NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4001 8.2649 123.5860 51.3398 22.0603 177.6192 2 K 3.8538 8.2103 113.5164 55.1568 31.1617 175.7770 3 K 4.2349 8.4564 120.2715 56.1409 36.3542 173.2093 4 V 3.9842 8.3153 122.9515 62.4221 31.6989 174.5285 5 Q 4.1151 7.6149 120.1806 54.2932 31.7698 173.5703 6 A 3.9093 8.1531 122.5101 52.7266 18.9546 176.0990 7 Y 4.8418 7.5262 118.0767 57.2110 40.5430 173.6849 8 V 4.7034 8.5478 113.8932 59.3400 35.0634 174.9390 9 K 5.1280 8.2117 122.4422 55.2282 35.1919 175.1111 10 L 4.4673 8.4317 120.5904 54.9956 44.1763 173.6615 11 Q 4.8270 8.7198 119.5753 55.0686 29.7768 174.9483 12 V 4.5259 8.0370 117.0310 58.7234 34.9560 175.7137 13 A 4.3027 8.7594 125.6639 52.0781 18.4821 176.8812 14 A 3.9380 8.2857 121.4062 53.6140 18.6613 179.3205 15 G 3.9373 7.6688 107.5769 41.0000 0.0000 171.9018 16 M 4.1421 7.7224 118.1811 55.7220 35.1834 173.7610 17 A 4.2470 8.5406 127.0579 52.1877 21.8859 174.9785 18 N 4.6280 9.0353 116.9137 52.8310 38.1350 172.9162 19 P 4.3599 0.0000 0.0000 62.7367 31.9985 176.6732 20 S 3.9980 8.7569 116.8749 61.3009 62.5387 173.4881 21 P 4.3572 0.0000 0.0000 65.3750 31.0001 175.9805 22 P 4.4245 0.0000 0.0000 65.0572 33.0436 178.1973 23 V 4.2488 7.7904 107.1015 59.9695 32.9447 181.9327 24 G 3.8975 9.4908 122.0406 46.5612 0.0000 173.2592 25 P 4.1730 0.0000 0.0000 65.9665 31.1735 175.9746 26 A 3.9557 7.8646 118.5068 55.0897 18.5127 178.8149 27 L 4.2773 7.5548 115.6085 56.5914 41.3978 178.9246 28 G 3.6255 8.4991 107.7379 47.9131 0.0000 175.6950 29 Q 4.0277 7.5526 119.6243 58.9996 28.8079 178.5980 30 Q 4.1660 7.6607 117.4199 57.2113 28.6571 177.2672 31 G 3.9687 7.7458 108.1073 45.4132 0.0000 173.9315 32 V 3.8803 7.4275 117.8854 62.4627 32.2862 176.7314 33 N 4.8281 8.8880 123.2443 51.4063 37.2201 175.7138 34 I 3.7101 8.0676 125.9240 64.6996 37.0125 176.7629 35 M 4.0163 8.2203 118.0373 58.8575 31.8577 177.7500 36 E 4.0392 8.2789 118.6174 59.2234 29.7727 178.2869 37 F 4.3554 8.7787 121.0180 61.4574 39.3565 176.4513 38 C 3.9700 8.4291 114.6082 61.6288 28.8070 175.9939 39 K 3.9685 7.8321 120.9735 58.6096 31.6769 178.7608 40 A 4.1193 8.3003 121.6387 55.3493 18.3441 178.9391 41 F 4.2337 8.8935 120.4092 61.3159 39.1799 176.7803 42 N 3.9546 8.2312 116.0012 56.3654 38.1927 176.8808 43 A 3.9881 7.3550 120.9877 55.4021 18.8036 179.2509 44 K 4.0413 7.7274 116.4207 59.0074 32.3214 179.2602 45 T 3.6495 7.6552 116.4545 66.3894 67.9258 176.1547 46 D 4.2789 7.5785 119.8892 57.3234 40.9197 178.5599 47 S 4.1856 7.8066 111.7660 61.4456 62.6172 175.5456 48 I 3.7979 7.5447 121.2817 61.1317 37.2651 176.0453 49 E 5.0318 7.3517 115.4099 55.9633 32.3921 176.1378 50 K 4.4788 8.8273 122.2112 55.7547 34.3917 176.7955 51 G 3.9534 9.0148 109.7373 45.0525 0.0000 173.2223 52 L 4.6146 7.3744 119.0840 51.8557 43.4899 174.2122 53 P 4.3760 0.0000 0.0000 63.2248 31.8202 175.7684 54 I 4.6678 8.2188 125.8525 58.6262 39.0786 173.8246 55 P 4.7881 0.0000 0.0000 62.5679 32.6788 175.5913 56 V 4.8820 9.1182 123.7921 59.8238 35.2162 174.9994 57 V 4.2799 8.0589 121.7886 61.3722 32.7858 174.3851 58 I 4.3836 8.3425 130.3207 61.0885 38.3168 175.3947 59 T 4.7512 9.3797 125.8237 61.9801 69.8848 174.0594 60 V 4.3980 7.6893 127.6010 62.1333 31.8736 174.9655 61 Y 4.8600 8.4282 123.8365 55.8554 40.6884 176.6389 62 A 4.2577 8.5968 122.2667 55.6452 18.7493 178.5052 63 D 4.4694 7.9533 112.8807 54.3362 40.5620 176.7766 64 R 3.7297 7.9026 112.3743 57.0109 29.3208 176.0044 65 S 4.7251 7.9216 113.9536 58.8383 64.8106 172.1291 66 F 5.5508 7.6679 112.9601 57.7931 40.0145 172.4313 67 T 5.3057 8.1741 113.3841 61.0973 71.5612 171.8383 68 F 5.8991 8.4091 116.3756 56.6700 40.8371 173.4390 69 V 4.2621 8.5018 121.6304 61.5687 33.6658 174.3245 70 T 4.4728 8.6054 125.2382 62.9522 68.9774 174.5401 71 K 4.5294 7.9130 128.8102 55.1364 34.3372 176.5886 72 T 4.3841 8.6076 109.8052 60.4929 69.9097 172.5713 73 P 4.3409 0.0000 0.0000 61.9459 32.0526 174.9664 74 P 4.3407 0.0000 0.0000 63.1138 33.2108 177.5052 75 A 4.0739 8.5247 120.7535 54.9223 18.4018 180.2111 76 A 3.9449 7.8816 119.2904 55.4640 18.6791 180.1284 77 V 3.6192 7.7025 110.5096 64.5278 31.6954 178.7053 78 L 4.0691 7.8338 118.5042 57.6132 41.3233 179.4753 79 L 4.1066 7.8303 118.8632 57.2941 41.5672 179.5764 80 K 3.9951 7.9572 118.9390 59.2478 32.1478 179.5338 81 K 3.9993 8.0521 118.8084 59.9468 32.3831 179.1151 82 A 3.9908 7.8692 120.9290 54.6725 18.3861 178.9918 83 A 4.2029 8.3066 118.2258 52.7727 18.7595 178.7371 84 G 3.8244 7.7059 104.6245 45.5583 0.0000 173.4501 85 I 4.3403 7.4175 112.7974 59.3883 39.5924 175.7274 86 K 4.2506 8.5298 119.2550 57.7607 32.8332 176.6190 87 S 4.8500 7.6194 111.4207 56.0348 66.7502 174.0436 88 G 3.9175 8.2296 110.2013 45.9123 0.0000 173.0353 89 S 4.2853 7.9891 111.9334 58.3690 63.1239 175.4333 90 G 4.3682 8.8151 109.4149 45.0032 0.0000 173.7557 91 K 4.6134 7.2252 116.4541 53.9742 32.3324 173.6036 92 P 4.2473 0.0000 0.0000 64.5595 32.5868 176.8777 93 N 4.6990 9.0005 122.4831 54.6092 37.7323 176.2581 94 K 4.0791 8.0524 115.7351 58.7794 32.3404 176.4764 95 D 4.7650 7.7316 115.9141 52.0724 43.5231 174.8640 96 K 4.4482 8.6494 126.3113 56.0259 32.8727 176.7834 97 V 3.9601 8.1236 124.5473 64.9864 32.5782 175.3128 98 G 4.3457 7.6335 105.8252 45.3277 0.0000 171.6909 99 K 5.1428 8.3826 117.5935 55.4001 36.1114 175.8964 100 I 4.7966 8.8924 121.6883 59.4515 41.6111 175.4504 101 S 4.6869 8.5695 120.3280 57.8222 63.9860 175.3676 102 R 3.9126 8.5225 122.1727 59.3858 29.5922 179.0038 103 A 3.9801 7.9201 120.3057 55.3259 18.4977 179.4269 104 Q 4.7362 7.6709 117.3118 58.6027 28.7647 178.7724 105 L 3.9844 7.8172 119.7752 57.9832 41.6096 179.4744 106 Q 3.9465 7.9874 118.8468 59.1465 29.0119 177.8352 107 E 4.7947 7.9213 120.8912 59.2584 29.6265 179.5377 108 I 3.7181 8.2595 119.6225 64.4297 36.8951 178.4362 109 A 4.0621 7.8756 120.8409 54.9865 18.3059 179.5001 110 Q 4.0846 8.2300 117.0249 59.3411 28.5971 178.8510 111 T 3.8672 7.7590 115.5290 66.5540 68.8408 176.2720 112 K 4.2943 8.3925 119.1475 56.1513 32.0855 178.4596 113 A 3.9469 7.4993 121.5808 55.4282 18.1915 179.3250 114 A 4.0753 7.9020 117.7796 55.3481 18.6835 178.8873 115 D 4.5138 7.9325 114.6557 55.2374 41.6903 177.0623 116 M 4.3414 7.5605 119.5427 55.2583 32.5908 176.3870 117 T 4.3135 8.3108 110.5187 61.3065 69.9222 175.3288 118 G 3.7786 8.0983 111.1039 46.4016 0.0000 173.4853 119 A 4.1057 8.6986 126.8736 54.2769 19.1065 177.2083 120 D 5.0505 7.5958 113.4692 51.7307 46.1865 176.8265 121 I 3.7603 8.1551 120.5694 64.5984 36.9899 178.6088 122 E 3.9360 8.1590 118.8064 59.2744 29.3583 178.8197 123 A 3.9680 8.0050 120.4394 55.5401 18.5499 179.2053 124 M 4.0004 7.9262 114.7326 59.0752 31.0202 178.8656 125 T 3.8854 7.8940 116.3547 66.4274 68.3842 176.7784 126 R 4.7487 7.6220 120.3069 58.9433 30.4690 178.9970 127 S 4.2764 8.0898 114.8784 61.7433 62.7775 176.8124 128 I 3.7647 7.8815 122.4085 64.3789 36.7717 178.3279 129 E 4.1006 8.2537 119.7712 59.3168 29.0290 179.5455 130 G 3.6895 7.7061 104.7755 47.9092 0.0000 175.5529 131 T 4.0503 7.8673 111.4061 64.4633 68.8897 176.5689 132 A 3.9841 7.8381 123.3330 55.1004 18.2663 179.8505 133 R 3.8574 7.9382 115.1568 59.2528 30.1692 178.8171 134 S 4.4886 7.6049 112.8183 59.4695 63.4129 174.6305 135 M 4.4979 7.5924 118.0549 54.3936 31.4867 176.1499 136 G 3.6609 8.1043 106.6351 47.0506 0.0000 173.1743 137 L 5.1612 7.9085 120.3836 51.6595 43.2857 177.0549 138 V 3.9777 8.3265 124.2304 62.6308 33.2623 174.8009 139 V 5.4635 8.1588 117.5608 58.8955 34.3528 174.7120 140 E 4.4369 8.7504 126.2216 54.9055 31.0303 175.6054 141 D 4.5718 8.5781 126.0769 54.4797 41.4589 176.0813 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 A 8.26 4.40 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 2 K 8.21 3.85 0.00 1.88 1.62 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.52 7.81 3 K 8.46 4.23 0.00 1.68 1.65 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.18 1.26 7.81 4 V 8.32 3.98 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 0.72 0.00 0.00 1.00 0.00 0.00 5 Q 7.61 4.12 0.00 2.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.14 2.25 0.00 6 A 8.15 3.91 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 7 Y 7.53 4.84 0.00 2.93 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 8 V 8.55 4.70 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 0.72 0.00 0.00 0.75 0.00 0.00 9 K 8.21 5.13 0.00 1.65 1.66 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.36 7.81 10 L 8.43 4.47 0.00 1.67 1.66 0.78 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.72 4.83 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 12 V 8.04 4.53 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 0.75 0.00 0.00 0.23 0.00 0.00 13 A 8.76 4.30 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 14 A 8.29 3.94 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 15 G 7.67 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 16 M 7.72 4.14 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 17 A 8.54 4.25 1.17 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 0.00 0.00 18 N 9.04 4.63 0.00 2.73 3.32 0.00 0.00 6.93 7.69 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 19 P 0.00 4.36 0.00 2.25 2.16 0.00 3.70 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 2.06 1.95 0.00 20 S 8.76 4.00 0.00 3.84 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 21 P 0.00 4.36 0.00 2.07 2.10 0.00 3.73 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 2.02 2.11 0.00 22 P 0.00 4.42 0.00 2.02 2.06 0.00 3.69 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 2.02 2.10 0.00 23 V 7.79 4.25 2.05 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 0.74 0.00 0.00 0.99 0.00 0.00 24 G 9.49 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 25 P 0.00 4.17 0.00 2.14 2.12 0.00 3.98 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 2.10 2.17 0.00 26 A 7.86 3.96 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 27 L 7.55 4.28 0.00 1.59 1.66 0.25 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.50 3.63 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 0.00 0.00 0.00 29 Q 7.55 4.03 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 30 Q 7.66 4.17 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.03 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 31 G 7.75 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 0.00 0.00 0.00 32 V 7.43 3.88 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 0.01 0.00 0.00 0.70 0.00 0.00 33 N 8.89 4.83 0.00 3.21 2.93 0.00 0.00 6.92 7.37 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 34 I 8.07 3.71 1.90 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 1.52 0.92 0.98 0.00 0.00 35 M 8.22 4.02 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 36 E 8.28 4.04 0.00 2.18 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 0.00 2.52 2.43 0.00 37 F 8.78 4.36 0.00 2.87 3.05 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 38 C 8.43 3.97 0.00 3.14 3.20 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 39 K 7.83 3.97 0.00 1.91 1.88 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.46 7.81 40 A 8.30 4.12 1.66 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 0.00 0.00 41 F 8.89 4.23 0.00 1.54 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.23 3.95 0.00 2.68 2.83 0.00 0.00 7.03 7.75 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 43 A 7.35 3.99 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 44 K 7.73 4.04 0.00 1.94 1.76 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 45 T 7.66 3.65 3.78 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 1.03 0.00 0.00 46 D 7.58 4.28 0.00 2.62 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 47 S 7.81 4.19 0.00 3.82 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 48 I 7.54 3.80 1.94 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 1.54 0.84 0.90 0.00 0.00 49 E 7.35 5.03 0.00 2.02 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 2.04 2.07 0.00 50 K 8.83 4.48 0.00 1.73 1.73 0.00 1.84 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.54 7.81 51 G 9.01 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 52 L 7.37 4.61 0.00 1.60 1.60 0.96 1.13 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 53 P 0.00 4.38 0.00 1.96 2.05 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 54 I 8.22 4.67 2.13 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 1.34 0.95 1.08 0.00 0.00 55 P 0.00 4.79 0.00 2.13 2.20 0.00 3.75 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 56 V 9.12 4.88 2.39 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 0.68 0.00 0.00 1.39 0.00 0.00 57 V 8.06 4.28 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 0.54 0.00 0.00 0.83 0.00 0.00 58 I 8.34 4.38 1.45 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 -0.30 -0.36 0.27 0.00 0.00 59 T 9.38 4.75 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 1.25 0.00 0.00 60 V 7.69 4.40 2.03 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 0.81 0.00 0.00 0.84 0.00 0.00 61 Y 8.43 4.86 0.00 3.09 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 62 A 8.60 4.26 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 63 D 7.95 4.47 0.00 2.78 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 64 R 7.90 3.73 0.00 2.27 2.09 0.00 3.17 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 65 S 7.92 4.73 0.00 4.02 4.07 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 66 F 7.67 5.55 0.00 2.95 2.89 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 67 T 8.17 5.31 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 1.37 0.00 0.00 68 F 8.41 5.90 0.00 3.26 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 69 V 8.50 4.26 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 1.00 0.00 0.00 0.93 0.00 0.00 70 T 8.61 4.47 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 1.32 0.00 0.00 71 K 7.91 4.53 0.00 1.76 2.14 0.00 1.69 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.38 7.81 72 T 8.61 4.38 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 1.26 0.00 0.00 73 P 0.00 4.34 0.00 2.22 2.21 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 74 P 0.00 4.34 0.00 2.18 2.05 0.00 3.61 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 2.13 2.19 0.00 75 A 8.52 4.07 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 76 A 7.88 3.94 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 77 V 7.70 3.62 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 0.97 0.00 0.00 1.00 0.00 0.00 78 L 7.83 4.07 0.00 1.66 1.72 0.97 1.08 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 79 L 7.83 4.11 0.00 1.83 1.71 0.92 1.36 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 80 K 7.96 4.00 0.00 2.01 2.01 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.77 7.81 81 K 8.05 4.00 0.00 2.02 2.07 0.00 1.32 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.59 7.81 82 A 7.87 3.99 1.42 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 0.00 0.00 83 A 8.31 4.20 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 G 7.71 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 85 I 7.42 4.34 1.87 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 1.41 0.70 0.91 0.00 0.00 86 K 8.53 4.25 0.00 1.76 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.44 7.81 87 S 7.62 4.85 0.00 3.81 3.76 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 88 G 8.23 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 0.00 0.00 0.00 0.00 89 S 7.99 4.29 0.00 3.99 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 90 G 8.82 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 91 K 7.23 4.61 0.00 1.88 1.90 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.43 7.81 92 P 0.00 4.25 0.00 2.06 2.20 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 93 N 9.00 4.70 0.00 2.88 2.98 0.00 0.00 7.01 7.61 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 94 K 8.05 4.08 0.00 1.97 1.87 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.58 7.81 95 D 7.73 4.77 0.00 2.58 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 0.00 0.00 0.00 0.00 96 K 8.65 4.45 0.00 1.76 1.73 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.48 7.81 97 V 8.12 3.96 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 0.98 0.00 0.00 98 G 7.63 4.35 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 99 K 8.38 5.14 0.00 1.77 1.73 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.45 7.81 100 I 8.89 4.80 1.87 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 1.28 1.07 0.98 0.00 0.00 101 S 8.57 4.69 0.00 4.06 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 0.00 102 R 8.52 3.91 0.00 2.35 1.98 0.00 3.10 0.00 0.00 3.45 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 103 A 7.92 3.98 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 0.00 104 Q 7.67 4.74 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.56 2.26 0.00 105 L 7.82 3.98 0.00 1.91 1.73 0.92 0.67 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 0.00 106 Q 7.99 3.95 0.00 2.16 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 107 E 7.92 4.79 0.00 2.23 2.00 0.00 0.00 0.00 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 2.53 0.00 108 I 8.26 3.72 2.00 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 1.46 1.12 0.91 0.00 0.00 109 A 7.88 4.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.23 4.08 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.69 0.00 111 T 7.76 3.87 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 1.22 0.00 0.00 112 K 8.39 4.29 0.00 1.82 1.84 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.41 7.81 113 A 7.50 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.90 4.08 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 0.00 115 D 7.93 4.51 0.00 2.66 2.73 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 0.00 116 M 7.56 4.34 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.48 0.00 117 T 8.31 4.31 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 1.21 0.00 0.00 118 G 8.10 3.78 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 0.00 0.00 0.00 119 A 8.70 4.11 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 D 7.60 5.05 0.00 2.64 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 0.00 121 I 8.16 3.76 1.87 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 1.64 1.05 0.91 0.00 0.00 122 E 8.16 3.94 0.00 2.05 2.00 0.00 0.00 0.00 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 2.44 0.00 123 A 8.00 3.97 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 0.00 124 M 7.93 4.00 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.78 0.00 125 T 7.89 3.89 4.42 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 1.21 0.00 0.00 126 R 7.62 4.75 0.00 1.92 2.00 0.00 3.13 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 127 S 8.09 4.28 0.00 4.06 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 0.00 128 I 7.88 3.76 2.02 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 1.84 1.62 0.91 0.00 0.00 129 E 8.25 4.10 0.00 2.25 2.00 0.00 0.00 0.00 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 2.65 0.00 130 G 7.71 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 0.00 131 T 7.87 4.05 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 1.21 0.00 0.00 132 A 7.84 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 7.94 3.86 0.00 1.94 2.02 0.00 3.16 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 1.67 1.83 0.00 134 S 7.60 4.49 0.00 3.99 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 0.00 135 M 7.59 4.50 0.00 2.16 2.24 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 2.54 2.70 0.00 136 G 8.10 3.66 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 0.00 0.00 0.00 137 L 7.91 5.16 0.00 1.50 1.61 0.95 1.09 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 0.00 138 V 8.33 3.98 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 0.96 0.00 0.00 0.93 0.00 0.00 139 V 8.16 5.46 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 0.88 0.00 0.00 0.93 0.00 0.00 140 E 8.75 4.44 0.00 2.09 1.83 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 2.31 2.38 0.00 141 D 8.58 4.57 0.00 2.67 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