NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4401 8.3049 120.2773 55.0938 33.4865 175.1098 2 Y 4.5514 8.4785 121.3589 58.1338 39.6216 172.6613 3 A 4.5194 7.9904 121.0817 52.6835 22.4245 174.8301 4 V 4.7923 7.5838 116.6441 62.2413 34.2636 171.6830 5 F 4.5980 7.8841 122.4942 58.4140 42.5918 175.3881 6 Q 4.1073 6.4697 118.8590 53.3516 27.6492 175.8497 7 S 3.5395 8.7899 132.1000 58.9157 61.8356 170.5044 8 G 3.9292 9.6403 115.0163 46.5706 0.0000 171.5020 9 G 4.1010 7.9743 104.9756 43.5354 0.0000 175.3335 10 K 4.5858 8.1982 122.3163 55.6721 31.9086 178.5282 11 Q 4.2424 7.8171 120.0425 56.3469 27.3521 174.6779 12 H 4.6017 8.2272 117.8239 56.0271 31.1513 176.0081 13 R 3.6988 8.0856 120.3410 59.4878 30.0708 176.9763 14 V 3.6377 7.3715 117.4919 62.5234 33.4803 176.5404 15 S 4.2272 9.0971 119.2909 59.8651 60.8916 174.6216 16 E 4.1589 5.9000 117.7298 55.9291 31.2646 177.7170 17 G 3.8694 8.7966 106.4490 44.7130 0.0000 172.7109 18 Q 3.8253 8.1349 111.6490 55.8084 27.0808 172.6128 19 T 4.6022 7.6174 117.5271 60.1726 70.5257 173.8382 20 V 4.0538 8.1021 119.7520 62.0591 32.2593 176.1739 21 R 4.1497 8.9733 123.6096 56.1041 36.4060 173.0069 22 L 4.7430 8.5056 129.2267 55.4301 44.4359 175.4142 23 E 4.6557 8.5280 120.5685 54.8038 34.1219 176.4293 24 K 3.9599 9.0838 119.6913 57.4691 31.0140 176.5387 25 L 4.2363 8.4478 130.0839 55.6039 49.8100 175.2594 26 D 4.5113 8.9286 122.9695 55.4867 39.9506 177.8442 27 I 3.9420 7.0009 115.8994 59.9001 40.4284 173.0701 28 A 4.3474 8.5712 130.3948 52.3764 19.2274 176.1539 29 T 4.1945 8.3410 114.3719 61.7703 71.4032 173.7336 30 G 4.0419 8.2008 105.7231 43.0859 0.0000 172.9426 31 E 3.3547 8.4246 123.2468 57.0296 28.4635 173.9966 32 T 3.7673 7.5750 120.9736 63.6298 69.4900 172.2326 33 V 4.3873 7.7725 118.4865 61.7494 33.6845 173.6736 34 E 3.6443 8.2287 118.4715 57.6779 26.1790 173.8094 35 F 4.5269 7.8658 117.8804 55.5013 39.7258 174.9746 36 A 4.4913 8.2446 125.5093 51.4847 18.7603 179.0131 37 E 4.1328 9.1643 122.8423 56.1754 31.6756 175.6962 38 V 4.4494 7.6512 111.0790 59.2141 35.3788 175.6593 39 L 5.2555 8.1006 120.9963 55.1496 41.0474 176.8202 40 M 4.3202 8.6655 117.3929 55.2311 32.7934 175.7719 41 I 3.5956 7.7387 111.3189 62.2220 37.8586 177.8009 42 A 4.1103 8.5866 128.5868 51.9416 17.5333 177.9728 43 N 4.0882 10.6722 116.4579 55.2697 38.7191 174.5729 44 G 4.0416 7.9216 105.9360 44.1039 0.0000 174.1862 45 E 3.6383 7.7083 114.7442 56.7625 27.9554 174.5711 46 E 4.3221 9.1281 117.9229 56.9533 30.7619 176.0082 47 V 4.4764 7.9344 122.3503 59.6833 32.4966 171.4205 48 K 4.1693 8.2163 118.8704 58.7787 32.2934 176.8212 49 I 4.5652 7.2891 120.8284 61.0349 37.7958 177.9898 50 G 3.8934 7.8988 109.2874 44.6647 0.0000 172.9333 51 V 3.6914 7.7247 122.1849 62.6633 32.6424 173.9728 52 P 4.4225 0.0000 0.0000 65.1647 31.2196 175.8913 53 F 4.8438 7.8166 117.6606 55.6226 42.5435 175.3396 54 V 3.4935 5.4500 123.6012 65.6443 31.6026 176.2885 55 D 4.7995 7.8317 119.8186 54.2253 39.6063 178.6140 56 G 4.3926 6.9673 106.8264 42.9266 0.0000 172.0073 57 G 4.0767 8.6039 111.6207 45.5243 0.0000 171.6911 58 V 3.8064 8.0391 120.7546 60.2657 33.0702 176.2969 59 I 2.9609 8.3122 105.7784 62.4309 35.4140 174.1136 60 K 4.3581 7.8077 125.1400 56.0229 34.8519 174.3925 61 A 4.9506 8.3418 125.5705 50.2719 22.5400 174.6280 62 E 4.5847 8.3907 117.7235 54.9294 32.5445 175.4207 63 V 4.2583 8.0355 122.0935 61.6309 33.1595 175.6435 64 V 4.1384 8.2504 121.4508 61.6738 31.6140 176.1653 65 A 4.2191 8.7490 126.5277 53.0131 20.2428 176.9515 66 H 3.8554 8.2747 109.5857 56.8069 25.2001 175.5473 67 G 3.6935 8.0501 110.7885 47.9740 0.0000 173.4441 68 R 4.4183 7.7334 121.3523 54.7691 33.0595 174.6266 69 G 4.0996 8.4279 115.3345 43.3630 0.0000 171.5355 70 E 4.1580 7.5061 122.1687 56.8034 33.1480 175.5912 71 K 4.0362 8.8492 122.4548 57.0793 32.1206 174.6416 72 V 4.2251 7.0032 114.7015 58.9986 32.5004 176.0909 73 K 4.0454 8.4506 126.2164 56.2548 37.1345 174.1632 74 I 3.0470 7.9314 117.0290 61.5137 37.3841 173.3528 75 V 4.2233 8.0586 119.3470 59.8417 34.1385 173.5078 76 K 3.4126 8.3916 126.5658 56.1614 32.3385 174.5105 77 F 3.6480 8.4773 131.0897 57.9096 36.3004 174.6447 78 R 4.7088 8.0342 122.2691 54.8445 33.6269 175.5117 79 R 4.5478 8.5906 123.0043 55.4012 32.7856 175.3734 80 R 4.6098 7.8396 111.8634 55.2507 31.2656 174.4535 81 K 4.5142 8.4978 131.3254 57.0266 30.6908 177.9294 82 H 4.4663 7.8089 124.8550 56.9552 30.8248 173.6590 83 Y 4.7544 6.6600 113.6064 57.8163 39.1922 174.4691 84 R 4.3686 7.4025 115.8942 56.2510 31.9834 173.5814 85 K 4.5042 7.8654 116.3328 56.4476 33.3137 175.7587 86 Q 4.0676 8.3567 120.2449 56.4068 28.2546 174.8718 87 Q 3.8547 7.4637 121.9454 57.4173 28.2796 175.1423 88 G 4.3898 7.8934 122.7020 46.0532 0.0000 169.0093 89 H 4.4570 7.4407 123.9817 55.3846 32.4827 173.3187 90 R 4.1349 8.2801 118.7146 55.8573 32.4778 173.6217 91 Q 3.8559 8.4827 126.5907 54.2548 30.8312 173.0804 92 W 4.5448 7.3358 121.4934 54.2459 31.5513 173.5282 93 F 5.3574 7.5941 112.1603 55.3368 40.5445 175.7229 94 T 4.8246 8.9086 109.8272 61.7826 69.4230 171.2961 95 D 4.7746 9.3518 130.3560 52.8299 40.3789 174.1594 96 V 3.9075 9.0508 118.8362 60.7704 31.6689 176.0514 97 K 4.0774 7.9257 124.3504 53.6873 32.7846 174.6611 98 I 3.6916 7.8228 121.5549 61.4126 37.3684 174.4011 99 T 4.1189 8.3987 112.5382 60.3847 70.6688 170.8580 100 G 4.2774 8.2166 117.3538 45.3031 0.0000 172.7716 101 I 3.4975 8.3578 125.3739 63.9430 36.7875 176.8237 102 S 4.6058 8.2056 116.6528 57.1762 67.7332 174.2472 103 A 4.6114 8.4900 123.7494 52.1952 18.0633 177.6738 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 1 M 8.30 4.44 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.68 0.00 2 Y 8.48 4.55 0.00 3.07 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 3 A 7.99 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 4 V 7.58 4.79 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 1.03 0.00 0.00 0.96 0.00 0.00 5 F 7.88 4.60 0.00 2.99 2.28 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 6 Q 6.47 4.11 0.00 1.42 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 5.84 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 7 S 8.79 3.54 0.00 4.24 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 0.00 8 G 9.64 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 0.00 0.00 0.00 9 G 7.97 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 10 K 8.20 4.59 0.00 1.67 1.77 0.00 1.60 0.00 0.00 2.30 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.45 7.81 11 Q 7.82 4.24 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.16 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 12 H 8.23 4.60 0.00 3.46 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.09 3.70 0.00 1.71 1.84 0.00 3.28 0.00 0.00 2.99 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 14 V 7.37 3.64 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.88 0.00 0.00 15 S 9.10 4.23 0.00 4.13 3.70 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 16 E 5.90 4.16 0.00 2.40 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 0.00 2.25 2.25 0.00 17 G 8.80 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 18 Q 8.13 3.83 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 19 T 7.62 4.60 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 1.19 0.00 0.00 20 V 8.10 4.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.91 0.00 0.00 21 R 8.97 4.15 0.00 1.65 1.58 0.00 3.20 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 22 L 8.51 4.74 0.00 1.58 1.47 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.53 4.66 0.00 2.02 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 2.17 2.29 0.00 24 K 9.08 3.96 0.00 1.73 1.58 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.42 7.81 25 L 8.45 4.24 0.00 1.57 1.44 0.96 1.02 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 26 D 8.93 4.51 0.00 2.79 2.84 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 27 I 7.00 3.94 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 1.36 0.46 0.92 0.00 0.00 28 A 8.57 4.35 1.27 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 29 T 8.34 4.19 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 30 G 8.20 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 31 E 8.42 3.35 0.00 2.04 1.64 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 2.23 2.33 0.00 32 T 7.58 3.77 4.35 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 1.21 0.00 0.00 33 V 7.77 4.39 2.60 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 1.05 0.00 0.00 0.98 0.00 0.00 34 E 8.23 3.64 0.00 2.21 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 2.26 2.42 0.00 35 F 7.87 4.53 0.00 2.88 3.03 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 36 A 8.24 4.49 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 37 E 9.16 4.13 0.00 1.19 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 2.44 2.09 0.00 38 V 7.65 4.45 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 0.82 0.00 0.00 1.11 0.00 0.00 39 L 8.10 5.26 0.00 1.60 1.67 0.98 1.08 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 40 M 8.67 4.32 0.00 2.38 2.37 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 2.92 2.64 0.00 41 I 7.74 3.60 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.47 1.07 0.00 0.00 42 A 8.59 4.11 1.32 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 43 N 10.67 4.09 0.00 2.91 2.87 0.00 0.00 7.37 7.78 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 44 G 7.92 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 45 E 7.71 3.64 0.00 2.20 2.13 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 2.31 2.47 0.00 46 E 9.13 4.32 0.00 2.09 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 1.71 2.04 0.00 47 V 7.93 4.48 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 0.72 0.00 0.00 0.91 0.00 0.00 48 K 8.22 4.17 0.00 1.88 1.97 0.00 1.50 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.46 7.81 49 I 7.29 4.57 1.86 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 1.22 0.95 0.91 0.00 0.00 50 G 7.90 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 0.00 0.00 0.00 51 V 7.72 3.69 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 0.94 0.00 0.00 1.00 0.00 0.00 52 P 0.00 4.42 0.00 2.16 2.21 0.00 3.72 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 2.08 2.16 0.00 53 F 7.82 4.84 0.00 3.09 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 54 V 5.45 3.49 0.67 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 0.76 0.00 0.00 0.26 0.00 0.00 55 D 7.83 4.80 0.00 3.13 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 56 G 6.97 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 57 G 8.60 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 58 V 8.04 3.81 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 0.79 0.00 0.00 0.94 0.00 0.00 59 I 8.31 2.96 1.86 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 1.41 0.50 0.90 0.00 0.00 60 K 7.81 4.36 0.00 1.64 1.73 0.00 1.62 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.35 7.81 61 A 8.34 4.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.39 4.58 0.00 2.30 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 63 V 8.04 4.26 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 1.09 0.00 0.00 0.93 0.00 0.00 64 V 8.25 4.14 2.16 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 0.77 0.00 0.00 1.09 0.00 0.00 65 A 8.75 4.22 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 66 H 8.27 3.86 0.00 3.33 3.46 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.05 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 0.00 0.00 0.00 68 R 7.73 4.42 0.00 1.83 1.71 0.00 3.35 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 69 G 8.43 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 70 E 7.51 4.16 0.00 1.86 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 71 K 8.85 4.04 0.00 1.97 1.76 0.00 1.43 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.42 7.81 72 V 7.00 4.23 0.67 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 -0.98 0.00 0.00 0.40 0.00 0.00 73 K 8.45 4.05 0.00 1.59 1.64 0.00 1.98 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.18 1.30 7.81 74 I 7.93 3.05 1.84 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 1.42 0.88 0.86 0.00 0.00 75 V 8.06 4.22 1.53 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 0.54 0.00 0.00 0.46 0.00 0.00 76 K 8.39 3.41 0.00 1.79 1.85 0.00 1.97 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.55 7.81 77 F 8.48 3.65 0.00 3.05 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 78 R 8.03 4.71 0.00 1.66 1.81 0.00 3.24 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 79 R 8.59 4.55 0.00 1.97 1.84 0.00 3.23 0.00 0.00 3.54 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 80 R 7.84 4.61 0.00 1.82 1.83 0.00 2.99 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.52 0.00 81 K 8.50 4.51 0.00 1.68 1.29 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.60 7.81 82 H 7.81 4.47 0.00 2.72 2.07 0.00 5.67 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 6.66 4.75 0.00 3.02 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 84 R 7.40 4.37 0.00 2.00 2.08 0.00 3.07 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 1.59 1.65 0.00 85 K 7.87 4.50 0.00 1.91 1.92 0.00 1.49 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.41 7.81 86 Q 8.36 4.07 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.08 0.00 0.00 0.00 0.00 0.00 2.54 2.32 0.00 87 Q 7.46 3.85 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.27 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 88 G 7.89 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 89 H 7.44 4.46 0.00 3.06 3.13 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.28 4.13 0.00 1.75 1.70 0.00 3.35 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 91 Q 8.48 3.86 0.00 1.76 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.55 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 92 W 7.34 4.54 0.00 3.10 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 7.59 5.36 0.00 3.38 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 94 T 8.91 4.82 4.31 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 1.36 0.00 0.00 95 D 9.35 4.77 0.00 2.77 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 96 V 9.05 3.91 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 0.61 0.00 0.00 0.91 0.00 0.00 97 K 7.93 4.08 0.00 1.91 1.66 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.43 7.81 98 I 7.82 3.69 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.57 0.98 0.00 0.00 99 T 8.40 4.12 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 100 G 8.22 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 0.00 101 I 8.36 3.50 1.87 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 1.60 0.85 0.91 0.00 0.00 102 S 8.21 4.61 0.00 3.80 3.70 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 0.00 103 A 8.49 4.61 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