NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2591 8.3344 116.7650 58.4373 64.2214 171.5409 5 V 3.7851 8.1720 121.7740 61.6359 31.6917 171.3155 6 V 4.1095 8.9749 128.3535 62.0209 33.6674 174.5563 7 K 4.7164 8.1258 122.8068 54.3256 35.1445 177.3733 8 S 4.1889 9.0082 119.1485 61.9533 62.8255 176.4632 9 E 4.2916 8.1587 115.2025 58.2062 29.7140 176.5171 10 D 4.7164 8.2811 120.6865 54.4881 40.9472 178.0020 11 Y 4.1166 7.3845 119.8747 59.9163 37.8390 177.0726 12 A 4.2441 6.9202 120.3438 52.5256 19.0505 176.7027 13 L 4.6606 7.2745 115.7652 51.8536 43.7641 174.8372 14 P 4.4539 0.0000 0.0000 62.8384 31.8534 176.1676 15 S 4.8566 8.2181 114.7500 56.4109 66.0250 172.9860 16 Y 4.4178 8.4670 122.6068 57.2709 39.4838 175.1240 17 V 4.2006 6.7535 123.3569 60.4971 34.0804 173.0497 18 D 4.6510 8.3296 123.0521 52.6995 41.9879 176.1873 19 R 4.4471 8.1726 120.0601 54.7250 32.2070 176.0318 20 R 3.8606 8.6057 122.1456 59.2464 30.1689 176.7535 21 D 4.8314 7.9872 114.0061 53.3866 40.1747 176.6301 22 Y 4.8672 8.2593 120.3588 55.9237 39.3753 172.4386 23 P 4.3770 0.0000 0.0000 64.9377 31.9077 177.1060 24 L 4.6124 7.2246 118.8207 51.5491 41.1750 174.1471 25 P 4.5094 0.0000 0.0000 62.5577 31.9180 177.4626 26 D 4.4097 8.6974 118.8637 56.3202 41.1106 176.8798 27 V 4.5005 7.2579 117.1575 60.7562 34.8153 174.2278 28 A 4.2522 8.3693 128.0496 52.0046 19.0606 177.2461 29 H 3.5991 8.5923 122.2494 58.2446 29.9455 175.8495 30 V 4.1045 7.2996 119.0402 61.0090 32.3039 175.1210 31 K 4.1281 8.3208 126.6871 57.1589 32.7302 176.4430 32 N 4.7811 7.9099 115.7626 51.3545 39.3195 173.9447 33 L 4.5976 8.2140 123.8646 53.6267 43.1825 177.8365 34 S 4.5410 8.7122 118.0071 56.9732 66.1913 174.9597 35 A 3.9746 8.4441 122.5312 55.6939 18.0042 179.7684 36 S 4.1044 8.0387 111.8677 61.8541 62.9441 176.5671 37 Q 4.0069 7.9580 121.4514 58.5813 28.3119 178.7076 38 K 4.0625 8.4782 119.7110 59.1976 31.9617 179.3188 39 A 3.9974 7.8016 120.8005 54.8511 18.4152 179.2572 40 L 3.8989 7.9647 118.8752 58.4735 41.9403 179.3860 41 K 3.9781 8.2464 117.3933 59.3856 32.1187 178.6000 42 E 4.1214 7.9228 119.7420 58.9907 29.6732 178.5988 43 K 3.9356 8.5542 120.0916 59.3491 31.9757 178.1840 44 E 4.3149 8.1953 118.5614 58.4991 29.6402 178.1079 45 K 4.2557 8.1458 116.8464 59.5972 32.7741 177.2684 46 A 4.4999 7.9098 124.8728 51.5078 20.3720 176.2955 47 S 4.2011 8.3670 108.7675 57.9633 63.4712 176.3874 48 W 4.6769 8.3219 126.6121 59.2730 29.1744 178.0483 49 S 4.4437 7.7683 110.9615 59.8630 62.4936 174.8906 50 S 4.5932 7.7830 115.9660 58.8009 63.4368 174.4260 51 L 4.4953 7.6432 121.3058 54.1573 42.2985 177.4791 52 S 4.5529 9.2066 117.9572 57.4773 65.5768 175.4168 53 I 3.6703 8.3200 123.7088 65.1427 36.8290 178.1800 54 D 4.4787 8.1513 118.6973 57.5685 40.6106 178.7462 55 E 4.0408 7.9180 119.1709 59.2241 29.4777 179.5125 56 K 3.9508 8.3639 119.0773 59.2534 32.0042 179.6594 57 V 3.5880 8.2880 118.9384 66.0943 31.3218 177.6598 58 E 3.9338 8.3547 118.0785 59.1204 29.6547 178.3347 59 L 4.0388 8.0129 120.4567 58.1568 42.3342 178.1773 60 Y 4.0427 8.0741 119.4134 60.9219 38.6276 178.1347 61 R 4.4056 8.3087 116.3162 57.8505 30.3849 177.9345 62 L 4.1023 7.7691 121.1076 57.0839 42.2041 178.3082 63 K 3.5518 7.4881 118.9986 57.3077 32.3265 176.2246 64 F 5.2656 6.7355 115.0930 55.4074 42.3383 175.3206 65 K 3.8985 9.4209 124.8258 58.6048 32.2881 177.1002 66 E 5.6403 8.2534 115.5523 53.1699 32.6966 176.5688 67 S 5.2834 8.5652 118.2759 56.9294 65.8770 175.2990 68 F 3.8157 9.0919 120.1929 60.8075 38.3776 177.7036 69 A 4.0972 8.1483 118.5626 55.2803 18.2898 179.1214 70 E 4.1153 7.9605 117.2521 59.6861 29.4148 179.3618 71 M 4.1581 8.0658 115.8479 57.6226 31.3543 177.2817 72 N 4.7241 7.7350 115.6651 51.9604 39.3295 175.0990 73 R 3.9783 7.1753 121.5727 56.5292 30.7460 175.7734 74 S 4.6601 8.4678 118.8516 57.1142 63.7381 173.2167 75 T 4.6103 8.2598 116.1372 60.4662 71.3537 173.5872 76 N 4.8005 8.2975 115.1309 53.1640 39.1271 176.5631 77 E 3.9010 8.0579 122.8681 59.2751 29.5286 178.7197 78 W 4.4393 8.4287 116.1063 59.8524 27.7635 178.1602 79 K 3.0755 6.5045 118.3349 59.3179 31.3061 179.4073 80 T 3.7774 7.5577 115.3408 66.3809 68.3694 176.8355 81 V 3.6043 7.8742 120.2127 66.0285 31.6180 178.2726 82 V 3.8100 8.5732 118.4496 65.9301 31.4575 178.1076 83 G 3.6324 8.3608 105.3250 47.9648 0.0000 175.5040 84 A 4.1523 8.3966 123.9374 54.4776 18.2863 179.4477 85 A 4.1442 8.3080 119.3069 55.9826 18.5303 179.8992 86 M 4.0607 8.4390 117.0518 58.2653 31.8465 178.9885 87 F 3.9760 8.3312 121.0784 61.3615 39.7214 177.3571 88 F 3.9823 8.5469 117.4012 60.3204 38.4417 177.8786 89 I 3.9297 8.0888 119.5259 64.2553 37.2055 178.3253 90 G 3.6374 8.2460 106.7952 47.6969 0.0000 175.4930 91 F 3.9952 8.0458 123.1961 61.2497 39.1965 177.3086 92 T 3.6530 7.8444 115.1073 66.4503 68.1663 176.2600 93 A 3.9538 7.7878 121.9327 54.8968 18.1602 179.6426 94 L 3.9079 7.4527 117.6454 57.6516 41.5788 179.4299 95 L 3.8592 7.6785 119.2216 57.4910 41.3908 179.4819 96 L 3.9884 7.7566 118.3997 57.9533 41.7354 179.2026 97 I 3.7096 7.9665 119.8953 64.3577 37.0005 178.2233 98 W 4.2473 8.5587 129.2009 60.4662 30.5170 177.5471 99 E 3.9891 8.7655 119.5699 59.2776 28.8795 178.7000 100 K 4.0578 8.1166 118.6990 59.6692 32.2902 178.0510 101 H 4.0298 7.8857 117.5028 59.1385 29.9584 176.1728 102 Y 4.1969 7.4446 115.9637 58.1786 38.3639 176.6922 103 V 3.9797 7.2103 118.2083 64.3339 32.7697 175.8285 104 Y 4.6327 7.6319 117.0868 57.7132 38.3724 176.2509 105 G 3.9612 8.4706 115.2231 44.1335 0.0000 170.7396 106 P 4.5001 0.0000 0.0000 61.6910 32.4556 175.9914 107 I 3.9007 7.8370 113.8930 59.5293 38.6065 173.8672 108 P 4.2996 0.0000 0.0000 63.0829 31.3014 177.3609 109 H 4.2691 8.5861 116.2581 58.0212 28.4811 176.7157 110 T 2.8157 7.0271 108.7138 61.9817 68.5077 174.8158 111 F 4.5134 7.5013 120.2826 57.8780 40.0192 176.7184 112 E 4.2644 7.8360 119.8784 55.7693 31.4677 177.2411 113 E 3.9603 8.8995 121.3689 59.9802 29.6059 179.3210 114 E 3.9074 8.3146 118.2231 59.1670 29.6590 178.1946 115 W 3.9900 8.3754 127.5951 60.9069 30.7609 178.2819 116 V 3.6878 8.1611 111.5972 64.0150 30.9208 178.5767 117 A 4.0549 7.9385 120.9338 55.0488 18.2070 179.8793 118 K 3.8334 8.1069 117.0877 59.5681 32.0591 179.4541 119 Q 3.9099 8.6496 120.2944 59.4742 28.8284 178.5281 120 T 4.0067 8.1435 116.9465 66.1372 68.3804 176.8048 121 K 3.6502 7.7105 121.2748 59.4341 32.2077 178.7988 122 R 3.8266 8.2045 119.4038 59.6629 29.9033 178.3356 123 M 3.9930 8.2150 118.5140 58.5431 31.8996 178.8558 124 L 4.1294 8.2113 119.1287 57.5965 41.3471 179.4678 125 D 4.4297 8.1309 119.2554 57.2093 40.8770 177.6458 126 M 4.3257 8.0702 114.6300 54.2224 32.0394 176.1340 127 K 3.9731 7.7132 117.0464 56.2754 30.5102 176.3263 128 V 3.4363 7.9524 118.2180 64.1429 32.4137 174.5352 129 A 4.2664 8.6576 130.3049 52.8460 15.2329 175.1166 130 P 4.6572 0.0000 0.0000 63.6436 32.7982 178.7369 131 I 4.1438 7.8221 119.4834 63.7954 37.6098 176.2244 132 Q 4.6158 7.9341 114.0014 57.1113 34.5618 176.4251 133 G 3.7657 8.4146 105.8416 48.0255 0.0000 172.7579 134 F 4.7737 7.8664 120.2561 58.9996 41.9474 176.8758 135 S 4.4309 9.1593 117.2853 61.3333 63.1399 176.2448 136 A 4.3982 8.1975 120.9111 53.4982 18.4783 177.5240 137 K 4.6417 8.6962 115.4405 55.6380 33.5618 175.3396 138 W 4.7662 7.9715 130.8872 55.5095 32.5903 175.2365 139 D 4.3826 7.6853 127.5452 52.8815 40.1892 176.4224 140 Y 4.2597 8.4145 124.2817 60.6913 38.2275 178.0695 141 D 4.4638 7.6165 118.3973 57.1300 41.1505 177.4767 142 K 4.1267 7.9123 115.2622 55.7374 32.4945 176.7048 143 N 3.8663 7.3061 115.6385 53.4027 36.7377 173.2746 144 E 4.1747 5.9000 113.0081 54.0705 33.8149 175.4469 145 W 4.5199 8.3150 121.0666 56.4377 29.5790 176.5320 146 K 3.9650 8.7471 124.6578 56.7802 32.5993 177.0871 147 K 3.9536 8.2353 121.8463 57.4868 32.2855 174.4782 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 4 S 8.33 4.26 0.00 3.83 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 5 V 8.17 3.79 2.07 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 0.74 0.00 0.00 0.92 0.00 0.00 6 V 8.97 4.11 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 0.90 0.00 0.00 0.98 0.00 0.00 7 K 8.13 4.72 0.00 1.81 1.64 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.42 7.81 8 S 9.01 4.19 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.16 4.29 0.00 2.06 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 0.00 2.30 2.34 0.00 10 D 8.28 4.72 0.00 2.93 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 11 Y 7.38 4.12 0.00 3.07 3.28 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 12 A 6.92 4.24 1.01 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 0.00 0.00 13 L 7.27 4.66 0.00 1.74 1.57 0.92 0.86 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 14 P 0.00 4.45 0.00 2.07 2.02 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 15 S 8.22 4.86 0.00 3.97 3.83 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 16 Y 8.47 4.42 0.00 3.00 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 17 V 6.75 4.20 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 0.64 0.00 0.00 0.84 0.00 0.00 18 D 8.33 4.65 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.17 4.45 0.00 1.89 1.92 0.00 2.93 0.00 0.00 3.51 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 20 R 8.61 3.86 0.00 1.82 2.18 0.00 3.33 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 21 D 7.99 4.83 0.00 2.84 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.26 4.87 0.00 2.74 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 23 P 0.00 4.38 0.00 2.26 2.43 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 24 L 7.22 4.61 0.00 1.51 1.67 0.93 1.13 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 25 P 0.00 4.51 0.00 2.44 1.71 0.00 3.94 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 26 D 8.70 4.41 0.00 2.76 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.26 4.50 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 0.84 0.00 0.00 0.98 0.00 0.00 28 A 8.37 4.25 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 29 H 8.59 3.60 0.00 2.28 3.16 0.00 5.74 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.30 4.10 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 0.78 0.00 0.00 0.69 0.00 0.00 31 K 8.32 4.13 0.00 1.74 1.81 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.40 7.81 32 N 7.91 4.78 0.00 2.64 2.72 0.00 0.00 6.89 7.85 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 33 L 8.21 4.60 0.00 1.60 1.56 0.89 0.90 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 34 S 8.71 4.54 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.44 3.97 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 36 S 8.04 4.10 0.00 4.05 4.14 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 0.00 0.00 0.00 0.00 37 Q 7.96 4.01 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 38 K 8.48 4.06 0.00 2.02 1.86 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.65 7.81 39 A 7.80 4.00 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 40 L 7.96 3.90 0.00 1.94 1.74 1.02 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.25 3.98 0.00 1.91 1.87 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.71 1.58 7.81 42 E 7.92 4.12 0.00 2.21 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 2.31 2.37 0.00 43 K 8.55 3.94 0.00 1.99 1.97 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.49 7.81 44 E 8.20 4.31 0.00 2.18 2.29 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 2.63 2.45 0.00 45 K 8.15 4.26 0.00 1.84 1.87 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.17 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.77 7.81 46 A 7.91 4.50 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 47 S 8.37 4.20 0.00 3.80 3.71 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 48 W 8.32 4.68 0.00 3.53 3.14 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 0.00 0.00 0.00 0.00 49 S 7.77 4.44 0.00 4.05 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 50 S 7.78 4.59 0.00 4.09 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 51 L 7.64 4.50 0.00 1.85 1.63 1.03 0.97 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 52 S 9.21 4.55 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.32 3.67 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 0.76 0.90 0.00 0.00 54 D 8.15 4.48 0.00 2.69 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 55 E 7.92 4.04 0.00 2.19 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 2.34 2.36 0.00 56 K 8.36 3.95 0.00 1.94 1.82 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.44 7.81 57 V 8.29 3.59 2.21 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 1.11 0.00 0.00 0.91 0.00 0.00 58 E 8.35 3.93 0.00 2.08 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 2.32 2.33 0.00 59 L 8.01 4.04 0.00 2.11 1.66 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.07 4.04 0.00 3.08 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 61 R 8.31 4.41 0.00 1.86 2.03 0.00 3.50 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 2.00 1.87 0.00 62 L 7.77 4.10 0.00 2.02 1.52 0.87 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.49 3.55 0.00 1.41 0.78 0.00 1.28 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.31 0.37 7.81 64 F 6.74 5.27 0.00 2.68 2.85 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 65 K 9.42 3.90 0.00 1.15 2.12 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.13 7.81 66 E 8.25 5.64 0.00 2.08 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 67 S 8.57 5.28 0.00 4.10 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 68 F 9.09 3.82 0.00 3.09 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 69 A 8.15 4.10 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 70 E 7.96 4.12 0.00 2.17 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 0.00 2.36 2.36 0.00 71 M 8.07 4.16 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 72 N 7.74 4.72 0.00 2.76 2.89 0.00 0.00 6.93 7.07 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 73 R 7.18 3.98 0.00 1.80 1.93 0.00 3.26 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 74 S 8.47 4.66 0.00 3.90 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 75 T 8.26 4.61 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 1.23 0.00 0.00 76 N 8.30 4.80 0.00 2.66 2.60 0.00 0.00 6.43 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 77 E 8.06 3.90 0.00 2.00 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 0.00 2.36 2.35 0.00 78 W 8.43 4.44 0.00 3.65 3.38 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 79 K 6.50 3.08 0.00 1.41 1.38 0.00 1.25 0.00 0.00 1.25 0.00 0.00 2.72 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.56 3.78 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 81 V 7.87 3.60 2.34 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 1.08 0.00 0.00 1.02 0.00 0.00 82 V 8.57 3.81 2.31 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 1.18 0.00 0.00 1.26 0.00 0.00 83 G 8.36 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 84 A 8.40 4.15 1.56 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 85 A 8.31 4.14 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.44 4.06 0.00 2.13 2.33 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.62 0.00 87 F 8.33 3.98 0.00 3.16 3.18 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 88 F 8.55 3.98 0.00 3.34 3.14 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 0.00 0.00 0.00 0.00 89 I 8.09 3.93 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.94 0.00 0.00 90 G 8.25 3.64 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 0.00 0.00 0.00 91 F 8.05 4.00 0.00 2.59 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 92 T 7.84 3.65 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 1.19 0.00 0.00 93 A 7.79 3.95 1.30 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 0.00 0.00 0.00 94 L 7.45 3.91 0.00 1.48 1.56 0.87 0.44 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 95 L 7.68 3.86 0.00 1.69 1.59 0.83 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.76 3.99 0.00 1.87 1.73 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.97 3.71 2.05 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 1.42 0.95 0.96 0.00 0.00 98 W 8.56 4.25 0.00 3.45 3.34 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 99 E 8.77 3.99 0.00 2.32 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 0.00 1.70 2.20 0.00 100 K 8.12 4.06 0.00 1.83 1.99 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.48 7.81 101 H 7.89 4.03 0.00 3.13 2.89 0.00 5.81 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 0.00 102 Y 7.44 4.20 0.00 1.43 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 0.00 0.00 0.00 0.00 103 V 7.21 3.98 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 0.71 0.00 0.00 0.88 0.00 0.00 104 Y 7.63 4.63 0.00 3.10 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 0.00 105 G 8.47 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.50 0.00 2.15 2.01 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 107 I 7.84 3.90 1.49 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.43 0.59 0.00 0.00 108 P 0.00 4.30 0.00 2.29 1.93 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 109 H 8.59 4.27 0.00 3.26 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.03 2.82 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 -0.14 0.00 0.00 111 F 7.50 4.51 0.00 3.07 3.08 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 0.00 0.00 0.00 0.00 112 E 7.84 4.26 0.00 2.30 2.15 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 2.63 2.52 0.00 113 E 8.90 3.96 0.00 2.08 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 0.00 2.47 2.46 0.00 114 E 8.31 3.91 0.00 2.09 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 0.00 2.39 2.39 0.00 115 W 8.38 3.99 0.00 3.60 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 0.00 116 V 8.16 3.69 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 0.90 0.00 0.00 1.06 0.00 0.00 117 A 7.94 4.05 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.11 3.83 0.00 1.63 1.59 0.00 1.38 0.00 0.00 1.33 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.46 7.81 119 Q 8.65 3.91 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 120 T 8.14 4.01 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 1.51 0.00 0.00 121 K 7.71 3.65 0.00 1.89 1.75 0.00 1.68 0.00 0.00 1.43 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.50 7.81 122 R 8.20 3.83 0.00 1.78 1.95 0.00 3.07 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 123 M 8.21 3.99 0.00 1.90 2.25 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.44 0.00 124 L 8.21 4.13 0.00 1.41 1.16 -1.00 0.68 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 0.00 125 D 8.13 4.43 0.00 2.70 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 0.00 126 M 8.07 4.33 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.89 0.00 127 K 7.71 3.97 0.00 1.84 1.95 0.00 1.21 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.43 7.81 128 V 7.95 3.44 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 0.81 0.00 0.00 0.87 0.00 0.00 129 A 8.66 4.27 1.46 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 0.00 0.00 130 P 0.00 4.66 0.00 2.28 2.40 0.00 3.83 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 131 I 7.82 4.14 1.92 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 1.46 0.60 0.95 0.00 0.00 132 Q 7.93 4.62 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.08 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.41 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 0.00 134 F 7.87 4.77 0.00 3.12 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 0.00 135 S 9.16 4.43 0.00 4.19 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 0.00 136 A 8.20 4.40 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 0.00 137 K 8.70 4.64 0.00 1.97 1.93 0.00 1.75 0.00 0.00 1.50 0.00 0.00 2.76 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.42 7.81 138 W 7.97 4.77 0.00 2.81 2.59 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 0.00 139 D 7.69 4.38 0.00 2.39 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 0.00 0.00 0.00 140 Y 8.41 4.26 0.00 3.10 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 0.00 141 D 7.62 4.46 0.00 2.81 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 0.00 142 K 7.91 4.13 0.00 1.53 1.69 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.35 7.81 143 N 7.31 3.87 0.00 2.75 2.82 0.00 0.00 6.67 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 0.00 144 E 5.90 4.17 0.00 1.78 1.72 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 1.92 2.01 0.00 145 W 8.32 4.52 0.00 3.17 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 0.00 146 K 8.75 3.96 0.00 1.81 1.77 0.00 1.94 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.44 7.81 147 K 8.24 3.95 0.00 1.65 1.60 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.17 1.31 7.81