NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3730 8.3044 120.3484 55.6335 33.3350 175.6401 2 L 4.2635 7.8147 121.8217 51.0562 40.4765 174.6304 3 T 3.8144 8.3131 113.4165 64.1562 69.8316 174.6490 4 D 4.5355 7.6931 120.6561 50.6084 42.5045 173.3839 5 P 4.2269 0.0000 0.0000 65.4487 31.5324 177.8840 6 I 3.6368 7.8770 117.4734 64.4298 37.0644 177.9230 7 A 3.9154 9.3859 122.4822 55.5357 18.1839 178.6748 8 D 4.1711 8.6506 116.5989 57.7080 41.2356 177.8099 9 M 3.8697 8.8328 118.8569 58.9952 32.1636 178.1399 10 L 3.8632 7.9300 118.7010 58.3802 41.6912 179.8666 11 T 3.7728 7.7116 115.1597 66.5926 68.3508 176.7642 12 R 4.0640 7.9849 119.8611 59.3750 30.1087 178.9377 13 I 3.6012 7.6483 119.3397 64.4355 37.2531 178.3129 14 R 3.7569 8.0344 119.4789 59.6406 30.0129 178.3099 15 N 4.2930 9.0401 117.1195 56.2755 38.4383 177.3732 16 A 4.0768 8.6992 122.8367 55.1572 18.3561 179.8326 17 T 3.9729 8.1002 108.6222 65.0497 68.7083 177.1082 18 R 3.7632 7.6130 119.4771 58.0941 30.0372 178.3704 19 V 4.3226 6.8360 108.5202 60.3215 32.0830 175.2226 20 Y 3.4389 7.3921 114.3991 57.9333 35.7436 170.4105 21 K 4.0986 8.0836 118.6452 57.0012 33.0689 177.0067 22 E 4.3158 8.9551 121.7843 58.8502 30.2675 175.5745 23 S 5.0856 8.1351 112.0787 58.7348 65.4487 171.6607 24 T 4.6686 7.6155 123.2206 62.6064 69.8128 172.7040 25 D 5.3649 8.3962 129.2768 54.0358 42.9010 176.3896 26 V 4.5152 8.2979 119.1279 60.0108 35.1651 171.1128 27 P 3.7150 0.0000 0.0000 62.8334 31.5792 175.9202 28 A 4.2608 8.1837 127.3888 52.0746 19.1569 176.9664 29 S 4.5403 8.3716 113.4400 56.0371 65.9370 175.5849 30 R 3.8965 8.8564 123.1327 59.7660 29.8723 178.6551 31 F 4.4388 8.4012 119.4651 61.7934 39.1510 177.3636 32 K 3.6870 8.3329 117.9260 59.3072 31.8810 179.0153 33 E 3.5600 8.3926 120.0035 58.9678 29.4031 178.8311 34 E 3.9188 8.5788 119.0344 59.4103 29.6175 179.1992 35 I 3.6585 7.4495 119.6853 64.4606 37.0988 178.3606 36 L 3.8714 7.9306 120.0148 57.7177 41.2321 179.3091 37 R 4.0841 7.7882 118.4674 59.8010 29.8104 178.6431 38 I 3.7443 7.4245 117.6804 64.5659 37.2608 178.2800 39 L 3.8664 8.0501 119.4785 57.8761 40.5753 179.2055 40 A 4.1808 8.2539 120.8778 54.4415 18.7065 179.1673 41 R 4.4287 8.2222 117.1472 59.5532 30.2014 177.3940 42 E 4.0368 8.9492 115.3805 56.5440 29.7488 177.4236 43 G 3.8018 9.4229 107.4776 45.6081 0.0000 174.5744 44 F 4.6062 7.9153 117.9762 58.6189 39.0990 175.5165 45 I 4.7287 7.2662 113.1360 58.8757 40.2877 176.1248 46 K 3.6587 8.7622 121.7728 58.0955 32.2643 176.5903 47 G 3.9425 6.4036 104.4721 44.2204 0.0000 171.4812 48 Y 5.7164 7.7006 117.1848 56.4775 41.2263 173.7007 49 E 4.7023 9.2220 116.2309 54.9239 33.3171 174.7948 50 R 4.6969 8.6520 120.9204 56.6840 31.0060 175.9803 51 V 4.6170 8.5821 121.9218 61.5860 36.1358 173.4219 52 D 5.3906 8.7612 122.9664 52.7128 43.2189 175.7042 53 V 4.1311 8.7412 124.4062 62.0494 32.9481 175.1688 54 D 4.2957 9.9777 126.6736 55.0514 39.6702 173.5121 55 G 4.1497 8.7194 106.2998 44.5489 0.0000 174.4973 56 K 4.6234 7.8284 118.4833 53.4927 34.2521 173.7858 57 P 4.8537 0.0000 0.0000 63.9228 32.1935 174.8590 58 Y 5.0603 8.9567 121.8546 56.4497 41.8464 173.9268 59 L 5.0073 8.5391 119.5064 53.8534 45.7801 176.3589 60 R 4.2414 9.3520 125.3461 56.1320 31.1480 176.1373 61 V 4.3930 8.3152 125.2624 61.2607 32.9676 175.0864 62 Y 4.3624 9.0430 128.1021 57.3377 38.2811 175.7760 63 L 4.4363 8.6050 125.0568 54.4063 42.8163 176.8065 64 K 4.5241 7.8470 121.1288 54.9922 35.1481 174.7306 65 Y 4.8967 8.4719 123.0131 56.0243 42.8289 175.8326 66 G 4.4149 9.0636 108.5937 45.5531 0.0000 171.2289 67 P 4.8572 0.0000 0.0000 61.5424 33.6168 175.4682 68 R 4.3865 8.4818 119.9933 56.8150 30.9112 175.1107 69 R 4.7627 8.5392 122.1289 54.6159 33.3383 175.3026 70 Q 4.4630 8.6702 118.6565 54.8546 31.2842 177.7325 71 G 3.6917 8.5124 107.5276 45.7467 0.0000 171.4691 72 P 4.1257 0.0000 0.0000 63.9488 31.7241 174.9443 73 D 4.1943 8.5623 122.0254 54.3172 38.6390 171.0654 74 P 4.4809 0.0000 0.0000 62.5707 32.2901 176.7156 75 R 3.8191 7.7649 118.6469 56.4310 30.2494 174.9256 76 P 5.2230 0.0000 0.0000 62.2000 32.4679 175.6144 77 E 4.3919 8.7722 122.4308 55.9974 30.9896 176.1612 78 Q 4.5764 8.6788 124.7750 55.9114 29.6105 176.6365 79 V 3.8089 8.3197 120.9266 64.7525 31.9516 176.1060 80 I 4.2405 7.2733 120.5768 59.9913 36.1147 174.5841 81 H 4.4542 8.4957 120.9218 57.4489 29.3702 175.0040 82 H 4.3208 7.1345 117.7643 53.8429 33.5622 171.8741 83 I 4.3255 6.6248 124.2482 60.5456 40.8417 172.7927 84 R 4.5514 7.4557 129.3400 54.5352 33.5123 174.4739 85 R 4.1690 8.6268 124.5486 56.9806 30.5277 174.9019 86 I 4.3343 8.1991 118.6363 62.8606 39.8966 176.0303 87 S 4.2123 7.9455 115.8006 58.2069 63.2688 173.9939 88 K 4.6579 8.4472 125.2531 53.6704 36.1375 174.2042 89 P 4.3985 0.0000 0.0000 64.1891 31.3733 175.8990 90 G 3.8999 8.6081 106.0158 45.6470 0.0000 174.1348 91 R 5.0797 7.0844 121.6523 56.3170 33.1286 174.4855 92 R 3.9101 7.6693 117.7197 56.3305 31.3540 177.2424 93 V 4.0840 7.9616 121.0258 61.4824 33.9916 173.5771 94 Y 5.2526 8.3041 125.2760 56.4275 40.5073 175.8974 95 V 4.5926 8.4422 115.2439 59.5144 36.4062 175.7822 96 G 4.1098 8.9337 112.7031 44.7084 0.0000 175.1679 97 V 3.4182 8.3677 119.7296 64.4756 31.1795 177.4958 98 K 4.2436 8.0048 117.1405 57.4842 32.2213 176.9332 99 E 4.5903 8.5992 118.7079 55.9246 29.8959 175.9177 100 I 4.0626 7.7347 120.9974 59.6109 36.9924 174.2173 101 P 4.3171 0.0000 0.0000 63.2648 31.3577 176.8201 102 R 4.3876 8.0903 119.7647 53.8562 29.6553 175.1098 103 V 3.4933 8.2011 121.8238 64.5344 32.6214 176.4425 104 R 3.3178 9.2816 126.6752 58.4257 27.4767 175.8321 105 R 3.7436 8.8150 108.7435 57.2488 29.3758 176.5787 106 G 4.1052 8.3561 105.9803 45.5087 0.0000 176.0751 107 L 4.2954 7.8959 118.3263 56.2185 41.7923 177.2070 108 G 4.4661 7.5451 106.0300 43.5321 0.0000 172.4079 109 I 4.6317 8.3219 115.3365 59.7411 40.7599 174.3619 110 A 4.7742 8.9165 123.2019 50.7089 22.4605 175.1426 111 I 4.9292 8.2413 123.0986 59.9538 39.3150 175.1776 112 L 5.3335 8.8711 126.0161 54.0835 44.8686 174.9263 113 S 5.2133 9.2765 115.0300 56.8375 64.5605 173.0196 114 T 5.1241 8.9302 117.1985 59.3158 72.2243 174.8273 115 S 4.4114 8.7198 113.7025 59.2125 62.8444 174.5309 116 K 4.4341 8.2274 119.6638 56.3114 32.6264 176.9974 117 G 3.7371 8.2725 108.1151 44.2926 0.0000 172.1654 118 V 4.6501 8.0976 119.2763 61.8512 32.4520 175.9501 119 L 5.2450 8.7737 126.9720 52.2896 45.8290 175.3480 120 T 5.0353 8.1974 109.3157 60.4106 71.2679 175.5229 121 D 4.6466 8.8014 123.9079 57.0989 39.1819 179.6235 122 R 3.9912 8.0290 119.3475 58.7563 29.8390 178.4462 123 E 3.9658 8.0228 117.6731 59.5834 29.3824 179.6004 124 A 4.0225 8.8817 121.5033 55.3121 18.3354 179.5705 125 R 3.8542 8.4080 116.4176 59.5370 30.3701 178.2123 126 K 4.0560 8.5841 119.7566 59.4985 32.1116 178.3970 127 L 4.1638 7.8956 117.0282 54.6414 42.9060 177.3049 128 G 4.0233 7.7357 107.2739 45.7872 0.0000 172.3980 129 V 4.4422 7.7121 109.8461 60.5996 36.6264 173.9015 130 G 4.2283 9.1883 109.2467 44.5989 0.0000 171.3062 131 G 4.2189 7.7930 105.2078 44.7160 0.0000 170.6532 132 E 4.2185 8.4459 119.8829 57.3519 30.4082 176.6663 133 L 4.1847 9.2020 130.5936 53.6706 41.1114 176.4644 134 I 3.8748 8.3340 124.6492 63.9173 37.7164 175.2054 135 C 4.8828 8.0956 114.9199 58.5206 32.9219 172.0418 136 E 4.7830 8.2979 118.5511 56.4033 31.4972 174.7314 137 V 4.2509 8.0922 126.2015 61.0082 33.4048 175.6269 138 W 4.8617 7.8743 123.5679 57.1721 28.1677 174.1556 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 M 8.30 4.37 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 2 L 7.81 4.26 0.00 1.79 1.53 0.91 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.31 3.81 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 1.21 0.00 0.00 4 D 7.69 4.54 0.00 2.55 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 0.00 0.00 0.00 5 P 0.00 4.23 0.00 2.23 2.09 0.00 3.70 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 2.14 2.19 0.00 6 I 7.88 3.64 2.03 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.08 0.80 0.00 0.00 7 A 9.39 3.92 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 8 D 8.65 4.17 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 9 M 8.83 3.87 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 10 L 7.93 3.86 0.00 1.76 1.60 0.82 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.71 3.77 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 1.16 0.00 0.00 12 R 7.98 4.06 0.00 1.94 1.96 0.00 3.23 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.92 0.00 13 I 7.65 3.60 1.96 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.82 0.00 0.00 14 R 8.03 3.76 0.00 1.72 1.99 0.00 3.00 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 15 N 9.04 4.29 0.00 2.73 2.81 0.00 0.00 6.99 7.42 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 16 A 8.70 4.08 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 17 T 8.10 3.97 4.55 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 1.09 0.00 0.00 18 R 7.61 3.76 0.00 1.91 1.98 0.00 3.04 0.00 0.00 3.46 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 19 V 6.84 4.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.02 0.00 0.00 20 Y 7.39 3.44 0.00 3.00 2.68 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 21 K 8.08 4.10 0.00 1.89 1.82 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.55 7.81 22 E 8.96 4.32 0.00 2.10 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 2.54 2.45 0.00 23 S 8.14 5.09 0.00 3.75 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 24 T 7.62 4.67 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 25 D 8.40 5.36 0.00 2.48 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 26 V 8.30 4.52 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 0.66 0.00 0.00 0.87 0.00 0.00 27 P 0.00 3.72 0.00 1.80 1.79 0.00 3.65 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 2.01 2.05 0.00 28 A 8.18 4.26 1.24 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 0.00 0.00 29 S 8.37 4.54 0.00 4.00 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 30 R 8.86 3.90 0.00 1.89 2.09 0.00 3.35 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 31 F 8.40 4.44 0.00 2.99 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 32 K 8.33 3.69 0.00 1.83 1.69 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.31 7.81 33 E 8.39 3.56 0.00 1.99 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 0.00 2.33 2.19 0.00 34 E 8.58 3.92 0.00 2.19 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 2.60 2.61 0.00 35 I 7.45 3.66 1.72 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.67 0.73 0.00 0.00 36 L 7.93 3.87 0.00 1.18 1.26 0.44 0.58 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 37 R 7.79 4.08 0.00 2.24 1.99 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 38 I 7.42 3.74 2.06 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 1.55 0.64 0.99 0.00 0.00 39 L 8.05 3.87 0.00 1.87 1.84 0.95 0.48 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 40 A 8.25 4.18 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.22 4.43 0.00 1.86 2.08 0.00 3.28 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 42 E 8.95 4.04 0.00 2.16 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 2.44 2.50 0.00 43 G 9.42 3.80 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 0.00 0.00 0.00 44 F 7.92 4.61 0.00 3.27 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 45 I 7.27 4.73 2.11 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.07 0.96 0.00 0.00 46 K 8.76 3.66 0.00 2.04 1.94 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.66 7.81 47 G 6.40 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 48 Y 7.70 5.72 0.00 3.18 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 49 E 9.22 4.70 0.00 2.05 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 2.58 2.46 0.00 50 R 8.65 4.70 0.00 1.79 1.98 0.00 3.23 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 51 V 8.58 4.62 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 1.00 0.00 0.00 1.07 0.00 0.00 52 D 8.76 5.39 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.74 4.13 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 0.64 0.00 0.00 0.76 0.00 0.00 54 D 9.98 4.30 0.00 2.74 2.68 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 55 G 8.72 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 56 K 7.83 4.62 0.00 2.07 1.74 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.42 7.81 57 P 0.00 4.85 0.00 2.05 2.20 0.00 3.64 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 1.96 1.97 0.00 58 Y 8.96 5.06 0.00 3.00 2.95 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 59 L 8.54 5.01 0.00 1.57 1.59 0.73 1.14 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 60 R 9.35 4.24 0.00 1.81 1.33 0.00 3.06 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 61 V 8.32 4.39 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 0.78 0.00 0.00 0.99 0.00 0.00 62 Y 9.04 4.36 0.00 3.14 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 63 L 8.60 4.44 0.00 1.79 1.17 0.91 0.79 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 64 K 7.85 4.52 0.00 1.71 1.50 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.43 7.81 65 Y 8.47 4.90 0.00 3.13 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 66 G 9.06 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 0.00 0.00 0.00 0.00 67 P 0.00 4.86 0.00 2.15 2.24 0.00 3.76 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 2.09 1.99 0.00 68 R 8.48 4.39 0.00 1.81 1.86 0.00 3.15 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 69 R 8.54 4.76 0.00 1.75 1.85 0.00 3.23 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 70 Q 8.67 4.46 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.01 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 71 G 8.51 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 72 P 0.00 4.13 0.00 2.19 2.07 0.00 3.92 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 73 D 8.56 4.19 0.00 2.80 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 74 P 0.00 4.48 0.00 2.20 2.23 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 75 R 7.76 3.82 0.00 1.90 1.87 0.00 3.37 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.52 0.00 76 P 0.00 5.22 0.00 2.15 2.30 0.00 2.96 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 1.73 1.79 0.00 77 E 8.77 4.39 0.00 2.15 1.91 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 2.51 2.47 0.00 78 Q 8.68 4.58 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.42 2.26 0.00 79 V 8.32 3.81 2.27 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 1.02 0.00 0.00 0.96 0.00 0.00 80 I 7.27 4.24 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.71 0.68 0.00 0.00 81 H 8.50 4.45 0.00 3.28 3.48 0.00 5.82 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 82 H 7.13 4.32 0.00 1.40 1.31 0.00 5.97 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.62 4.33 1.53 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.88 0.65 0.00 0.00 84 R 7.46 4.55 0.00 1.55 1.57 0.00 3.37 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 85 R 8.63 4.17 0.00 1.69 1.82 0.00 3.48 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 86 I 8.20 4.33 2.07 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 1.19 0.75 0.89 0.00 0.00 87 S 7.95 4.21 0.00 3.81 3.73 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 88 K 8.45 4.66 0.00 1.79 1.59 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.48 7.81 89 P 0.00 4.40 0.00 2.16 2.08 0.00 3.94 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 1.98 1.98 0.00 90 G 8.61 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 91 R 7.08 5.08 0.00 1.84 1.79 0.00 3.22 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.00 92 R 7.67 3.91 0.00 1.70 1.31 0.00 3.34 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.38 0.00 93 V 7.96 4.08 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 0.80 0.00 0.00 0.89 0.00 0.00 94 Y 8.30 5.25 0.00 2.91 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.44 4.59 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 0.89 0.00 0.00 1.03 0.00 0.00 96 G 8.93 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.37 3.42 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 0.77 0.00 0.00 1.02 0.00 0.00 98 K 8.00 4.24 0.00 1.78 1.90 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.60 4.59 0.00 2.03 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 0.00 2.25 2.25 0.00 100 I 7.73 4.06 1.89 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 1.50 0.66 0.94 0.00 0.00 101 P 0.00 4.32 0.00 2.20 2.09 0.00 3.76 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 2.03 2.03 0.00 102 R 8.09 4.39 0.00 1.80 1.92 0.00 3.23 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 103 V 8.20 3.49 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 1.34 0.00 0.00 1.09 0.00 0.00 104 R 9.28 3.32 0.00 1.69 1.63 0.00 3.00 0.00 0.00 2.70 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 8.81 3.74 0.00 1.76 1.88 0.00 3.26 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 106 G 8.36 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 7.90 4.30 0.00 1.63 1.77 0.89 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 0.00 108 G 7.55 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 8.32 4.63 2.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.94 1.18 0.00 0.00 110 A 8.92 4.77 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.24 4.93 1.85 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 1.32 0.86 0.90 0.00 0.00 112 L 8.87 5.33 0.00 1.98 1.78 0.97 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.28 5.21 0.00 4.10 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 0.00 114 T 8.93 5.12 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 1.27 0.00 0.00 115 S 8.72 4.41 0.00 3.99 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 0.00 116 K 8.23 4.43 0.00 1.76 1.83 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.34 7.81 117 G 8.27 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 0.00 0.00 0.00 118 V 8.10 4.65 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 0.97 0.00 0.00 1.14 0.00 0.00 119 L 8.77 5.25 0.00 1.69 1.57 0.97 0.71 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 0.00 120 T 8.20 5.04 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 1.39 0.00 0.00 121 D 8.80 4.65 0.00 2.94 3.04 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 0.00 122 R 8.03 3.99 0.00 1.90 2.04 0.00 3.17 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 123 E 8.02 3.97 0.00 2.28 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 2.36 2.38 0.00 124 A 8.88 4.02 1.40 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 0.00 125 R 8.41 3.85 0.00 2.01 2.00 0.00 3.29 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 126 K 8.58 4.06 0.00 1.82 2.02 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.49 7.81 127 L 7.90 4.16 0.00 1.92 1.72 0.93 1.10 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 0.00 128 G 7.74 4.02 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 0.00 0.00 0.00 129 V 7.71 4.44 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 0.71 0.00 0.00 0.95 0.00 0.00 130 G 9.19 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 0.00 131 G 7.79 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 0.00 0.00 0.00 0.00 132 E 8.45 4.22 0.00 2.43 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 2.43 2.22 0.00 133 L 9.20 4.18 0.00 1.74 1.54 0.94 0.94 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 0.00 134 I 8.33 3.87 2.13 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.00 0.86 0.00 0.00 135 C 8.10 4.88 0.00 3.02 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 0.00 136 E 8.30 4.78 0.00 2.17 1.86 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 2.42 2.44 0.00 137 V 8.09 4.25 1.68 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 -0.46 0.00 0.00 0.64 0.00 0.00 138 W 7.87 4.86 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