NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6096 8.3649 120.1947 54.2370 41.1334 174.9256 2 C 4.9953 8.1424 121.5115 53.1686 43.4537 171.8317 3 P 4.6195 0.0000 0.0000 62.3828 32.4469 177.5210 4 S 4.1869 8.9802 116.3870 61.7530 62.5671 175.0810 5 D 4.7223 8.3529 117.0956 53.0539 39.4556 175.2847 6 W 4.9936 8.5396 119.4079 55.2945 32.8313 174.8105 7 S 5.1308 9.6174 117.6340 56.9742 65.3053 173.8821 8 S 5.8988 8.6536 118.1838 57.0004 65.4488 173.2057 9 Y 3.9026 8.7992 117.3624 58.1411 41.4971 173.8282 10 E 3.6577 9.2777 128.6574 57.5438 27.0055 175.3509 11 G 3.9407 7.8241 103.2124 46.2249 0.0000 171.2684 12 H 5.2218 8.1105 116.1227 53.8095 33.0762 171.9774 13 C 5.5099 8.0002 116.8719 55.4167 38.8077 172.9911 14 Y 5.7108 9.7877 121.0978 56.3849 41.8922 174.7529 15 K 4.4951 8.9264 123.1173 54.6974 35.7499 173.1093 16 P 5.3375 0.0000 0.0000 61.6058 32.9353 175.1216 17 F 4.7164 8.8597 121.0618 55.2808 42.8746 175.2139 18 N 4.5492 7.9135 117.5174 51.5236 37.2587 174.2729 19 E 4.1663 7.7481 119.0232 55.3403 29.8765 174.5760 20 P 4.4364 0.0000 0.0000 63.4154 31.7081 175.8103 21 K 4.8160 8.9209 123.7126 54.1966 36.9346 176.3462 22 N 5.7046 8.5393 119.3220 51.2578 38.7820 175.7639 23 W 2.6168 7.8311 126.7706 60.1967 30.3248 177.5369 24 A 4.0110 8.0061 119.6863 55.5858 17.7910 179.2530 25 D 4.1829 8.7925 117.2911 57.0855 40.7347 178.8655 26 A 2.9842 7.5524 121.6159 54.8407 18.2731 178.8021 27 E 3.3435 7.1685 117.5853 59.4448 29.2962 178.2952 28 N 4.0885 7.6271 116.0495 56.8958 39.1015 176.1487 29 F 4.1426 8.1883 121.7670 61.6276 39.3200 176.4985 30 C 4.2355 8.2008 116.2778 60.0840 39.7041 176.2115 31 T 4.1363 7.7392 111.8953 63.4310 68.4138 175.1089 32 Q 4.3003 7.2107 117.6085 56.0134 28.9913 176.3002 33 Q 4.1663 7.4469 118.3878 58.1998 28.9926 174.9711 34 H 4.1453 7.2322 114.9646 55.3824 32.3557 172.7176 35 T 3.9289 7.8354 120.2163 64.4753 68.6766 175.2413 36 G 3.8574 8.6810 113.2231 45.9347 0.0000 172.9280 37 S 4.9976 7.3995 113.9830 58.1613 64.0097 172.8692 38 H 5.2940 9.1603 122.1416 54.2657 33.9015 172.5553 39 L 4.7235 9.0350 120.2723 54.7048 42.0477 178.3049 40 V 4.2084 8.8065 122.3346 62.3056 32.4518 175.3362 41 S 4.6403 9.5874 116.7273 56.3883 65.5749 173.3616 42 F 5.4356 8.5342 121.6281 56.4591 40.1032 175.5128 43 Q 4.6774 9.8746 124.9581 55.9037 29.8341 175.7709 44 S 4.6475 7.4375 111.9682 56.8095 66.6682 175.9503 45 T 3.8459 8.2519 118.9489 66.6037 68.2066 176.9793 46 E 3.9561 8.1197 120.1715 59.3716 29.5790 178.8223 47 E 3.4196 8.0188 119.2219 58.9958 29.6975 178.7247 48 A 2.7007 7.6030 120.6325 54.8625 18.2749 179.2842 49 D 4.1232 8.2278 117.8009 57.2583 40.8451 178.8619 50 F 3.8947 7.8250 121.0405 61.2977 39.3604 177.4348 51 V 3.1231 7.4734 117.7998 65.5545 31.1694 178.1453 52 V 3.5676 7.5306 118.0614 65.9524 31.4555 177.8605 53 K 3.8717 7.9727 119.4737 59.3686 32.0451 178.5036 54 L 3.6627 7.4960 120.2794 57.9238 41.9519 178.7966 55 A 3.7754 8.1953 121.1261 54.9177 18.2085 179.4178 56 F 4.9934 8.3238 120.6964 61.3774 39.3488 177.3905 57 Q 3.8879 7.9112 116.1226 58.8985 28.4302 178.8507 58 T 3.8155 7.3549 115.5410 65.4399 68.8323 175.8879 59 F 4.8422 7.7577 115.8173 56.7551 40.7167 177.3116 60 D 3.8851 8.1353 121.5569 55.5425 38.9111 173.5860 61 Y 4.8913 8.9427 128.4264 58.1638 39.7629 174.6280 62 G 3.5274 7.6014 112.9250 46.0192 0.0000 171.2716 63 I 4.8276 6.9120 112.6327 58.8952 40.2161 174.7124 64 F 4.8935 8.4993 123.6647 55.0091 42.2440 174.9428 65 W 5.1637 9.1870 123.7525 57.3791 29.7048 174.8996 66 M 4.9746 9.0711 120.8300 52.9215 35.2932 175.3649 67 G 4.1260 8.6025 110.3014 45.8175 0.0000 174.1542 68 L 4.5941 8.1591 120.9422 52.7345 44.7071 174.9590 69 S 4.0038 7.4949 119.0223 56.5531 66.4329 173.1279 70 K 4.1324 8.2645 117.0770 56.1133 29.3208 177.2244 71 I 3.6250 7.2091 111.5648 62.7906 37.9683 176.9153 72 W 5.0584 7.6810 118.0284 56.1425 30.9825 176.6810 73 N 4.3430 8.0098 115.9682 55.8867 38.0555 176.2789 74 Q 4.5493 7.9352 113.9625 55.6321 29.2872 175.1991 75 C 4.2938 7.9477 116.6088 59.6687 28.6114 173.8735 76 N 4.6053 7.9167 120.5135 52.1162 36.9949 172.7196 77 W 4.3520 8.2741 122.2791 55.8240 30.0675 176.0872 78 Q 4.5927 8.2252 121.0965 53.8534 32.5382 174.5442 79 W 4.5886 8.6118 121.3296 56.3010 29.8304 177.9101 80 S 4.2078 9.0693 117.6266 60.6761 62.6128 174.5217 81 N 4.6181 8.3490 116.7660 52.1707 37.3083 174.7824 82 A 3.7786 8.3645 119.7253 53.2468 16.6976 178.2904 83 A 4.2578 8.5026 121.3643 53.3846 19.0356 178.2633 84 M 4.2875 8.4198 120.6766 54.9630 33.0575 176.0716 85 L 4.6470 8.5687 127.6031 54.6804 41.9029 175.2522 86 K 4.4926 8.7839 123.2811 58.1301 34.5149 176.8474 87 Y 4.3795 8.0095 117.9590 57.8711 39.4391 174.6351 88 T 4.2985 6.7441 120.5385 62.5899 73.1240 174.0943 89 D 4.5405 7.3793 121.8648 52.8897 41.6472 175.8164 90 W 4.1913 7.7436 119.7296 56.7197 30.2513 177.1583 91 A 4.2417 8.9371 126.3444 54.3062 18.2854 177.6020 92 E 4.7346 8.0199 113.3582 54.4796 32.8017 175.6842 93 E 3.9150 8.8827 124.3890 58.8154 30.2407 176.7397 94 S 4.8751 7.5192 112.9435 56.8731 67.8769 172.2976 95 Y 4.8790 8.4498 119.1152 56.4767 41.2322 175.4140 96 C 5.2077 9.7317 119.8641 55.1223 39.1557 172.8648 97 V 5.1331 8.3398 120.6621 61.9594 33.3333 174.3204 98 Y 5.8466 8.8633 124.6257 55.7886 42.2641 173.3943 99 F 5.2708 9.0186 113.0111 55.3264 41.7858 173.8520 100 K 4.9907 8.9239 119.9490 55.6085 33.5647 177.6866 101 S 4.6565 8.8726 117.8347 60.3228 62.6140 175.3204 102 T 3.9236 8.0191 111.8122 63.8113 69.1757 174.3212 103 N 5.0087 7.7073 116.4331 51.0752 40.3137 173.2590 104 N 4.6442 8.5411 114.2083 52.7923 37.5593 175.1253 105 K 4.2961 7.7904 119.0265 56.0571 32.7474 176.9060 106 W 4.6265 8.8561 123.8543 57.0540 29.7479 175.7367 107 R 4.7708 8.8181 122.0211 54.5522 33.9561 174.4707 108 S 5.4050 8.4862 116.6297 57.6603 65.2096 173.5171 109 I 4.4707 8.7109 119.0182 60.2718 42.1853 173.2362 110 T 3.6649 8.1505 122.8223 62.6294 67.2499 175.5332 111 C 4.3549 9.0762 126.0956 59.2556 40.3557 175.3103 112 R 4.0823 7.3747 113.8142 56.7561 29.9759 176.3925 113 M 4.3497 8.1683 119.8549 55.9693 33.6413 174.5694 114 I 5.0233 8.0622 122.8057 60.0511 39.5990 174.7210 115 A 4.1003 8.5125 126.2188 51.3389 23.4059 174.5428 116 N 4.9917 7.8160 116.4046 53.4130 41.4351 174.2629 117 F 5.3576 7.6049 112.8423 57.1536 41.9060 172.9574 118 V 5.1097 8.6291 118.0760 61.5611 34.7492 174.9294 119 C 5.6683 9.7284 124.7801 55.9881 44.5155 172.1992 120 E 5.8561 9.7177 120.7466 55.7895 33.3571 173.6241 121 F 5.0889 7.6152 116.9450 55.7735 41.1943 172.5242 122 Q 4.2094 8.7297 121.8021 55.3726 29.6947 175.4806 123 A 4.4056 8.4494 127.5075 52.3410 18.0169 177.0523 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 D 8.36 4.61 0.00 2.65 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 2 C 8.14 5.00 0.00 3.14 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 3 P 0.00 4.62 0.00 2.39 2.06 0.00 3.51 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.06 0.00 4 S 8.98 4.19 0.00 4.03 4.10 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 5 D 8.35 4.72 0.00 2.76 2.86 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 6 W 8.54 4.99 0.00 3.27 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 7 S 9.62 5.13 0.00 3.91 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 8 S 8.65 5.90 0.00 3.92 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 9 Y 8.80 3.90 0.00 1.51 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 9.28 3.66 0.00 1.82 1.74 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 1.47 1.74 0.00 11 G 7.82 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 12 H 8.11 5.22 0.00 3.46 2.67 0.00 5.75 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 8.00 5.51 0.00 1.23 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 14 Y 9.79 5.71 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 15 K 8.93 4.50 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.30 0.62 7.81 16 P 0.00 5.34 0.00 2.25 2.03 0.00 3.43 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.04 0.00 17 F 8.86 4.72 0.00 1.51 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 18 N 7.91 4.55 0.00 2.07 1.42 0.00 0.00 6.45 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.75 4.17 0.00 1.75 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 20 P 0.00 4.44 0.00 1.99 1.98 0.00 3.61 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 1.92 1.92 0.00 21 K 8.92 4.82 0.00 1.45 1.47 0.00 1.15 0.00 0.00 1.37 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.41 7.81 22 N 8.54 5.70 0.00 3.20 3.01 0.00 0.00 6.34 8.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 W 7.83 2.62 0.00 1.78 2.64 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 24 A 8.01 4.01 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 25 D 8.79 4.18 0.00 2.54 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 26 A 7.55 2.98 0.48 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 27 E 7.17 3.34 0.00 1.16 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 2.11 2.18 0.00 28 N 7.63 4.09 0.00 2.65 2.76 0.00 0.00 7.31 6.92 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 29 F 8.19 4.14 0.00 3.07 2.97 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 0.00 0.00 0.00 0.00 30 C 8.20 4.24 0.00 3.13 3.17 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 0.00 0.00 0.00 0.00 31 T 7.74 4.14 4.12 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 1.14 0.00 0.00 32 Q 7.21 4.30 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.34 2.06 0.00 33 Q 7.45 4.17 0.00 2.39 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 1.95 2.11 0.00 34 H 7.23 4.15 0.00 2.69 2.44 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.84 3.93 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 1.10 0.00 0.00 36 G 8.68 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.40 5.00 0.00 4.05 3.98 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 38 H 9.16 5.29 0.00 3.11 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 9.04 4.72 0.00 1.50 1.62 -0.15 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.81 4.21 2.30 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 0.89 0.00 0.00 0.95 0.00 0.00 41 S 9.59 4.64 0.00 3.90 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 42 F 8.53 5.44 0.00 3.29 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 43 Q 9.87 4.68 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 44 S 7.44 4.65 0.00 4.16 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 45 T 8.25 3.85 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 1.20 0.00 0.00 46 E 8.12 3.96 0.00 2.18 2.13 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 2.46 2.46 0.00 47 E 8.02 3.42 0.00 2.19 2.21 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 2.59 2.41 0.00 48 A 7.60 2.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.23 4.12 0.00 2.73 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 50 F 7.83 3.89 0.00 2.52 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.47 3.12 1.99 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 0.96 0.00 0.00 0.94 0.00 0.00 52 V 7.53 3.57 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 1.07 0.00 0.00 0.69 0.00 0.00 53 K 7.97 3.87 0.00 1.91 1.74 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.47 7.81 54 L 7.50 3.66 0.00 1.13 1.39 0.74 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.20 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.32 4.99 0.00 3.34 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 57 Q 7.91 3.89 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 58 T 7.35 3.82 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 0.04 0.00 0.00 59 F 7.76 4.84 0.00 3.20 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 60 D 8.14 3.89 0.00 2.90 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 61 Y 8.94 4.89 0.00 3.14 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 62 G 7.60 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 63 I 6.91 4.83 1.32 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.37 0.61 0.00 0.00 64 F 8.50 4.89 0.00 1.75 2.84 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 65 W 9.19 5.16 0.00 3.26 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 66 M 9.07 4.97 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 67 G 8.60 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 68 L 8.16 4.59 0.00 1.55 1.33 0.87 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.49 4.00 0.00 2.72 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 70 K 8.26 4.13 0.00 1.73 1.80 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.02 7.81 71 I 7.21 3.62 1.32 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 0.80 -0.36 0.61 0.00 0.00 72 W 7.68 5.06 0.00 3.74 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 73 N 8.01 4.34 0.00 2.84 2.82 0.00 0.00 6.83 7.19 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 74 Q 7.94 4.55 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.04 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 75 C 7.95 4.29 0.00 2.57 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 7.92 4.61 0.00 2.62 2.64 0.00 0.00 7.03 7.95 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 77 W 8.27 4.35 0.00 3.40 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 78 Q 8.23 4.59 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.94 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 79 W 8.61 4.59 0.00 3.67 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 9.07 4.21 0.00 4.04 4.09 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 81 N 8.35 4.62 0.00 2.85 2.97 0.00 0.00 6.04 7.26 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 82 A 8.36 3.78 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.50 4.26 1.22 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 84 M 8.42 4.29 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 85 L 8.57 4.65 0.00 1.71 1.71 0.86 0.59 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 86 K 8.78 4.49 0.00 1.85 1.86 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.68 7.81 87 Y 8.01 4.38 0.00 2.93 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 88 T 6.74 4.30 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 1.23 0.00 0.00 89 D 7.38 4.54 0.00 2.34 2.44 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 90 W 7.74 4.19 0.00 3.23 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 91 A 8.94 4.24 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 92 E 8.02 4.73 0.00 2.01 1.63 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 2.25 2.07 0.00 93 E 8.88 3.92 0.00 1.86 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 2.14 2.19 0.00 94 S 7.52 4.88 0.00 3.57 3.47 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 95 Y 8.45 4.88 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.73 5.21 0.00 2.80 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 97 V 8.34 5.13 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 0.98 0.00 0.00 0.87 0.00 0.00 98 Y 8.86 5.85 0.00 3.03 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 99 F 9.02 5.27 0.00 3.20 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.92 4.99 0.00 1.95 2.04 0.00 1.86 0.00 0.00 2.20 0.00 0.00 3.12 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.75 1.71 7.81 101 S 8.87 4.66 0.00 4.21 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 0.00 102 T 8.02 3.92 4.17 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 0.00 0.00 0.00 1.34 0.00 0.00 103 N 7.71 5.01 0.00 2.78 2.78 0.00 0.00 6.02 8.04 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 0.00 104 N 8.54 4.64 0.00 2.66 2.76 0.00 0.00 6.08 7.13 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 0.00 105 K 7.79 4.30 0.00 1.99 1.85 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.57 7.81 106 W 8.86 4.63 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.82 4.77 0.00 0.67 1.42 0.00 3.00 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 1.51 1.67 0.00 108 S 8.49 5.41 0.00 4.04 4.14 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 0.00 109 I 8.71 4.47 2.08 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 0.92 1.00 1.11 0.00 0.00 110 T 8.15 3.66 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 1.15 0.00 0.00 111 C 9.08 4.35 0.00 2.85 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 7.37 4.08 0.00 1.94 2.01 0.00 3.05 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 113 M 8.17 4.35 0.00 2.31 1.97 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 114 I 8.06 5.02 1.82 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 1.26 0.63 0.79 0.00 0.00 115 A 8.51 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 N 7.82 4.99 0.00 1.44 2.33 0.00 0.00 7.03 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 F 7.60 5.36 0.00 3.22 3.33 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 0.00 118 V 8.63 5.11 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 1.36 0.00 0.00 1.18 0.00 0.00 119 C 9.73 5.67 0.00 3.29 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 0.00 120 E 9.72 5.86 0.00 1.89 1.82 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 2.20 1.74 0.00 121 F 7.62 5.09 0.00 3.03 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 Q 8.73 4.21 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.11 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 123 A 8.45 4.41 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