NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3690 8.2649 123.5861 52.3712 19.9089 176.9365 3 T 3.9584 8.5484 118.9606 64.8185 68.9299 173.5215 4 L 4.4927 7.5779 123.7759 53.5170 41.5078 174.8680 5 R 4.8749 8.1807 119.0565 53.6539 32.8911 175.5586 6 S 5.0499 8.6058 113.5460 58.8342 64.2513 172.9020 7 F 4.9422 8.3406 114.8466 55.7349 41.8243 173.2223 8 V 4.1093 8.3728 119.8995 62.1933 31.0576 175.4059 9 L 4.0886 8.3757 131.1983 56.2836 42.5795 176.4831 10 V 4.0578 7.2917 118.0332 60.7917 32.7799 173.9130 11 D 4.9351 8.5801 128.3310 53.6043 40.1040 175.0567 12 N 4.7673 9.3688 125.9352 52.9089 39.4443 175.7693 13 G 3.6793 9.0942 103.3000 46.7346 0.0000 174.6360 14 G 4.2434 8.4250 113.3939 45.9614 0.0000 174.2336 15 T 3.6654 7.2606 108.7304 63.0883 68.9906 173.9535 16 G 4.0649 7.6119 113.4970 44.3037 0.0000 173.5412 17 N 4.5363 8.0033 116.3210 53.1433 39.8170 175.8708 18 V 3.9990 8.3613 123.4136 61.7321 32.9188 174.6003 19 T 4.8521 8.2455 124.8152 61.8897 70.9013 174.6341 20 V 4.5106 8.0449 123.3797 60.0143 34.5140 175.0477 21 V 4.9627 8.9278 116.6914 58.8025 35.1485 173.3563 22 P 4.3857 0.0000 0.0000 62.8963 31.3467 176.5876 23 V 4.4055 8.5798 120.7459 63.7702 34.5582 174.9480 24 S 4.6298 7.6444 112.7175 56.8969 66.7177 174.4958 25 N 4.9726 8.3240 114.2743 53.3275 39.6436 173.4762 26 A 4.0466 8.2011 119.4303 53.3228 18.8794 177.9985 27 N 4.3424 9.8662 117.1615 54.0189 36.4718 174.3140 28 G 3.7211 7.6816 101.8032 47.0778 0.0000 175.2462 29 V 4.5126 7.8006 120.4636 60.2416 33.1764 174.7441 30 A 3.9764 8.8409 130.6527 51.6919 19.7244 175.6467 31 E 5.2155 8.2534 122.1895 54.2527 33.0140 174.2608 32 W 5.2949 10.1245 127.0928 55.0014 32.3592 174.5625 33 L 5.3236 9.3292 126.1201 53.2928 45.1551 176.4846 34 S 4.6210 8.6129 120.1679 57.6683 65.0979 174.4133 35 N 4.6415 8.4189 118.0117 51.8707 36.8917 172.8236 36 N 4.9112 7.5599 118.5001 51.4321 43.4934 174.2799 37 S 4.3443 8.3640 113.3787 58.1775 63.5542 175.3647 38 R 4.1533 8.7913 121.8419 59.5688 30.0038 179.1221 39 S 4.1880 7.5351 111.9930 60.3780 63.1499 174.9224 40 Q 4.4199 8.2446 117.6262 55.2346 29.2195 175.3954 41 A 4.4053 7.2863 119.9025 51.9606 19.5471 177.2775 42 Y 4.3883 9.5660 118.3299 57.5920 39.6477 174.9606 43 R 5.3298 8.8444 122.4049 54.9941 34.4829 173.8279 44 V 5.2269 9.1620 124.2845 61.5919 35.3330 174.0197 45 T 6.0179 9.5909 116.7839 59.2942 72.4639 172.5495 46 A 5.9343 8.9390 123.1933 51.8948 22.9745 175.0628 47 S 5.0468 8.6962 112.9299 57.5143 66.6900 172.7042 48 Y 5.0418 8.7390 123.0709 55.8372 39.6947 174.4667 49 R 4.4953 8.3063 122.1672 53.8875 32.8894 175.3992 50 A 4.4016 8.0607 121.9286 51.2568 19.9780 177.0064 51 S 4.2926 8.6007 114.3189 57.7497 65.5534 175.6225 52 G 3.8925 8.6841 117.5098 45.1167 0.0000 173.4794 53 A 4.7000 7.8036 125.2509 51.8166 19.3884 177.3646 54 D 4.7375 7.4919 115.6876 54.1105 41.3009 174.4346 55 K 4.7301 7.5898 115.5803 57.0824 36.1255 174.2109 56 R 4.7304 8.5081 120.8680 54.5332 33.6879 174.9844 57 K 5.0115 8.5463 121.1177 55.2036 35.9702 174.3355 58 Y 5.2587 9.3568 124.9186 56.8153 40.7669 174.8495 59 T 5.0845 9.1334 119.5844 62.0294 72.0898 173.0087 60 I 5.3253 8.9604 127.2189 59.4483 41.1725 174.9495 61 K 5.1946 9.3545 124.4028 54.6453 36.6148 175.0612 62 L 5.3442 9.0500 124.8895 53.3644 45.9278 174.7663 63 E 4.9346 9.2576 124.8760 54.3924 32.9600 174.9802 64 V 4.4259 8.4582 124.3732 60.1708 34.3545 173.2421 65 P 4.7759 0.0000 0.0000 62.2932 32.5733 175.3772 66 K 4.2758 8.5103 122.8479 56.2962 32.7044 175.9348 67 I 4.3080 8.4731 127.0370 63.0995 38.6808 176.4900 68 V 3.8335 7.6087 111.8487 63.4892 31.6644 176.7399 69 T 3.7117 8.8617 120.2252 63.5009 66.8691 172.4552 70 Q 3.8613 8.0903 119.6227 56.0594 29.2098 176.3153 71 V 4.0018 7.9194 120.6765 60.8003 31.5606 175.3962 72 V 3.7306 8.1388 127.5927 64.4068 31.6917 175.7003 73 N 4.1772 9.5883 123.0273 53.6597 36.8247 174.6333 74 G 3.7651 7.7224 108.0300 44.7868 0.0000 174.2505 75 V 4.0110 7.8986 118.8629 60.7530 30.9538 173.0870 76 E 4.4549 8.1198 124.1139 54.1222 30.7687 175.8653 77 L 4.7872 8.2622 123.6752 52.5014 44.0665 174.4552 78 P 4.7159 0.0000 0.0000 61.7180 32.7329 177.6505 79 V 3.7666 8.6334 121.7274 66.2851 31.2201 178.3429 80 S 4.4988 8.3556 112.3499 61.3784 62.4831 175.6457 81 A 4.3336 8.2622 122.9003 52.7231 19.0241 177.5261 82 W 4.8506 8.4640 117.3902 55.9860 30.4461 175.5880 83 K 4.9274 8.0647 118.6693 55.2941 34.7562 174.4065 84 A 4.9398 9.0464 127.9007 50.3826 21.7271 175.0476 85 Y 5.2637 8.7667 117.6301 56.2984 41.5447 175.0623 86 A 4.8659 8.9529 122.5615 50.6608 23.1880 175.3528 87 S 5.0986 8.7163 115.9904 56.8513 66.8366 173.5992 88 I 4.6855 9.1675 124.7856 59.5532 40.6671 174.0016 89 D 5.3744 8.9306 126.1543 52.3859 43.4588 175.0123 90 L 4.8436 9.1040 125.8285 53.4702 44.9770 174.9533 91 T 5.0878 8.7184 122.3530 61.8682 71.1943 173.4778 92 I 4.6697 8.8318 127.4986 58.4562 40.5890 173.6797 93 P 4.6495 0.0000 0.0000 62.4758 31.6199 177.4541 94 I 3.5876 7.6188 113.9930 63.9531 37.3010 177.2681 95 F 4.4468 7.1895 117.3193 58.5854 39.1115 175.4379 96 A 4.2195 7.8853 124.7476 52.1637 18.7428 176.8019 97 A 4.8086 8.8068 125.2757 50.4164 21.6137 177.6346 98 T 3.8073 8.1087 109.1616 65.3728 68.5816 175.5863 99 D 4.3544 8.2245 122.4439 55.7569 39.1783 178.4642 100 D 4.3569 8.4428 120.3727 57.3066 40.9320 178.6633 101 V 3.6493 7.8567 118.4634 66.3760 31.5020 177.9731 102 T 4.0531 8.2867 109.6896 64.5546 68.3652 176.7154 103 V 3.4932 7.4995 121.1332 65.9048 31.6179 177.6635 104 I 3.7146 7.6972 119.6287 64.7714 37.1344 177.6490 105 S 4.0198 8.4646 113.7271 61.8240 62.1140 176.4905 106 K 3.9567 8.4597 121.0247 59.4437 31.8192 179.3846 107 S 4.0859 8.8207 116.0697 61.6677 62.8810 176.6251 108 L 3.9846 8.0543 121.1670 58.0230 41.2312 179.3578 109 A 4.1640 7.7335 118.8225 55.2388 18.5531 179.7139 110 G 3.6244 8.6504 104.2583 47.8093 0.0000 175.2902 111 L 3.7569 7.9642 122.4809 57.7849 42.0795 178.5001 112 F 4.5995 7.6203 113.1768 56.2261 39.9463 176.1123 113 K 3.9866 7.5151 121.3806 56.3173 32.6024 176.0530 114 V 3.9045 8.1614 124.9163 64.1789 31.9355 176.1659 115 G 4.0448 9.0986 115.2899 45.4005 0.0000 173.7112 116 N 4.8176 7.8977 117.1055 51.1879 41.2496 173.9292 117 P 4.1792 0.0000 0.0000 66.5209 31.2146 178.2435 118 I 3.9452 7.9146 119.5814 63.7079 37.0989 177.9213 119 A 4.0660 8.0254 120.6721 55.2308 18.3986 178.7773 120 E 3.8061 8.7029 117.7674 59.5223 29.6638 178.6832 121 A 3.8401 8.5822 120.8374 55.3497 18.3761 179.3172 122 I 3.6388 7.8225 118.2190 64.8116 37.1363 178.6333 123 S 4.4121 7.9813 112.4484 59.8866 62.9795 175.1798 124 S 4.6195 7.4406 116.2580 57.3908 63.1469 173.8219 125 Q 3.4678 7.6728 118.9460 57.2646 26.6086 173.6421 126 S 4.6606 7.8451 114.2046 57.3359 65.0571 173.5852 127 G 4.1568 8.1483 110.1325 44.4402 0.0000 172.1334 128 F 4.8315 8.2527 118.9194 55.8736 41.3811 174.2310 129 Y 4.6208 7.6225 120.0118 56.5582 39.9305 173.8452 130 A 4.1815 8.7796 122.7710 52.4527 19.1318 177.3505 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 4.37 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.55 3.96 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 1.25 0.00 0.00 4 L 7.58 4.49 0.00 1.53 1.57 0.22 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.18 4.87 0.00 2.02 1.93 0.00 3.17 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 6 S 8.61 5.05 0.00 3.99 4.01 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 7 F 8.34 4.94 0.00 3.05 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 8 V 8.37 4.11 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 0.90 0.00 0.00 9 L 8.38 4.09 0.00 1.12 1.33 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.29 4.06 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 0.92 0.00 0.00 0.78 0.00 0.00 11 D 8.58 4.94 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 N 9.37 4.77 0.00 2.78 2.79 0.00 0.00 6.97 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 13 G 9.09 3.68 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 0.00 0.00 0.00 14 G 8.42 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 0.00 0.00 0.00 0.00 15 T 7.26 3.67 4.23 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 1.21 0.00 0.00 16 G 7.61 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.00 4.54 0.00 2.55 2.70 0.00 0.00 6.99 7.68 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 18 V 8.36 4.00 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 0.08 0.00 0.00 0.64 0.00 0.00 19 T 8.25 4.85 4.14 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 0.00 0.00 0.00 1.16 0.00 0.00 20 V 8.04 4.51 1.61 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 0.03 0.00 0.00 0.93 0.00 0.00 21 V 8.93 4.96 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 0.81 0.00 0.00 1.03 0.00 0.00 22 P 0.00 4.39 0.00 1.82 1.64 0.00 3.66 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 23 V 8.58 4.41 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 0.78 0.00 0.00 0.93 0.00 0.00 24 S 7.64 4.63 0.00 3.84 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 25 N 8.32 4.97 0.00 2.67 2.66 0.00 0.00 6.75 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 26 A 8.20 4.05 1.26 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 0.00 0.00 0.00 27 N 9.87 4.34 0.00 2.81 2.85 0.00 0.00 7.01 7.65 0.00 0.00 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 G 7.68 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 0.00 0.00 0.00 29 V 7.80 4.51 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 0.85 0.00 0.00 1.01 0.00 0.00 30 A 8.84 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.25 5.22 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 2.22 2.34 0.00 32 W 10.12 5.29 0.00 3.32 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 33 L 9.33 5.32 0.00 1.69 1.49 0.95 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.61 4.62 0.00 3.93 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 35 N 8.42 4.64 0.00 2.69 2.77 0.00 0.00 6.68 7.79 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 36 N 7.56 4.91 0.00 2.73 2.70 0.00 0.00 7.26 7.57 0.00 0.00 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 S 8.36 4.34 0.00 3.98 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 38 R 8.79 4.15 0.00 1.90 2.07 0.00 3.14 0.00 0.00 3.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 39 S 7.54 4.19 0.00 4.15 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 40 Q 8.24 4.42 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 41 A 7.29 4.41 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 42 Y 9.57 4.39 0.00 2.85 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.84 5.33 0.00 1.90 1.73 0.00 3.09 0.00 0.00 3.40 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 44 V 9.16 5.23 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 0.93 0.00 0.00 0.97 0.00 0.00 45 T 9.59 6.02 4.36 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 1.33 0.00 0.00 46 A 8.94 5.93 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.70 5.05 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 48 Y 8.74 5.04 0.00 2.70 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 49 R 8.31 4.50 0.00 1.83 1.94 0.00 2.78 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 50 A 8.06 4.40 1.09 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 0.00 0.00 51 S 8.60 4.29 0.00 3.72 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.68 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 53 A 7.80 4.70 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 54 D 7.49 4.74 0.00 2.56 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 55 K 7.59 4.73 0.00 1.68 1.83 0.00 1.24 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.45 7.81 56 R 8.51 4.73 0.00 1.60 1.05 0.00 2.99 0.00 0.00 2.94 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 57 K 8.55 5.01 0.00 1.69 1.49 0.00 1.59 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.56 7.81 58 Y 9.36 5.26 0.00 2.99 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 59 T 9.13 5.08 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 1.27 0.00 0.00 60 I 8.96 5.33 1.91 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 1.33 0.80 1.00 0.00 0.00 61 K 9.35 5.19 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.43 7.81 62 L 9.05 5.34 0.00 1.70 1.43 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.26 4.93 0.00 1.82 1.52 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 1.85 2.22 0.00 64 V 8.46 4.43 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 0.85 0.00 0.00 0.89 0.00 0.00 65 P 0.00 4.78 0.00 1.96 1.91 0.00 2.44 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.27 0.00 66 K 8.51 4.28 0.00 1.82 2.04 0.00 1.43 0.00 0.00 0.90 0.00 0.00 2.40 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.56 1.40 7.81 67 I 8.47 4.31 1.93 0.00 0.00 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 1.46 0.67 0.97 0.00 0.00 68 V 7.61 3.83 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 0.73 0.00 0.00 0.95 0.00 0.00 69 T 8.86 3.71 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 1.49 0.00 0.00 70 Q 8.09 3.86 0.00 1.95 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.23 0.00 71 V 7.92 4.00 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 0.86 0.00 0.00 0.89 0.00 0.00 72 V 8.14 3.73 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 0.83 0.00 0.00 0.91 0.00 0.00 73 N 9.59 4.18 0.00 2.83 2.90 0.00 0.00 7.00 7.52 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 74 G 7.72 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 0.00 0.00 0.00 75 V 7.90 4.01 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 0.84 0.00 0.00 0.89 0.00 0.00 76 E 8.12 4.45 0.00 1.16 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 1.99 1.96 0.00 77 L 8.26 4.79 0.00 1.67 1.64 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.72 0.00 2.25 2.01 0.00 3.74 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 2.13 2.12 0.00 79 V 8.63 3.77 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 1.06 0.00 0.00 0.99 0.00 0.00 80 S 8.36 4.50 0.00 4.09 4.06 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 0.00 0.00 0.00 81 A 8.26 4.33 1.16 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 0.00 0.00 82 W 8.46 4.85 0.00 3.24 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 83 K 8.06 4.93 0.00 1.75 1.54 0.00 1.67 0.00 0.00 1.51 0.00 0.00 2.72 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.73 1.31 7.81 84 A 9.05 4.94 1.16 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 0.00 0.00 85 Y 8.77 5.26 0.00 2.79 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 86 A 8.95 4.87 1.19 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 0.00 0.00 0.00 0.00 0.00 87 S 8.72 5.10 0.00 3.75 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 88 I 9.17 4.69 1.90 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 1.19 0.64 0.97 0.00 0.00 89 D 8.93 5.37 0.00 2.55 2.61 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 0.00 90 L 9.10 4.84 0.00 1.82 1.70 1.00 0.68 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 91 T 8.72 5.09 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 1.23 0.00 0.00 92 I 8.83 4.67 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.95 1.00 0.00 0.00 93 P 0.00 4.65 0.00 2.25 2.22 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 2.14 2.04 0.00 94 I 7.62 3.59 1.62 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 0.59 -0.36 0.76 0.00 0.00 95 F 7.19 4.45 0.00 3.13 3.13 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 96 A 7.89 4.22 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 97 A 8.81 4.81 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 98 T 8.11 3.81 4.25 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 0.00 0.00 1.22 0.00 0.00 99 D 8.22 4.35 0.00 2.89 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 0.00 100 D 8.44 4.36 0.00 2.92 2.79 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 0.00 101 V 7.86 3.65 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 1.01 0.00 0.00 1.00 0.00 0.00 102 T 8.29 4.05 4.23 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 1.20 0.00 0.00 103 V 7.50 3.49 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 1.02 0.00 0.00 0.98 0.00 0.00 104 I 7.70 3.71 2.09 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 1.43 0.67 0.93 0.00 0.00 105 S 8.46 4.02 0.00 3.83 4.05 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 0.00 106 K 8.46 3.96 0.00 1.94 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 S 8.82 4.09 0.00 3.94 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 0.00 108 L 8.05 3.98 0.00 1.87 1.82 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.73 4.16 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 0.00 110 G 8.65 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.96 3.76 0.00 1.47 1.62 0.66 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.62 4.60 0.00 3.15 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 0.00 113 K 7.52 3.99 0.00 1.99 1.83 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.41 7.81 114 V 8.16 3.90 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 0.85 0.00 0.00 0.96 0.00 0.00 115 G 9.10 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 0.00 116 N 7.90 4.82 0.00 2.96 2.71 0.00 0.00 6.54 7.60 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 0.00 117 P 0.00 4.18 0.00 2.33 2.36 0.00 3.70 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 2.06 2.09 0.00 118 I 7.91 3.95 1.93 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 1.32 0.56 0.94 0.00 0.00 119 A 8.03 4.07 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 0.00 120 E 8.70 3.81 0.00 1.99 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 0.00 2.28 2.33 0.00 121 A 8.58 3.84 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 0.00 122 I 7.82 3.64 2.11 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.97 0.95 0.00 0.00 123 S 7.98 4.41 0.00 4.06 4.01 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 0.00 124 S 7.44 4.62 0.00 4.06 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 0.00 125 Q 7.67 3.47 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 126 S 7.85 4.66 0.00 3.84 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 0.00 127 G 8.15 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 0.00 0.00 0.00 128 F 8.25 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 0.00 129 Y 7.62 4.62 0.00 3.10 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 0.00 130 A 8.78 4.18 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