NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2976 8.3049 120.3336 54.8088 32.8761 173.8134 2 L 3.2193 8.6147 123.4976 55.0690 40.1174 172.3363 3 Q 4.0889 8.1711 120.5979 54.3436 30.9095 171.2680 4 P 4.0572 0.0000 0.0000 63.4520 31.1270 175.5990 5 K 3.9861 8.5791 125.0528 58.7241 32.2524 175.9485 6 R 4.7981 7.4810 112.2451 54.5580 32.7555 174.3890 7 T 4.6652 8.0009 114.0043 61.9469 72.2241 175.1104 8 K 4.1063 8.7617 123.4470 57.4144 32.0464 177.1256 9 F 4.6843 7.8245 118.5084 56.4837 42.5835 174.3928 10 R 4.1529 9.0169 125.9517 58.6098 30.0883 177.3505 11 K 4.3785 7.7686 116.5628 54.6387 34.6673 176.0651 12 M 4.2741 8.4536 123.5770 54.9216 32.0311 175.4935 13 H 4.2546 8.0368 117.3008 55.8926 29.2596 175.9778 14 K 4.5962 8.4538 133.9078 56.2009 34.9211 177.6338 15 G 3.7749 8.0564 107.5433 45.9534 0.0000 173.1094 16 R 4.8521 7.9233 126.0105 55.5394 30.2831 174.1305 17 N 4.6485 8.1070 117.0266 53.9992 39.5546 176.0877 18 R 4.5021 8.2878 117.9504 54.7558 31.4547 175.3397 19 G 3.9214 8.2879 104.8262 46.4691 0.0000 170.2984 20 L 3.4644 8.4963 124.3490 53.8984 37.9146 174.5585 21 A 4.3811 8.0791 126.6142 51.7979 19.5326 176.6753 22 Q 4.3879 8.5595 113.8620 56.8540 31.4837 176.6599 23 G 3.9205 7.7208 108.0090 44.7116 0.0000 173.9985 24 T 4.1757 7.9615 120.8727 65.6682 69.3340 175.8339 25 D 4.6499 7.7173 118.3912 53.8476 42.1095 176.9999 26 V 4.5119 7.7356 118.4366 61.4420 30.1109 175.5685 27 S 4.4311 8.2571 116.8404 58.1859 62.2721 174.7695 28 F 4.0662 7.1573 117.4106 58.3042 42.5072 178.0527 29 G 4.4626 9.1694 114.6928 45.2328 0.0000 173.1900 30 S 4.6571 8.6249 112.4494 57.8891 63.3869 174.0352 31 F 5.0147 8.0204 118.4781 56.8976 43.6796 173.4522 32 G 4.4441 9.0187 109.0459 45.3093 0.0000 170.8877 33 L 4.9004 8.0089 121.3832 52.7543 44.0024 176.1244 34 K 4.2744 9.6130 129.0221 57.3145 33.8455 177.2670 35 A 3.8873 8.7796 127.4831 51.0871 18.2542 176.5834 36 V 3.5056 9.2730 118.0694 59.2347 29.6292 169.4635 37 G 3.9926 7.7916 108.5688 43.5371 0.0000 170.0172 38 R 4.6421 8.0795 118.0220 53.3255 33.3041 172.7564 39 G 3.7521 8.3302 102.8440 44.3798 0.0000 172.3099 40 R 4.6361 8.3490 114.4716 54.1521 32.2114 175.4093 41 L 4.8019 8.1597 123.8712 53.4208 43.9808 175.6549 42 T 4.1898 8.9834 123.5829 64.0259 69.4749 175.1805 43 A 4.1838 8.4882 123.8213 53.7951 18.2806 179.0988 44 R 4.3796 8.0087 114.3454 57.7927 31.4484 178.2791 45 Q 4.0219 8.0036 117.6368 58.9784 28.7412 178.8097 46 I 4.6149 7.7829 115.0898 63.1662 37.7268 177.7041 47 E 4.1190 8.1093 120.1774 58.4623 29.7156 177.9308 48 A 4.0447 8.7914 120.9491 54.3178 18.2434 179.0372 49 A 4.0984 8.0786 119.1384 54.2584 18.8380 179.8217 50 R 3.6571 7.9841 117.8018 59.4728 30.2073 178.4432 51 R 3.8282 8.2036 118.5740 59.4900 30.0228 178.2440 52 A 4.1306 7.9477 118.9079 54.3870 18.3849 178.3853 53 M 4.1655 7.1468 115.8694 57.9788 32.8461 177.5891 54 T 4.1675 7.8279 114.4752 64.9093 68.6164 176.8270 55 R 3.8759 7.6345 120.2989 59.0988 30.1202 177.9024 56 A 4.0940 7.7665 119.6038 55.1475 18.8081 179.4292 57 V 3.5151 7.5484 109.3729 64.3444 32.1384 178.0950 58 K 3.8342 7.8772 116.6596 56.0973 30.7984 176.5225 59 R 4.3073 8.3223 116.3525 56.9866 28.4120 177.4384 60 Q 4.3624 7.2006 116.2712 55.3423 33.1980 176.7448 61 G 3.8201 8.8024 109.5825 44.6281 0.0000 171.8546 62 K 4.4330 8.0115 118.0259 54.3424 35.3574 174.9580 63 I 4.7461 7.7484 125.6170 59.3012 40.2924 174.7560 64 W 5.0246 8.5816 125.6133 54.8726 33.0407 174.4851 65 I 4.7160 8.3438 121.9554 60.1134 38.8715 175.4327 66 R 4.2093 8.8345 126.6933 58.3531 31.0778 178.0875 67 V 3.7450 7.5499 111.4537 60.8792 32.1539 175.1603 68 F 4.6728 7.9608 126.2924 56.8224 40.8719 173.4652 69 P 2.9700 0.0000 0.0000 59.6392 31.8391 175.8385 70 D 5.0075 7.4035 126.9338 54.8902 41.8793 174.1619 71 K 4.3012 7.9484 117.5832 55.3771 32.2305 175.4997 72 P 3.1044 0.0000 0.0000 61.2219 31.5058 171.6586 73 I 3.1569 7.5255 129.5818 61.0903 35.9777 172.9304 74 T 4.7049 8.0722 114.4681 60.0580 71.7597 173.6159 75 E 4.6111 8.3981 120.7341 54.9253 33.7805 175.1567 76 K 4.2636 9.0927 126.6376 54.7205 32.5917 174.6947 77 P 4.3587 0.0000 0.0000 62.3591 33.3302 177.2543 78 L 4.1813 9.0062 129.7675 56.4442 42.2783 175.7664 79 A 4.3930 8.7624 119.0833 52.3512 19.5873 178.7798 80 V 4.2875 7.4829 120.1305 60.7552 33.2353 176.2487 81 R 4.0762 8.3994 123.3109 56.1753 29.2666 176.4728 82 M 4.1889 8.5027 119.8227 56.0097 32.8517 176.2160 83 G 4.1234 8.3793 106.7409 47.1732 0.0000 173.8215 84 K 4.4699 7.2269 110.8145 56.3900 32.9524 177.0269 85 G 4.0520 8.2332 105.4802 43.8806 0.0000 174.6577 86 K 3.9577 8.5495 122.5407 55.6307 31.8480 176.8395 87 G 4.0551 8.5747 114.2816 46.7336 0.0000 170.9136 88 N 4.9011 8.4633 117.2981 51.8723 40.0240 174.2241 89 V 4.4936 8.0249 111.4589 60.5777 32.7451 176.5261 90 E 4.6607 8.5071 119.3586 55.1089 31.8779 175.3220 91 Y 4.7164 6.9379 117.0659 56.6795 39.5540 172.6568 92 W 4.9629 8.1745 120.7049 54.8961 32.7703 175.1108 93 V 4.4368 8.6312 116.7055 61.1721 34.4512 171.6840 94 A 4.6183 7.8911 125.9542 49.5045 20.4211 176.1662 95 L 4.6454 8.6399 123.2300 56.0622 40.2855 176.7874 96 I 4.3951 8.0785 117.1092 59.9184 39.2582 175.1804 97 Q 4.7331 8.2991 120.7785 53.2620 32.9503 172.3030 98 P 4.2639 0.0000 0.0000 64.7834 31.9036 175.9260 99 G 3.9993 9.8676 112.9439 45.6874 0.0000 172.8718 100 K 3.9248 8.3257 120.2988 56.2823 33.0960 176.8057 101 V 3.7172 8.5228 126.5581 61.6668 31.4461 176.0853 102 L 3.9416 9.2058 127.9917 56.4820 41.8484 178.0175 103 Y 5.3740 7.4030 114.8469 55.9649 42.0950 173.2816 104 E 5.2299 8.8079 117.1984 56.6128 34.6016 173.7621 105 M 5.1704 10.5319 120.3049 53.6522 36.0158 173.9605 106 D 4.9108 8.8082 119.1699 55.8262 47.3155 176.8293 107 G 3.9744 7.9858 108.7014 43.5766 0.0000 174.0755 108 V 4.3797 7.0723 117.4776 60.5043 32.0944 170.3693 109 P 4.5501 0.0000 0.0000 61.9777 31.8236 175.6009 110 E 3.7445 8.6477 117.7489 57.2171 28.4469 175.1191 111 E 4.6294 7.8395 133.3636 56.1048 32.6798 177.7391 112 L 4.1600 7.4040 116.4252 55.6068 42.4488 177.5959 113 A 3.9788 7.4066 119.8890 55.2707 18.1029 179.3696 114 R 3.7696 7.4106 116.6152 59.4358 29.9608 178.0628 115 E 3.9619 7.8312 117.3214 58.3269 29.8250 178.4467 116 A 4.0893 7.1428 121.3033 55.0554 18.6762 181.4761 117 F 4.9288 7.7501 116.3708 57.5771 37.7782 176.5882 118 K 4.3918 7.9601 118.7847 57.5276 34.6998 176.5113 119 L 4.2859 8.0525 117.3166 54.7163 42.2705 176.2616 120 A 4.5813 7.7117 119.6843 52.6895 21.5416 178.7133 121 A 3.9322 8.2639 118.5502 55.4887 18.4678 179.0925 122 A 4.2357 7.3963 115.5631 53.6642 18.2308 177.9900 123 K 4.3471 7.6547 114.1845 56.1518 32.8055 176.4646 124 L 4.5736 7.7245 119.7671 53.1519 43.2267 174.3572 125 P 4.8959 0.0000 0.0000 62.1748 31.4205 174.8770 126 I 4.3105 7.6823 111.6037 59.7646 39.8953 173.0647 127 K 3.9655 8.5042 125.6808 56.5500 31.6064 175.1544 128 T 5.5419 8.1983 113.9707 59.5368 71.1464 173.4400 129 T 4.7475 7.9556 117.6390 60.0579 70.9841 172.6178 130 F 4.7214 8.7963 126.0767 58.0208 40.7229 174.7386 131 V 4.6605 7.5973 123.3803 60.4110 34.9502 173.5790 132 T 4.9099 8.7749 125.0164 61.3344 67.7926 175.0545 133 K 4.1344 8.5002 116.2707 56.6643 34.1249 174.3044 134 T 3.7663 7.9346 116.5159 63.2960 69.6160 169.4915 135 V 3.8029 8.5028 127.3611 64.0239 29.8773 175.5677 136 M 4.1315 9.1737 117.2265 55.5237 32.0983 174.3249 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 4.30 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.60 0.00 2 L 8.61 3.22 0.00 1.66 1.26 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.17 4.09 0.00 0.93 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.88 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 4 P 0.00 4.06 0.00 2.14 2.08 0.00 3.15 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.74 0.00 5 K 8.58 3.99 0.00 1.67 1.86 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.52 7.81 6 R 7.48 4.80 0.00 1.89 1.82 0.00 3.01 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 7 T 8.00 4.67 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 8 K 8.76 4.11 0.00 1.75 1.50 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.41 1.38 7.81 9 F 7.82 4.68 0.00 3.01 2.93 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 10 R 9.02 4.15 0.00 1.85 2.03 0.00 3.41 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 11 K 7.77 4.38 0.00 1.67 1.65 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.43 7.81 12 M 8.45 4.27 0.00 2.00 2.01 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 2.66 2.55 0.00 13 H 8.04 4.25 0.00 3.11 3.17 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.45 4.60 0.00 1.71 1.79 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.16 1.20 7.81 15 G 8.06 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 16 R 7.92 4.85 0.00 2.04 2.00 0.00 3.03 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.37 0.00 17 N 8.11 4.65 0.00 2.74 2.79 0.00 0.00 6.76 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 18 R 8.29 4.50 0.00 1.75 1.85 0.00 3.44 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 19 G 8.29 3.92 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 0.00 0.00 0.00 20 L 8.50 3.46 0.00 1.84 1.84 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.08 4.38 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 22 Q 8.56 4.39 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.19 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 23 G 7.72 3.92 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 0.00 0.00 0.00 24 T 7.96 4.18 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 25 D 7.72 4.65 0.00 2.65 2.62 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 26 V 7.74 4.51 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 1.49 0.00 0.00 0.96 0.00 0.00 27 S 8.26 4.43 0.00 3.96 3.55 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 28 F 7.16 4.07 0.00 2.35 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 29 G 9.17 4.46 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 30 S 8.62 4.66 0.00 3.47 3.85 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 0.00 0.00 0.00 31 F 8.02 5.01 0.00 3.15 2.90 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 32 G 9.02 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 33 L 8.01 4.90 0.00 0.47 1.19 0.58 0.83 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 K 9.61 4.27 0.00 1.89 1.68 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.45 7.81 35 A 8.78 3.89 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 36 V 9.27 3.51 2.27 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 0.79 0.00 0.00 0.96 0.00 0.00 37 G 7.79 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 0.00 0.00 0.00 38 R 8.08 4.64 0.00 1.77 1.86 0.00 3.19 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 39 G 8.33 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 40 R 8.35 4.64 0.00 1.78 1.88 0.00 3.01 0.00 0.00 3.15 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 41 L 8.16 4.80 0.00 1.73 1.56 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.98 4.19 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 1.40 0.00 0.00 43 A 8.49 4.18 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.38 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 45 Q 8.00 4.02 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 46 I 7.78 4.61 1.90 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 1.65 1.22 0.87 0.00 0.00 47 E 8.11 4.12 0.00 2.26 2.01 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 2.39 2.34 0.00 48 A 8.79 4.04 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 49 A 8.08 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 3.66 0.00 2.37 2.19 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 51 R 8.20 3.83 0.00 2.02 2.10 0.00 3.16 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 52 A 7.95 4.13 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 53 M 7.15 4.17 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 54 T 7.83 4.17 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 1.19 0.00 0.00 55 R 7.63 3.88 0.00 1.93 1.94 0.00 3.29 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 56 A 7.77 4.09 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 0.00 0.00 0.00 0.00 0.00 57 V 7.55 3.52 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 0.71 0.00 0.00 0.94 0.00 0.00 58 K 7.88 3.83 0.00 1.86 1.87 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.34 7.81 59 R 8.32 4.31 0.00 1.75 1.86 0.00 3.17 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 1.59 1.63 0.00 60 Q 7.20 4.36 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 61 G 8.80 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.01 4.43 0.00 1.57 1.06 0.00 1.23 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.21 7.81 63 I 7.75 4.75 1.79 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 1.37 0.74 0.99 0.00 0.00 64 W 8.58 5.02 0.00 3.14 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 65 I 8.34 4.72 1.88 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 1.43 0.70 0.70 0.00 0.00 66 R 8.83 4.21 0.00 1.83 1.92 0.00 3.15 0.00 0.00 3.23 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 67 V 7.55 3.74 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 0.60 0.00 0.00 0.75 0.00 0.00 68 F 7.96 4.67 0.00 2.89 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 69 P 0.00 2.97 0.00 1.34 1.56 0.00 2.59 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.80 0.00 70 D 7.40 5.01 0.00 3.26 2.89 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 71 K 7.95 4.30 0.00 1.98 2.07 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.43 7.81 72 P 0.00 3.10 0.00 2.06 1.84 0.00 3.79 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 73 I 7.53 3.16 1.42 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.79 0.53 0.00 0.00 74 T 8.07 4.70 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 1.17 0.00 0.00 75 E 8.40 4.61 0.00 1.86 1.86 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 2.28 2.35 0.00 76 K 9.09 4.26 0.00 1.76 1.74 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.46 7.81 77 P 0.00 4.36 0.00 2.09 1.06 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 78 L 9.01 4.18 0.00 1.56 1.38 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.76 4.39 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 80 V 7.48 4.29 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 0.84 0.00 0.00 0.93 0.00 0.00 81 R 8.40 4.08 0.00 1.82 1.91 0.00 3.21 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 82 M 8.50 4.19 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.48 0.00 83 G 8.38 4.12 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 0.00 84 K 7.23 4.47 0.00 1.73 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.50 7.81 85 G 8.23 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 0.00 0.00 0.00 86 K 8.55 3.96 0.00 1.73 1.76 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 87 G 8.57 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 88 N 8.46 4.90 0.00 2.82 2.97 0.00 0.00 5.88 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 89 V 8.02 4.49 1.63 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 0.45 0.00 0.00 0.79 0.00 0.00 90 E 8.51 4.66 0.00 2.05 1.95 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 2.23 2.22 0.00 91 Y 6.94 4.72 0.00 3.04 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 W 8.17 4.96 0.00 3.18 3.26 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 93 V 8.63 4.44 2.01 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 0.48 0.00 0.00 1.00 0.00 0.00 94 A 7.89 4.62 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 95 L 8.64 4.65 0.00 1.53 1.95 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.08 4.40 1.85 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 1.28 0.55 0.99 0.00 0.00 97 Q 8.30 4.73 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 98 P 0.00 4.26 0.00 2.09 2.07 0.00 3.56 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 2.13 2.22 0.00 99 G 9.87 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 0.00 100 K 8.33 3.92 0.00 1.79 1.80 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.62 1.63 7.81 101 V 8.52 3.72 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 0.68 0.00 0.00 0.96 0.00 0.00 102 L 9.21 3.94 0.00 1.70 1.34 0.85 0.92 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 0.00 103 Y 7.40 5.37 0.00 2.65 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 0.00 104 E 8.81 5.23 0.00 2.40 2.32 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 2.55 2.47 0.00 105 M 10.53 5.17 0.00 2.28 1.84 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.19 0.00 106 D 8.81 4.91 0.00 2.72 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 0.00 107 G 7.99 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 0.00 0.00 0.00 108 V 7.07 4.38 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 0.61 0.00 0.00 0.87 0.00 0.00 109 P 0.00 4.55 0.00 2.21 2.10 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 110 E 8.65 3.74 0.00 1.96 1.74 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 2.51 2.36 0.00 111 E 7.84 4.63 0.00 1.93 1.81 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 2.06 2.09 0.00 112 L 7.40 4.16 0.00 1.67 1.55 0.84 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.41 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.41 3.77 0.00 0.88 1.50 0.00 2.75 0.00 0.00 2.91 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.50 0.00 115 E 7.83 3.96 0.00 2.18 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 2.25 2.40 0.00 116 A 7.14 4.09 1.20 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 0.00 117 F 7.75 4.93 0.00 3.31 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 0.00 118 K 7.96 4.39 0.00 1.86 1.79 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.31 7.81 119 L 8.05 4.29 0.00 1.65 1.63 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 120 A 7.71 4.58 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 0.00 121 A 8.26 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.40 4.24 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 0.00 123 K 7.65 4.35 0.00 1.91 1.87 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.53 7.81 124 L 7.72 4.57 0.00 1.68 1.66 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.90 0.00 2.17 2.13 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.22 0.00 126 I 7.68 4.31 1.89 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 1.62 0.32 0.99 0.00 0.00 127 K 8.50 3.97 0.00 1.91 1.98 0.00 1.55 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.69 7.81 128 T 8.20 5.54 4.38 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 129 T 7.96 4.75 4.30 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 1.27 0.00 0.00 130 F 8.80 4.72 0.00 3.13 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 0.00 131 V 7.60 4.66 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 0.93 0.00 0.00 0.96 0.00 0.00 132 T 8.77 4.91 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 1.43 0.00 0.00 133 K 8.50 4.13 0.00 1.57 1.67 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.31 7.81 134 T 7.93 3.77 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 1.24 0.00 0.00 135 V 8.50 3.80 2.07 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 0.74 0.00 0.00 0.92 0.00 0.00 136 M 9.17 4.13 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00