NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6747 8.4249 119.1997 53.8722 39.8783 175.1853 4 Q 4.2808 7.2834 118.7733 52.6592 29.0268 174.6117 5 Y 4.6943 7.1439 120.0000 58.6507 40.6637 175.0240 6 Y 5.6215 8.0343 120.8043 56.5553 43.4593 173.4159 7 G 4.4852 6.5053 106.7736 47.0480 0.0000 172.9026 8 T 3.9324 8.1521 114.5623 60.5042 67.6357 172.6274 9 G 3.3911 9.5818 122.5016 44.7224 0.0000 172.9314 10 R 4.7060 7.9730 122.6880 54.3146 34.4477 175.1261 11 R 4.0913 8.7842 112.9551 56.4156 32.1745 172.5743 12 K 3.7956 9.7334 123.3410 57.7823 29.6117 174.3759 13 S 3.9901 8.0583 112.1688 57.9795 61.8193 169.5714 14 S 4.8393 7.8399 113.8105 57.1500 64.8982 173.0005 15 A 4.7126 8.4744 123.0718 51.3007 22.4378 175.9142 16 A 4.8797 7.7640 126.6326 52.4253 22.4172 176.4664 17 R 4.3555 7.8649 108.3274 56.3928 32.4349 172.8247 18 V 4.0938 7.1220 116.7390 59.8456 33.2765 175.0693 19 F 5.0520 8.6790 126.3693 56.1626 40.1150 175.0618 20 I 4.7557 8.7511 126.0250 59.4005 38.1216 175.4986 21 K 4.3309 8.4250 127.7331 53.9221 34.7277 172.2532 22 P 3.9621 0.0000 0.0000 64.7591 30.9265 175.5361 23 G 3.9909 9.0431 113.0520 46.3067 0.0000 171.1304 24 N 5.4074 9.1652 122.1655 49.7711 40.1657 176.0801 25 G 4.1043 8.6520 110.1484 46.4951 0.0000 174.8698 26 K 3.9693 8.1492 118.9206 57.2344 32.5647 175.9881 27 I 4.6612 8.3555 121.8377 59.2480 41.5147 173.9488 28 V 4.5788 8.5020 127.3186 61.2143 35.2857 173.9117 29 I 4.6927 8.3277 124.1424 60.2361 42.1898 175.0173 30 N 3.7640 9.7803 121.8635 55.5440 36.4722 173.9303 31 Q 4.0787 8.4474 129.4091 56.6340 28.7763 175.0870 32 R 4.3998 7.2855 121.7969 56.1908 30.4533 175.0186 33 S 4.9532 8.2167 117.2799 57.8437 67.2462 174.2871 34 L 3.8131 8.0563 121.5334 58.6295 41.9853 179.0765 35 E 4.1303 8.1397 117.4074 59.0378 29.0443 178.2965 36 Q 4.1966 7.2942 118.0666 58.3618 29.8249 178.0358 37 Y 3.8558 8.3884 119.2682 59.9202 37.6350 178.1722 38 F 4.9461 5.4600 129.3338 56.6425 38.5135 174.6725 39 G 4.1114 7.8117 111.1039 43.1994 0.0000 169.8235 40 R 3.9593 8.8368 124.2254 56.3683 29.2180 176.2189 41 E 3.9694 8.2950 116.2346 56.7114 28.6673 176.8101 42 T 4.6947 8.4619 127.6376 62.9989 69.8022 175.3824 43 A 3.7409 8.2808 124.7196 54.9702 17.2011 178.0398 44 R 3.6444 7.6719 110.2994 61.2451 30.6175 178.0460 45 M 4.3996 7.6596 116.5583 55.9752 31.2181 178.2847 46 V 4.0730 9.2403 120.0564 65.9158 32.0729 177.8336 47 V 3.8402 7.6903 112.1548 63.8271 31.7399 177.4726 48 R 4.3849 7.8114 120.6058 56.6139 29.6379 176.7056 49 Q 4.4065 8.0051 114.4041 56.7772 31.7850 175.4342 50 P 3.7614 0.0000 0.0000 65.1426 31.7580 176.5668 51 L 4.4837 6.8934 116.2948 54.6322 41.3335 176.9732 52 E 4.4970 7.7598 116.4278 57.0369 32.6563 177.3085 53 L 4.4946 7.8243 115.2037 54.8728 42.2646 177.2758 54 V 4.1029 7.6406 110.1265 61.2545 34.3001 175.7492 55 D 4.7747 9.0546 118.5253 55.0230 39.3381 173.9276 56 M 4.5408 8.1371 122.2722 54.9106 35.3297 174.2304 57 V 3.7732 9.9697 118.2104 62.5621 30.4546 171.4233 58 E 5.4428 7.5584 111.6837 57.4375 33.3205 175.7959 59 K 4.3040 7.4775 119.7228 56.5007 32.2421 177.0548 60 L 4.8182 7.7273 118.9548 53.8327 45.1142 174.9908 61 D 5.1744 8.1717 119.4255 52.4542 41.2895 174.9087 62 L 5.2037 8.0204 123.3732 54.6739 43.1410 175.9305 63 Y 5.0616 8.4485 119.9813 56.5429 41.4854 173.8649 64 I 4.8113 8.3656 127.4759 59.2667 40.3529 175.6922 65 T 5.4379 7.9493 119.0389 61.6796 68.6889 173.3830 66 V 4.4080 7.5928 122.3443 61.0061 33.6436 176.9725 67 K 4.5987 8.8545 121.9467 55.8468 36.5438 176.9110 68 G 4.2151 8.6833 109.6585 46.5003 0.0000 173.9626 69 G 4.4699 8.1012 103.8469 46.2664 0.0000 173.8129 70 G 4.0526 7.9990 109.2025 45.4007 0.0000 173.8557 71 I 3.9399 8.4764 119.5494 64.3027 37.5544 177.5688 72 S 4.7533 7.9284 111.4486 58.0629 63.3362 174.7527 73 G 3.8522 7.7592 111.5929 47.7018 0.0000 176.4525 74 Q 3.9831 7.9327 119.1671 59.2027 28.5645 178.7945 75 A 4.1076 7.6173 121.3366 55.0269 18.6979 179.7337 76 G 3.8128 8.0853 103.4938 48.0438 0.0000 175.5786 77 A 3.4468 7.9625 123.8024 53.9054 18.1424 179.0524 78 I 4.0062 8.3136 118.1656 63.1390 38.3247 177.8719 79 R 4.0549 8.8094 120.5676 59.9326 29.6048 178.0668 80 H 4.4455 9.3110 118.5770 58.4678 28.5630 177.1051 81 G 3.5567 7.3124 104.3385 48.0263 0.0000 176.0736 82 I 3.9279 8.5660 123.1155 63.9882 37.3162 177.7967 83 T 4.0559 7.8831 113.4714 63.5912 67.6066 175.6528 84 R 4.3660 7.5355 118.1145 56.3556 30.1295 177.0500 85 A 4.8874 6.8987 123.2108 53.3205 19.9817 179.3550 86 L 4.1048 7.4142 113.2349 56.2194 41.6573 177.9164 87 M 4.1193 7.9078 120.5294 58.6382 32.4465 177.5220 88 E 3.8922 8.1223 115.0328 59.2453 30.1451 176.4328 89 Y 3.5772 7.1187 123.2940 57.0088 38.1781 173.4391 90 D 4.1890 8.1546 129.6538 54.7765 37.2817 174.2561 91 E 4.2555 8.1318 116.6152 57.2330 29.5625 178.3183 92 S 4.2742 7.7599 115.4689 60.5794 63.1718 174.6442 93 L 4.4822 8.7933 120.7222 54.8469 41.4021 177.4605 94 R 4.4249 7.7228 119.1130 56.8705 31.5258 177.4586 95 S 4.5244 8.0764 110.1515 58.7897 62.3321 173.6553 96 E 4.6945 8.0354 116.4940 56.5763 31.4838 176.2681 97 L 4.8051 7.7532 118.0236 55.8042 43.8263 178.6052 98 R 3.9552 8.0684 118.2545 59.0313 30.1923 177.7294 99 K 4.3224 8.1132 114.1140 56.8454 31.9240 176.4626 100 A 4.5045 8.0086 119.9971 51.8794 20.9537 177.2633 101 G 3.9841 8.7880 104.1535 46.5334 0.0000 173.3303 102 F 4.8492 7.8282 118.5589 58.0144 44.6239 176.4790 103 V 3.8253 8.0453 114.2875 64.6654 31.5815 177.0890 104 T 3.9682 7.6605 114.2078 63.9904 68.8042 173.3113 105 R 4.0147 8.5864 121.4472 62.0197 30.4528 178.9620 106 D 3.9660 8.5532 111.9371 56.7436 39.8252 176.7752 107 A 3.4351 8.6744 126.2916 51.0382 20.9770 180.4810 108 R 3.4947 7.7725 115.5356 55.3187 31.1645 176.2238 109 Q 4.3542 7.8742 122.6443 55.2337 29.2701 172.6420 110 V 3.0879 7.9970 122.9758 62.1454 32.1311 171.2161 111 E 4.1621 8.7255 127.4249 56.2227 30.2153 175.3585 112 R 4.5660 8.0318 117.3047 53.5947 31.2917 175.7850 113 K 4.0500 8.5244 123.2126 56.1866 32.4576 176.9325 114 K 4.3514 8.4621 126.5786 55.9090 33.3978 176.0270 115 V 4.2183 8.1098 118.7764 61.7081 32.8827 175.8574 116 G 3.8947 10.1042 109.6452 45.9862 0.0000 173.0784 117 L 4.5561 7.3935 118.5976 54.3619 44.9025 174.0567 118 R 4.6460 8.4579 111.1453 57.2554 34.0910 175.6145 119 K 4.2993 8.3273 117.1291 55.8023 32.2392 175.1652 120 A 4.3720 9.8051 121.3777 52.3855 16.9312 180.8003 121 R 4.5545 7.3486 109.6656 57.0008 32.9140 174.3707 122 R 4.1879 8.1028 120.1138 55.5279 30.7496 175.1648 123 R 4.7463 8.3389 125.7676 53.8733 31.4217 173.9640 124 P 4.3301 0.0000 0.0000 62.8850 31.7651 175.3730 125 Q 4.5531 8.6542 120.6376 54.5026 29.8634 174.6986 126 F 5.0529 8.2623 118.4469 55.9640 40.6068 174.3499 127 S 3.8212 7.9286 114.5216 58.0317 64.2172 176.5556 128 K 4.3800 8.3631 123.3114 54.7181 31.7305 175.5606 129 R 4.3078 8.3835 123.9426 56.0235 30.2046 175.5116 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 3 N 8.42 4.67 0.00 2.67 2.73 0.00 0.00 6.79 6.19 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 4 Q 7.28 4.28 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 5 Y 7.14 4.69 0.00 3.06 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 6 Y 8.03 5.62 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 7 G 6.51 4.49 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 0.00 0.00 0.00 8 T 8.15 3.93 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 1.38 0.00 0.00 9 G 9.58 3.39 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 0.00 10 R 7.97 4.71 0.00 1.79 2.02 0.00 3.27 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 11 R 8.78 4.09 0.00 1.85 1.97 0.00 3.28 0.00 0.00 3.07 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 12 K 9.73 3.80 0.00 1.93 1.73 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.40 7.81 13 S 8.06 3.99 0.00 4.22 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 14 S 7.84 4.84 0.00 4.19 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 15 A 8.47 4.71 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 16 A 7.76 4.88 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 17 R 7.86 4.36 0.00 1.90 1.78 0.00 3.52 0.00 0.00 3.66 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.78 0.00 18 V 7.12 4.09 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 0.54 0.00 0.00 0.64 0.00 0.00 19 F 8.68 5.05 0.00 3.36 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 20 I 8.75 4.76 2.05 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 1.32 0.62 1.00 0.00 0.00 21 K 8.42 4.33 0.00 1.69 1.87 0.00 1.49 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.35 7.81 22 P 0.00 3.96 0.00 2.03 2.06 0.00 3.49 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 1.94 2.01 0.00 23 G 9.04 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 24 N 9.17 5.41 0.00 2.88 2.97 0.00 0.00 6.84 6.92 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 25 G 8.65 4.10 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 0.00 0.00 0.00 26 K 8.15 3.97 0.00 1.76 1.85 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.63 1.41 7.81 27 I 8.36 4.66 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.47 0.92 0.00 0.00 28 V 8.50 4.58 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 1.08 0.00 0.00 0.97 0.00 0.00 29 I 8.33 4.69 1.65 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.04 0.49 0.00 0.00 30 N 9.78 3.76 0.00 2.55 2.91 0.00 0.00 7.46 5.75 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 31 Q 8.45 4.08 0.00 2.28 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 32 R 7.29 4.40 0.00 1.91 1.83 0.00 3.26 0.00 0.00 3.59 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 33 S 8.22 4.95 0.00 3.82 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 34 L 8.06 3.81 0.00 1.74 1.66 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.14 4.13 0.00 2.09 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 0.00 2.43 2.36 0.00 36 Q 7.29 4.20 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.12 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 37 Y 8.39 3.86 0.00 2.38 1.84 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 38 F 5.46 4.95 0.00 3.16 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 39 G 7.81 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.84 3.96 0.00 1.99 2.07 0.00 3.25 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 1.51 1.66 0.00 41 E 8.29 3.97 0.00 2.08 1.77 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 2.34 2.37 0.00 42 T 8.46 4.69 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 43 A 8.28 3.74 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 44 R 7.67 3.64 0.00 1.96 1.93 0.00 3.26 0.00 0.00 3.46 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.97 0.00 45 M 7.66 4.40 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.50 0.00 46 V 9.24 4.07 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 0.86 0.00 0.00 0.94 0.00 0.00 47 V 7.69 3.84 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 0.83 0.00 0.00 1.08 0.00 0.00 48 R 7.81 4.38 0.00 1.81 1.85 0.00 3.20 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 49 Q 8.01 4.41 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 50 P 0.00 3.76 0.00 1.99 1.87 0.00 3.80 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 1.98 1.90 0.00 51 L 6.89 4.48 0.00 1.68 1.67 0.91 0.76 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 52 E 7.76 4.50 0.00 2.04 1.91 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 2.19 2.31 0.00 53 L 7.82 4.49 0.00 1.57 1.67 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.64 4.10 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 0.75 0.00 0.00 0.98 0.00 0.00 55 D 9.05 4.77 0.00 2.72 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 56 M 8.14 4.54 0.00 1.88 1.90 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 2.48 2.58 0.00 57 V 9.97 3.77 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 0.91 0.00 0.00 0.93 0.00 0.00 58 E 7.56 5.44 0.00 2.12 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 2.25 2.28 0.00 59 K 7.48 4.30 0.00 1.76 1.69 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.52 7.81 60 L 7.73 4.82 0.00 1.63 1.57 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.17 5.17 0.00 2.74 2.51 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 62 L 8.02 5.20 0.00 1.79 1.99 0.94 0.61 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 63 Y 8.45 5.06 0.00 2.97 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 64 I 8.37 4.81 1.75 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 1.20 2.08 0.87 0.00 0.00 65 T 7.95 5.44 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 1.19 0.00 0.00 66 V 7.59 4.41 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 0.77 0.00 0.00 1.00 0.00 0.00 67 K 8.85 4.60 0.00 1.69 1.70 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.39 7.81 68 G 8.68 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 0.00 0.00 0.00 0.00 69 G 8.10 4.47 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 0.00 70 G 8.00 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 71 I 8.48 3.94 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 1.51 0.84 0.82 0.00 0.00 72 S 7.93 4.75 0.00 3.86 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 73 G 7.76 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 74 Q 7.93 3.98 0.00 2.13 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.68 2.84 0.00 75 A 7.62 4.11 1.15 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 0.00 0.00 76 G 8.09 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 77 A 7.96 3.45 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 78 I 8.31 4.01 1.98 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 1.43 1.20 0.94 0.00 0.00 79 R 8.81 4.05 0.00 1.92 2.03 0.00 3.35 0.00 0.00 3.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.05 0.00 80 H 9.31 4.45 0.00 3.24 3.51 0.00 5.82 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 81 G 7.31 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.57 3.93 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.70 0.85 0.00 0.00 83 T 7.88 4.06 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 1.38 0.00 0.00 84 R 7.54 4.37 0.00 1.74 1.84 0.00 3.32 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 85 A 6.90 4.89 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 86 L 7.41 4.10 0.00 1.61 1.72 0.86 0.95 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 87 M 7.91 4.12 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.63 0.00 88 E 8.12 3.89 0.00 1.96 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 0.00 2.28 2.47 0.00 89 Y 7.12 3.58 0.00 2.61 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 90 D 8.15 4.19 0.00 2.93 2.64 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 0.00 0.00 0.00 0.00 91 E 8.13 4.26 0.00 1.90 1.96 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 2.27 2.61 0.00 92 S 7.76 4.27 0.00 3.83 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 93 L 8.79 4.48 0.00 1.82 1.66 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.72 4.42 0.00 1.81 1.95 0.00 3.29 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 95 S 8.08 4.52 0.00 3.83 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 96 E 8.04 4.69 0.00 1.95 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 2.20 2.23 0.00 97 L 7.75 4.81 0.00 1.74 1.79 0.98 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.07 3.96 0.00 1.89 1.93 0.00 3.10 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 99 K 8.11 4.32 0.00 1.77 1.99 0.00 1.96 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 100 A 8.01 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.79 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 0.00 0.00 0.00 102 F 7.83 4.85 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 0.00 103 V 8.05 3.83 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 0.74 0.00 0.00 0.94 0.00 0.00 104 T 7.66 3.97 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 1.18 0.00 0.00 105 R 8.59 4.01 0.00 1.75 1.88 0.00 3.40 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 106 D 8.55 3.97 0.00 2.68 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 0.00 107 A 8.67 3.44 1.15 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 0.00 0.00 108 R 7.77 3.49 0.00 1.96 1.96 0.00 3.13 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 109 Q 7.87 4.35 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.20 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 110 V 8.00 3.09 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 0.78 0.00 0.00 0.93 0.00 0.00 111 E 8.73 4.16 0.00 1.94 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 2.29 2.37 0.00 112 R 8.03 4.57 0.00 1.93 1.88 0.00 3.09 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 113 K 8.52 4.05 0.00 1.74 1.77 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.46 4.35 0.00 1.77 1.77 0.00 1.92 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.48 7.81 115 V 8.11 4.22 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 0.72 0.00 0.00 0.93 0.00 0.00 116 G 10.10 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 0.00 117 L 7.39 4.56 0.00 1.60 1.76 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.46 4.65 0.00 1.88 1.98 0.00 3.05 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 119 K 8.33 4.30 0.00 1.72 1.89 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.41 7.81 120 A 9.81 4.37 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 0.00 121 R 7.35 4.55 0.00 1.76 1.88 0.00 3.21 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 122 R 8.10 4.19 0.00 1.87 1.80 0.00 3.34 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 1.68 1.56 0.00 123 R 8.34 4.75 0.00 1.80 1.82 0.00 3.39 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 124 P 0.00 4.33 0.00 2.25 2.07 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 125 Q 8.65 4.55 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 126 F 8.26 5.05 0.00 3.16 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 0.00 127 S 7.93 3.82 0.00 3.74 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 0.00 128 K 8.36 4.38 0.00 1.73 1.84 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.48 7.81 129 R 8.38 4.31 0.00 2.18 1.95 0.00 3.39 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00