NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9887 8.3544 109.7346 44.6649 0.0000 174.6436 2 L 3.7711 8.1018 122.7170 57.3820 42.1000 176.0738 3 H 4.6362 8.5631 113.3938 55.5931 31.4679 174.6434 4 C 5.0085 7.6474 115.8076 53.8891 40.1934 171.5749 5 P 4.4964 0.0000 0.0000 62.4345 31.5704 176.0957 6 S 4.3218 8.5209 115.3612 60.9366 63.0019 174.9231 7 D 4.6382 8.9813 122.4636 54.2482 38.0400 173.6783 8 W 4.9831 8.0802 118.7653 55.3888 31.4529 175.1146 9 Y 4.8753 9.6034 120.8772 56.7788 40.3130 174.1955 10 Y 5.1058 8.7830 124.3488 56.9398 40.3162 173.6864 11 Y 4.2256 8.3581 126.9993 56.9766 43.7251 175.2858 12 D 3.4231 6.7032 123.5904 55.1095 41.8745 174.3435 13 Q 4.7702 8.7640 109.5910 54.6251 30.6213 174.4194 14 H 4.9380 8.0708 113.7465 54.2439 33.5368 172.0557 15 C 5.4893 8.4891 118.5874 56.4692 40.2872 172.5092 16 Y 6.2322 9.5532 119.0851 55.7622 42.4992 174.5116 17 R 4.3254 7.9948 116.4976 55.4151 33.4249 173.2107 18 I 4.0826 8.1491 127.5273 60.7546 38.5711 174.6912 19 F 3.8247 8.5683 129.0596 55.7919 39.9969 175.9122 20 N 4.8918 8.2403 124.0848 52.0265 36.2091 173.8566 21 E 4.6387 7.4310 121.0333 54.4817 34.2188 173.3424 22 E 4.7928 8.5858 125.1723 55.3055 30.9008 175.2605 23 M 4.9116 8.8296 123.1425 54.0449 37.4455 174.5822 24 N 5.7794 8.5521 118.4104 50.8180 39.5462 175.9462 25 W 4.0576 8.6148 127.4550 60.7182 30.6641 177.5687 26 E 4.3368 8.5399 116.4786 59.0151 29.3999 178.4425 27 D 4.5696 8.0550 119.7925 56.9577 40.9303 178.2142 28 A 2.9210 8.1978 121.6961 54.8834 18.0778 179.3155 29 E 3.6138 7.6212 116.6713 58.8504 29.8610 178.6388 30 W 4.3777 8.2641 128.5020 60.3260 30.8536 177.4616 31 F 3.6497 8.6344 121.0685 61.7571 38.5956 176.3273 32 C 4.2752 8.5787 116.0990 60.7262 38.2906 176.5110 33 T 3.9441 7.6444 118.0428 65.6737 67.7637 176.4796 34 K 3.6624 7.4406 118.9545 58.1456 32.2394 178.2945 35 Q 3.8135 7.8157 117.9887 58.0082 29.1507 175.8936 36 A 3.8729 6.7174 118.4013 50.9079 22.3412 175.5781 37 K 3.9929 8.3201 119.5270 57.9078 32.4064 177.7011 38 G 3.8613 8.7355 109.8118 46.0610 0.0000 173.3083 39 A 4.7640 7.5825 121.5822 52.2208 20.1560 176.7161 40 H 4.8669 8.9924 115.0153 54.2302 34.0464 173.1992 41 L 4.4507 8.8349 120.4850 55.3348 42.3053 178.2010 42 V 4.0172 8.8465 115.4125 62.0998 32.7622 175.5957 43 S 4.9548 8.7106 117.3387 56.5213 65.3260 173.8212 44 I 4.7902 8.1662 122.0531 60.2124 39.5074 175.1263 45 K 4.6878 9.6075 124.5118 55.3657 33.0616 176.2742 46 S 4.6247 7.5491 113.2687 56.6609 66.1254 176.7185 47 A 4.0666 8.1817 123.6423 55.2476 18.1114 180.0035 48 K 3.9720 8.0525 116.5982 59.6395 32.1450 179.0657 49 E 3.9400 8.3175 119.1072 58.7719 29.4671 178.5625 50 A 4.0687 8.6143 121.5061 55.2545 18.5290 178.6174 51 D 4.3137 8.3783 116.9382 57.8348 41.0951 178.7620 52 F 3.7350 7.9030 120.5100 61.1662 39.2864 177.2703 53 V 3.0336 7.9819 117.9953 65.5945 31.2167 177.9338 54 A 3.9745 8.1867 120.9099 54.6840 18.2938 179.0935 55 W 3.9701 8.0584 126.9517 61.0505 30.5789 177.7525 56 M 3.1244 7.7675 118.0539 58.3091 31.3747 178.4007 57 V 3.1047 7.3093 118.2846 65.9050 31.3714 177.8150 58 T 3.8748 7.7632 114.7590 66.9792 68.4468 175.7097 59 Q 3.9563 7.1870 116.8574 56.6812 29.0206 176.1191 60 N 4.7738 7.0051 114.5777 52.1779 40.5616 174.5305 61 I 3.9370 7.6129 119.8293 60.1383 38.8491 175.3796 62 E 3.9599 9.5473 127.3477 56.5903 29.7786 178.0416 63 E 3.9005 8.8104 123.0886 59.2122 29.5887 178.1059 64 S 4.4833 7.6048 110.1667 57.8091 63.5557 173.5407 65 F 5.2209 7.6264 119.9842 56.7095 40.8392 176.0459 66 S 4.9308 8.5231 114.4118 59.0608 65.6113 172.5459 67 H 5.6116 8.4458 116.5147 54.4005 32.2928 173.0095 68 V 4.6681 8.9963 121.7616 60.9445 34.2890 174.9314 69 S 4.9290 9.2051 124.7973 58.9372 63.6492 173.4755 70 I 4.4958 8.5515 116.4584 58.7539 41.1739 175.8196 71 G 4.1510 8.6405 108.9059 45.5186 0.0000 173.3376 72 L 4.5982 7.4785 119.1296 53.0802 42.8283 176.2955 73 R 4.5041 8.0584 121.8524 54.1344 33.1736 174.5903 74 V 3.6780 8.2767 124.3989 63.2065 31.9586 176.1675 75 Q 4.2483 8.4385 124.9444 57.3082 29.5182 176.3143 76 N 4.4741 7.8621 114.5871 53.3509 39.1027 174.9884 77 K 4.1729 8.1117 120.6914 58.3198 32.8394 177.8340 78 E 4.1571 7.8833 116.8407 55.9237 30.0303 177.0291 79 K 4.0412 8.5205 120.5001 59.3238 32.2172 176.7175 80 Q 4.4989 7.4888 113.3907 55.5386 31.3056 173.5931 81 C 4.6359 8.2871 112.5059 59.2809 29.3689 174.1672 82 S 4.1615 9.3888 117.6722 58.3016 62.0935 173.8221 83 T 4.2746 8.3959 117.4381 61.6970 69.7304 174.3539 84 K 5.0017 7.5579 120.5690 54.3425 35.5160 175.6190 85 W 4.7167 8.8165 122.4453 55.4248 30.4054 177.7853 86 S 4.5218 8.7866 113.8587 60.6387 62.7420 174.6407 87 D 4.6146 8.2164 119.4999 53.4445 39.3844 176.5947 88 G 4.0575 8.7848 110.2293 45.7297 0.0000 174.5203 89 S 4.4626 8.6762 114.6021 57.9560 63.9664 172.9137 90 S 5.0118 8.3267 115.1234 56.8687 63.4554 174.5585 91 V 4.1416 8.3400 127.4413 62.0469 29.5497 175.5580 92 S 4.7771 8.6520 118.1370 57.4702 64.6189 173.9337 93 Y 4.7347 7.6662 120.9430 56.0423 41.7035 173.8134 94 D 4.3456 7.1407 119.8624 54.1756 43.7832 174.9475 95 N 4.8841 8.7506 123.5228 52.5743 39.7046 174.1760 96 L 4.0110 8.2106 121.1572 55.0100 42.6948 176.9811 97 L 4.2524 8.4114 125.7520 54.5406 42.7836 177.3045 98 D 4.4185 9.0827 123.2660 57.7838 40.9083 179.0594 99 L 4.0414 8.0409 116.6417 57.7961 41.5863 177.7149 100 Y 4.2497 8.2081 113.5410 57.5432 38.1820 175.4906 101 I 4.1112 8.1354 123.1376 61.0581 37.0496 175.9638 102 T 4.5700 8.1980 116.5441 59.5671 68.1632 173.5008 103 K 4.2920 8.2779 127.1582 57.5001 34.5213 176.3430 104 C 4.5855 7.9897 118.9685 55.8443 37.6458 172.3409 105 S 5.3951 8.4078 112.0853 58.2563 66.2342 172.8105 106 L 5.1843 8.8851 119.6277 55.1094 44.0781 173.9763 107 L 5.4040 9.3821 119.7366 53.1487 45.2037 175.6154 108 K 4.8521 8.3575 120.3438 54.3014 34.5245 177.1691 109 K 2.4800 9.1649 126.6847 59.1196 32.1760 178.0146 110 E 4.0861 7.7374 112.4311 57.2560 29.6492 176.5336 111 T 4.4629 7.4052 112.5454 62.0546 68.3871 174.3415 112 G 3.6343 7.9252 105.9085 45.5330 0.0000 174.3118 113 F 3.9194 6.9674 114.4771 58.8290 36.5155 176.3552 114 R 4.5989 7.7761 116.1064 55.7897 32.5404 176.2201 115 K 4.4659 8.0916 115.6123 54.2687 34.9053 174.4738 116 W 5.4198 8.0762 118.9367 55.4702 31.1101 176.0243 117 F 4.8433 9.0818 122.5093 55.2973 41.5075 175.3019 118 V 4.3118 8.5966 122.7926 63.4989 32.2951 174.6975 119 A 4.7361 8.7242 126.3116 50.2952 22.9805 175.5385 120 S 4.4531 8.7168 114.3443 59.0272 62.7056 176.2561 121 C 4.1496 9.0072 123.9735 59.1981 40.2788 174.9171 122 I 3.9819 7.2933 111.0578 60.9137 38.0644 176.5575 123 G 3.6360 7.6137 111.5294 45.8295 0.0000 173.1058 124 K 4.9505 8.4421 122.3858 54.7044 32.6557 175.4399 125 I 4.7211 8.7916 118.9099 57.7082 41.9466 172.8913 126 P 5.3975 0.0000 0.0000 62.9038 32.6741 174.6346 127 F 5.1925 7.7337 112.0562 56.0901 41.5904 172.9077 128 V 4.8117 8.2718 118.9639 61.6104 33.7091 173.9272 129 C 5.6144 9.3962 125.3055 55.7700 38.5261 172.6447 130 K 5.4320 9.3256 122.6900 55.1057 35.6689 174.9059 131 F 5.3266 8.9638 120.3639 55.3224 41.8353 171.1360 132 P 4.9981 0.0000 0.0000 60.5347 32.0280 173.8083 133 P 4.7363 0.0000 0.0000 62.6327 32.1410 175.3635 134 Q 4.6937 8.3194 117.5653 54.5902 30.7915 175.8704 135 C 4.3834 8.2950 117.3461 60.1163 29.2161 174.0727 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 G 8.35 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 2 L 8.10 3.77 0.00 1.56 1.53 0.76 0.54 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 3 H 8.56 4.64 0.00 2.26 2.92 0.00 5.90 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 4 C 7.65 5.01 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.50 0.00 2.18 2.03 0.00 3.28 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.02 0.00 6 S 8.52 4.32 0.00 3.97 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 7 D 8.98 4.64 0.00 2.90 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 W 8.08 4.98 0.00 3.47 3.36 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 9 Y 9.60 4.88 0.00 3.47 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 10 Y 8.78 5.11 0.00 3.17 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 11 Y 8.36 4.23 0.00 1.43 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 6.70 3.42 0.00 1.58 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 0.00 0.00 0.00 13 Q 8.76 4.77 0.00 1.84 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 14 H 8.07 4.94 0.00 2.79 2.77 0.00 5.60 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 15 C 8.49 5.49 0.00 1.78 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 16 Y 9.55 6.23 0.00 3.25 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 17 R 7.99 4.33 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 18 I 8.15 4.08 1.58 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.78 0.58 0.00 0.00 19 F 8.57 3.82 0.00 1.55 2.49 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 20 N 8.24 4.89 0.00 2.61 3.18 0.00 0.00 6.86 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 21 E 7.43 4.64 0.00 1.87 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 2.15 2.35 0.00 22 E 8.59 4.79 0.00 1.84 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.79 0.00 23 M 8.83 4.91 0.00 1.72 1.77 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 24 N 8.55 5.78 0.00 3.25 3.01 0.00 0.00 6.36 8.88 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 25 W 8.61 4.06 0.00 3.46 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 26 E 8.54 4.34 0.00 2.49 2.52 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 2.47 2.45 0.00 27 D 8.06 4.57 0.00 2.83 2.77 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 28 A 8.20 2.92 0.35 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 29 E 7.62 3.61 0.00 1.16 1.50 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 2.17 2.29 0.00 30 W 8.26 4.38 0.00 3.46 3.24 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 0.00 31 F 8.63 3.65 0.00 2.93 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.58 4.28 0.00 3.13 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.64 3.94 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 34 K 7.44 3.66 0.00 1.33 1.53 0.00 1.08 0.00 0.00 1.26 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.26 7.81 35 Q 7.82 3.81 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.20 2.73 0.00 36 A 6.72 3.87 -0.18 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 37 K 8.32 3.99 0.00 1.65 1.70 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.30 7.81 38 G 8.74 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.58 4.76 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 40 H 8.99 4.87 0.00 3.23 3.19 0.00 5.85 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.83 4.45 0.00 1.29 1.55 -0.26 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.85 4.02 2.23 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 1.04 0.00 0.00 1.04 0.00 0.00 43 S 8.71 4.95 0.00 3.96 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 44 I 8.17 4.79 2.12 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 1.29 0.00 0.00 45 K 9.61 4.69 0.00 1.87 1.88 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.42 7.81 46 S 7.55 4.62 0.00 4.05 4.01 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 47 A 8.18 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.05 3.97 0.00 1.95 2.03 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.54 7.81 49 E 8.32 3.94 0.00 2.31 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 0.00 2.48 2.57 0.00 50 A 8.61 4.07 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 51 D 8.38 4.31 0.00 2.83 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 52 F 7.90 3.73 0.00 2.02 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 0.00 0.00 0.00 53 V 7.98 3.03 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 0.90 0.00 0.00 0.98 0.00 0.00 54 A 8.19 3.97 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 W 8.06 3.97 0.00 3.30 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 56 M 7.77 3.12 0.00 1.42 0.93 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.79 0.00 57 V 7.31 3.10 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 -0.58 0.00 0.00 0.61 0.00 0.00 58 T 7.76 3.87 4.29 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 1.13 0.00 0.00 59 Q 7.19 3.96 0.00 1.31 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 60 N 7.01 4.77 0.00 2.35 2.61 0.00 0.00 6.91 7.32 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 61 I 7.61 3.94 1.70 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 1.40 0.81 0.92 0.00 0.00 62 E 9.55 3.96 0.00 2.18 1.55 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 2.22 2.24 0.00 63 E 8.81 3.90 0.00 1.85 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 2.28 2.28 0.00 64 S 7.60 4.48 0.00 3.77 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 65 F 7.63 5.22 0.00 3.04 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 66 S 8.52 4.93 0.00 3.86 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 8.45 5.61 0.00 3.02 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 9.00 4.67 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.81 0.00 0.00 69 S 9.21 4.93 0.00 3.94 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 70 I 8.55 4.50 1.99 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.89 0.96 0.00 0.00 71 G 8.64 4.15 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 0.00 72 L 7.48 4.60 0.00 1.58 1.56 0.68 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.06 4.50 0.00 0.76 1.43 0.00 2.21 0.00 0.00 2.57 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.26 0.00 74 V 8.28 3.68 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 0.79 0.00 0.00 0.89 0.00 0.00 75 Q 8.44 4.25 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 76 N 7.86 4.47 0.00 2.66 3.04 0.00 0.00 6.91 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 77 K 8.11 4.17 0.00 1.66 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.37 7.81 78 E 7.88 4.16 0.00 2.06 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 2.28 2.37 0.00 79 K 8.52 4.04 0.00 1.87 1.83 0.00 1.78 0.00 0.00 1.91 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.38 7.81 80 Q 7.49 4.50 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.91 0.00 0.00 0.00 0.00 0.00 2.13 2.50 0.00 81 C 8.29 4.64 0.00 2.89 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 9.39 4.16 0.00 3.60 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 83 T 8.40 4.27 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 1.17 0.00 0.00 84 K 7.56 5.00 0.00 1.72 1.76 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.41 7.81 85 W 8.82 4.72 0.00 3.53 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 86 S 8.79 4.52 0.00 4.04 4.08 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 87 D 8.22 4.61 0.00 2.81 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 88 G 8.78 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 89 S 8.68 4.46 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 90 S 8.33 5.01 0.00 3.90 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 91 V 8.34 4.14 1.97 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 0.55 0.00 0.00 -0.00 0.00 0.00 92 S 8.65 4.78 0.00 4.07 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 93 Y 7.67 4.73 0.00 2.99 2.96 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 94 D 7.14 4.35 0.00 2.56 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 0.00 0.00 0.00 95 N 8.75 4.88 0.00 2.77 2.78 0.00 0.00 7.10 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 96 L 8.21 4.01 0.00 1.64 1.56 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.41 4.25 0.00 1.91 1.71 1.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 98 D 9.08 4.42 0.00 2.71 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 99 L 8.04 4.04 0.00 1.68 1.68 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.21 4.25 0.00 2.92 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 0.00 101 I 8.14 4.11 1.96 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 1.50 0.70 0.87 0.00 0.00 102 T 8.20 4.57 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 1.19 0.00 0.00 103 K 8.28 4.29 0.00 1.57 1.67 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.36 1.37 7.81 104 C 7.99 4.59 0.00 2.80 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 0.00 105 S 8.41 5.40 0.00 3.91 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 0.00 106 L 8.89 5.18 0.00 2.00 1.89 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 107 L 9.38 5.40 0.00 1.85 2.03 1.34 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.36 4.85 0.00 1.27 1.42 0.00 0.61 0.00 0.00 0.88 0.00 0.00 2.20 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.16 0.78 7.81 109 K 9.16 2.48 0.00 1.70 1.67 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 1.19 7.81 110 E 7.74 4.09 0.00 2.02 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 2.09 2.13 0.00 111 T 7.41 4.46 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 1.35 0.00 0.00 112 G 7.93 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 0.00 113 F 6.97 3.92 0.00 3.18 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 0.00 114 R 7.78 4.60 0.00 2.00 1.95 0.00 3.34 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.73 0.00 115 K 8.09 4.47 0.00 1.44 1.49 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.30 7.81 116 W 8.08 5.42 0.00 3.22 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 F 9.08 4.84 0.00 3.01 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 0.00 118 V 8.60 4.31 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 0.76 0.00 0.00 0.97 0.00 0.00 119 A 8.72 4.74 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 0.00 120 S 8.72 4.45 0.00 3.88 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 9.01 4.15 0.00 2.95 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 0.00 122 I 7.29 3.98 1.88 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 1.23 0.55 0.92 0.00 0.00 123 G 7.61 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 0.00 124 K 8.44 4.95 0.00 1.65 1.79 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.43 7.81 125 I 8.79 4.72 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.02 0.94 0.00 0.00 126 P 0.00 5.40 0.00 1.90 1.82 0.00 3.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.22 0.00 127 F 7.73 5.19 0.00 3.08 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 0.00 128 V 8.27 4.81 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.84 0.00 0.00 129 C 9.40 5.61 0.00 3.35 3.57 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 0.00 0.00 0.00 0.00 130 K 9.33 5.43 0.00 1.70 1.65 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.67 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.23 0.80 7.81 131 F 8.96 5.33 0.00 2.98 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 0.00 132 P 0.00 5.00 0.00 2.09 2.10 0.00 4.06 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 133 P 0.00 4.74 0.00 2.16 2.09 0.00 3.81 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 134 Q 8.32 4.69 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 135 C 8.30 4.38 0.00 2.86 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