NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1503 8.1727 122.0472 56.2770 34.1357 174.1466 2 V 4.7081 8.1329 126.7223 60.5997 32.4196 174.4420 3 F 4.4782 10.0224 128.7049 57.5667 40.2488 174.8761 4 E 4.2859 9.0475 120.6273 55.7004 30.9523 177.0459 5 R 3.3691 9.0252 121.2378 60.7071 29.9801 179.5623 6 C 4.3493 8.0298 115.3215 59.5905 40.2394 175.6756 7 E 3.9107 8.1274 120.7920 59.2831 29.3179 178.5242 8 L 3.5015 7.9588 120.0640 57.7287 42.0505 178.5760 9 A 3.9118 7.8147 120.7581 55.4327 18.2608 179.9209 10 R 3.8940 8.0146 116.4073 59.5702 30.1591 179.4236 11 T 3.8417 7.9280 115.5763 66.6576 68.5610 176.6946 12 L 3.8562 8.2435 121.2473 57.4877 41.5849 179.4559 13 K 3.9077 8.0929 119.6253 59.5870 31.9445 178.9050 14 R 3.9667 8.0234 117.9323 58.9294 30.0184 177.4600 15 L 4.3860 7.3789 116.0699 54.0586 41.7431 176.7836 16 G 3.8456 7.7929 106.8328 47.0577 0.0000 175.0059 17 M 4.0011 7.7211 120.2929 55.8339 32.5728 175.6946 18 D 4.4725 8.0089 117.8233 55.8402 40.7832 175.5667 19 G 3.9366 9.1439 115.1783 45.6063 0.0000 171.7089 20 Y 3.9576 8.2409 121.9814 58.7124 39.0971 176.5016 21 R 3.5227 8.8941 127.1227 57.3024 27.7914 177.1416 22 G 3.8089 8.1787 102.1331 45.8523 0.0000 173.6140 23 I 4.0783 7.6006 122.1648 59.1017 38.1412 175.9251 24 S 4.6295 8.3145 120.2519 57.7230 63.9667 174.9155 25 L 4.2069 8.6862 123.6007 58.5824 41.7057 179.3161 26 A 4.1434 8.1720 120.1159 55.3373 18.2625 179.2526 27 N 4.4376 8.1457 114.9752 56.2990 38.5340 177.7321 28 W 4.2235 8.0343 119.9476 59.8438 29.0693 178.3739 29 M 4.1198 8.4129 118.8498 58.6381 31.4650 177.9224 30 C 3.1804 8.0869 118.6616 59.0877 43.4044 175.3763 31 L 3.9720 8.1174 121.7108 58.2736 41.7859 178.7778 32 A 4.2785 8.4350 122.3381 54.3586 18.2710 179.4200 33 K 2.8848 8.3147 118.3160 59.4121 32.0527 179.1883 34 W 4.2193 7.6646 117.3824 59.2812 29.0356 178.3340 35 E 4.3550 8.4581 118.8821 58.7030 29.2954 177.7856 36 S 4.5186 8.0897 109.3135 56.6852 64.8634 174.5898 37 G 3.7045 8.0558 109.0307 46.7800 0.0000 173.0550 38 Y 3.6185 7.6681 113.6204 58.8930 35.0621 169.0590 39 N 5.3120 7.5766 118.7875 51.8945 40.1869 175.2907 40 T 4.0538 9.1543 118.0262 63.8429 69.1302 175.9204 41 R 4.4474 8.1437 116.8642 55.6122 30.1639 176.2261 42 A 4.3206 7.6839 122.4736 52.7742 19.2780 177.0212 43 T 5.0352 8.3645 111.0917 60.0418 72.5830 173.1539 44 N 4.8471 8.7981 121.7808 52.4791 42.2636 172.4247 45 Y 4.6142 8.7528 128.0687 57.2312 40.8362 173.9353 46 N 4.7658 8.3757 124.7912 50.9925 38.3636 175.0339 47 A 3.6503 8.2190 127.5782 54.8775 18.8868 180.1288 48 G 3.7369 8.0637 103.7986 48.2082 0.0000 173.6552 49 D 4.6983 6.9911 111.8305 51.9452 40.3899 175.6020 50 R 4.0091 8.2780 116.5841 57.2919 28.0073 175.7734 51 S 4.9887 7.6179 111.5238 56.9789 66.6282 172.6779 52 T 5.1215 8.9239 115.8508 61.9929 72.9037 172.8577 53 D 5.4469 9.1208 125.2505 53.3843 43.1546 175.0524 54 Y 4.9937 9.3057 121.1766 57.4688 41.4543 177.3717 55 G 4.4762 9.2025 112.5520 46.0853 0.0000 173.3160 56 I 3.9424 8.1376 116.4494 63.0180 37.9107 178.0066 57 F 4.8346 7.8511 115.3215 56.4378 39.8111 175.2996 58 Q 3.5976 7.9864 119.2624 57.1224 26.7101 174.2355 59 I 4.3334 8.0390 118.6163 61.2673 39.1956 176.8934 60 N 5.4272 9.1696 125.6363 53.2812 39.8260 175.8284 61 S 4.6157 8.9972 120.3686 60.4036 63.4084 175.4585 62 R 3.6727 8.5574 122.0979 58.7226 30.3327 177.8764 63 Y 4.2152 7.4609 114.2461 57.9865 40.8090 177.3253 64 W 4.7469 8.1353 119.2911 58.0048 29.9930 173.7938 65 C 5.6016 7.8963 110.6032 53.4736 45.1383 171.8080 66 N 4.9598 8.8071 119.7216 52.2020 39.8154 174.8752 67 D 4.8778 8.3992 122.5522 52.1489 40.5007 178.1898 68 G 4.0637 8.5620 108.7194 46.2368 0.0000 174.8102 69 K 4.3990 7.9982 116.4404 56.7226 33.2215 176.0397 70 T 4.5519 7.7562 117.2875 61.5627 69.3533 172.8554 71 P 4.1804 0.0000 0.0000 64.3346 31.8778 176.4980 72 G 3.8899 8.5248 110.5704 46.2745 0.0000 172.8161 73 A 4.5076 7.6700 119.6645 50.7571 20.9946 177.1560 74 V 4.3629 8.4138 112.2217 59.4905 35.7502 176.4239 75 N 4.8997 8.0861 116.9446 52.0235 37.9429 174.3998 76 A 3.8700 9.0959 125.6012 55.0453 19.0532 178.8153 77 C 4.4818 8.4078 111.1407 57.8583 41.0466 173.0955 78 H 4.1320 7.8337 116.3762 56.5730 26.2288 174.1435 79 L 4.8162 8.4415 118.1762 52.8522 46.5314 176.8277 80 S 4.5981 8.3579 115.3929 58.0746 63.2181 176.0271 81 C 4.0931 8.7384 123.7784 59.6617 40.8176 176.3017 82 S 3.8672 7.8536 114.7041 61.4000 61.6059 176.0583 83 A 4.0853 7.8169 122.4230 54.4618 17.9766 177.9344 84 L 4.4635 7.8791 116.6099 55.0548 41.6865 177.6065 85 L 5.0584 7.8509 116.9545 54.5130 42.5203 176.7564 86 Q 4.3683 7.8720 117.6438 55.3500 29.5791 175.9782 87 D 4.3814 8.5330 120.0359 57.1613 41.1247 176.7578 88 N 4.5488 8.0187 118.2327 53.2411 39.1318 174.5814 89 I 4.2293 8.4703 119.0256 61.0453 37.9443 177.0011 90 A 3.9415 8.5916 125.1768 55.9670 18.1057 180.1176 91 D 4.2667 8.0735 116.4325 57.4259 40.9913 178.6576 92 A 4.0640 7.9880 120.8236 55.2389 18.3548 179.7219 93 V 3.4538 8.2787 116.9435 65.9542 31.5771 178.0509 94 A 3.8166 8.0888 120.6710 55.2939 18.1044 178.8641 95 C 4.2235 8.4974 116.9083 59.6960 40.9412 175.5496 96 A 3.9669 8.4216 122.8307 55.1052 17.6140 179.7557 97 K 3.7477 7.6990 116.2360 59.4400 32.3752 179.1155 98 R 4.0932 7.7870 118.9706 59.4114 30.0940 178.5964 99 V 2.4915 7.6206 118.0961 65.7960 30.9455 178.0373 100 V 3.8932 7.8058 110.2752 62.7780 31.2966 177.9530 101 R 4.1100 7.6681 117.9109 57.7160 30.4385 176.0702 102 D 4.7109 7.4742 118.5214 52.9196 41.7999 175.2015 103 P 4.2270 0.0000 0.0000 66.3587 30.9322 177.9489 104 Q 4.0139 8.1878 117.5360 56.3300 29.9727 177.3982 105 G 3.7723 7.8673 107.0683 46.8852 0.0000 176.3817 106 I 3.4667 7.8075 120.6227 63.5514 37.8528 177.7381 107 R 4.2742 7.3657 117.3273 57.6258 29.9572 177.4101 108 A 4.1074 7.6527 120.7381 53.6072 18.6267 177.7002 109 W 4.6722 8.1143 116.9449 55.4577 29.6723 177.5733 110 V 3.7586 8.6702 123.8247 65.9044 30.8940 177.6655 111 A 4.0389 8.2664 120.3197 54.6615 18.1655 179.2327 112 W 3.9842 8.3710 127.1158 60.6176 30.5715 178.3802 113 R 3.7684 8.2354 116.4149 59.4554 29.6746 178.3754 114 N 4.4251 8.1780 115.2380 55.2060 38.6482 176.1566 115 R 4.2330 7.8049 112.9548 55.6876 30.6463 174.8730 116 C 4.5022 7.3431 114.6986 58.4651 42.6184 174.1165 117 Q 3.1794 6.4234 119.3615 57.3523 28.5985 176.7466 118 G 3.8092 8.6552 111.6397 46.0234 0.0000 172.8688 119 R 4.4136 7.4374 117.8749 53.8078 32.6256 175.4710 120 D 4.5630 8.4216 118.7258 54.1397 40.4925 175.7256 121 V 4.5928 8.2090 119.0920 61.1735 32.4519 178.1950 122 R 4.0254 8.2088 122.2957 59.3354 30.3368 178.7422 123 Q 3.9355 8.2983 115.4055 59.5493 28.2564 178.7943 124 Y 4.3319 7.8710 115.1021 60.0452 38.2986 176.9681 125 V 4.3778 8.0276 111.1772 60.7085 32.7862 175.4275 126 Q 4.2191 7.5973 119.4802 57.2569 28.6902 177.0853 127 G 3.9890 8.9517 110.9231 45.8551 0.0000 174.6066 128 C 4.3804 7.9765 115.8287 57.3203 40.5119 174.1398 129 G 3.8588 8.1761 107.1557 46.6063 0.0000 174.0718 130 V 3.9994 7.8701 118.0916 61.0735 31.9941 175.8485 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 1.98 1.60 0.00 1.23 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 1.10 7.81 2 V 8.13 4.71 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 0.91 0.00 0.00 0.94 0.00 0.00 3 F 10.02 4.48 0.00 2.84 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 4 E 9.05 4.29 0.00 1.94 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 2.42 2.40 0.00 5 R 9.03 3.37 0.00 1.98 1.93 0.00 3.43 0.00 0.00 3.47 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.83 0.00 6 C 8.03 4.35 0.00 3.01 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 8.13 3.91 0.00 2.07 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 0.00 2.63 2.44 0.00 8 L 7.96 3.50 0.00 1.27 1.33 -0.18 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.81 3.91 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 10 R 8.01 3.89 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 11 T 7.93 3.84 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 1.22 0.00 0.00 12 L 8.24 3.86 0.00 1.70 1.57 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.09 3.91 0.00 1.99 1.91 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 8.02 3.97 0.00 2.04 1.92 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.38 4.39 0.00 1.67 1.55 0.87 0.96 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 16 G 7.79 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 0.00 0.00 0.00 17 M 7.72 4.00 0.00 1.34 1.96 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.21 0.00 18 D 8.01 4.47 0.00 2.67 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 19 G 9.14 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 20 Y 8.24 3.96 0.00 3.34 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 21 R 8.89 3.52 0.00 1.89 1.83 0.00 3.27 0.00 0.00 3.01 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 1.44 0.00 22 G 8.18 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 0.00 0.00 0.00 23 I 7.60 4.08 1.68 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.61 -0.25 0.00 0.00 24 S 8.31 4.63 0.00 4.06 4.03 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 25 L 8.69 4.21 0.00 2.00 1.80 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.14 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 8.15 4.44 0.00 2.83 2.76 0.00 0.00 6.96 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 28 W 8.03 4.22 0.00 3.48 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 29 M 8.41 4.12 0.00 2.13 2.35 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.90 0.00 30 C 8.09 3.18 0.00 2.59 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 31 L 8.12 3.97 0.00 1.84 1.84 0.54 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.44 4.28 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 2.88 0.00 1.50 1.74 0.00 0.66 0.00 0.00 0.99 0.00 0.00 2.57 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.10 0.21 7.81 34 W 7.66 4.22 0.00 3.37 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 35 E 8.46 4.35 0.00 2.04 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 2.61 2.45 0.00 36 S 8.09 4.52 0.00 4.05 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 37 G 8.06 3.70 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 0.00 0.00 0.00 38 Y 7.67 3.62 0.00 3.26 2.98 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 39 N 7.58 5.31 0.00 2.91 2.81 0.00 0.00 7.02 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 9.15 4.05 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 1.46 0.00 0.00 41 R 8.14 4.45 0.00 1.98 2.09 0.00 3.08 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 42 A 7.68 4.32 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 43 T 8.36 5.04 4.03 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 1.32 0.00 0.00 44 N 8.80 4.85 0.00 3.03 2.67 0.00 0.00 6.91 7.15 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 45 Y 8.75 4.61 0.00 2.98 2.84 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 46 N 8.38 4.77 0.00 2.65 2.59 0.00 0.00 6.59 6.76 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 47 A 8.22 3.65 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 48 G 8.06 3.74 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 0.00 0.00 0.00 49 D 6.99 4.70 0.00 2.77 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 50 R 8.28 4.01 0.00 2.03 2.21 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 51 S 7.62 4.99 0.00 3.82 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 52 T 8.92 5.12 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 0.64 0.00 0.00 53 D 9.12 5.45 0.00 2.67 2.84 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 54 Y 9.31 4.99 0.00 2.90 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 55 G 9.20 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 3.94 1.68 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 2.34 0.04 0.00 0.00 57 F 7.85 4.83 0.00 3.24 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 58 Q 7.99 3.60 0.00 2.53 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.74 0.00 59 I 8.04 4.33 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.00 1.14 0.00 0.00 60 N 9.17 5.43 0.00 3.12 3.11 0.00 0.00 6.97 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 61 S 9.00 4.62 0.00 4.06 4.37 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 62 R 8.56 3.67 0.00 1.50 0.66 0.00 2.76 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 63 Y 7.46 4.22 0.00 1.43 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 0.00 0.00 0.00 64 W 8.14 4.75 0.00 3.70 3.33 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 65 C 7.90 5.60 0.00 3.13 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 66 N 8.81 4.96 0.00 2.79 2.69 0.00 0.00 7.03 8.26 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 67 D 8.40 4.88 0.00 2.89 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 68 G 8.56 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 69 K 8.00 4.40 0.00 1.92 1.93 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.47 7.81 70 T 7.76 4.55 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 1.15 0.00 0.00 71 P 0.00 4.18 0.00 2.02 1.99 0.00 3.80 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 2.04 2.10 0.00 72 G 8.52 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 73 A 7.67 4.51 1.21 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 0.00 0.00 0.00 74 V 8.41 4.36 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 0.62 0.00 0.00 0.84 0.00 0.00 75 N 8.09 4.90 0.00 2.75 2.60 0.00 0.00 6.78 7.99 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 76 A 9.10 3.87 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 77 C 8.41 4.48 0.00 3.30 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 78 H 7.83 4.13 0.00 3.31 3.35 0.00 5.80 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 79 L 8.44 4.82 0.00 1.66 1.49 0.96 0.99 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 80 S 8.36 4.60 0.00 3.83 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 81 C 8.74 4.09 0.00 2.26 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 82 S 7.85 3.87 0.00 3.90 3.84 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 83 A 7.82 4.09 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 84 L 7.88 4.46 0.00 1.91 1.81 1.06 0.67 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 85 L 7.85 5.06 0.00 1.77 1.70 1.12 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.87 4.37 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 87 D 8.53 4.38 0.00 2.61 2.65 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 0.00 0.00 0.00 0.00 88 N 8.02 4.55 0.00 2.69 2.75 0.00 0.00 6.96 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 8.47 4.23 1.78 0.00 0.00 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 1.61 1.00 1.00 0.00 0.00 90 A 8.59 3.94 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 8.07 4.27 0.00 2.75 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 92 A 7.99 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 8.28 3.45 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 0.77 0.00 0.00 0.92 0.00 0.00 94 A 8.09 3.82 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 95 C 8.50 4.22 0.00 3.14 3.32 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 96 A 8.42 3.97 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 97 K 7.70 3.75 0.00 1.60 1.27 0.00 1.27 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 1.00 7.81 98 R 7.79 4.09 0.00 2.01 2.18 0.00 3.31 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 1.87 2.06 0.00 99 V 7.62 2.49 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 -0.27 0.00 0.00 -0.63 0.00 0.00 100 V 7.81 3.89 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 1.11 0.00 0.00 1.45 0.00 0.00 101 R 7.67 4.11 0.00 2.18 2.08 0.00 3.35 0.00 0.00 3.31 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 102 D 7.47 4.71 0.00 3.09 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 4.23 0.00 2.15 2.20 0.00 3.79 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 1.99 2.01 0.00 104 Q 8.19 4.01 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.91 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.87 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 0.00 106 I 7.81 3.47 0.96 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.63 0.00 0.00 107 R 7.37 4.27 0.00 2.08 2.04 0.00 3.25 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.62 0.00 108 A 7.65 4.11 0.79 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 0.00 0.00 109 W 8.11 4.67 0.00 3.48 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 0.00 110 V 8.67 3.76 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 1.17 0.00 0.00 0.99 0.00 0.00 111 A 8.27 4.04 1.54 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 0.00 112 W 8.37 3.98 0.00 3.48 3.51 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 0.00 113 R 8.24 3.77 0.00 2.11 2.00 0.00 3.55 0.00 0.00 3.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.11 0.00 114 N 8.18 4.43 0.00 2.66 2.72 0.00 0.00 6.88 7.24 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 0.00 115 R 7.80 4.23 0.00 0.87 1.10 0.00 2.80 0.00 0.00 2.90 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.79 0.00 116 C 7.34 4.50 0.00 1.58 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 0.00 117 Q 6.42 3.18 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.22 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 118 G 8.66 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 0.00 0.00 0.00 119 R 7.44 4.41 0.00 1.87 1.83 0.00 3.15 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 120 D 8.42 4.56 0.00 2.62 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 0.00 121 V 8.21 4.59 2.43 0.00 0.00 0.00 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 0.00 122 R 8.21 4.03 0.00 1.94 2.02 0.00 3.33 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 1.69 1.69 0.00 123 Q 8.30 3.94 0.00 2.00 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 2.28 1.86 0.00 124 Y 7.87 4.33 0.00 3.24 3.15 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 0.00 0.00 0.00 0.00 125 V 8.03 4.38 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 1.04 0.00 0.00 1.06 0.00 0.00 126 Q 7.60 4.22 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 127 G 8.95 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 0.00 128 C 7.98 4.38 0.00 3.11 3.15 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 0.00 0.00 0.00 0.00 129 G 8.18 3.86 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 0.00 0.00 0.00 130 V 7.87 4.00 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 0.75 0.00 0.00 0.96 0.00 0.00