NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1473 8.1727 122.0484 56.2879 34.0830 174.0414 2 V 4.5377 8.1856 127.3476 60.6662 32.2319 174.4720 3 F 4.4399 9.9798 128.7783 57.6198 40.2360 174.7504 4 E 4.3017 9.0238 120.9163 55.3853 31.1093 176.7474 5 R 3.2733 8.9825 121.0451 60.8941 30.0259 179.3508 6 C 4.3068 8.0167 115.2079 59.7791 40.2008 175.6607 7 E 3.9071 8.1602 120.6130 59.2682 29.2139 178.5783 8 L 3.5464 8.0132 120.0445 57.8089 42.0671 178.5109 9 A 3.9362 7.8128 120.7520 55.5285 18.2287 179.9342 10 R 3.9295 8.0836 116.3110 59.5035 29.6418 179.3472 11 T 3.8556 7.9449 115.6727 66.6535 68.5089 176.6911 12 L 3.9064 8.1927 121.3286 57.4215 41.6241 179.4279 13 K 3.9444 7.9651 119.6778 59.6485 31.9640 179.1411 14 R 3.9951 7.9998 117.2061 58.7887 29.9676 178.0078 15 L 4.4037 7.1806 115.5050 54.1951 41.6663 177.2076 16 G 3.9162 7.8526 106.7638 46.6157 0.0000 175.1628 17 M 3.9721 7.7626 121.2897 57.0096 32.1699 175.5138 18 D 4.4642 7.9873 117.2388 56.7283 40.4776 175.5359 19 G 3.9510 9.5458 115.5062 45.0720 0.0000 170.7769 20 Y 4.3026 8.3533 122.0586 58.6000 38.8558 176.2674 21 R 3.5686 8.9990 126.8284 57.2934 27.7623 177.2081 22 G 3.8016 8.1983 103.0364 45.8336 0.0000 174.0261 23 I 4.0804 7.4721 121.8585 58.9931 37.8966 175.9744 24 S 4.6222 8.2948 120.2473 57.7332 63.8867 174.9936 25 L 4.2436 8.5947 122.9279 58.4656 41.7382 179.2164 26 A 4.1816 8.1512 120.2502 55.2603 18.3130 179.2724 27 N 4.4514 8.0692 115.2261 56.3371 38.6654 177.7136 28 W 4.3383 8.0291 119.9076 59.9828 29.1591 178.3391 29 M 4.1749 8.6570 119.1869 58.6254 31.4597 177.9989 30 C 3.2664 8.1304 118.6194 58.9824 43.9084 175.3876 31 L 4.0130 8.1453 121.7863 58.2763 41.7935 178.8788 32 A 4.2421 8.2387 122.0457 54.3533 18.2916 179.2782 33 K 2.7430 8.1507 118.1769 59.4723 32.0142 179.1400 34 W 4.2345 7.7935 117.5646 59.2442 29.0551 178.4315 35 E 4.3450 8.4055 118.8456 58.7729 29.1999 177.9240 36 S 4.5187 7.8842 108.9854 56.8872 64.8979 174.2964 37 G 3.3532 8.3653 108.6252 47.0404 0.0000 173.3969 38 Y 3.6385 7.6364 113.3756 58.7119 35.3719 168.8686 39 N 5.3076 7.6100 119.3331 51.9260 39.9933 175.6123 40 T 4.0057 8.8652 117.3543 64.2479 69.1033 175.9694 41 R 4.3522 8.1528 119.0141 55.8429 30.7122 176.2954 42 A 4.3380 7.6818 122.4146 52.5297 19.3586 177.0325 43 T 5.5029 8.2867 110.8969 59.2834 72.4033 173.0992 44 N 4.8404 8.4423 121.7818 52.1724 42.0895 172.1417 45 Y 4.7786 8.6581 128.2023 57.2532 40.8375 173.9527 46 N 4.8098 8.4233 124.5617 51.0251 37.5541 175.1015 47 A 3.5887 8.1573 127.8566 54.7682 18.8560 180.1870 48 G 3.8169 7.9586 103.9103 48.0193 0.0000 173.6433 49 D 4.6392 7.0011 113.3076 52.1528 40.4783 176.4087 50 R 4.1878 8.3361 117.0302 57.0998 28.3664 175.9584 51 S 4.8550 7.9674 113.9572 57.6133 65.9640 173.0562 52 T 5.1162 8.8156 115.6482 62.0695 72.9520 172.9743 53 D 5.3898 9.0432 125.9671 53.4691 42.9353 175.1173 54 Y 5.0022 9.1047 120.8774 57.4274 41.7558 177.5803 55 G 4.6075 8.8322 111.3007 45.9004 0.0000 173.7091 56 I 4.0225 8.0636 116.4620 62.8590 38.0193 177.9666 57 F 4.8914 7.9530 115.7699 56.3823 39.9424 175.1965 58 Q 3.5713 7.8356 119.2335 57.0702 26.5565 174.1630 59 I 4.3950 8.2662 118.8966 60.8270 39.0565 177.0175 60 N 5.3004 9.1706 126.5599 53.5754 39.6381 175.7690 61 S 4.5388 9.1290 120.8184 60.9447 63.4330 175.6696 62 R 3.8098 8.8449 122.0963 59.0605 29.9785 177.4459 63 Y 4.2370 7.6061 113.2142 57.7495 40.3881 177.4564 64 W 4.7814 7.8637 119.3158 57.8876 30.1510 173.6534 65 C 5.4966 7.9062 110.0030 53.7673 44.4784 172.3146 66 N 4.8660 8.9177 119.9959 52.2946 39.3742 174.9250 67 D 4.8158 8.5855 123.1875 52.3450 40.3281 177.0247 68 G 4.0074 8.7287 107.7818 46.1122 0.0000 174.3073 69 K 4.6341 8.3489 117.4462 56.4969 33.2892 175.9864 70 T 4.5362 7.9051 115.6267 61.5581 70.7337 172.1852 71 P 4.1390 0.0000 0.0000 64.1794 31.7993 177.0957 72 G 3.6918 8.7933 106.3337 46.2927 0.0000 173.1684 73 A 4.3534 7.7064 121.1527 52.3268 18.4983 178.0144 74 G 3.8651 8.1832 112.1861 44.9703 0.0000 173.3173 75 N 4.9294 7.9858 114.3716 51.8843 38.8477 174.7197 76 A 3.9108 8.5342 123.6388 55.2688 19.1018 178.3114 77 C 4.5981 8.4123 110.9558 57.0829 41.1998 173.0698 78 H 4.0478 8.0532 116.8256 56.4937 26.3699 174.0484 79 L 4.8042 8.4973 118.0726 52.8983 46.5720 176.6183 80 S 4.5970 8.3807 115.4597 58.0585 63.2532 176.0508 81 C 4.1301 8.8065 124.5073 59.6411 40.8416 176.3497 82 S 3.8829 7.6741 115.0417 61.3188 61.6586 175.9929 83 A 4.0738 7.7409 122.3496 54.4156 18.1321 177.9522 84 L 4.4267 7.8252 116.3132 55.1228 41.8521 177.6172 85 L 5.0344 7.8257 117.4700 54.5254 42.3052 176.6490 86 Q 4.3689 7.7929 117.6535 55.2768 29.6245 175.9471 87 D 4.4183 8.6024 120.6041 57.2630 41.1241 176.9312 88 N 4.5348 8.0377 118.0724 53.3867 39.3562 174.6595 89 I 4.2509 8.4354 118.5795 60.9376 37.9736 177.0692 90 A 3.9317 8.3778 124.7794 55.9132 18.1163 180.0269 91 D 4.2625 8.0831 116.4712 57.4870 40.8834 178.7381 92 A 4.0640 7.9691 120.8005 55.2079 18.4575 179.7231 93 V 3.4082 8.2990 117.0215 65.9291 31.5528 178.1510 94 A 3.8572 8.1001 120.8537 55.2341 18.1216 178.8464 95 C 4.2460 8.5340 117.0732 59.6774 43.2377 175.6466 96 A 3.8706 8.2673 122.7948 54.8628 17.5576 179.8373 97 K 3.8177 7.6088 116.4685 59.4557 32.2255 179.0926 98 R 4.0900 7.7860 119.0037 59.4111 29.9832 178.5604 99 V 2.6292 7.6213 117.9982 65.9264 31.5062 178.3457 100 V 3.7998 7.8842 110.9869 63.4740 31.1692 178.2279 101 R 4.1770 7.5923 116.9773 57.3073 30.4118 176.6249 102 D 4.6620 7.6160 119.2829 53.1228 41.7382 175.4604 103 P 4.1662 0.0000 0.0000 66.1664 31.4923 178.0148 104 Q 4.0187 8.1872 116.4870 57.0071 29.9571 177.7699 105 G 4.0624 7.9566 106.7423 47.0164 0.0000 175.7166 106 I 3.8279 7.7250 120.9502 62.8388 38.0047 177.7623 107 R 4.2515 7.2555 118.0622 58.3433 29.9957 177.5717 108 A 4.0349 7.5460 120.4776 54.0889 18.6147 177.4533 109 W 4.7132 8.1398 116.5876 55.4039 29.4880 177.2272 110 V 3.7216 8.7918 124.0753 66.1754 30.8844 177.6711 111 A 4.0239 8.2663 119.8090 54.6286 18.1744 179.2844 112 W 4.0107 8.4439 127.4398 60.5614 30.5584 178.5264 113 R 3.7544 8.2222 116.7080 59.3843 29.7080 178.3475 114 N 4.4147 8.2865 115.3557 55.3791 38.6216 176.0637 115 R 4.2400 7.7870 115.0836 55.5557 31.9772 175.2195 116 C 4.5409 7.2471 114.2009 57.6107 42.9153 174.3078 117 Q 3.0816 6.8288 120.4948 57.0170 28.7388 175.4532 118 N 4.1770 8.5942 121.3227 54.5209 36.2333 173.8752 119 R 4.5573 7.3050 114.5838 54.1162 33.6662 175.8646 120 D 4.5698 8.4541 119.2312 54.0152 40.0818 175.6896 121 V 4.6139 8.0916 117.8608 61.0366 32.4173 178.4000 122 R 4.0488 7.9684 121.5148 59.3127 29.8458 178.8874 123 Q 3.9940 8.2336 115.4691 59.3947 28.3819 178.5635 124 Y 4.1873 7.7524 114.9535 60.1100 38.1489 177.0255 125 V 4.3688 7.8208 110.8108 60.7030 32.8717 175.4574 126 Q 4.1546 7.6581 120.2747 57.3371 28.6681 177.0065 127 G 3.9430 8.9584 110.7304 45.9858 0.0000 174.3006 128 C 4.4633 8.1389 115.8809 56.4564 40.4968 173.9536 129 G 3.9119 8.1131 107.2484 46.6874 0.0000 174.3194 130 V 4.0110 7.8633 118.0925 61.0873 32.0803 175.7997 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 K 8.17 4.15 0.00 2.05 1.62 0.00 1.25 0.00 0.00 1.02 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.10 7.81 2 V 8.19 4.54 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.98 4.44 0.00 2.85 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 4 E 9.02 4.30 0.00 1.96 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 2.30 2.24 0.00 5 R 8.98 3.27 0.00 1.97 1.92 0.00 3.40 0.00 0.00 3.45 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.84 0.00 6 C 8.02 4.31 0.00 3.00 3.12 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 7 E 8.16 3.91 0.00 2.06 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 0.00 2.68 2.44 0.00 8 L 8.01 3.55 0.00 1.33 1.33 -0.32 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.81 3.94 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 10 R 8.08 3.93 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.94 3.86 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 1.23 0.00 0.00 12 L 8.19 3.91 0.00 1.73 1.58 0.88 0.28 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 13 K 7.97 3.94 0.00 1.95 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.00 4.00 0.00 1.98 1.97 0.00 3.21 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 15 L 7.18 4.40 0.00 1.68 1.56 0.89 0.85 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 16 G 7.85 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 17 M 7.76 3.97 0.00 1.38 2.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.21 0.00 18 D 7.99 4.46 0.00 2.70 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 19 G 9.55 3.95 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 0.00 0.00 0.00 20 Y 8.35 4.30 0.00 3.40 3.25 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 21 R 9.00 3.57 0.00 1.85 1.82 0.00 3.33 0.00 0.00 2.98 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 22 G 8.20 3.80 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 0.00 0.00 0.00 23 I 7.47 4.08 1.63 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.70 -0.28 0.00 0.00 24 S 8.29 4.62 0.00 4.05 4.02 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 25 L 8.59 4.24 0.00 2.05 1.81 1.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.15 4.18 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 0.00 0.00 0.00 0.00 0.00 27 N 8.07 4.45 0.00 2.73 2.78 0.00 0.00 6.95 7.73 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 28 W 8.03 4.34 0.00 3.51 3.08 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 29 M 8.66 4.17 0.00 2.14 2.36 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.13 3.27 0.00 2.55 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 31 L 8.15 4.01 0.00 1.83 1.89 0.46 -0.30 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 32 A 8.24 4.24 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 33 K 8.15 2.74 0.00 1.73 1.61 0.00 0.61 0.00 0.00 0.90 0.00 0.00 2.67 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.15 0.33 7.81 34 W 7.79 4.23 0.00 3.35 3.28 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 35 E 8.41 4.35 0.00 2.03 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 2.56 2.53 0.00 36 S 7.88 4.52 0.00 4.06 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 37 G 8.37 3.35 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 0.00 38 Y 7.64 3.64 0.00 3.27 2.94 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 39 N 7.61 5.31 0.00 2.78 2.86 0.00 0.00 7.01 7.10 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 40 T 8.87 4.01 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 1.45 0.00 0.00 41 R 8.15 4.35 0.00 1.99 2.03 0.00 3.18 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 1.64 1.58 0.00 42 A 7.68 4.34 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 43 T 8.29 5.50 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 1.30 0.00 0.00 44 N 8.44 4.84 0.00 2.83 2.75 0.00 0.00 6.79 7.56 0.00 0.00 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 Y 8.66 4.78 0.00 2.97 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 46 N 8.42 4.81 0.00 2.63 2.58 0.00 0.00 6.66 6.64 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 47 A 8.16 3.59 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 48 G 7.96 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 49 D 7.00 4.64 0.00 2.64 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 50 R 8.34 4.19 0.00 2.06 2.28 0.00 3.14 0.00 0.00 3.18 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 51 S 7.97 4.85 0.00 4.03 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 52 T 8.82 5.12 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 0.67 0.00 0.00 53 D 9.04 5.39 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 54 Y 9.10 5.00 0.00 2.94 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 55 G 8.83 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 0.00 0.00 0.00 0.00 56 I 8.06 4.02 1.66 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.34 0.03 0.00 0.00 57 F 7.95 4.89 0.00 3.19 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 58 Q 7.84 3.57 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.27 4.39 2.13 0.00 0.00 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 1.40 1.15 1.09 0.00 0.00 60 N 9.17 5.30 0.00 3.09 3.03 0.00 0.00 6.96 7.55 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 61 S 9.13 4.54 0.00 4.10 4.40 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.84 3.81 0.00 1.63 1.70 0.00 2.65 0.00 0.00 2.79 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 63 Y 7.61 4.24 0.00 1.47 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 0.00 0.00 0.00 64 W 7.86 4.78 0.00 3.61 3.30 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 65 C 7.91 5.50 0.00 3.16 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 66 N 8.92 4.87 0.00 2.80 2.71 0.00 0.00 7.04 8.55 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 67 D 8.59 4.82 0.00 2.85 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 68 G 8.73 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 0.00 0.00 0.00 69 K 8.35 4.63 0.00 1.87 1.84 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.45 7.81 70 T 7.91 4.54 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 1.19 0.00 0.00 71 P 0.00 4.14 0.00 2.13 1.97 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 72 G 8.79 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 73 A 7.71 4.35 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 74 G 8.18 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 75 N 7.99 4.93 0.00 2.72 2.58 0.00 0.00 6.75 7.93 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 76 A 8.53 3.91 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 77 C 8.41 4.60 0.00 3.29 3.24 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 78 H 8.05 4.05 0.00 3.26 3.35 0.00 5.81 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 79 L 8.50 4.80 0.00 1.66 1.50 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.38 4.60 0.00 3.83 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 81 C 8.81 4.13 0.00 2.27 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 82 S 7.67 3.88 0.00 3.78 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 83 A 7.74 4.07 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 84 L 7.83 4.43 0.00 1.91 1.81 1.06 0.44 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 85 L 7.83 5.03 0.00 1.77 1.71 1.13 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.79 4.37 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 87 D 8.60 4.42 0.00 2.62 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 88 N 8.04 4.53 0.00 2.69 2.74 0.00 0.00 6.93 7.94 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 89 I 8.44 4.25 1.75 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.00 0.96 0.00 0.00 90 A 8.38 3.93 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 91 D 8.08 4.26 0.00 2.74 2.74 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 0.00 0.00 0.00 92 A 7.97 4.06 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 93 V 8.30 3.41 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 0.70 0.00 0.00 0.85 0.00 0.00 94 A 8.10 3.86 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 95 C 8.53 4.25 0.00 3.14 3.30 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 96 A 8.27 3.87 0.73 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 0.00 0.00 97 K 7.61 3.82 0.00 1.67 1.47 0.00 1.31 0.00 0.00 0.85 0.00 0.00 2.32 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.90 7.81 98 R 7.79 4.09 0.00 2.00 2.17 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 99 V 7.62 2.63 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 -0.23 0.00 0.00 -0.46 0.00 0.00 100 V 7.88 3.80 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 1.09 0.00 0.00 1.45 0.00 0.00 101 R 7.59 4.18 0.00 1.97 2.05 0.00 3.24 0.00 0.00 3.40 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.14 0.00 102 D 7.62 4.66 0.00 3.03 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 0.00 103 P 0.00 4.17 0.00 2.01 2.12 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 104 Q 8.19 4.02 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.70 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 105 G 7.96 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 0.00 106 I 7.72 3.83 1.04 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.86 -0.89 0.00 0.00 107 R 7.26 4.25 0.00 1.94 2.05 0.00 3.23 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.49 0.00 108 A 7.55 4.03 0.84 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 0.00 0.00 109 W 8.14 4.71 0.00 3.61 3.25 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 0.00 110 V 8.79 3.72 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 1.19 0.00 0.00 1.01 0.00 0.00 111 A 8.27 4.02 1.51 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 0.00 112 W 8.44 4.01 0.00 3.47 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.22 3.75 0.00 2.02 2.00 0.00 3.35 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.16 0.00 114 N 8.29 4.41 0.00 2.69 2.72 0.00 0.00 6.87 8.38 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 0.00 115 R 7.79 4.24 0.00 1.04 0.75 0.00 2.21 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.06 0.00 116 C 7.25 4.54 0.00 1.48 2.63 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 0.00 0.00 0.00 0.00 117 Q 6.83 3.08 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.80 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 118 N 8.59 4.18 0.00 2.78 2.81 0.00 0.00 6.85 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 0.00 119 R 7.30 4.56 0.00 1.73 1.77 0.00 3.23 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 0.00 120 D 8.45 4.57 0.00 2.64 2.63 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 0.00 0.00 0.00 0.00 121 V 8.09 4.61 2.37 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 0.95 0.00 0.00 1.04 0.00 0.00 122 R 7.97 4.05 0.00 1.96 2.02 0.00 3.17 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 123 Q 8.23 3.99 0.00 2.05 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.90 0.00 0.00 0.00 0.00 0.00 2.17 1.58 0.00 124 Y 7.75 4.19 0.00 3.22 3.17 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 0.00 125 V 7.82 4.37 2.14 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 0.90 0.00 0.00 1.06 0.00 0.00 126 Q 7.66 4.15 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.73 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 127 G 8.96 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 0.00 0.00 0.00 128 C 8.14 4.46 0.00 3.08 3.14 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 0.00 129 G 8.11 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 0.00 0.00 0.00 130 V 7.86 4.01 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 0.85 0.00 0.00 0.96 0.00 0.00