NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7437 8.4249 118.1280 52.8828 39.0309 173.2569 3 T 3.5963 7.9463 117.8457 62.4073 69.3229 171.9464 4 K 4.4668 8.9369 127.0049 54.8110 34.8325 174.8765 5 Y 4.7559 8.7432 124.2329 56.3042 39.8686 175.7138 6 N 4.4989 8.6729 120.8048 53.5079 40.6955 175.8708 7 K 3.8098 8.7750 128.0208 59.8488 32.4399 178.8720 8 E 3.9051 8.2066 118.3228 59.1289 29.4039 178.9362 9 F 4.2368 8.9202 121.1470 61.3687 39.4332 177.1997 10 L 3.6818 8.0341 118.5936 57.4746 41.1763 179.5577 11 L 3.6168 7.6456 119.0466 57.7969 41.5564 178.8826 12 Y 3.8734 7.7381 119.1077 60.6601 38.7882 177.8837 13 L 3.8869 8.1966 121.4345 57.9427 42.0508 178.6354 14 A 4.1068 8.2523 121.2947 55.1011 18.2873 179.8943 15 G 3.4032 7.7186 104.1322 47.8680 0.0000 175.6979 16 F 3.8095 7.9714 123.5354 60.8154 39.3686 177.4192 17 V 3.6393 8.4432 118.2586 66.1492 31.1813 177.7668 18 D 4.4851 8.3870 118.0961 57.5984 40.6039 178.2026 19 G 3.5605 7.7404 106.3393 45.6534 0.0000 174.3577 20 D 4.7096 8.3148 119.3144 52.4301 41.6320 176.6559 21 G 4.2293 7.3856 107.7915 45.2930 0.0000 173.2970 22 S 4.6900 8.7151 113.5742 56.8884 66.2371 172.7627 23 I 4.9625 8.5270 127.7108 59.8914 38.8801 174.8458 24 I 4.6474 9.0482 128.6743 59.2358 40.0730 174.7056 25 A 5.2834 8.7161 127.8795 50.2561 21.6471 175.1536 26 Q 4.6254 9.2515 120.0179 54.1224 33.5304 174.2557 27 I 4.7684 8.3722 122.5704 59.6102 39.3346 174.4485 28 E 4.6561 9.0883 128.9890 53.4200 31.7993 173.3781 29 P 4.6886 0.0000 0.0000 63.1619 32.4716 175.6074 30 N 4.6918 8.8972 120.9470 53.1340 42.2948 175.4335 31 Q 4.1435 9.1227 126.0231 58.3621 29.1464 177.1923 32 S 4.2947 8.2184 111.0365 59.2333 63.7690 174.0182 33 Y 4.2532 7.7720 119.7767 56.6583 38.9335 176.1512 34 K 3.5222 8.6447 123.6900 59.3748 31.8834 178.0033 35 F 4.8475 7.5031 115.2759 57.0875 39.2861 176.7578 36 K 4.2378 8.7106 118.0900 57.2776 30.0839 174.7784 37 H 5.3744 7.7109 113.0800 54.6404 33.2752 172.7527 38 R 4.4987 8.9235 120.1924 54.5190 33.5691 173.8128 39 L 5.1558 8.4953 123.4259 53.1127 43.8071 175.7981 40 K 4.6513 9.1146 124.0307 54.5791 35.4344 174.6117 41 L 5.3105 8.6289 126.2855 53.3167 45.2402 175.4820 42 T 4.8689 9.2582 119.8599 61.8542 72.8320 172.4353 43 F 5.3436 9.4175 129.2351 56.5719 41.5331 174.3436 44 K 4.7767 8.2121 126.2875 54.5176 36.0997 174.7935 45 V 4.4985 8.6363 125.9187 61.4605 34.2930 174.2762 46 T 5.0560 8.1105 124.4642 62.5494 70.4749 174.0551 47 Q 4.5946 8.9997 123.9642 54.5719 33.2827 173.4321 48 K 4.1831 8.8985 125.9489 57.3125 32.7583 177.6043 49 T 3.9492 8.6490 122.2211 66.4786 68.7030 176.1763 50 Q 4.0310 8.2856 121.6138 58.8541 29.0836 177.4783 51 R 4.6205 8.2631 115.5468 55.9168 30.5228 177.9363 52 R 3.9067 8.3284 122.5032 59.3017 29.7257 178.0700 53 W 4.3754 8.4383 116.1927 59.8195 27.7427 177.9524 54 F 3.4727 7.2688 121.2014 60.6962 38.5921 177.1969 55 L 3.9029 7.6510 118.2091 57.8113 41.1024 178.9541 56 D 4.4110 8.4531 119.1707 57.3878 40.7294 179.0103 57 K 3.9492 8.2483 119.0280 59.2538 32.0383 179.0151 58 L 3.6733 7.5011 120.5677 58.0330 41.8234 178.8850 59 V 3.7315 7.8836 118.3403 66.4566 31.1273 177.5796 60 D 4.2978 7.4323 115.5760 57.3445 41.1622 177.7574 61 E 3.9454 8.0204 118.1311 59.3880 29.5783 179.0399 62 I 4.0094 7.9986 119.3265 62.4813 37.2694 177.4992 63 G 4.0664 9.9889 106.7746 45.0711 0.0000 172.7265 64 V 4.3698 7.3469 117.0163 61.1282 34.2343 174.2049 65 G 3.7619 10.4507 107.8302 45.3257 0.0000 171.2581 66 Y 4.8555 7.0703 114.8014 56.2498 41.7547 173.5131 67 V 4.8575 8.5271 119.3191 61.0903 34.1434 174.3462 68 S 4.8295 8.9127 121.8655 56.5138 65.3248 171.7606 69 D 5.1182 8.8561 126.8800 52.6938 42.1428 175.8389 70 S 4.5815 8.8839 120.2877 57.7589 63.5194 174.2849 71 G 4.1320 8.1334 111.9716 46.1956 0.0000 175.4609 72 S 4.2692 8.6808 114.6241 59.8527 63.8131 174.0025 73 V 5.0653 7.5167 111.3162 59.5958 36.0918 174.7690 74 S 5.2975 9.1258 117.6569 56.9870 67.3620 172.9883 75 N 5.4107 8.9515 118.0554 51.6917 42.6162 173.5272 76 Y 4.5548 9.0892 125.8500 57.5849 40.5380 174.3382 77 I 4.5252 6.9956 125.9861 59.1889 41.5726 173.9875 78 L 4.7560 8.8728 128.2886 53.6812 44.3361 176.8758 79 S 4.7937 8.8103 119.7804 57.0563 65.8708 174.8921 80 E 4.0276 8.2752 121.2301 56.2320 30.1813 176.9181 81 I 3.7825 8.5546 127.6123 64.6534 37.3609 178.5322 82 K 4.0329 8.0196 118.4817 59.1702 31.9930 177.5969 83 P 4.4032 0.0000 0.0000 65.3944 31.1399 178.4794 84 L 4.0831 8.2281 119.3706 58.2963 42.0518 178.2464 85 H 4.0528 8.5324 118.4570 59.5446 29.6595 176.6920 86 N 4.3990 8.3772 118.6588 56.5096 38.7517 176.6469 87 F 4.4121 8.6254 122.2490 61.5491 39.5169 177.2505 88 L 3.5477 8.2617 118.8941 57.6555 41.0944 179.3326 89 T 3.7540 7.6279 115.1583 67.0928 68.5107 176.0708 90 Q 4.1839 7.5497 118.3173 58.5241 29.0604 178.0067 91 L 3.9904 7.6667 121.6453 57.8973 42.1329 178.4752 92 Q 3.8205 8.0841 119.8284 58.9316 28.6878 176.8469 93 P 4.0621 0.0000 0.0000 64.4549 31.3052 176.8045 94 F 4.7613 7.6867 114.3488 57.2304 40.0538 176.1852 95 L 4.3177 7.5398 120.7226 54.4656 42.0784 176.7763 96 K 4.4558 9.4243 120.6881 56.9756 34.4792 177.4613 97 L 4.4012 8.3414 116.5895 55.3427 42.9016 177.2908 98 K 4.9093 8.0324 115.3641 55.2198 32.9455 177.6808 99 Q 3.9249 8.0793 122.4262 59.2698 28.9298 178.4030 100 K 3.9202 7.9328 118.9890 59.4442 32.0220 179.0961 101 Q 3.9850 8.0864 117.6188 58.9778 28.6746 178.6823 102 A 4.0127 7.9806 121.5866 55.4062 18.4472 179.5287 103 N 4.2700 8.3682 115.0154 56.2183 38.4530 177.7683 104 L 3.9162 8.0450 120.7214 57.4788 41.5863 179.6302 105 V 3.6308 7.8808 118.3617 65.9232 31.5239 177.8820 106 L 3.9895 8.0307 118.8357 57.8866 41.5378 179.5852 107 K 3.9367 8.0692 119.3055 59.3864 31.8697 178.8004 108 I 4.0634 7.9359 119.3527 64.7223 37.4133 178.1494 109 I 3.9536 8.1057 120.5611 64.5960 36.7702 178.3639 110 E 4.0845 8.2016 118.0283 59.1634 29.5673 178.5401 111 Q 4.4697 8.0833 115.8708 56.0349 28.8711 177.5537 112 L 4.0697 7.7149 121.2945 57.4133 42.1393 177.1206 113 P 4.4397 0.0000 0.0000 65.8926 31.2516 178.3836 114 S 4.1539 8.2926 110.9884 61.5886 61.9666 175.7845 115 A 4.2073 8.0390 121.9166 54.3059 18.2564 179.1891 116 K 4.2725 8.0578 115.9047 58.3397 32.3004 177.5358 117 E 4.5814 7.8924 116.9346 56.5428 30.8017 176.5580 118 S 4.7214 7.9032 113.4089 55.3791 66.2718 172.4811 119 P 3.0396 0.0000 0.0000 65.2216 31.3666 178.1774 120 D 4.2691 7.9786 118.2852 57.3911 40.7934 178.9754 121 K 3.8573 8.0784 118.6217 59.2007 31.9643 179.0796 122 F 4.0048 8.2752 121.2218 61.3228 39.2400 176.9157 123 L 3.7175 7.9014 118.5949 57.8944 41.2207 179.2349 124 E 3.5822 7.5580 117.5214 59.1774 29.9017 178.7179 125 V 2.3376 7.0862 118.0720 65.6411 31.4579 177.7601 126 C 3.8967 7.5721 116.9071 62.7657 27.9173 176.1673 127 T 4.1533 7.3583 112.6817 63.8957 68.2924 176.6541 128 W 4.4751 7.6111 121.4117 59.2215 29.0670 178.7590 129 V 3.6078 7.6396 118.1698 65.9712 30.6509 177.3025 130 D 4.4061 8.1440 118.6995 57.8456 40.7308 179.1255 131 Q 4.0998 8.0190 117.9552 58.9398 28.5974 179.0000 132 I 3.6973 7.8518 120.5826 64.3936 36.9681 178.2659 133 A 3.9636 7.8834 120.0130 55.1895 18.2357 179.2355 134 A 4.0854 7.9734 118.5459 55.2606 18.5010 179.5871 135 L 4.1055 7.8935 116.7932 57.0400 41.9037 177.5863 136 N 4.5986 7.8156 115.2298 53.2387 39.5624 175.5673 137 D 4.6286 8.1010 120.4677 53.2653 39.3775 176.3118 138 S 4.3883 7.6394 114.5226 57.9578 63.5411 173.7199 139 K 4.6624 8.5221 123.5979 55.9876 34.3647 176.8045 140 T 4.6423 7.7507 106.9673 60.8941 69.5479 173.8148 141 R 4.1142 8.0348 121.5147 56.9389 30.8296 174.9453 142 K 4.3758 8.5968 121.3407 58.1652 34.4005 176.5460 143 T 4.3102 7.7993 114.8516 62.7994 69.1901 174.6814 144 T 4.7190 8.3259 116.8395 59.0718 73.2676 174.7841 145 S 4.0418 8.7305 115.3058 61.7344 62.4066 176.4627 146 E 4.0266 7.8058 120.9764 59.3041 28.9147 178.8562 147 T 4.0228 7.9120 115.4334 66.7069 68.5593 176.4533 148 V 3.4883 7.5726 119.3971 66.1905 31.5688 177.9870 149 R 4.1050 8.4523 118.5390 58.9910 29.5660 178.4369 150 A 4.4358 7.4852 120.9127 52.0806 17.3466 178.2711 151 V 4.0015 8.0970 112.6329 63.0055 32.0308 176.7570 152 L 3.9784 7.7983 121.5042 56.4809 41.3955 176.9353 153 D 4.5316 8.9227 122.9109 53.8827 41.0629 176.7063 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 2 N 8.42 4.74 0.00 2.72 2.86 0.00 0.00 6.96 6.65 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 3 T 7.95 3.60 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 0.87 0.00 0.00 4 K 8.94 4.47 0.00 1.63 1.60 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.44 7.81 5 Y 8.74 4.76 0.00 3.20 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 6 N 8.67 4.50 0.00 2.80 2.78 0.00 0.00 6.65 6.63 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 7 K 8.77 3.81 0.00 1.90 1.79 0.00 1.86 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.27 1.50 7.81 8 E 8.21 3.91 0.00 2.27 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 2.37 0.00 9 F 8.92 4.24 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 10 L 8.03 3.68 0.00 1.44 1.55 1.18 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.65 3.62 0.00 1.65 1.60 0.81 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.74 3.87 0.00 3.16 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 13 L 8.20 3.89 0.00 1.17 1.25 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.25 4.11 1.48 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 0.00 0.00 0.00 15 G 7.72 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.97 3.81 0.00 2.79 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 17 V 8.44 3.64 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 1.20 0.00 0.00 1.40 0.00 0.00 18 D 8.39 4.49 0.00 2.81 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 19 G 7.74 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.31 4.71 0.00 1.85 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 21 G 7.39 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 0.00 0.00 0.00 22 S 8.72 4.69 0.00 3.78 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 23 I 8.53 4.96 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.94 1.01 0.00 0.00 24 I 9.05 4.65 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.71 0.92 0.00 0.00 25 A 8.72 5.28 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 9.25 4.63 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.37 4.77 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.51 0.90 0.00 0.00 28 E 9.09 4.66 0.00 1.97 1.73 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 2.19 2.26 0.00 29 P 0.00 4.69 0.00 1.99 1.98 0.00 3.80 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 2.06 2.18 0.00 30 N 8.90 4.69 0.00 2.83 3.00 0.00 0.00 6.93 6.69 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 31 Q 9.12 4.14 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 32 S 8.22 4.29 0.00 3.85 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 33 Y 7.77 4.25 0.00 3.15 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 34 K 8.64 3.52 0.00 1.35 1.09 0.00 1.31 0.00 0.00 0.61 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.38 1.06 7.81 35 F 7.50 4.85 0.00 2.24 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 36 K 8.71 4.24 0.00 1.97 1.87 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.57 7.81 37 H 7.71 5.37 0.00 3.31 3.30 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.92 4.50 0.00 0.67 0.78 0.00 3.09 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.35 0.00 39 L 8.50 5.16 0.00 1.60 1.56 0.81 0.57 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 40 K 9.11 4.65 0.00 1.77 1.61 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.41 7.81 41 L 8.63 5.31 0.00 1.67 1.59 1.00 0.73 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 42 T 9.26 4.87 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 1.18 0.00 0.00 43 F 9.42 5.34 0.00 3.25 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 44 K 8.21 4.78 0.00 1.67 1.39 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.70 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 1.23 7.81 45 V 8.64 4.50 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 1.28 0.00 0.00 0.78 0.00 0.00 46 T 8.11 5.06 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 47 Q 9.00 4.59 0.00 2.24 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.87 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 48 K 8.90 4.18 0.00 1.83 1.71 0.00 1.79 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.52 7.81 49 T 8.65 3.95 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 1.33 0.00 0.00 50 Q 8.29 4.03 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.44 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 51 R 8.26 4.62 0.00 1.93 1.60 0.00 3.04 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 52 R 8.33 3.91 0.00 2.00 2.07 0.00 3.18 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 53 W 8.44 4.38 0.00 3.69 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 F 7.27 3.47 0.00 1.58 2.63 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 55 L 7.65 3.90 0.00 1.91 1.78 1.02 1.23 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 56 D 8.45 4.41 0.00 2.95 2.79 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 57 K 8.25 3.95 0.00 1.77 1.75 0.00 1.95 0.00 0.00 2.03 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.85 7.81 58 L 7.50 3.67 0.00 1.60 1.38 0.69 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.88 3.73 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 1.13 0.00 0.00 1.19 0.00 0.00 60 D 7.43 4.30 0.00 2.70 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 61 E 8.02 3.95 0.00 1.82 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 2.06 2.27 0.00 62 I 8.00 4.01 1.83 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.51 0.66 0.00 0.00 63 G 9.99 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 0.00 0.00 0.00 64 V 7.35 4.37 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 0.80 0.00 0.00 1.02 0.00 0.00 65 G 10.45 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 0.00 0.00 0.00 66 Y 7.07 4.86 0.00 3.04 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.53 4.86 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 0.86 0.00 0.00 1.10 0.00 0.00 68 S 8.91 4.83 0.00 4.08 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.86 5.12 0.00 2.74 2.58 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 70 S 8.88 4.58 0.00 3.98 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 71 G 8.13 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.68 4.27 0.00 3.88 3.87 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 73 V 7.52 5.07 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 0.74 0.00 0.00 0.93 0.00 0.00 74 S 9.13 5.30 0.00 3.73 3.74 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 75 N 8.95 5.41 0.00 2.58 2.54 0.00 0.00 7.02 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 76 Y 9.09 4.55 0.00 3.06 2.79 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 77 I 7.00 4.53 0.58 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.66 0.64 0.00 0.00 78 L 8.87 4.76 0.00 1.69 1.70 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.81 4.79 0.00 3.93 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 80 E 8.28 4.03 0.00 2.10 1.92 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 2.44 2.47 0.00 81 I 8.55 3.78 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.78 0.98 0.00 0.00 82 K 8.02 4.03 0.00 1.85 1.90 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.57 7.81 83 P 0.00 4.40 0.00 2.25 2.20 0.00 3.77 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 2.19 2.21 0.00 84 L 8.23 4.08 0.00 2.00 2.00 1.17 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.53 4.05 0.00 3.39 3.53 0.00 5.64 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 86 N 8.38 4.40 0.00 3.00 2.94 0.00 0.00 6.92 7.58 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 87 F 8.63 4.41 0.00 3.23 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 88 L 8.26 3.55 0.00 1.72 1.58 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.63 3.75 4.39 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 1.18 0.00 0.00 90 Q 7.55 4.18 0.00 2.23 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 91 L 7.67 3.99 0.00 0.84 1.11 0.75 0.34 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 92 Q 8.08 3.82 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.55 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 93 P 0.00 4.06 0.00 0.83 1.61 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.93 0.00 94 F 7.69 4.76 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.54 4.32 0.00 1.63 1.63 0.91 0.78 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 96 K 9.42 4.46 0.00 1.72 1.79 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.36 7.81 97 L 8.34 4.40 0.00 1.75 1.68 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.03 4.91 0.00 1.93 1.80 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.35 1.28 7.81 99 Q 8.08 3.92 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.27 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 100 K 7.93 3.92 0.00 1.81 1.80 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.49 7.81 101 Q 8.09 3.99 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 102 A 7.98 4.01 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 0.00 103 N 8.37 4.27 0.00 2.70 2.78 0.00 0.00 7.07 6.63 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 0.00 104 L 8.04 3.92 0.00 1.83 1.72 0.94 0.51 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 0.00 105 V 7.88 3.63 2.26 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 1.18 0.00 0.00 1.04 0.00 0.00 106 L 8.03 3.99 0.00 1.88 1.68 0.82 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.07 3.94 0.00 1.77 1.72 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.80 1.12 7.81 108 I 7.94 4.06 2.15 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.14 1.00 0.00 0.00 109 I 8.11 3.95 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.87 0.98 0.00 0.00 110 E 8.20 4.08 0.00 2.21 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 2.39 2.43 0.00 111 Q 8.08 4.47 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.82 3.03 0.00 112 L 7.71 4.07 0.00 1.80 1.82 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.44 0.00 2.20 2.14 0.00 3.73 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 2.16 2.19 0.00 114 S 8.29 4.15 0.00 3.93 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 0.00 115 A 8.04 4.21 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.06 4.27 0.00 2.12 1.93 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.72 7.81 117 E 7.89 4.58 0.00 1.97 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 2.32 2.52 0.00 118 S 7.90 4.72 0.00 3.88 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 0.00 119 P 0.00 3.04 0.00 2.06 1.72 0.00 3.75 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 120 D 7.98 4.27 0.00 2.73 2.72 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 0.00 121 K 8.08 3.86 0.00 1.92 1.83 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.42 7.81 122 F 8.28 4.00 0.00 3.06 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 0.00 123 L 7.90 3.72 0.00 1.87 1.57 0.85 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.56 3.58 0.00 1.76 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 1.47 2.08 0.00 125 V 7.09 2.34 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 0.81 0.00 0.00 0.48 0.00 0.00 126 C 7.57 3.90 0.00 2.87 2.72 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 0.00 127 T 7.36 4.15 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 1.12 0.00 0.00 128 W 7.61 4.48 0.00 3.54 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 0.00 129 V 7.64 3.61 2.20 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 1.06 0.00 0.00 0.94 0.00 0.00 130 D 8.14 4.41 0.00 2.97 2.72 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 0.00 131 Q 8.02 4.10 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 132 I 7.85 3.70 2.05 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 1.48 0.79 0.94 0.00 0.00 133 A 7.88 3.96 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 0.00 134 A 7.97 4.09 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 0.00 135 L 7.89 4.11 0.00 1.79 1.74 0.93 0.92 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 0.00 136 N 7.82 4.60 0.00 2.85 2.77 0.00 0.00 7.05 8.44 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 0.00 137 D 8.10 4.63 0.00 2.64 2.62 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 0.00 138 S 7.64 4.39 0.00 3.91 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 0.00 139 K 8.52 4.66 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.57 7.81 140 T 7.75 4.64 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 0.00 141 R 8.03 4.11 0.00 1.79 1.86 0.00 3.17 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 142 K 8.60 4.38 0.00 1.74 1.79 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.41 7.81 143 T 7.80 4.31 4.41 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 1.27 0.00 0.00 144 T 8.33 4.72 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 1.26 0.00 0.00 145 S 8.73 4.04 0.00 3.96 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 0.00 146 E 7.81 4.03 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 147 T 7.91 4.02 4.34 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 1.26 0.00 0.00 148 V 7.57 3.49 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 0.76 0.00 0.00 149 R 8.45 4.11 0.00 1.94 2.10 0.00 3.21 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 150 A 7.49 4.44 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 0.00 151 V 8.10 4.00 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 0.77 0.00 0.00 0.97 0.00 0.00 152 L 7.80 3.98 0.00 1.71 1.65 0.96 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.92 4.53 0.00 2.80 2.79 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