NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.2197 0.0000 0.0000 62.5194 33.8149 174.7544 2 H 4.8353 7.8541 121.8362 54.1181 32.7420 171.2872 3 F 5.6606 9.3313 125.0121 55.6436 43.2142 173.5078 4 L 4.3447 8.3650 124.0030 53.5113 44.0525 175.1866 5 I 4.5717 8.2259 127.9545 59.9157 38.7576 174.2606 6 L 5.1352 9.0123 130.9987 53.3523 44.1293 174.7201 7 N 5.3962 9.4573 124.3649 51.6282 41.3886 174.6331 8 G 4.3708 8.9908 113.5240 43.8978 0.0000 170.9959 9 P 4.4666 0.0000 0.0000 63.9549 31.9847 176.8787 10 N 4.4876 9.1107 118.0477 53.7688 38.2242 176.7956 11 V 3.5299 7.3727 118.5515 65.5325 31.7005 177.4760 12 N 4.3991 8.0713 115.7891 54.9523 37.5325 175.4499 13 R 4.3651 7.9391 118.0743 55.6653 30.1000 175.9084 14 L 3.7320 7.4445 119.5864 56.5757 42.3847 176.5449 15 G 4.1781 9.2582 113.6381 46.3759 0.0000 175.7313 16 S 4.3213 7.3037 108.7979 58.6621 63.3587 174.5503 17 R 4.2316 8.0575 118.8128 55.9802 32.8049 175.2321 18 E 3.9927 9.0853 117.8758 56.7770 29.7961 175.4108 19 P 4.9463 0.0000 0.0000 63.6485 32.0986 177.1660 20 E 3.9861 8.1373 117.7428 58.2486 29.4979 177.7376 21 V 3.8431 7.3632 115.8548 64.2923 32.9128 176.8073 22 F 4.7772 7.1807 113.8729 56.7874 39.8511 177.0311 23 G 4.0576 8.4986 109.8744 45.7808 0.0000 175.3260 24 R 3.8238 8.7987 122.4895 59.4530 29.5488 174.4715 25 Q 4.4602 7.3910 115.4447 56.2895 29.3796 176.4557 26 T 4.7218 8.4999 112.6703 59.3767 72.2672 175.5870 27 L 3.8677 8.1476 121.4727 58.3334 41.9696 178.6452 28 T 3.7231 7.7848 115.2627 66.7680 68.4743 175.8017 29 D 4.3478 7.6168 119.6505 57.6143 40.8449 179.1648 30 I 3.6162 7.6319 120.0318 64.1706 37.0529 178.0277 31 E 3.0541 7.9033 120.0897 59.2826 29.1728 178.9097 32 T 4.0093 7.8007 115.5868 66.8819 68.5671 176.2019 33 D 4.4487 8.0737 120.5589 57.5596 40.8482 179.0175 34 L 4.2041 8.1017 119.4250 57.7998 41.6098 179.4625 35 F 4.6616 8.4453 117.9208 60.7466 38.7570 177.8449 36 Q 4.0598 8.1431 117.6444 59.1071 28.3038 178.3095 37 F 4.1913 8.4145 121.3817 61.2062 39.1337 177.0852 38 A 3.9437 8.7480 120.8955 55.2427 17.7907 179.4275 39 E 3.6789 8.3464 116.9054 59.5401 29.2853 179.4705 40 A 4.0239 8.2797 120.1124 53.8045 18.4114 178.6261 41 L 4.3599 6.9183 114.3521 53.4227 43.2948 176.4582 42 H 4.0628 7.0852 113.9884 57.1849 26.5946 173.6851 43 I 4.7104 8.6271 111.5297 59.2418 41.3518 176.3029 44 Q 4.7762 9.1382 121.9445 54.3431 31.2159 174.8541 45 L 5.2619 8.4752 121.1817 53.3056 45.6212 175.8954 46 T 4.7765 8.5871 118.9609 61.8093 71.8049 172.9295 47 F 5.2058 8.8776 123.9351 56.0152 41.4502 175.1017 48 F 5.0320 8.8258 123.8632 57.1438 43.1165 172.6727 49 Q 5.2509 7.6700 125.8814 53.4284 31.7604 173.7472 50 S 4.4923 8.1113 118.2077 57.4721 65.8803 173.9978 51 N 4.7065 8.8944 120.4192 53.5059 39.4588 174.6046 52 H 4.7808 7.9522 117.1468 53.9114 30.6795 175.2048 53 E 4.0093 9.1186 125.3608 59.6002 29.4773 179.3109 54 G 3.7234 8.1248 104.5749 47.4342 0.0000 175.2225 55 D 4.4868 8.0057 121.1863 57.1855 40.8961 178.6558 56 L 4.1109 7.9340 119.0592 57.9443 41.7563 179.4129 57 I 3.6765 7.6830 119.4976 64.4028 36.9903 178.2146 58 D 4.2888 8.1360 119.4688 57.2661 40.4457 178.7166 59 A 3.9108 7.7307 119.9101 55.2233 18.8231 179.4237 60 I 3.8462 8.1656 118.7022 64.8999 36.9687 178.3589 61 H 4.2797 8.0180 115.7601 59.0243 28.7474 177.3316 62 E 4.1948 8.3745 119.0537 58.1434 29.3630 178.8829 63 A 4.1987 7.8651 121.2672 55.0552 18.1105 178.8190 64 E 3.9420 8.3627 117.4327 59.3485 29.2563 177.9202 65 E 4.5869 7.4265 114.7976 56.2693 29.8886 176.2939 66 Q 4.1119 8.3181 118.6186 55.3671 31.2521 173.7311 67 Y 4.9195 7.6952 113.1843 56.2327 41.3171 174.8777 68 S 4.8277 8.4472 113.2760 57.8711 63.9840 174.2278 69 G 4.2613 7.7604 105.2404 46.1164 0.0000 172.6174 70 I 5.1394 8.2546 122.2421 59.1391 41.3057 174.7681 71 V 4.4524 8.6464 126.1760 61.2530 33.4430 173.9400 72 L 5.0363 9.1098 131.1897 53.3937 44.5298 174.5396 73 N 5.2360 9.2674 125.9002 50.4058 39.7018 172.7023 74 P 4.4605 0.0000 0.0000 61.9355 33.2953 178.0896 75 G 3.8849 8.3597 108.3755 46.2867 0.0000 175.2871 76 A 4.3320 8.5037 121.3788 54.4460 18.9487 179.6561 77 L 3.2923 7.4987 114.9984 57.2669 41.3524 179.0315 78 S 3.9447 7.6930 113.0699 61.6193 61.9278 175.1482 79 H 4.9739 8.1788 116.9751 55.4709 28.9301 175.1985 80 Y 4.5790 7.2019 115.0416 56.1160 42.0562 175.9389 81 S 4.1807 7.7919 116.4284 57.9117 61.3246 173.4689 82 Y 4.3478 8.2300 126.1326 60.0705 37.9951 177.2634 83 A 4.0945 8.0274 121.8322 55.0343 18.5542 179.5279 84 I 3.7453 7.6648 118.2549 64.1967 37.2879 178.5247 85 R 3.9141 7.7789 119.2584 59.7167 30.0043 178.4392 86 D 4.4295 8.4213 118.4077 57.1301 40.5137 178.6152 87 A 4.1019 7.7315 120.7789 55.2305 18.1804 179.5743 88 V 3.7225 8.0044 116.7656 66.1894 31.3528 178.5182 89 S 4.2585 7.9145 114.2753 61.0972 62.7734 175.8556 90 S 4.4718 7.9250 114.6065 58.1390 63.2846 173.6195 91 I 4.8106 7.0031 114.4078 58.3150 40.0143 175.6053 92 S 4.4762 9.1558 115.3584 59.4343 63.6672 174.9037 93 L 4.4050 7.8436 121.0085 53.9397 42.4750 174.9981 94 P 4.5427 0.0000 0.0000 62.8009 32.8818 175.0517 95 V 4.9458 8.4735 122.6574 61.0144 34.8287 173.8615 96 V 4.6428 8.3337 126.9784 61.0553 34.0799 173.5560 97 E 4.9459 8.7948 129.0355 54.7960 31.0093 174.6789 98 V 4.8119 8.9065 126.3888 61.3772 35.3494 173.7962 99 H 4.7667 8.7866 123.1180 54.1442 32.4671 174.5394 100 L 4.0907 8.7213 122.7114 57.6152 42.6076 177.8112 101 S 4.6326 7.9867 111.2575 56.9548 64.6700 173.9782 102 N 4.4940 8.1574 119.8090 52.0463 37.4306 174.8630 103 L 3.7535 8.0740 124.9800 57.7196 41.9022 179.5969 104 Y 3.8281 7.0199 113.8159 60.0928 37.7479 176.8008 105 A 4.4866 7.7238 120.8197 52.1030 19.9845 177.2846 106 R 4.7081 7.4316 116.4967 54.5507 32.2224 175.8759 107 E 3.9695 8.4069 118.4794 57.4122 30.3176 177.7144 108 E 3.3274 8.5857 122.2222 58.9231 29.9633 179.1599 109 F 4.2506 7.8132 112.7606 59.5347 38.0031 175.9764 110 R 3.5015 6.7342 118.0439 56.7442 29.7622 176.4808 111 H 4.8119 8.0128 115.0507 55.9087 29.1811 175.0858 112 Q 4.6900 7.7612 117.7268 54.1523 31.4381 173.7824 113 S 4.8923 8.6026 114.4239 56.7968 64.2993 174.2868 114 V 4.0262 8.8981 120.6115 62.4004 32.0157 177.0664 115 I 4.0981 7.5387 120.1254 62.7699 38.3196 177.5869 116 A 4.0009 8.2486 123.5535 54.7763 18.3481 177.5629 117 P 4.2464 0.0000 0.0000 65.4299 31.3641 177.4414 118 V 4.1200 7.5838 107.5262 60.9295 31.9920 175.2788 119 A 4.6430 7.3981 123.7405 50.1503 20.8835 177.5542 120 K 4.0682 8.9186 118.8195 59.1215 32.3547 177.5486 121 G 3.9138 7.0436 103.1233 46.3389 0.0000 171.6798 122 Q 5.2053 8.5461 119.3335 54.4469 32.6530 174.5228 123 I 4.6356 8.7401 125.2115 59.5001 40.6984 174.6753 124 V 4.6920 8.3021 125.8373 62.3491 34.2610 175.5083 125 G 3.9350 9.0149 115.3987 45.6664 0.0000 173.4957 126 L 4.5006 7.7009 117.7570 53.9205 42.6318 178.5271 127 G 3.8198 8.0300 108.9597 45.8403 0.0000 175.0054 128 A 4.2842 8.4664 119.2651 54.6415 18.4412 179.3374 129 E 3.9661 8.3679 118.0274 59.2800 29.5590 178.8522 130 G 3.6098 8.1968 105.8795 47.9050 0.0000 175.1949 131 Y 4.0754 7.8659 118.7308 60.8701 37.8078 178.9246 132 K 3.7535 7.9027 118.8165 59.3455 32.1189 179.1724 133 L 4.0016 7.9448 119.0109 57.7808 41.5514 179.5746 134 A 3.9636 7.9923 120.6043 55.1174 18.3698 179.6591 135 V 3.3828 8.0171 116.9484 66.3225 31.4535 178.3865 136 R 4.0237 8.3717 117.7480 59.3843 29.8424 178.3293 137 Y 4.4216 8.1759 120.6773 60.2175 38.6076 177.9854 138 L 3.7220 7.6843 118.2790 57.8269 41.6909 179.4855 139 L 4.2926 7.6566 117.7414 57.8494 41.9226 179.3592 140 S 4.1603 8.8524 115.1014 60.9463 62.3515 174.5156 141 Q 4.1717 7.3498 125.5389 55.9397 28.7701 175.0930 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 P 0.00 4.22 0.00 1.45 1.59 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 2 H 7.85 4.84 0.00 3.07 3.04 0.00 5.54 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 F 9.33 5.66 0.00 2.99 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 4 L 8.37 4.34 0.00 0.83 1.19 0.82 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.23 4.57 1.50 0.00 0.00 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 0.49 0.75 0.97 0.00 0.00 6 L 9.01 5.14 0.00 1.68 1.55 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 7 N 9.46 5.40 0.00 2.59 2.67 0.00 0.00 6.34 7.51 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 8 G 8.99 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 0.00 0.00 0.00 9 P 0.00 4.47 0.00 2.06 1.97 0.00 4.21 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 10 N 9.11 4.49 0.00 2.92 2.92 0.00 0.00 6.45 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.37 3.53 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 1.04 0.00 0.00 0.96 0.00 0.00 12 N 8.07 4.40 0.00 2.81 3.00 0.00 0.00 5.98 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 13 R 7.94 4.37 0.00 1.82 1.90 0.00 3.26 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 14 L 7.44 3.73 0.00 1.84 1.58 0.81 0.96 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 15 G 9.26 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.30 4.32 0.00 4.07 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 17 R 8.06 4.23 0.00 1.90 1.79 0.00 3.10 0.00 0.00 3.15 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 18 E 9.09 3.99 0.00 2.38 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 2.47 2.48 0.00 19 P 0.00 4.95 0.00 2.29 2.32 0.00 3.71 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 20 E 8.14 3.99 0.00 1.91 1.99 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 2.30 2.28 0.00 21 V 7.36 3.84 0.91 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 -0.30 0.00 0.00 0.74 0.00 0.00 22 F 7.18 4.78 0.00 3.35 2.99 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 23 G 8.50 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 24 R 8.80 3.82 0.00 1.84 1.91 0.00 3.28 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.27 0.00 25 Q 7.39 4.46 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 26 T 8.50 4.72 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 1.19 0.00 0.00 27 L 8.15 3.87 0.00 1.70 1.61 0.79 0.66 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 28 T 7.78 3.72 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 1.17 0.00 0.00 29 D 7.62 4.35 0.00 2.78 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 I 7.63 3.62 1.87 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 1.37 0.54 0.59 0.00 0.00 31 E 7.90 3.05 0.00 1.52 1.89 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 1.70 1.47 0.00 32 T 7.80 4.01 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 1.25 0.00 0.00 33 D 8.07 4.45 0.00 2.90 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 4.20 0.00 1.91 1.90 0.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.45 4.66 0.00 3.36 3.06 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 36 Q 8.14 4.06 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 37 F 8.41 4.19 0.00 3.25 3.41 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 38 A 8.75 3.94 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.35 3.68 0.00 2.30 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 2.33 2.20 0.00 40 A 8.28 4.02 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 41 L 6.92 4.36 0.00 1.45 1.54 -0.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 42 H 7.09 4.06 0.00 3.25 3.34 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 I 8.63 4.71 1.80 0.00 0.00 1.00 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 0.78 0.97 0.00 0.00 44 Q 9.14 4.78 0.00 1.64 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 45 L 8.48 5.26 0.00 1.35 0.89 1.03 0.94 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 46 T 8.59 4.78 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 1.38 0.00 0.00 47 F 8.88 5.21 0.00 2.87 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 48 F 8.83 5.03 0.00 3.15 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 49 Q 7.67 5.25 0.00 1.91 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.51 0.00 0.00 0.00 0.00 0.00 2.23 2.01 0.00 50 S 8.11 4.49 0.00 3.56 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 51 N 8.89 4.71 0.00 2.72 2.77 0.00 0.00 6.88 8.16 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 52 H 7.95 4.78 0.00 3.39 3.26 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 9.12 4.01 0.00 2.00 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 2.36 2.31 0.00 54 G 8.12 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.01 4.49 0.00 3.08 3.02 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 56 L 7.93 4.11 0.00 1.80 1.75 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.68 3.68 1.83 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 1.50 1.02 0.74 0.00 0.00 58 D 8.14 4.29 0.00 2.87 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 59 A 7.73 3.91 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 60 I 8.17 3.85 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 1.54 1.05 1.00 0.00 0.00 61 H 8.02 4.28 0.00 3.28 3.36 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.37 4.19 0.00 2.10 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 2.32 2.33 0.00 63 A 7.87 4.20 1.59 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 0.00 0.00 64 E 8.36 3.94 0.00 2.12 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 2.50 0.00 65 E 7.43 4.59 0.00 2.03 1.89 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 2.26 2.28 0.00 66 Q 8.32 4.11 0.00 1.58 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 6.68 0.00 0.00 0.00 0.00 0.00 1.16 1.64 0.00 67 Y 7.70 4.92 0.00 2.98 2.97 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 68 S 8.45 4.83 0.00 3.97 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 69 G 7.76 4.26 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 0.00 0.00 0.00 70 I 8.25 5.14 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.31 0.95 0.00 0.00 71 V 8.65 4.45 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 1.01 0.00 0.00 0.88 0.00 0.00 72 L 9.11 5.04 0.00 1.71 1.44 0.98 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 73 N 9.27 5.24 0.00 2.71 2.93 0.00 0.00 6.82 7.33 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 74 P 0.00 4.46 0.00 2.18 2.21 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 75 G 8.36 3.88 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 0.00 76 A 8.50 4.33 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 77 L 7.50 3.29 0.00 1.73 1.44 0.82 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.69 3.94 0.00 3.95 3.42 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 79 H 8.18 4.97 0.00 3.45 3.59 0.00 5.68 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 7.20 4.58 0.00 2.88 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 81 S 7.79 4.18 0.00 3.49 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 82 Y 8.23 4.35 0.00 3.09 2.88 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 83 A 8.03 4.09 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 84 I 7.66 3.75 1.94 0.00 0.00 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 1.38 0.83 0.88 0.00 0.00 85 R 7.78 3.91 0.00 2.03 2.27 0.00 3.46 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 86 D 8.42 4.43 0.00 2.86 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 87 A 7.73 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 88 V 8.00 3.72 2.24 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 1.08 0.00 0.00 1.00 0.00 0.00 89 S 7.91 4.26 0.00 4.09 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 90 S 7.93 4.47 0.00 4.03 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 91 I 7.00 4.81 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.19 0.96 0.00 0.00 92 S 9.16 4.48 0.00 4.00 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 0.00 93 L 7.84 4.40 0.00 1.62 1.73 1.12 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.54 0.00 2.21 2.26 0.00 3.85 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 95 V 8.47 4.95 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 1.06 0.00 0.00 1.00 0.00 0.00 96 V 8.33 4.64 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 0.57 0.00 0.00 0.88 0.00 0.00 97 E 8.79 4.95 0.00 2.06 1.75 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 2.18 2.29 0.00 98 V 8.91 4.81 1.70 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 0.44 0.00 0.00 0.79 0.00 0.00 99 H 8.79 4.77 0.00 3.00 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.72 4.09 0.00 1.74 1.79 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 101 S 7.99 4.63 0.00 3.85 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 0.00 102 N 8.16 4.49 0.00 2.71 2.70 0.00 0.00 6.85 6.66 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 0.00 103 L 8.07 3.75 0.00 0.97 1.52 0.49 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 7.02 3.83 0.00 3.01 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 0.00 105 A 7.72 4.49 1.28 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 0.00 0.00 106 R 7.43 4.71 0.00 1.79 1.75 0.00 3.05 0.00 0.00 3.13 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 107 E 8.41 3.97 0.00 1.40 1.76 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 2.48 2.34 0.00 108 E 8.59 3.33 0.00 1.89 1.89 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 2.30 2.16 0.00 109 F 7.81 4.25 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 0.00 110 R 6.73 3.50 0.00 1.53 1.63 0.00 2.87 0.00 0.00 3.05 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.50 0.00 111 H 8.01 4.81 0.00 3.22 3.45 0.00 5.61 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 7.76 4.69 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 113 S 8.60 4.89 0.00 3.82 3.79 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 0.00 114 V 8.90 4.03 1.87 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 0.45 0.00 0.00 0.64 0.00 0.00 115 I 7.54 4.10 1.98 0.00 0.00 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 1.31 1.38 0.90 0.00 0.00 116 A 8.25 4.00 1.32 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 0.00 0.00 117 P 0.00 4.25 0.00 2.09 2.19 0.00 3.65 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 118 V 7.58 4.12 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 0.70 0.00 0.00 1.03 0.00 0.00 119 A 7.40 4.64 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 0.00 120 K 8.92 4.07 0.00 1.83 1.85 0.00 2.02 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.69 7.81 121 G 7.04 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 0.00 122 Q 8.55 5.21 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.63 0.00 0.00 0.00 0.00 0.00 2.24 2.55 0.00 123 I 8.74 4.64 1.77 0.00 0.00 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 1.04 0.60 0.86 0.00 0.00 124 V 8.30 4.69 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 0.53 0.00 0.00 0.88 0.00 0.00 125 G 9.01 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 0.00 126 L 7.70 4.50 0.00 1.60 1.65 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.03 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 0.00 128 A 8.47 4.28 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 0.00 129 E 8.37 3.97 0.00 2.07 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 2.36 2.41 0.00 130 G 8.20 3.61 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 0.00 131 Y 7.87 4.08 0.00 3.19 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 0.00 132 K 7.90 3.75 0.00 1.69 1.26 0.00 1.53 0.00 0.00 1.17 0.00 0.00 2.54 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 1.09 7.81 133 L 7.94 4.00 0.00 1.85 1.73 0.90 0.58 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 0.00 134 A 7.99 3.96 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 0.00 135 V 8.02 3.38 2.50 0.00 0.00 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 0.00 0.00 1.11 0.00 0.00 136 R 8.37 4.02 0.00 2.19 2.06 0.00 3.31 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 1.82 2.08 0.00 137 Y 8.18 4.42 0.00 3.09 3.11 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 0.00 138 L 7.68 3.72 0.00 1.46 0.82 0.95 0.41 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 0.00 139 L 7.66 4.29 0.00 1.85 1.79 1.00 0.98 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 0.00 140 S 8.85 4.16 0.00 3.89 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 0.00 141 Q 7.35 4.17 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.58 0.00 0.00 0.00 0.00 0.00 1.65 1.32 0.00