NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7602 8.3549 109.7166 45.7054 0.0000 173.6574 1 H 4.2833 8.2236 122.5982 52.8099 30.5068 172.6049 2 P 4.0230 0.0000 0.0000 62.7178 32.4337 175.9109 3 T 4.4865 8.0014 116.7176 61.7215 70.2691 173.9914 4 L 4.6618 8.5653 126.9999 54.1728 42.9138 176.2501 5 K 4.7605 9.3398 124.5736 54.9494 34.0001 175.6252 6 T 5.2952 8.3402 114.3923 59.2512 71.9482 172.0774 7 P 4.5303 0.0000 0.0000 62.5521 32.5780 176.0717 8 E 4.3225 8.8010 120.8808 59.1787 30.5363 176.3960 9 S 5.1905 7.7928 110.6807 57.0852 66.3897 173.6557 10 V 4.5347 8.9747 120.1761 61.5820 35.1882 173.9204 11 T 4.9662 8.6808 123.1972 61.8449 70.5453 173.8840 12 G 4.2250 9.0216 113.5115 44.6591 0.0000 172.0316 13 T 4.9924 8.1798 116.8695 61.5957 70.2606 174.5731 14 W 4.4714 8.9546 135.0000 59.2365 31.0587 176.2566 15 K 3.7177 9.1997 123.9829 56.6203 30.4464 176.3190 16 G 4.2280 7.7697 109.6955 44.4339 0.0000 172.2103 17 D 5.6055 8.3860 118.2773 52.5643 44.1200 176.1196 18 V 4.5195 8.5710 119.6971 59.9772 35.3959 173.6622 19 K 4.7648 8.5348 123.0011 54.7508 34.6729 175.2195 20 I 4.2437 8.5506 128.8425 59.4435 38.3888 174.8543 21 Q 4.4587 8.5893 129.1989 56.3436 30.0754 175.3806 22 C 4.9940 9.1335 126.8622 58.4184 34.7508 172.4442 23 I 5.3560 8.9441 120.2987 59.3121 41.0062 173.9638 24 Y 5.2713 8.7066 121.9347 55.2859 42.0463 173.8136 25 D 4.7704 8.7366 120.2588 52.4458 41.7108 174.5117 26 P 4.6002 0.0000 0.0000 62.8209 32.1999 175.8498 27 L 4.4259 8.0168 122.0920 52.8466 43.1042 176.1137 28 R 4.1595 8.3812 122.9411 57.8295 30.3240 176.9197 29 G 4.0005 9.0883 113.0567 45.7151 0.0000 172.3898 30 Y 4.4396 8.0143 117.6962 56.7871 39.0863 174.7217 31 R 4.7686 8.8404 125.0394 54.3797 32.4599 174.6216 32 Q 4.4710 9.1707 128.5681 56.5042 29.1245 175.7212 33 V 4.4219 8.6539 119.1531 61.4602 34.1826 175.6298 34 L 4.6758 7.2885 120.7430 53.8397 45.6431 173.8156 35 V 4.8386 8.7519 124.4933 61.1133 34.9780 174.2850 36 K 5.3406 9.1555 126.3351 54.4765 36.3548 175.0018 37 W 5.2958 9.4012 123.0572 55.0529 32.0501 174.8902 38 L 5.4139 9.3710 123.2914 53.1612 45.7382 175.6791 39 V 4.9211 8.3862 112.8152 58.2779 36.1893 175.0894 40 R 4.3735 8.2215 121.3688 56.3703 30.8304 177.1393 41 H 4.5214 8.9339 122.8225 55.0077 30.3815 171.9428 42 G 3.8216 9.1031 113.8314 45.7910 0.0000 169.7052 43 S 4.4967 8.3019 119.6455 58.8757 62.6152 169.5615 44 D 4.7109 7.5842 119.1171 53.4560 41.7074 175.9922 45 S 5.1312 8.3069 117.2009 58.0694 64.8801 173.6233 46 V 4.5768 8.6210 119.6502 60.3227 34.8147 174.4686 47 T 4.6385 8.7075 121.2254 63.7443 68.4466 174.2808 48 I 4.4157 8.8925 119.6157 61.2681 39.6258 175.6087 49 F 5.0537 7.9504 124.3365 56.8538 43.0646 172.4911 50 L 5.0639 7.9086 126.6057 53.2031 45.8164 174.6254 51 R 5.0131 9.1014 126.8244 54.8190 32.7177 174.4728 52 D 4.8406 8.6584 125.4997 52.5322 41.7478 175.6155 53 S 4.1895 8.8298 112.4015 61.1948 63.1512 174.6556 54 T 4.4059 8.3154 110.5461 61.2987 69.4894 174.8512 55 G 3.8384 8.1601 107.9600 44.5714 0.0000 171.7936 56 D 5.0591 8.2228 120.6234 52.9922 42.9941 175.9581 57 H 4.7488 8.5795 120.1434 54.1186 32.2041 172.6941 58 I 4.9511 8.4142 124.1557 59.3209 37.9565 175.2097 59 Q 4.1096 8.7348 125.6146 58.3409 29.4259 177.2363 60 Q 4.2837 8.1418 118.3665 54.6376 30.0148 176.0834 61 A 4.0402 8.9823 126.5310 55.3024 18.4133 179.4560 62 K 4.0662 7.9236 112.6943 59.0151 32.9395 177.0929 63 Y 4.7107 7.9443 116.6723 58.3745 39.1051 175.7050 64 R 4.2185 7.6664 119.8080 57.5573 30.1901 176.9875 65 G 4.0510 9.3118 112.0142 45.0152 0.0000 173.3589 66 R 4.6442 8.4624 117.2061 55.5998 32.8363 175.3842 67 L 5.2169 8.0020 118.3645 52.6024 44.7754 175.8896 68 K 4.5073 8.8151 123.7568 54.6708 35.6810 174.7107 69 V 4.5382 8.0811 126.8476 60.7096 33.1949 175.3848 70 S 4.4649 8.6414 124.3904 59.6045 62.9599 174.1863 71 H 4.9605 8.6962 115.0131 54.9139 30.0933 174.5790 72 K 3.9563 8.0169 119.1611 58.1567 32.6297 177.0477 73 V 4.1138 7.4205 119.2320 60.2161 32.2447 173.1587 74 P 4.4541 0.0000 0.0000 64.2749 31.7434 176.8753 75 G 2.9354 8.8051 110.1584 45.8593 0.0000 172.0427 76 D 4.9908 7.5921 119.2011 53.1480 40.9660 176.1713 77 V 4.6694 8.2709 123.1805 60.9597 32.3644 176.8109 78 S 4.6183 8.6238 116.3957 58.8598 64.3527 173.3056 79 L 4.2788 8.1445 125.3071 53.3149 43.5968 174.6811 80 Q 4.8662 8.8674 127.8716 54.2910 31.6936 173.9248 81 I 4.8281 8.5202 127.1083 59.5018 40.0505 173.8932 82 N 4.9785 9.1280 126.7003 53.2531 40.0059 174.7304 83 T 3.5049 8.4718 121.9107 62.9977 66.0349 171.2483 84 L 4.2571 8.6344 123.5323 55.0244 42.8433 177.1700 85 Q 5.0783 9.2924 122.6064 54.4282 30.9473 176.7263 86 M 4.0346 8.8215 119.8979 58.8668 32.0733 178.2861 87 D 4.6371 8.0207 115.6272 55.8690 41.1355 176.7364 88 D 4.7094 8.1410 118.9197 55.8195 41.1881 176.9008 89 R 4.2388 7.7959 119.2416 56.9585 30.5843 175.6248 90 N 4.2359 8.5647 120.9098 53.9138 43.7814 172.1449 91 H 5.3950 8.2095 117.7152 54.5987 30.8763 173.9079 92 Y 4.9309 9.5381 121.6684 56.6497 40.5538 174.7449 93 T 5.0726 9.1768 120.7461 61.9231 71.6573 172.6621 94 C 4.1063 8.3422 126.4391 57.1304 33.7394 171.8241 95 E 4.9702 8.7927 127.2782 54.2582 32.1952 174.4331 96 V 4.4906 8.5935 126.8141 61.1342 34.7921 174.0802 97 T 4.8530 8.0642 123.3928 61.4530 71.4411 173.2106 98 W 5.3814 9.2413 125.0843 54.9250 33.5084 174.0177 99 Q 5.0079 9.2040 124.7800 55.3735 30.2625 175.2406 100 T 3.9922 8.5430 116.9031 59.1112 71.1625 173.8962 101 P 4.1486 0.0000 0.0000 65.6329 31.3018 177.3203 102 D 4.4980 7.9168 115.0980 54.2758 40.9059 177.0531 103 G 3.8202 8.3574 108.1817 45.2793 0.0000 173.2499 104 N 4.7474 7.6843 118.9127 52.8543 40.9757 173.4617 105 Q 5.2402 8.4839 120.1294 54.1600 31.0760 175.7653 106 V 4.6519 9.1204 116.9628 59.5382 35.8318 174.6210 107 I 5.0544 8.4308 123.2118 59.6741 40.0952 175.1075 108 R 4.9803 9.0181 125.0615 54.5392 33.8773 174.2445 109 D 5.7151 8.3923 119.7419 51.5947 42.9840 174.2779 110 K 4.7604 8.3096 116.9493 55.0348 37.0979 175.0082 111 I 5.1315 8.3753 122.3817 59.6906 39.9977 175.0894 112 I 4.8266 9.1616 127.2307 59.3699 40.6786 174.3353 113 E 4.6147 9.0716 128.7650 55.8750 31.0046 174.7736 114 L 5.1040 9.2224 129.4963 53.5608 44.2415 175.2128 115 R 4.8712 8.9409 125.3938 54.5026 33.2501 175.3425 116 V 4.7777 8.2887 121.0687 61.3115 33.8408 174.4505 117 R 4.6590 9.1055 128.9854 54.4361 32.6712 176.2822 118 K 4.3973 8.5214 123.2602 56.8169 32.2689 176.7769 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 0 G 8.35 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 1 H 8.22 4.28 0.00 3.15 3.05 0.00 5.71 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.02 0.00 0.63 1.28 0.00 2.46 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.71 0.00 3 T 8.00 4.49 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 1.22 0.00 0.00 4 L 8.57 4.66 0.00 1.58 1.68 0.93 1.13 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 5 K 9.34 4.76 0.00 1.82 1.75 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.41 7.81 6 T 8.34 5.30 4.32 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 1.33 0.00 0.00 7 P 0.00 4.53 0.00 2.42 2.12 0.00 3.96 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 2.04 1.98 0.00 8 E 8.80 4.32 0.00 2.11 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 2.42 2.34 0.00 9 S 7.79 5.19 0.00 3.96 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 10 V 8.97 4.53 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 1.06 0.00 0.00 0.93 0.00 0.00 11 T 8.68 4.97 4.25 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 1.22 0.00 0.00 12 G 9.02 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 13 T 8.18 4.99 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 1.26 0.00 0.00 14 W 8.95 4.47 0.00 3.15 3.21 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 15 K 9.20 3.72 0.00 1.41 1.56 0.00 1.14 0.00 0.00 0.79 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 0.21 7.81 16 G 7.77 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 17 D 8.39 5.61 0.00 2.49 2.50 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 0.00 0.00 0.00 18 V 8.57 4.52 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.85 0.00 0.00 19 K 8.53 4.76 0.00 1.66 1.63 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.68 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.23 1.31 7.81 20 I 8.55 4.24 1.42 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 0.87 0.40 1.05 0.00 0.00 21 Q 8.59 4.46 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 22 C 9.13 4.99 0.00 3.24 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 23 I 8.94 5.36 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.13 0.94 0.00 0.00 24 Y 8.71 5.27 0.00 3.09 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.74 4.77 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 26 P 0.00 4.60 0.00 2.13 2.14 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 27 L 8.02 4.43 0.00 0.83 1.23 0.30 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.38 4.16 0.00 1.79 1.90 0.00 3.29 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 29 G 9.09 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 0.00 0.00 0.00 30 Y 8.01 4.44 0.00 3.05 2.89 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 31 R 8.84 4.77 0.00 1.94 1.85 0.00 3.13 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 32 Q 9.17 4.47 0.00 2.39 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.62 0.00 0.00 0.00 0.00 0.00 2.26 2.09 0.00 33 V 8.65 4.42 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 0.79 0.00 0.00 0.99 0.00 0.00 34 L 7.29 4.68 0.00 1.65 1.32 0.88 0.75 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 35 V 8.75 4.84 2.28 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 1.05 0.00 0.00 0.96 0.00 0.00 36 K 9.16 5.34 0.00 1.63 1.66 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.34 7.81 37 W 9.40 5.30 0.00 3.36 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 38 L 9.37 5.41 0.00 1.59 1.61 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.39 4.92 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 0.18 0.00 0.00 0.93 0.00 0.00 40 R 8.22 4.37 0.00 1.76 1.86 0.00 3.12 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 41 H 8.93 4.52 0.00 3.04 3.16 0.00 5.92 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 9.10 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 0.00 0.00 0.00 43 S 8.30 4.50 0.00 4.04 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 44 D 7.58 4.71 0.00 2.79 2.57 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 45 S 8.31 5.13 0.00 3.88 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 46 V 8.62 4.58 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 0.86 0.00 0.00 0.98 0.00 0.00 47 T 8.71 4.64 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 48 I 8.89 4.42 1.14 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.62 0.88 0.00 0.00 49 F 7.95 5.05 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 50 L 7.91 5.06 0.00 1.67 1.26 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 51 R 9.10 5.01 0.00 2.20 1.92 0.00 3.26 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 52 D 8.66 4.84 0.00 2.88 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 53 S 8.83 4.19 0.00 4.01 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 54 T 8.32 4.41 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 1.22 0.00 0.00 55 G 8.16 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 56 D 8.22 5.06 0.00 2.55 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 57 H 8.58 4.75 0.00 2.83 3.08 0.00 5.55 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.41 4.95 1.96 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 1.62 0.72 1.07 0.00 0.00 59 Q 8.73 4.11 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.90 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 60 Q 8.14 4.28 0.00 2.45 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.85 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 61 A 8.98 4.04 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 62 K 7.92 4.07 0.00 1.66 1.81 0.00 1.30 0.00 0.00 1.53 0.00 0.00 2.96 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.00 0.44 7.81 63 Y 7.94 4.71 0.00 3.24 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 64 R 7.67 4.22 0.00 1.89 1.93 0.00 3.17 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 65 G 9.31 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 66 R 8.46 4.64 0.00 1.98 2.00 0.00 3.33 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 67 L 8.00 5.22 0.00 1.53 1.43 0.65 0.70 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 68 K 8.82 4.51 0.00 1.73 1.50 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.34 7.81 69 V 8.08 4.54 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 0.90 0.00 0.00 -0.52 0.00 0.00 70 S 8.64 4.46 0.00 4.01 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 71 H 8.70 4.96 0.00 3.24 3.37 0.00 5.52 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 72 K 8.02 3.96 0.00 1.67 1.82 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.18 1.04 7.81 73 V 7.42 4.11 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 0.97 0.00 0.00 0.90 0.00 0.00 74 P 0.00 4.45 0.00 2.05 2.00 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 75 G 8.81 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 0.00 0.00 0.00 76 D 7.59 4.99 0.00 2.61 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 77 V 8.27 4.67 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 0.89 0.00 0.00 1.15 0.00 0.00 78 S 8.62 4.62 0.00 3.78 3.85 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 79 L 8.14 4.28 0.00 0.27 0.13 0.25 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.87 4.87 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.53 0.00 0.00 0.00 0.00 0.00 2.16 2.37 0.00 81 I 8.52 4.83 1.76 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 0.95 0.42 0.94 0.00 0.00 82 N 9.13 4.98 0.00 2.67 2.81 0.00 0.00 7.29 7.29 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 83 T 8.47 3.50 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 1.12 0.00 0.00 84 L 8.63 4.26 0.00 1.89 1.71 1.01 0.87 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 85 Q 9.29 5.08 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 86 M 8.82 4.03 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.15 0.00 87 D 8.02 4.64 0.00 2.70 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 88 D 8.14 4.71 0.00 2.97 2.92 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 0.00 0.00 0.00 89 R 7.80 4.24 0.00 1.76 1.92 0.00 3.21 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 90 N 8.56 4.24 0.00 2.80 2.28 0.00 0.00 6.72 9.18 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 91 H 8.21 5.40 0.00 3.21 3.27 0.00 5.83 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 9.54 4.93 0.00 3.05 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 9.18 5.07 4.25 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 1.17 0.00 0.00 94 C 8.34 4.11 0.00 1.23 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 0.00 0.00 0.00 95 E 8.79 4.97 0.00 1.89 1.60 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 2.03 2.11 0.00 96 V 8.59 4.49 1.18 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 -0.25 0.00 0.00 0.74 0.00 0.00 97 T 8.06 4.85 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 1.21 0.00 0.00 98 W 9.24 5.38 0.00 3.42 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 9.20 5.01 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.64 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 100 T 8.54 3.99 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 101 P 0.00 4.15 0.00 1.97 2.11 0.00 3.09 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.15 0.00 102 D 7.92 4.50 0.00 2.63 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 0.00 103 G 8.36 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 0.00 0.00 0.00 104 N 7.68 4.75 0.00 2.80 2.68 0.00 0.00 7.00 8.08 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 0.00 105 Q 8.48 5.24 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.52 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 106 V 9.12 4.65 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 0.70 0.00 0.00 1.07 0.00 0.00 107 I 8.43 5.05 1.87 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 1.28 0.60 0.89 0.00 0.00 108 R 9.02 4.98 0.00 1.98 1.87 0.00 3.30 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.95 0.00 109 D 8.39 5.72 0.00 2.59 2.48 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 0.00 110 K 8.31 4.76 0.00 1.60 1.68 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.42 7.81 111 I 8.38 5.13 1.91 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 1.37 0.62 0.99 0.00 0.00 112 I 9.16 4.83 2.09 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.77 1.02 0.00 0.00 113 E 9.07 4.61 0.00 2.16 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 2.10 0.00 114 L 9.22 5.10 0.00 1.59 1.67 0.88 0.55 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 0.00 115 R 8.94 4.87 0.00 1.79 1.80 0.00 3.13 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 1.57 1.56 0.00 116 V 8.29 4.78 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 0.92 0.00 0.00 1.00 0.00 0.00 117 R 9.11 4.66 0.00 1.90 1.78 0.00 3.15 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 118 K 8.52 4.40 0.00 1.79 1.80 0.00 1.65 0.00 0.00 1.16 0.00 0.00 2.88 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.17 1.26 7.81