775 30.1122 176.1763 113 K 4.0607 8.5783 122.8875 56.7409 33.0854 175.6682 114 K 4.6597 8.1572 121.5927 54.0155 35.7724 176.1925 115 V 3.8172 8.2513 121.8859 63.6061 31.4673 175.9685 116 G 4.0766 8.9770 113.4210 45.0009 0.0000 173.0331 117 L 4.7584 7.2835 118.6435 52.9454 43.6941 177.0736 118 R 4.0746 8.5987 120.7204 58.0185 29.8198 177.2113 119 K 4.1977 8.0288 110.8891 56.9566 33.0424 175.0359 120 A 4.3942 8.9129 134.0135 53.1386 17.7444 178.7183 121 R 4.3559 9.3494 109.4433 57.2404 34.2600 175.1002 122 R 3.8345 7.9812 118.3491 56.6202 29.7392 174.8726 123 R 4.5500 8.2204 125.8894 54.4056 31.2216 174.4669 124 P 4.4759 0.0000 0.0000 62.2726 32.0599 176.6612 125 Q 4.5465 8.2987 119.6648 56.5431 29.8061 176.7358 126 F 4.8587 8.2691 112.1338 55.5730 37.5314 174.6160 127 S 3.8934 7.8780 117.4668 59.9308 63.6164 174.3427 128 K 3.7762 8.9087 118.6326 56.3000 31.2415 176.1596 129 R 3.9975 7.2306 121.4554 57.2907 30.3720 175.8097 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 3 N 8.41 4.72 0.00 2.70 2.81 0.00 0.00 7.03 6.19 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 4 Q 8.64 4.45 0.00 2.41 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 5 Y 9.34 4.63 0.00 2.99 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 6 Y 7.99 5.65 0.00 2.88 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 7 G 7.26 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 0.00 0.00 0.00 0.00 8 T 8.07 4.41 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 1.24 0.00 0.00 9 G 8.66 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 0.00 0.00 0.00 10 R 7.60 5.31 0.00 1.81 1.74 0.00 3.17 0.00 0.00 3.83 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.85 0.00 11 R 8.86 4.32 0.00 1.95 1.78 0.00 3.41 0.00 0.00 3.72 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 12 K 9.32 3.81 0.00 1.88 1.77 0.00 1.97 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.40 7.81 13 S 7.82 3.75 0.00 4.01 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 14 S 7.75 5.72 0.00 3.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.72 5.23 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 16 A 8.43 5.47 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 17 R 8.91 4.85 0.00 2.05 2.16 0.00 3.40 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.78 0.00 18 V 7.99 4.67 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 0.98 0.00 0.00 0.87 0.00 0.00 19 F 9.65 6.17 0.00 2.70 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 20 I 8.57 5.05 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.43 0.78 0.00 0.00 21 K 10.24 4.98 0.00 1.66 1.67 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.48 7.81 22 P 0.00 4.69 0.00 2.19 2.08 0.00 3.90 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 23 G 7.39 4.10 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 0.00 24 N 8.29 4.40 0.00 2.89 2.98 0.00 0.00 5.82 7.30 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 25 G 8.54 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 0.00 0.00 0.00 0.00 26 K 7.35 4.89 0.00 1.74 1.78 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.43 7.81 27 I 8.29 3.85 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 0.98 0.00 0.00 28 V 8.84 4.93 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 0.78 0.00 0.00 0.87 0.00 0.00 29 I 8.76 4.97 2.00 0.00 0.00 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 1.46 1.83 1.13 0.00 0.00 30 N 9.07 4.12 0.00 2.85 2.76 0.00 0.00 7.25 7.69 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 31 Q 7.68 3.27 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.64 6.83 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 32 R 7.30 4.36 0.00 1.84 1.55 0.00 3.00 0.00 0.00 2.85 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.62 0.00 33 S 7.97 5.59 0.00 4.00 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 34 L 8.07 3.88 0.00 1.77 1.69 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.91 4.47 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 2.30 2.35 0.00 36 Q 7.56 4.23 0.00 2.37 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 37 Y 8.02 4.88 0.00 2.91 2.75 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 38 F 7.50 5.08 0.00 2.85 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 39 G 8.01 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 40 R 8.50 3.89 0.00 2.01 2.07 0.00 3.17 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 41 E 8.57 4.41 0.00 1.90 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 2.22 2.29 0.00 42 T 8.84 4.25 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 1.20 0.00 0.00 43 A 7.05 4.32 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.69 4.42 0.00 1.76 1.82 0.00 3.22 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 45 M 7.86 4.19 0.00 2.33 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 46 V 7.83 3.97 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 0.66 0.00 0.00 0.81 0.00 0.00 47 V 7.52 3.98 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 0.62 0.00 0.00 1.00 0.00 0.00 48 R 7.74 4.18 0.00 1.78 1.96 0.00 3.37 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 1.77 1.58 0.00 49 Q 9.65 4.13 0.00 2.09 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 50 P 0.00 3.58 0.00 1.92 1.86 0.00 3.58 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.86 0.00 51 L 7.65 4.46 0.00 1.71 1.64 0.86 0.86 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 52 E 8.22 4.19 0.00 2.04 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 2.56 2.42 0.00 53 L 7.54 4.58 0.00 1.63 1.66 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.73 4.08 2.02 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 0.56 0.00 0.00 0.92 0.00 0.00 55 D 8.25 4.23 0.00 2.77 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 56 M 7.66 4.72 0.00 2.28 2.13 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 2.46 2.62 0.00 57 V 8.57 4.11 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 0.90 0.00 0.00 0.92 0.00 0.00 58 E 7.54 4.77 0.00 2.09 1.97 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 2.32 2.07 0.00 59 K 7.81 3.92 0.00 1.76 1.82 0.00 1.53 0.00 0.00 1.77 0.00 0.00 3.23 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.37 7.81 60 L 7.35 5.01 0.00 1.85 1.62 0.87 0.57 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 61 D 9.15 5.63 0.00 2.67 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 62 L 8.37 4.63 0.00 1.74 1.62 0.94 0.73 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 63 Y 8.91 4.68 0.00 3.32 3.21 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 64 I 8.72 5.20 1.96 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 1.29 0.66 1.02 0.00 0.00 65 T 9.06 5.40 4.61 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 1.45 0.00 0.00 66 V 8.54 5.50 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.13 0.00 0.00 67 K 8.80 4.51 0.00 1.92 1.68 0.00 1.72 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.55 7.81 68 G 8.83 4.39 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 0.00 0.00 0.00 69 G 8.08 4.51 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 0.00 0.00 0.00 70 G 9.30 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.12 2.42 1.71 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.60 1.06 0.00 0.00 72 S 8.48 4.09 0.00 3.82 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 73 G 8.81 3.46 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 0.00 74 Q 7.98 3.97 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 75 A 8.73 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.89 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 0.00 0.00 0.00 77 A 8.06 3.94 1.39 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 0.00 0.00 78 I 8.68 3.76 1.94 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 1.48 0.67 0.93 0.00 0.00 79 R 9.07 3.62 0.00 1.91 1.99 0.00 2.78 0.00 0.00 2.98 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.50 0.00 80 H 9.06 4.07 0.00 3.28 3.49 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.58 3.50 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 0.00 82 I 8.05 3.77 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 0.85 0.00 0.00 83 T 7.75 3.79 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 1.26 0.00 0.00 84 R 8.52 3.99 0.00 1.77 1.81 0.00 3.21 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.53 0.00 85 A 7.75 5.41 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 86 L 7.88 4.79 0.00 1.67 1.58 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.99 4.88 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 88 E 8.44 4.23 0.00 2.38 2.02 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 2.42 2.40 0.00 89 Y 8.71 4.27 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 90 D 7.98 4.84 0.00 2.85 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 91 E 9.03 4.43 0.00 1.97 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 2.29 2.37 0.00 92 S 9.27 4.84 0.00 3.92 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 93 L 7.80 4.62 0.00 1.85 1.73 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.87 3.81 0.00 1.83 1.97 0.00 3.33 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 95 S 8.16 3.80 0.00 3.88 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 7.52 4.38 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 97 L 8.62 4.65 0.00 1.78 1.78 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.95 3.92 0.00 1.76 1.97 0.00 3.22 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 99 K 7.43 3.95 0.00 1.90 1.92 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.39 7.81 100 A 7.59 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.81 3.53 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 0.00 0.00 0.00 0.00 102 F 7.77 5.16 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 0.00 103 V 7.88 4.24 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 0.74 0.00 0.00 0.96 0.00 0.00 104 T 7.96 4.46 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 1.21 0.00 0.00 105 R 8.50 3.97 0.00 1.69 1.83 0.00 3.36 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 106 D 8.31 4.50 0.00 2.85 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 0.00 107 A 8.10 4.52 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 0.00 108 R 7.84 4.21 0.00 1.79 1.91 0.00 3.15 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 109 Q 7.66 4.30 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.06 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 110 V 7.92 3.93 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 0.72 0.00 0.00 0.93 0.00 0.00 111 E 8.37 4.41 0.00 1.90 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 2.24 2.34 0.00 112 R 8.43 3.99 0.00 2.03 2.06 0.00 3.03 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 1.68 1.62 0.00 113 K 8.58 4.06 0.00 1.73 1.77 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.48 7.81 114 K 8.16 4.66 0.00 1.79 1.62 0.00 1.96 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.60 7.81 115 V 8.25 3.82 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 8.98 4.08 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 0.00 0.00 0.00 117 L 7.28 4.76 0.00 1.75 1.71 0.92 0.86 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 0.00 118 R 8.60 4.07 0.00 1.93 1.99 0.00 3.21 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 119 K 8.03 4.20 0.00 1.87 1.90 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.28 7.81 120 A 8.91 4.39 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 0.00 121 R 9.35 4.36 0.00 1.75 1.90 0.00 3.33 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 122 R 7.98 3.83 0.00 1.88 1.85 0.00 3.22 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 R 8.22 4.55 0.00 1.77 1.79 0.00 3.29 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 124 P 0.00 4.48 0.00 2.10 1.99 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 125 Q 8.30 4.55 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.45 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 126 F 8.27 4.86 0.00 3.12 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 0.00 127 S 7.88 3.89 0.00 3.91 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 0.00 128 K 8.91 3.78 0.00 1.84 1.92 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.47 7.81 129 R 7.23 4.00 0.00 1.90 1.92 0.00 3.32 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.63 0.00