NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.2790 8.3144 122.1441 54.1333 34.3335 175.2681 12 S 4.8482 7.4886 113.2789 54.0417 65.5848 171.0513 13 S 4.7300 8.5988 117.4388 57.6857 65.0692 173.1306 14 C 4.4717 8.2817 122.0916 57.9175 43.0911 172.7984 15 K 4.5277 8.8917 124.4904 55.8737 36.1917 174.8576 16 R 4.6230 8.4861 119.6682 56.6670 30.7189 176.1996 17 H 4.9143 9.3434 119.8088 53.0216 32.7519 171.5723 18 P 4.5182 0.0000 0.0000 62.9561 32.4529 176.2493 19 L 4.1185 7.6423 121.8828 54.8424 45.0144 172.4782 20 Y 4.5108 8.3397 128.8421 55.8798 40.9184 174.2005 21 V 3.6726 7.2559 127.8407 61.5476 33.0662 173.9906 22 D 4.5974 7.9645 128.5125 52.5456 42.2282 177.0291 23 F 4.5454 8.2863 125.9523 60.6373 38.8469 177.9454 24 S 4.5514 8.2113 116.4984 61.3091 62.4550 176.4150 25 D 4.4021 8.0119 119.6419 56.6390 40.5742 178.1746 26 V 3.7136 7.5455 116.9651 62.6605 31.7833 175.9110 27 G 3.8934 7.9501 106.0036 46.6855 0.0000 173.8998 28 W 5.3383 8.8430 117.4369 56.1484 29.7707 177.3738 29 N 4.6599 8.3576 116.7878 54.3813 36.8934 176.1791 30 D 4.5428 8.2340 118.5360 54.4196 40.5488 177.0375 31 W 4.6305 8.1800 114.8473 55.9840 29.5843 175.0032 32 I 4.0902 6.8000 120.4267 59.4812 36.8058 175.5119 33 V 3.9017 8.4300 127.0070 65.7236 32.0844 176.2266 34 A 4.7845 7.6023 119.3217 50.2294 21.0648 174.4463 35 P 4.9157 0.0000 0.0000 61.3041 33.6712 175.3103 36 P 4.4599 0.0000 0.0000 64.3352 31.4811 176.5590 37 G 3.4601 7.1689 103.4313 45.8963 0.0000 171.0947 38 Y 4.7280 6.1827 115.1954 56.3000 41.6351 174.1502 39 H 4.5671 8.9956 118.0903 55.2296 28.1165 174.8613 40 A 4.2833 7.8667 126.5865 52.4418 19.9509 178.2802 41 F 4.1269 8.0264 115.1026 57.3674 38.9073 173.0060 42 Y 4.9917 8.3314 117.6771 56.9135 41.4787 172.6171 43 C 5.4339 8.8507 116.9976 55.7589 43.6678 173.0602 44 H 4.8913 8.8763 121.1616 55.4929 33.3455 171.7136 45 G 4.5139 8.3526 107.7043 43.7689 0.0000 173.1915 46 E 4.2191 9.0889 122.7606 56.1458 30.4070 175.3414 47 C 5.2917 8.2112 120.2074 54.2878 37.1248 172.1641 48 P 4.6072 0.0000 0.0000 62.1277 32.3119 176.0529 49 F 4.7070 8.4925 121.9310 56.4713 40.4409 173.6538 50 P 3.4940 0.0000 0.0000 61.0321 31.9034 175.7232 51 L 4.0248 8.6491 123.4834 54.3026 42.3589 176.6001 52 A 3.9210 8.5900 129.3644 52.5732 18.8445 176.9268 53 D 4.3724 9.0118 124.1314 57.8417 40.9134 178.4094 54 H 4.2388 8.1322 111.9303 58.0443 28.5036 175.3673 55 L 4.1527 7.7679 121.4349 54.3703 42.2658 176.4262 56 N 4.5691 8.8204 122.9655 53.6930 39.9028 173.7241 57 S 5.3025 8.4404 121.8518 56.9692 67.0548 174.4161 58 T 4.3235 8.0576 111.6405 60.8210 69.9488 175.4874 59 N 4.3410 8.7274 119.5103 56.7093 38.4324 177.1539 60 H 4.0379 8.2210 118.9150 59.2481 30.0662 176.9368 61 A 4.1135 8.0342 122.5496 55.2026 18.1505 179.6889 62 I 3.6617 7.7869 118.2581 64.5229 37.1644 178.8095 63 V 3.5574 7.9911 119.2680 66.1213 31.3617 177.8137 64 Q 3.8959 8.4992 119.5841 59.4648 28.9497 178.4088 65 T 3.9230 8.1346 116.9347 66.4411 68.2679 176.4586 66 L 3.7481 7.7992 121.3273 57.9918 42.4097 178.9098 67 V 3.6396 7.9303 118.3505 66.0535 31.3831 177.5018 68 N 4.4291 8.5446 117.4106 56.6196 38.4848 176.7774 69 S 4.0691 7.4970 114.3091 60.2304 62.8540 175.2505 70 V 4.3671 7.1514 113.6238 60.5347 32.8772 176.1276 71 N 4.7783 7.7067 119.0004 52.5290 40.2007 174.9514 72 S 4.3453 8.3320 116.7093 59.6601 63.3302 176.4997 73 K 4.0854 8.1163 120.2715 58.2624 32.0945 176.8776 74 I 4.2465 7.8066 121.1535 58.7919 37.8487 174.1042 75 P 4.4375 0.0000 0.0000 62.3508 31.8333 176.0709 76 K 4.2228 8.2257 118.6580 55.5751 32.8524 176.5172 77 A 4.3594 8.2646 122.1983 52.3679 19.4181 176.2025 78 C 4.8378 9.0690 119.2990 57.5929 34.9634 172.2499 79 C 5.1012 8.7598 125.2160 56.4166 45.0139 172.7073 80 V 4.7283 8.8380 119.0063 58.8105 36.6294 172.9902 81 P 4.9439 0.0000 0.0000 63.3311 31.0306 176.7337 82 T 4.6200 9.0695 114.0117 61.6195 71.0034 174.2596 83 E 4.7757 7.9736 121.8430 54.9316 33.7470 174.2633 84 L 5.4831 8.6420 123.0321 53.2317 46.3871 175.2110 85 S 4.9148 9.1338 114.3575 56.7390 66.9146 172.8106 86 A 5.2790 8.5375 122.0129 50.7455 21.1018 176.1231 87 I 4.7413 8.2892 111.2656 59.4432 41.4363 174.6644 88 S 5.2584 8.6471 119.1894 58.3366 64.2570 173.5552 89 M 5.1126 9.3612 122.0803 53.5746 36.8424 173.8339 90 L 5.3263 9.1381 124.1746 53.5125 45.0632 174.8826 91 Y 5.2557 8.6965 123.3637 55.6866 42.3375 173.4399 92 L 5.1569 9.1977 120.6736 53.2991 43.3032 177.1551 93 D 4.8856 9.0776 124.6489 51.8178 41.0233 176.6559 94 E 3.8542 8.7589 116.5009 59.4631 29.0467 177.4926 95 N 4.7154 8.2613 114.4574 52.6385 38.6071 174.5351 96 E 3.8215 8.3484 115.8293 57.1675 27.8208 173.9005 97 K 4.4325 8.5734 120.7454 55.1665 33.9414 175.7685 98 V 4.2343 8.2565 127.3345 62.7373 32.3099 175.1957 99 V 4.2880 8.8455 127.3758 60.8219 34.9637 173.5088 100 L 5.0778 8.3128 128.4817 53.3153 43.9199 175.3592 101 K 4.5017 9.0338 126.5441 55.0896 36.1102 174.6377 102 N 5.1410 8.7176 125.1204 52.2092 39.1510 174.0469 103 Y 4.1614 8.8289 123.3851 57.6566 38.9088 176.0396 104 Q 4.4438 8.8481 123.4261 55.2267 30.2443 175.0862 105 D 4.4543 8.3685 117.6608 56.1054 38.4484 174.4357 106 M 4.5483 8.3433 117.7571 55.8788 34.0731 178.1069 107 V 4.8256 7.7464 118.7421 60.8486 34.5059 174.7787 108 V 4.0611 9.0416 129.1641 63.1997 31.3341 175.1713 109 E 4.3189 9.3303 128.1690 57.8648 30.8886 176.6448 110 G 4.5423 7.6930 103.8448 44.8262 0.0000 172.4606 111 C 5.6252 8.4937 117.7665 55.3534 44.1390 173.0726 112 G 4.1960 8.6819 105.8965 45.8753 0.0000 171.5673 113 C 5.2359 8.7379 118.4943 55.9250 39.4690 174.5840 114 R 4.3147 9.1061 122.5266 56.3561 30.7877 175.2878 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 11 K 8.31 4.28 0.00 1.79 1.79 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 12 S 7.49 4.85 0.00 3.99 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 13 S 8.60 4.73 0.00 3.97 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 14 C 8.28 4.47 0.00 3.16 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 15 K 8.89 4.53 0.00 1.80 1.86 0.00 1.31 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.47 1.33 7.81 16 R 8.49 4.62 0.00 1.63 1.84 0.00 2.70 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 17 H 9.34 4.91 0.00 1.62 2.71 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.52 0.00 1.92 1.91 0.00 3.71 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 19 L 7.64 4.12 0.00 1.99 1.65 0.81 0.68 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 20 Y 8.34 4.51 0.00 2.89 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 7.26 3.67 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 0.60 0.00 0.00 0.46 0.00 0.00 22 D 7.96 4.60 0.00 2.81 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.29 4.55 0.00 3.27 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 24 S 8.21 4.55 0.00 4.13 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 25 D 8.01 4.40 0.00 2.70 2.66 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 26 V 7.55 3.71 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 -0.68 0.00 0.00 0.70 0.00 0.00 27 G 7.95 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 28 W 8.84 5.34 0.00 3.29 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 0.00 0.00 0.00 0.00 29 N 8.36 4.66 0.00 2.94 3.17 0.00 0.00 5.90 8.07 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 30 D 8.23 4.54 0.00 2.92 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 31 W 8.18 4.63 0.00 3.78 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 32 I 6.80 4.09 1.37 0.00 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.53 0.00 0.00 33 V 8.43 3.90 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 0.72 0.00 0.00 0.94 0.00 0.00 34 A 7.60 4.78 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 35 P 0.00 4.92 0.00 2.38 2.30 0.00 3.92 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.08 0.00 36 P 0.00 4.46 0.00 2.29 2.21 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 37 G 7.17 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 38 Y 6.18 4.73 0.00 2.99 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 39 H 9.00 4.57 0.00 3.19 2.97 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.87 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.03 4.13 0.00 3.32 3.22 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 0.00 42 Y 8.33 4.99 0.00 3.10 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 43 C 8.85 5.43 0.00 2.94 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 44 H 8.88 4.89 0.00 3.31 2.83 0.00 5.77 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.35 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 46 E 9.09 4.22 0.00 1.96 1.83 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 2.32 2.29 0.00 47 C 8.21 5.29 0.00 3.08 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 P 0.00 4.61 0.00 2.24 2.44 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 49 F 8.49 4.71 0.00 3.00 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 50 P 0.00 3.49 0.00 1.75 1.38 0.00 3.47 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.03 0.00 51 L 8.65 4.02 0.00 1.59 1.58 0.99 1.15 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 52 A 8.59 3.92 1.08 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 53 D 9.01 4.37 0.00 2.65 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 54 H 8.13 4.24 0.00 3.20 3.46 0.00 5.72 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 55 L 7.77 4.15 0.00 1.74 1.61 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.82 4.57 0.00 2.78 2.72 0.00 0.00 6.96 7.63 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 57 S 8.44 5.30 0.00 3.73 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 58 T 8.06 4.32 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 59 N 8.73 4.34 0.00 2.77 2.93 0.00 0.00 6.44 8.16 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 60 H 8.22 4.04 0.00 3.21 3.32 0.00 5.68 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 61 A 8.03 4.11 1.37 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 0.00 0.00 0.00 62 I 7.79 3.66 2.08 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 1.42 0.96 0.94 0.00 0.00 63 V 7.99 3.56 2.12 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 1.02 0.00 0.00 0.96 0.00 0.00 64 Q 8.50 3.90 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 65 T 8.13 3.92 4.50 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 1.43 0.00 0.00 66 L 7.80 3.75 0.00 1.80 1.88 0.95 0.88 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 67 V 7.93 3.64 2.17 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 0.90 0.00 0.00 0.94 0.00 0.00 68 N 8.54 4.43 0.00 2.84 2.97 0.00 0.00 7.02 7.33 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 69 S 7.50 4.07 0.00 3.35 3.10 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 70 V 7.15 4.37 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 0.58 0.00 0.00 0.91 0.00 0.00 71 N 7.71 4.78 0.00 2.59 2.72 0.00 0.00 6.95 7.71 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 72 S 8.33 4.35 0.00 4.00 3.97 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 73 K 8.12 4.09 0.00 1.98 1.90 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.40 7.81 74 I 7.81 4.25 1.93 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 1.34 0.77 0.90 0.00 0.00 75 P 0.00 4.44 0.00 2.18 2.06 0.00 3.76 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 2.15 2.00 0.00 76 K 8.23 4.22 0.00 1.79 1.82 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.44 7.81 77 A 8.26 4.36 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 78 C 9.07 4.84 0.00 2.96 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 79 C 8.76 5.10 0.00 3.18 3.01 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 0.00 0.00 0.00 80 V 8.84 4.73 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 0.73 0.00 0.00 1.00 0.00 0.00 81 P 0.00 4.94 0.00 1.99 2.06 0.00 3.69 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 2.11 2.18 0.00 82 T 9.07 4.62 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 1.29 0.00 0.00 83 E 7.97 4.78 0.00 2.01 1.83 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 2.29 2.40 0.00 84 L 8.64 5.48 0.00 1.66 1.66 0.97 0.94 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 85 S 9.13 4.91 0.00 3.87 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 86 A 8.54 5.28 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 87 I 8.29 4.74 1.80 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.69 0.81 0.00 0.00 88 S 8.65 5.26 0.00 3.82 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 89 M 9.36 5.11 0.00 1.87 2.20 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 90 L 9.14 5.33 0.00 1.70 1.48 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.70 5.26 0.00 3.19 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 92 L 9.20 5.16 0.00 1.67 1.72 1.04 1.16 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 93 D 9.08 4.89 0.00 2.93 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 94 E 8.76 3.85 0.00 2.06 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 0.00 2.28 2.29 0.00 95 N 8.26 4.72 0.00 2.83 2.86 0.00 0.00 6.92 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 96 E 8.35 3.82 0.00 2.11 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 2.26 2.39 0.00 97 K 8.57 4.43 0.00 1.77 2.09 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.34 7.81 98 V 8.26 4.23 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 0.72 0.00 0.00 0.91 0.00 0.00 99 V 8.85 4.29 0.96 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 0.70 0.00 0.00 0.75 0.00 0.00 100 L 8.31 5.08 0.00 1.61 1.47 0.99 0.50 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 0.00 101 K 9.03 4.50 0.00 1.93 1.45 0.00 0.61 0.00 0.00 0.96 0.00 0.00 2.69 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.99 1.22 7.81 102 N 8.72 5.14 0.00 2.63 2.79 0.00 0.00 7.10 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 0.00 103 Y 8.83 4.16 0.00 2.89 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 0.00 104 Q 8.85 4.44 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 105 D 8.37 4.45 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 0.00 106 M 8.34 4.55 0.00 1.73 2.08 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.95 0.00 107 V 7.75 4.83 2.24 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 1.41 0.00 0.00 1.29 0.00 0.00 108 V 9.04 4.06 2.26 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 0.86 0.00 0.00 1.07 0.00 0.00 109 E 9.33 4.32 0.00 1.89 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 2.29 2.40 0.00 110 G 7.69 4.54 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 0.00 111 C 8.49 5.63 0.00 2.84 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 0.00 112 G 8.68 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 0.00 0.00 0.00 0.00 113 C 8.74 5.24 0.00 2.92 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 0.00 114 R 9.11 4.31 0.00 1.66 1.77 0.00 3.34 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00