NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.6366 8.4444 120.3920 56.2554 31.5316 173.8773 1D H 4.4275 8.2996 115.4736 56.1006 30.6448 172.2223 1E H 5.0415 7.6625 114.3303 54.3558 33.6619 171.5842 1F H 4.6245 8.8677 116.9350 56.0044 28.8812 174.3281 1G F 4.9024 8.3627 119.3510 57.8486 39.8453 173.9884 2 N 4.6230 8.5360 117.2433 52.3918 39.0569 174.5622 3 L 4.7999 8.0282 123.2334 51.9047 44.1551 174.6593 4 P 4.5400 0.0000 0.0000 61.7871 32.0885 174.8714 5 P 4.2684 0.0000 0.0000 64.9018 31.6600 176.7037 6 G 3.7690 7.7980 107.8031 45.2197 0.0000 170.9105 7 N 4.4925 8.0085 115.5837 51.4357 40.3353 173.5464 8 Y 4.8901 7.8077 112.2893 57.8893 38.3742 177.4296 9 K 4.1574 8.7136 122.4562 58.8235 32.2215 177.5278 10 K 4.7024 7.5806 115.2112 53.5143 34.9089 174.0158 11 P 4.7111 0.0000 0.0000 62.9426 32.2770 175.6075 12 K 4.9188 9.4620 120.0989 55.1037 37.2189 175.1687 13 L 5.0714 9.1829 121.4918 53.3806 44.4137 176.1159 14 L 5.0001 8.6312 122.4213 53.4967 43.5516 174.4425 15 Y 4.9239 9.2478 126.8425 56.5557 40.6485 173.6177 16 C 4.3933 8.6959 127.9933 56.6617 32.3743 174.6533 17 S 3.8076 8.2995 121.7327 60.8762 63.1097 174.8728 18 N 4.1240 7.8890 119.2406 56.2300 38.3223 175.2853 19 G 3.9266 7.5030 101.7667 44.3737 0.0000 172.4895 20 G 3.4210 7.7667 107.1673 44.6308 0.0000 173.3721 21 H 4.8814 7.4034 114.9800 53.6111 32.1287 173.8670 22 F 5.2226 8.9659 120.5789 56.0851 40.3728 175.2546 23 L 4.6043 9.2211 126.5801 55.4501 43.2230 175.6135 24 R 4.9465 9.4794 126.2492 54.5893 33.6282 174.0240 25 I 4.4707 8.2660 126.5582 59.4180 38.9362 175.6913 26 L 4.1323 8.7405 127.8884 53.4030 42.3337 176.8060 27 P 4.1575 0.0000 0.0000 65.8737 31.2705 177.2435 28 D 4.5346 7.9774 114.3788 53.5445 39.6151 177.0783 29 G 4.0573 8.5930 110.3536 45.2644 0.0000 174.0591 30 T 4.4172 8.2144 110.4201 61.2402 69.6754 173.7612 31 V 4.8450 7.9379 121.8742 61.3607 34.9023 174.6392 32 D 4.5779 8.4233 124.9467 53.0720 42.7447 174.1094 33 G 4.5535 8.5538 104.5024 45.4621 0.0000 172.1875 34 T 5.0148 8.8520 114.6789 60.4913 71.0373 174.7119 35 R 4.2910 8.8418 124.0399 56.7228 31.0326 176.3393 36 D 4.5690 8.2520 119.0462 53.5995 40.2764 176.5708 37 R 3.7149 8.6348 127.7479 58.0896 30.3101 177.0183 38 S 4.4368 8.1939 110.8269 58.4725 63.5856 173.9822 39 D 4.3784 7.6961 121.8913 54.9632 41.2512 176.0745 40 Q 4.1669 8.5022 123.6479 57.2323 29.4389 176.0105 41 H 4.8606 9.1680 115.9363 55.4382 28.9198 175.5850 42 I 4.5526 7.4639 110.5198 59.8574 38.3777 175.0947 43 Q 4.3181 7.7549 121.9742 55.4868 29.8759 174.5988 44 L 5.1405 8.8465 124.3890 52.8072 45.5480 175.3083 45 Q 4.7412 9.1848 125.1890 54.5513 30.6409 174.3809 46 L 5.2120 8.5966 126.6519 53.8599 43.6019 176.1433 47 S 4.6210 8.4749 114.6679 56.7619 66.7445 173.0543 48 A 4.7697 8.4425 122.9978 51.1861 20.1353 177.5303 49 E 4.4213 8.5966 119.3850 56.5138 29.5984 180.1322 50 S 4.5121 7.6684 116.4519 57.0218 63.9359 173.1695 51 V 3.8008 8.1773 121.4891 64.7895 31.5440 176.2325 52 G 3.9927 9.2445 114.7158 45.2538 0.0000 171.8965 53 E 5.1712 8.3142 119.8683 54.6639 32.1876 175.6019 54 V 4.8401 8.8430 116.0169 60.0148 36.8644 173.9562 55 Y 5.2721 8.7645 119.8392 55.8254 41.1776 175.2181 56 I 4.5413 8.5604 121.8452 59.5811 40.5970 174.1556 57 K 4.6842 8.6338 128.9138 53.9244 35.1684 175.1136 58 S 4.6077 8.8287 123.3961 58.6609 62.5858 174.9568 59 T 3.7948 8.8029 119.0196 64.6722 68.7260 175.8938 60 E 4.0430 8.3914 122.6744 58.5568 29.8153 177.1125 61 T 4.3408 7.7933 105.7348 60.6415 70.1368 175.3739 62 G 3.8379 8.2707 110.1999 45.3518 0.0000 173.8324 63 Q 4.4049 7.5825 119.1686 56.1123 30.1471 174.7462 64 Y 4.6871 9.1689 120.7412 56.0921 40.5081 175.0044 65 L 4.3814 9.0500 126.0387 55.3091 43.3369 175.6530 66 A 5.0176 8.9139 126.5235 50.5090 23.2086 174.1782 67 M 5.3838 8.4975 118.7791 53.8995 35.1116 175.6174 68 D 5.0219 9.4003 126.5456 52.4457 41.3288 176.8449 69 T 4.3291 8.5095 107.8440 63.5941 68.9254 174.6022 70 D 4.7151 8.4724 121.0587 54.0773 41.3567 176.9440 71 G 3.2888 8.3066 107.9198 45.1626 0.0000 172.9821 72 L 4.7517 8.2163 120.1015 53.3783 43.3672 176.1962 73 L 5.0859 8.5222 123.0017 54.9919 42.8695 175.4411 74 Y 4.9260 8.9311 119.7410 56.1572 42.0759 173.3304 75 G 4.2166 9.0317 108.2745 45.1751 0.0000 173.1975 76 S 5.0883 9.1450 120.4875 56.5061 64.3306 175.2882 77 Q 4.0498 9.1302 125.7323 58.1030 28.9393 176.4412 78 T 4.6967 7.4448 106.8495 59.0185 71.7903 172.8535 79 P 3.9772 0.0000 0.0000 61.6102 29.8898 174.7224 80 N 4.6407 7.5107 121.9672 52.5296 40.5545 176.0542 81 A 3.8971 8.5607 121.1011 55.6180 18.6291 178.7284 82 N 4.6086 8.1177 110.8819 53.7562 37.8301 175.4538 83 C 4.9894 8.0241 115.9230 59.2059 29.8317 172.9684 84 L 4.3160 7.1848 120.5320 53.4215 43.0275 175.7768 85 F 5.0993 8.8247 121.0649 55.5622 43.6958 174.1884 86 L 4.8090 9.2208 122.6082 53.8359 42.6626 175.3300 87 E 4.5993 8.8659 126.6228 55.1095 30.4306 175.6131 88 R 4.8017 8.5611 124.9818 54.0639 34.9345 174.5101 89 L 4.6912 8.7002 123.7860 55.3176 43.0581 175.8066 90 E 4.7261 9.2451 124.5521 55.2500 33.6990 174.7513 91 E 4.0196 9.7872 122.9103 57.8145 27.3671 174.4072 92 N 4.3291 8.5288 110.3940 54.1218 36.6306 173.9829 93 H 4.8240 8.6089 116.6617 57.6147 36.9654 173.3927 94 Y 4.7351 7.8443 116.1133 57.3245 40.3278 173.6305 95 N 5.6286 9.6533 117.8685 51.9309 41.4634 174.5458 96 T 5.2785 8.7642 112.4231 60.1521 72.9876 172.3930 97 Y 5.0886 8.6449 119.0750 56.5340 41.7736 174.1935 98 I 4.6670 8.4373 125.4693 58.9914 40.0275 175.2066 99 S 4.0017 9.0011 122.5429 58.3952 62.2482 174.0333 100 K 3.8954 8.6626 129.1767 59.3391 32.2693 178.6810 101 A 3.8757 7.7809 120.3253 54.6803 18.5213 177.4408 102 H 4.7172 7.5790 112.8106 55.2773 29.7132 176.5223 103 A 3.9566 7.6590 125.3657 54.9906 18.3767 180.6858 104 E 3.7537 7.8652 112.5401 58.3770 29.7202 177.6320 105 K 4.1838 7.5171 117.3968 55.4197 32.8262 175.6666 106 N 3.9374 7.6420 115.5311 53.9762 36.3776 175.0858 107 W 5.1112 7.7569 118.1081 56.1284 30.6507 177.4657 108 F 5.3285 9.1356 124.0999 55.8341 40.7452 175.7939 109 V 4.0743 8.9177 121.1737 62.7429 32.4960 175.1820 110 G 4.4741 8.6322 113.0048 45.1274 0.0000 171.3176 111 L 5.2573 8.6580 121.5076 52.4457 45.3209 177.1210 112 K 4.1271 9.1532 123.0482 55.5199 32.8772 178.4146 113 K 3.9281 8.4177 119.5939 59.2612 31.9652 177.9111 114 N 4.5888 8.0863 114.1197 52.6139 37.7147 175.9776 115 G 3.5260 8.2479 108.8326 45.1470 0.0000 173.5608 116 S 4.8863 8.1368 115.0059 57.3145 65.0948 173.7367 117 C 4.7683 8.4808 119.0157 59.8915 28.7243 173.4531 118 K 4.3552 8.5933 122.2007 55.4902 33.0089 177.0141 119 R 4.0797 8.5177 123.7421 55.6218 31.2197 177.1542 120 G 3.4373 8.7731 115.2079 48.2977 0.0000 174.1876 121 P 4.3437 0.0000 0.0000 64.3202 31.3926 177.4758 122 R 4.3034 7.8379 116.0256 56.4770 30.4431 176.4267 123 T 5.0641 7.5088 108.2640 60.1245 70.6298 173.4905 124 H 4.7365 7.8839 115.1601 54.8627 30.6085 172.9734 125 Y 3.9406 8.7089 118.3928 60.1249 38.0512 177.3029 126 G 4.0466 9.0188 111.6507 45.3487 0.0000 173.8524 127 Q 4.2297 7.4370 119.0804 55.2048 29.7377 177.2467 128 K 3.8086 8.3263 119.3643 58.7549 32.7344 179.3757 129 A 3.9927 8.0900 121.3185 54.0215 18.2900 178.4593 130 I 4.4583 7.1924 105.7419 60.4161 38.2875 175.2428 131 L 4.3797 7.3849 123.2785 53.9003 42.6168 175.7059 132 F 5.2083 9.3053 122.7257 55.4770 43.2093 174.3927 133 L 5.2866 9.3678 123.1313 52.6316 44.8040 173.9163 134 P 5.1400 0.0000 0.0000 63.0160 32.3381 175.6441 135 L 5.0117 9.0617 121.7319 52.1545 46.2221 174.3664 136 P 4.6252 0.0000 0.0000 62.6845 32.3238 177.1091 137 V 3.7753 8.1692 114.2610 61.7646 31.6469 176.3315 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 1C H 8.44 4.64 0.00 3.13 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.30 4.43 0.00 3.29 3.32 0.00 5.94 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.66 5.04 0.00 3.24 3.33 0.00 5.76 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.87 4.62 0.00 3.32 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.36 4.90 0.00 2.87 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.54 4.62 0.00 2.95 2.78 0.00 0.00 6.86 6.74 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 3 L 8.03 4.80 0.00 1.46 1.40 0.61 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.54 0.00 2.17 2.19 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 5 P 0.00 4.27 0.00 2.17 2.20 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 6 G 7.80 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 7 N 8.01 4.49 0.00 2.59 2.62 0.00 0.00 5.84 7.55 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 8 Y 7.81 4.89 0.00 3.07 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 9 K 8.71 4.16 0.00 1.82 1.90 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.59 7.81 10 K 7.58 4.70 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.43 7.81 11 P 0.00 4.71 0.00 1.93 1.97 0.00 3.62 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 2.02 2.34 0.00 12 K 9.46 4.92 0.00 1.62 1.70 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.64 7.81 13 L 9.18 5.07 0.00 1.69 1.71 0.47 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.63 5.00 0.00 1.57 1.62 0.39 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.25 4.92 0.00 3.26 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 16 C 8.70 4.39 0.00 2.32 2.45 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 17 S 8.30 3.81 0.00 3.97 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 18 N 7.89 4.12 0.00 2.51 2.68 0.00 0.00 6.70 7.98 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 19 G 7.50 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.77 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 0.00 0.00 0.00 21 H 7.40 4.88 0.00 3.00 3.15 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.97 5.22 0.00 3.05 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 23 L 9.22 4.60 0.00 1.83 1.54 0.95 0.31 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 24 R 9.48 4.95 0.00 1.91 2.06 0.00 3.30 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.80 0.00 25 I 8.27 4.47 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.75 0.89 0.00 0.00 26 L 8.74 4.13 0.00 1.88 1.53 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.16 0.00 1.98 2.10 0.00 3.50 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.89 0.00 28 D 7.98 4.53 0.00 2.79 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 29 G 8.59 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 30 T 8.21 4.42 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 1.28 0.00 0.00 31 V 7.94 4.85 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 0.90 0.00 0.00 0.92 0.00 0.00 32 D 8.42 4.58 0.00 2.99 2.75 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 33 G 8.55 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 0.00 0.00 0.00 0.00 34 T 8.85 5.01 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 1.38 0.00 0.00 35 R 8.84 4.29 0.00 1.87 1.98 0.00 3.21 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.40 0.00 36 D 8.25 4.57 0.00 2.84 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.63 3.71 0.00 1.89 1.92 0.00 3.30 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.08 0.00 38 S 8.19 4.44 0.00 4.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 D 7.70 4.38 0.00 2.83 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 40 Q 8.50 4.17 0.00 1.84 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.11 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.17 4.86 0.00 3.32 3.49 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.46 4.55 1.91 0.00 0.00 0.43 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 1.03 1.02 0.00 0.00 43 Q 7.75 4.32 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 44 L 8.85 5.14 0.00 1.60 1.43 0.82 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.18 4.74 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.60 5.21 0.00 1.72 1.42 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.47 4.62 0.00 3.93 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 48 A 8.44 4.77 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.60 4.42 0.00 1.72 1.16 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 2.17 2.33 0.00 50 S 7.67 4.51 0.00 4.26 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.18 3.80 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 1.00 0.00 0.00 1.04 0.00 0.00 52 G 9.24 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 53 E 8.31 5.17 0.00 2.04 1.69 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 2.20 2.28 0.00 54 V 8.84 4.84 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 0.60 0.00 0.00 1.14 0.00 0.00 55 Y 8.76 5.27 0.00 2.99 3.10 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 0.00 0.00 0.00 0.00 56 I 8.56 4.54 1.71 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.55 0.65 0.00 0.00 57 K 8.63 4.68 0.00 1.19 1.47 0.00 1.19 0.00 0.00 1.18 0.00 0.00 2.64 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.88 0.22 7.81 58 S 8.83 4.61 0.00 3.86 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 59 T 8.80 3.79 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 1.17 0.00 0.00 60 E 8.39 4.04 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 2.20 2.38 0.00 61 T 7.79 4.34 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 1.24 0.00 0.00 62 G 8.27 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 0.00 0.00 0.00 63 Q 7.58 4.40 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.73 0.00 0.00 0.00 0.00 0.00 2.55 2.33 0.00 64 Y 9.17 4.69 0.00 2.94 2.94 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 65 L 9.05 4.38 0.00 1.60 1.50 0.81 0.16 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 66 A 8.91 5.02 0.52 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 0.00 0.00 67 M 8.50 5.38 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 68 D 9.40 5.02 0.00 2.99 2.94 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 69 T 8.51 4.33 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 70 D 8.47 4.72 0.00 2.77 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.31 3.29 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 0.00 72 L 8.22 4.75 0.00 2.06 1.63 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.52 5.09 0.00 1.57 1.61 0.91 0.87 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 74 Y 8.93 4.93 0.00 2.98 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 75 G 9.03 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 76 S 9.14 5.09 0.00 3.71 3.81 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 77 Q 9.13 4.05 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 78 T 7.44 4.70 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 1.22 0.00 0.00 79 P 0.00 3.98 0.00 1.13 0.49 0.00 3.52 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.34 0.00 80 N 7.51 4.64 0.00 2.93 2.80 0.00 0.00 6.85 7.17 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 81 A 8.56 3.90 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.12 4.61 0.00 3.07 3.06 0.00 0.00 6.18 7.68 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 83 C 8.02 4.99 0.00 3.14 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.18 4.32 0.00 1.41 1.24 0.75 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.82 5.10 0.00 3.03 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 86 L 9.22 4.81 0.00 1.51 1.62 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.87 4.60 0.00 2.15 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 2.18 1.96 0.00 88 R 8.56 4.80 0.00 1.78 1.77 0.00 3.14 0.00 0.00 2.89 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 89 L 8.70 4.69 0.00 1.73 1.69 1.02 0.96 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 90 E 9.25 4.73 0.00 2.21 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 2.30 2.44 0.00 91 E 9.79 4.02 0.00 2.43 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 0.00 2.30 2.40 0.00 92 N 8.53 4.33 0.00 2.83 2.88 0.00 0.00 6.86 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 93 H 8.61 4.82 0.00 2.81 2.86 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.84 4.74 0.00 3.04 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 95 N 9.65 5.63 0.00 2.98 2.55 0.00 0.00 6.96 6.93 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 96 T 8.76 5.28 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 1.33 0.00 0.00 97 Y 8.64 5.09 0.00 2.79 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 98 I 8.44 4.67 1.65 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 -0.30 0.27 0.68 0.00 0.00 99 S 9.00 4.00 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.66 3.90 0.00 1.65 1.55 0.00 1.67 0.00 0.00 1.51 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.28 7.81 101 A 7.78 3.88 1.03 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 0.00 0.00 102 H 7.58 4.72 0.00 3.00 2.31 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.66 3.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 7.87 3.75 0.00 1.86 1.78 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 2.10 2.13 0.00 105 K 7.52 4.18 0.00 0.85 1.45 0.00 1.36 0.00 0.00 1.38 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.01 7.81 106 N 7.64 3.94 0.00 3.06 3.07 0.00 0.00 6.91 7.59 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 0.00 107 W 7.76 5.11 0.00 3.33 3.10 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 0.00 0.00 0.00 0.00 108 F 9.14 5.33 0.00 2.89 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 0.00 109 V 8.92 4.07 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 0.68 0.00 0.00 0.52 0.00 0.00 110 G 8.63 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 0.00 111 L 8.66 5.26 0.00 1.43 1.44 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.15 4.13 0.00 1.93 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.44 7.81 113 K 8.42 3.93 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.42 7.81 114 N 8.09 4.59 0.00 2.79 2.89 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.25 3.53 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 0.00 116 S 8.14 4.89 0.00 3.87 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 C 8.48 4.77 0.00 2.88 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.59 4.36 0.00 1.61 1.68 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.33 7.81 119 R 8.52 4.08 0.00 1.74 1.62 0.00 3.17 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.46 0.00 120 G 8.77 3.44 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 0.00 121 P 0.00 4.34 0.00 1.93 2.18 0.00 3.04 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 122 R 7.84 4.30 0.00 1.81 1.93 0.00 3.29 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 123 T 7.51 5.06 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 1.37 0.00 0.00 124 H 7.88 4.74 0.00 3.38 3.52 0.00 5.48 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 0.00 125 Y 8.71 3.94 0.00 3.13 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 0.00 126 G 9.02 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 0.00 0.00 0.00 127 Q 7.44 4.23 0.00 1.82 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.14 0.00 128 K 8.33 3.81 0.00 1.80 1.64 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.27 7.81 129 A 8.09 3.99 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 0.00 130 I 7.19 4.46 1.65 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.51 0.00 0.00 131 L 7.38 4.38 0.00 1.12 0.71 0.27 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.31 5.21 0.00 3.39 3.13 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 0.00 133 L 9.37 5.29 0.00 2.01 1.79 0.81 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.14 0.00 2.22 2.19 0.00 3.88 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 135 L 9.06 5.01 0.00 1.66 1.59 0.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.63 0.00 1.93 1.98 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 137 V 8.17 3.78 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 0.64 0.00 0.00 0.91 0.00 0.00