NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5419 8.1476 118.1917 55.2787 32.7653 174.7538 2 T 4.0452 8.4264 111.5864 60.1392 71.4286 174.2707 3 M 4.0765 8.6070 120.2976 58.7377 32.4983 178.7196 4 E 3.9491 8.2300 118.9718 59.5905 29.7124 178.7764 5 Q 4.0063 8.0415 117.5133 58.6997 28.7582 178.3681 6 F 4.1556 8.3766 121.6890 61.4817 39.2751 177.1983 7 L 3.7644 7.9016 117.0645 58.0753 41.3432 179.4403 8 T 4.0190 7.6819 116.0228 66.2791 68.3254 176.9131 9 S 4.0335 8.1255 116.6651 61.4135 62.7513 176.3975 10 L 3.6829 7.2489 121.9445 57.9142 41.3885 179.4366 11 D 4.3560 7.8740 117.9102 57.4465 40.5872 178.6208 12 M 4.0492 7.4702 118.1342 58.3314 32.1361 178.5173 13 I 3.7841 7.9850 120.3060 64.3563 37.3206 178.2437 14 R 4.1199 7.9120 119.7163 59.7575 29.6912 178.5299 15 S 4.5300 8.0746 112.5397 60.9819 62.8175 175.7378 16 G 3.9922 7.7049 106.4852 44.8460 0.0000 173.3729 17 C 4.8235 7.7511 116.8092 61.3742 31.1266 175.7528 18 A 4.2144 9.0737 122.8216 55.0712 17.8805 177.9580 19 P 4.3802 0.0000 0.0000 65.1365 31.4402 177.7026 20 K 3.9337 7.8549 116.3908 57.5209 32.1520 176.4315 21 F 4.9332 7.9260 116.1951 55.4622 42.6493 174.7251 22 K 4.4470 9.5350 122.4058 55.1934 31.5327 176.4205 23 L 4.8235 8.1166 122.9788 52.1759 45.5093 176.9917 24 K 4.3885 8.2555 120.8335 55.4642 33.8277 177.9996 25 T 3.8591 8.5776 121.4830 66.8792 68.4383 176.2845 26 E 3.8726 8.0361 118.8262 59.4277 29.6012 178.8976 27 D 3.9941 7.8334 119.3803 56.9863 40.9435 178.5138 28 L 4.0069 7.7715 119.1808 57.8009 41.6041 179.0913 29 D 4.3721 8.3396 119.1750 57.5684 40.6782 179.2752 30 R 3.9587 7.7620 117.8773 59.2772 29.9910 179.1663 31 L 3.7387 7.9695 118.8051 57.6964 41.4724 179.3571 32 R 4.8147 8.3338 120.1354 58.1850 29.6017 177.8707 33 V 4.3571 7.2776 108.9318 60.7051 31.8125 176.0642 34 G 4.3441 8.5889 107.3087 47.0802 0.0000 174.1168 35 D 4.8331 8.4888 121.1332 52.8209 40.1247 175.6041 36 F 4.3821 8.7522 122.3684 57.1093 39.9137 176.6422 37 N 4.8134 8.3044 121.5302 51.5676 37.5113 174.3778 38 F 4.9403 7.0361 111.8530 55.0597 40.9704 172.7767 39 P 4.2343 0.0000 0.0000 61.9344 31.5310 174.6087 40 P 4.3542 0.0000 0.0000 61.7030 32.6599 176.5717 41 S 4.3954 8.0926 115.3902 57.6753 65.4143 175.0313 42 Q 3.8652 8.4239 122.3239 59.3097 28.6933 177.8687 43 D 4.3636 8.0497 119.3802 57.3932 41.0570 178.2981 44 L 3.8711 7.7078 120.5841 58.4976 42.0495 178.9929 45 M 3.9854 7.7091 118.3111 58.6866 31.9191 178.2267 46 C 4.3490 8.4064 116.9617 59.6946 38.9788 175.4446 47 Y 3.5170 7.8068 121.9678 60.7461 38.3722 178.4021 48 T 4.2611 7.9438 110.4711 64.5723 68.7209 176.4460 49 K 4.1027 7.9703 122.0788 59.5309 32.1888 178.2207 50 C 4.1340 8.2032 118.9439 62.5603 31.3805 175.7157 51 V 3.4358 7.6847 119.6774 66.2355 31.1141 178.2921 52 S 4.3181 8.3644 114.8017 61.4672 62.4186 176.6781 53 L 4.0860 8.1275 121.5505 57.8813 41.3969 178.8084 54 M 4.1519 7.7449 117.0490 58.5859 32.2727 177.9580 55 A 4.1529 7.7048 119.7548 53.0518 18.5874 178.6467 56 G 3.9271 7.7501 104.1295 45.6924 0.0000 174.6776 57 S 4.2866 7.9175 114.5717 59.8713 63.6277 174.1341 58 V 5.1878 7.7179 112.3281 58.3839 35.4794 174.4350 59 N 4.8553 8.2371 119.0828 51.2861 39.3227 175.7458 60 K 4.1705 8.4655 116.3554 58.6544 31.7838 178.1333 61 K 4.2241 8.3008 117.6221 56.0204 32.3962 177.7165 62 G 3.8995 8.1680 106.9938 46.1395 0.0000 173.5689 63 E 4.1262 8.5852 120.6504 54.9207 29.4320 176.0653 64 F 4.6198 8.3848 127.3754 58.0192 39.8951 174.4818 65 N 4.4099 8.4080 128.0614 51.5922 38.1711 174.9110 66 A 3.6680 8.0647 126.7267 54.4954 18.6559 177.0434 67 P 4.1523 0.0000 0.0000 65.7253 31.3431 178.8083 68 K 3.9319 8.0573 117.6486 59.0502 32.1719 178.5026 69 A 3.9606 7.9938 121.3686 55.3269 18.1364 179.5060 70 L 3.9462 7.8131 115.6873 58.0233 41.7440 179.4537 71 A 4.1442 7.8301 119.7653 55.2657 18.6168 179.4433 72 Q 4.1230 8.4675 116.7540 58.6354 28.6734 178.6129 73 L 3.8957 7.9141 120.5126 57.6215 41.5384 177.8670 74 P 4.2505 0.0000 0.0000 64.6834 31.3310 177.1129 75 H 4.7761 8.4423 113.7016 55.4876 29.2741 174.8193 76 L 4.6393 7.6420 119.5757 55.4431 43.7837 177.0251 77 V 4.1080 7.6300 109.9894 58.2283 34.5170 173.8905 78 P 4.6403 0.0000 0.0000 61.1095 32.2090 175.3066 79 P 4.1336 0.0000 0.0000 66.2273 30.8662 178.6750 80 E 3.9827 8.1553 115.3849 58.6098 29.6990 177.9561 81 M 4.4593 7.8591 116.9381 55.0206 32.8481 177.3416 82 M 3.9198 7.5990 120.4263 58.6779 32.2172 177.9763 83 E 3.9028 8.0863 118.3978 59.5246 29.8333 178.4080 84 M 4.0123 7.9751 117.5725 58.9208 32.2898 178.2694 85 S 4.0690 8.0898 115.1592 61.5094 63.0800 176.8319 86 R 3.9219 8.3336 121.1771 59.4036 29.8691 179.3675 87 K 4.0750 8.2145 118.1211 59.4352 32.1016 179.7388 88 S 4.2128 8.0538 115.7448 61.3438 62.8349 176.7681 89 V 4.0402 8.2187 123.6275 66.9542 31.1575 178.6330 90 E 4.1015 7.9986 116.0579 61.0864 29.6474 180.4045 91 A 4.4394 8.1006 120.1766 53.8471 18.8119 177.9072 92 C 4.7550 8.0130 112.8551 56.3024 41.1170 175.7032 93 R 4.1773 7.9483 118.0051 58.7190 29.1346 177.2207 94 D 4.6544 8.0294 116.9985 54.7717 41.0116 178.4182 95 T 3.8845 7.7390 117.2136 67.0748 68.1960 175.2504 96 H 4.5465 8.1874 114.0661 57.4859 28.6840 176.6420 97 K 4.1872 8.0202 120.9103 58.1478 32.2984 177.7558 98 Q 3.9291 7.7906 116.8474 57.0930 28.9862 176.0197 99 F 4.9614 7.8558 115.1743 55.5583 42.0648 174.8103 100 K 4.3933 8.6963 121.9507 57.7061 33.7225 177.5150 101 E 4.2984 8.0012 119.3224 55.1895 31.3467 176.8581 102 S 4.4001 8.6565 123.1294 61.3291 62.9002 177.6019 103 C 4.2840 8.5126 119.9323 59.3565 41.2756 175.2458 104 E 3.7939 8.4257 120.8229 59.5231 29.1443 178.9276 105 R 3.9041 8.2324 118.0912 59.4248 30.1318 179.2791 106 V 3.5096 7.5442 117.6814 66.0697 31.6071 177.2288 107 Y 3.9628 7.9082 120.6672 60.3122 38.6095 178.3702 108 Q 3.6307 7.9156 118.6643 58.7980 28.5292 178.9300 109 T 3.2348 7.4153 116.7244 66.1232 68.4041 176.6080 110 A 3.5286 7.5154 122.9731 54.7792 18.4079 179.5378 111 K 2.4800 7.0897 118.3529 59.0805 32.0624 178.1308 112 C 3.9113 7.4247 118.5920 59.4619 40.6693 175.3926 113 F 4.1213 7.2040 119.6360 60.6694 38.2357 177.8283 114 S 3.4640 6.6977 112.0607 61.2672 62.6612 175.9975 115 E 4.1116 7.5422 120.5582 58.0131 29.3227 177.7237 116 N 4.9289 7.6075 114.1065 51.7616 39.2093 174.6111 117 A 4.3405 7.2982 125.8458 51.2383 18.4796 177.9457 118 D 4.8524 8.7516 121.2129 53.9821 39.7412 176.8660 119 G 4.0028 7.4291 107.7095 45.7954 0.0000 172.5969 120 Q 4.2474 8.7879 120.4281 55.7550 29.7150 174.8942 121 F 5.1132 8.9009 124.8903 56.7053 42.2166 173.8273 122 M 5.2730 7.7788 123.7919 52.1267 35.3871 174.3843 123 W 4.7024 8.7100 132.5492 54.4997 33.9509 173.7616 124 P 4.2712 0.0000 0.0000 63.1374 30.7376 176.0271 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 8.15 4.54 0.00 2.24 2.31 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 2 T 8.43 4.05 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 3 M 8.61 4.08 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.70 0.00 4 E 8.23 3.95 0.00 2.13 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 2.39 2.48 0.00 5 Q 8.04 4.01 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 6 F 8.38 4.16 0.00 3.09 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 7 L 7.90 3.76 0.00 1.65 1.68 0.97 0.85 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 8 T 7.68 4.02 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 1.18 0.00 0.00 9 S 8.13 4.03 0.00 3.94 4.19 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 10 L 7.25 3.68 0.00 1.61 1.58 0.65 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.87 4.36 0.00 2.77 2.69 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 12 M 7.47 4.05 0.00 1.95 2.19 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 13 I 7.98 3.78 1.84 0.00 0.00 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 1.31 1.37 0.74 0.00 0.00 14 R 7.91 4.12 0.00 2.22 2.14 0.00 3.14 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 15 S 8.07 4.53 0.00 4.09 4.13 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 16 G 7.70 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 17 C 7.75 4.82 0.00 3.21 3.19 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 18 A 9.07 4.21 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 19 P 0.00 4.38 0.00 2.06 2.15 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 20 K 7.85 3.93 0.00 0.98 1.06 0.00 1.56 0.00 0.00 1.54 0.00 0.00 3.19 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.42 7.81 21 F 7.93 4.93 0.00 3.04 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 22 K 9.54 4.45 0.00 1.85 1.81 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 23 L 8.12 4.82 0.00 1.51 1.41 0.71 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.26 4.39 0.00 1.71 1.97 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.43 7.81 25 T 8.58 3.86 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 1.18 0.00 0.00 26 E 8.04 3.87 0.00 2.02 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 0.00 2.22 2.22 0.00 27 D 7.83 3.99 0.00 2.95 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 28 L 7.77 4.01 0.00 1.84 1.68 0.76 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.34 4.37 0.00 2.79 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 30 R 7.76 3.96 0.00 1.87 2.21 0.00 2.73 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 31 L 7.97 3.74 0.00 1.82 1.65 0.82 -0.13 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 32 R 8.33 4.81 0.00 2.09 2.21 0.00 3.13 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 33 V 7.28 4.36 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 0.78 0.00 0.00 1.10 0.00 0.00 34 G 8.59 4.34 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 0.00 35 D 8.49 4.83 0.00 2.72 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 36 F 8.75 4.38 0.00 2.86 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 37 N 8.30 4.81 0.00 2.81 2.98 0.00 0.00 6.90 7.02 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 38 F 7.04 4.94 0.00 3.12 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 39 P 0.00 4.23 0.00 2.08 2.02 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 40 P 0.00 4.35 0.00 1.48 1.14 0.00 3.50 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.44 0.00 41 S 8.09 4.40 0.00 4.04 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 42 Q 8.42 3.87 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 43 D 8.05 4.36 0.00 2.82 2.78 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 44 L 7.71 3.87 0.00 1.71 1.63 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 45 M 7.71 3.99 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.73 0.00 46 C 8.41 4.35 0.00 2.80 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 47 Y 7.81 3.52 0.00 2.56 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 48 T 7.94 4.26 4.21 0.00 0.00 0.00 0.00 0.00 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 49 K 7.97 4.10 0.00 1.91 2.11 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.52 7.81 50 C 8.20 4.13 0.00 3.45 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 51 V 7.68 3.44 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 0.26 0.00 0.00 0.37 0.00 0.00 52 S 8.36 4.32 0.00 4.25 4.13 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 53 L 8.13 4.09 0.00 1.84 1.77 0.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 54 M 7.74 4.15 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 55 A 7.70 4.15 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 56 G 7.75 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 57 S 7.92 4.29 0.00 4.34 4.29 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 58 V 7.72 5.19 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 1.29 0.00 0.00 1.02 0.00 0.00 59 N 8.24 4.86 0.00 2.96 2.98 0.00 0.00 5.97 7.02 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 60 K 8.47 4.17 0.00 1.80 1.95 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.49 7.81 61 K 8.30 4.22 0.00 2.02 1.87 0.00 1.91 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.45 7.81 62 G 8.17 3.90 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 0.00 0.00 0.00 63 E 8.59 4.13 0.00 2.19 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 0.00 2.41 2.30 0.00 64 F 8.38 4.62 0.00 2.91 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 65 N 8.41 4.41 0.00 2.66 2.59 0.00 0.00 6.64 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 66 A 8.06 3.67 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 67 P 0.00 4.15 0.00 2.12 2.09 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 68 K 8.06 3.93 0.00 1.75 1.70 0.00 1.70 0.00 0.00 1.99 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.47 7.81 69 A 7.99 3.96 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 70 L 7.81 3.95 0.00 1.80 1.76 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.83 4.14 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 72 Q 8.47 4.12 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 73 L 7.91 3.90 0.00 1.69 1.72 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.25 0.00 1.84 2.02 0.00 3.84 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.14 0.00 75 H 8.44 4.78 0.00 3.15 3.34 0.00 5.80 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.64 4.64 0.00 1.60 1.70 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.63 4.11 1.68 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 0.57 0.00 0.00 0.87 0.00 0.00 78 P 0.00 4.64 0.00 2.35 2.26 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 79 P 0.00 4.13 0.00 2.14 2.13 0.00 3.57 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 2.09 2.17 0.00 80 E 8.16 3.98 0.00 1.84 1.98 0.00 0.00 0.00 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 2.44 0.00 81 M 7.86 4.46 0.00 1.81 1.72 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 2.27 2.39 0.00 82 M 7.60 3.92 0.00 1.94 2.20 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.80 0.00 83 E 8.09 3.90 0.00 2.06 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 2.37 2.43 0.00 84 M 7.98 4.01 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.69 0.00 85 S 8.09 4.07 0.00 3.99 3.81 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 86 R 8.33 3.92 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 87 K 8.21 4.08 0.00 1.94 1.87 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.73 7.81 88 S 8.05 4.21 0.00 3.94 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 4.04 2.33 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 1.24 0.00 0.00 1.09 0.00 0.00 90 E 8.00 4.10 0.00 2.15 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 2.26 2.20 0.00 91 A 8.10 4.44 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 92 C 8.01 4.76 0.00 2.86 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 93 R 7.95 4.18 0.00 2.16 2.52 0.00 3.27 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.68 0.00 94 D 8.03 4.65 0.00 2.90 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 95 T 7.74 3.88 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 1.17 0.00 0.00 96 H 8.19 4.55 0.00 3.36 3.50 0.00 5.71 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.02 4.19 0.00 1.74 1.83 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.16 7.81 98 Q 7.79 3.93 0.00 0.94 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.64 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 99 F 7.86 4.96 0.00 2.98 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 0.00 100 K 8.70 4.39 0.00 1.77 1.87 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.40 7.81 101 E 8.00 4.30 0.00 2.05 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 2.40 2.33 0.00 102 S 8.66 4.40 0.00 4.14 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 0.00 103 C 8.51 4.28 0.00 3.28 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 0.00 104 E 8.43 3.79 0.00 2.13 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 2.44 2.24 0.00 105 R 8.23 3.90 0.00 2.11 2.14 0.00 3.40 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 106 V 7.54 3.51 2.25 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 1.22 0.00 0.00 1.05 0.00 0.00 107 Y 7.91 3.96 0.00 3.00 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 0.00 108 Q 7.92 3.63 0.00 1.51 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.04 1.16 0.00 109 T 7.42 3.23 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 -0.05 0.00 0.00 110 A 7.52 3.53 0.47 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 0.00 111 K 7.09 2.48 0.00 0.80 1.25 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.10 1.17 7.81 112 C 7.42 3.91 0.00 2.77 2.68 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 0.00 113 F 7.20 4.12 0.00 2.50 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 0.00 0.00 0.00 0.00 114 S 6.70 3.46 0.00 4.21 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 0.00 115 E 7.54 4.11 0.00 1.94 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 2.26 2.28 0.00 116 N 7.61 4.93 0.00 2.75 2.80 0.00 0.00 6.95 6.96 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 0.00 117 A 7.30 4.34 1.44 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 0.00 118 D 8.75 4.85 0.00 2.81 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 0.00 119 G 7.43 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 0.00 120 Q 8.79 4.25 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.65 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 121 F 8.90 5.11 0.00 3.11 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 0.00 122 M 7.78 5.27 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.40 0.00 123 W 8.71 4.70 0.00 3.77 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 0.00 124 P 0.00 4.27 0.00 1.70 1.87 0.00 2.20 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.69 0.00