NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1368 8.1727 122.0463 56.2815 34.1312 174.1342 2 V 4.5205 8.1299 126.8326 60.7002 32.2587 174.4815 3 F 4.4532 10.0257 128.9396 57.5797 40.2104 174.8454 4 E 4.2412 9.0846 121.0647 55.3153 31.2189 176.3224 5 R 3.2403 8.9947 118.9630 61.2341 29.9221 179.1736 6 C 4.3032 8.0323 115.3079 59.8061 36.8218 175.7553 7 E 3.8868 8.1279 120.5982 59.2798 29.2141 178.5492 8 L 3.5490 8.0271 120.0731 57.8514 42.0831 178.6022 9 A 3.9251 7.8650 120.7346 55.4082 18.2155 179.9151 10 R 3.9179 8.0163 116.4704 59.4403 30.1313 179.3786 11 T 3.8384 7.8216 115.6224 66.6335 68.4621 176.6610 12 L 3.8238 8.0463 121.1727 57.5172 41.5802 179.4285 13 K 3.8728 8.0419 119.5584 59.6320 31.9398 178.8264 14 R 3.9077 8.0668 117.8388 58.8904 29.9992 177.4260 15 L 4.4110 7.3703 116.0486 54.1173 41.7657 177.0782 16 G 3.8923 7.9205 107.0233 46.5516 0.0000 175.0378 17 M 3.8978 7.8752 121.2322 56.6709 32.2030 175.5600 18 D 4.3086 7.9775 117.3549 56.0722 40.5286 175.4813 19 G 3.9372 9.3402 115.0244 45.3711 0.0000 170.8637 20 Y 4.1815 8.2639 121.8008 58.6954 38.9107 176.4729 21 R 3.5599 8.9814 126.9416 57.2749 27.7749 177.3076 22 G 3.8158 8.2784 103.6285 45.6642 0.0000 174.1059 23 I 4.0347 7.6745 122.3083 59.2714 37.9101 175.9270 24 S 4.6652 8.3254 120.3626 57.7323 63.8914 174.9789 25 L 4.2626 8.7438 122.8313 58.4930 41.7888 179.1413 26 A 4.1475 8.1329 120.2846 55.2085 18.2901 179.2553 27 N 4.4512 8.0656 114.6324 56.3660 38.5709 177.7206 28 W 4.2778 8.0531 119.8839 59.9747 29.0788 178.3994 29 M 4.1410 8.4447 118.8727 58.5835 31.4398 177.9913 30 C 3.2757 8.0673 118.6209 58.9793 42.3056 175.4171 31 L 3.9764 8.2300 121.8918 58.2600 41.7895 178.8030 32 A 4.2055 8.4154 120.9016 54.9466 18.2309 179.3960 33 K 2.8780 8.3255 118.3486 59.4475 32.0726 179.2224 34 W 4.1171 7.7738 117.6957 59.3761 29.0346 178.3855 35 E 4.3550 8.5398 118.9205 58.8368 29.1509 178.0847 36 S 4.5066 7.8765 108.9345 57.0971 64.9851 174.3327 37 G 3.3642 8.5173 108.4985 46.9919 0.0000 173.3782 38 Y 3.6531 7.6406 113.5362 58.8411 34.8129 168.7820 39 N 5.3065 7.6579 119.1148 51.9638 40.2063 175.4489 40 T 4.1361 8.9760 117.2318 64.0090 69.2492 176.0563 41 R 4.3431 8.0011 119.4837 55.6867 30.5490 176.1155 42 A 4.3790 7.5678 120.9880 52.5801 19.3543 177.3587 43 T 5.1204 8.2566 110.0196 60.4700 72.5058 173.2113 44 N 4.7893 8.6725 122.1954 52.7507 41.8630 172.6109 45 Y 4.6313 8.7786 128.3147 57.4095 40.8042 173.9212 46 N 4.5900 8.4994 124.4595 51.0165 38.8763 175.1261 47 A 3.6627 8.2529 127.4413 54.7399 18.9485 179.2806 48 G 3.7349 8.0702 104.2757 48.1545 0.0000 173.9233 49 D 4.7192 7.4617 115.2032 52.0769 40.0951 175.8003 50 R 3.9560 8.1560 115.8608 56.9369 28.2342 175.8895 51 S 4.9064 7.6000 113.1294 57.2767 66.2590 172.8397 52 T 5.1060 8.7083 115.5171 62.0215 72.8364 172.9738 53 D 5.4730 9.0696 125.5778 53.3779 43.1637 175.1305 54 Y 4.8785 8.9794 120.2690 57.4194 41.9550 177.4463 55 G 4.6182 8.9186 111.6994 45.8491 0.0000 173.6050 56 I 3.9971 8.2667 116.9084 62.8451 37.9357 177.4479 57 F 4.7652 7.9658 115.6463 56.3751 39.9920 175.1062 58 Q 3.6150 7.9926 119.2579 57.1085 26.6266 174.2641 59 I 4.3191 8.0866 118.7976 61.2820 39.2618 176.8652 60 N 5.3914 9.1191 125.7324 53.2455 39.9714 175.7449 61 S 4.6145 9.2743 120.2195 60.7185 63.8944 176.1624 62 R 3.6611 8.7987 122.2290 58.8679 30.3169 177.7331 63 Y 4.7228 7.6835 111.1214 57.0752 40.4653 176.7677 64 W 4.9132 8.1985 118.7434 57.6441 31.2418 173.8554 65 C 5.6164 8.2038 111.4725 53.7630 44.9481 172.9111 66 N 5.0339 9.0420 119.2462 52.1022 39.9730 174.7938 67 D 4.7848 8.8054 123.9440 52.2409 40.3956 177.4283 68 G 3.9660 8.5144 107.5714 46.1371 0.0000 174.5571 69 K 4.4603 8.0161 116.8442 56.5883 33.1827 175.6875 70 T 4.4567 7.6604 117.4341 61.2437 69.5723 172.3236 71 P 4.1445 0.0000 0.0000 64.2245 31.7441 176.2234 72 G 3.7340 8.5858 110.1876 46.1320 0.0000 173.1520 73 A 3.9061 6.9005 119.7812 51.1095 19.3630 176.9949 74 F 4.9197 8.2582 117.7965 55.5183 43.1064 175.5443 75 N 5.0084 8.2494 116.1730 51.8845 37.5255 174.1827 76 A 4.0408 8.8748 123.7686 55.0162 19.2409 178.9012 77 C 4.4652 8.9261 110.6923 56.4823 40.7962 173.8665 78 H 4.0695 7.6829 115.8203 56.4357 26.3629 174.0161 79 L 4.7894 8.4165 118.0182 52.9806 46.5300 176.5498 80 S 4.6409 8.3864 115.4231 57.9952 63.2622 176.0238 81 C 4.0099 8.7888 124.3698 59.6974 40.3991 176.4183 82 S 3.8784 7.8869 114.8516 61.2284 61.6592 175.9361 83 A 4.0365 7.9336 122.6843 54.3888 18.2191 178.4902 84 L 4.4929 7.8978 116.3502 54.9341 41.6171 177.5640 85 L 5.0590 7.6454 118.0507 54.5540 42.2169 176.6618 86 Q 4.3752 7.7796 117.6513 55.3449 29.6096 175.9829 87 D 4.4018 8.5537 120.2084 57.1977 41.1418 176.8898 88 N 4.5515 8.0317 118.1812 53.3241 39.3676 174.6564 89 I 4.2420 8.4707 118.7193 60.9724 37.9568 177.0286 90 A 3.9237 8.3562 124.7209 56.0096 18.2009 180.0473 91 D 4.2745 8.1002 116.4397 57.4530 40.9324 178.7777 92 A 4.1073 7.9640 120.8960 55.0474 18.4122 179.7307 93 V 3.3955 8.3788 117.0619 65.9435 31.6221 178.0765 94 A 3.8353 8.1158 120.7371 55.3159 18.1356 178.8513 95 C 4.2459 8.3795 116.7285 59.7719 38.2863 175.5308 96 A 3.9487 8.4067 122.8093 55.1265 17.6706 179.8391 97 K 3.8396 7.9649 117.0768 59.4360 31.8134 179.3854 98 R 3.9686 7.6868 117.9310 59.4800 30.2891 178.3123 99 V 2.7724 7.7217 118.0194 65.8557 30.9856 178.1610 100 V 3.8677 7.7496 110.2002 63.0885 31.2810 178.1978 101 R 4.1586 7.7077 117.5550 57.3850 30.4219 176.4805 102 D 4.7216 7.5084 119.0771 52.5583 41.9300 175.3500 103 P 4.2224 0.0000 0.0000 66.3731 31.0645 177.9109 104 Q 4.0021 8.1738 117.8853 56.2224 29.9479 177.3726 105 G 3.6807 7.8076 106.6208 46.7629 0.0000 176.0234 106 I 3.5341 7.8119 120.2479 63.5274 37.8825 177.7666 107 R 4.2366 7.2939 117.0213 57.5749 29.9874 177.4126 108 A 4.0504 7.7571 121.4433 54.3505 18.7583 177.8462 109 W 4.6235 7.9833 116.7871 55.6528 29.6448 177.6264 110 V 3.7622 8.7150 123.7353 65.8926 30.9687 177.5729 111 A 4.0330 8.3370 120.3057 54.7894 18.0848 179.2737 112 W 3.9750 8.2888 126.4964 60.7099 30.6170 178.4178 113 R 3.7646 8.2584 116.2280 59.3029 29.6435 178.4028 114 N 4.3684 8.1705 115.0928 55.7540 38.7374 176.8761 115 R 4.1328 7.8478 115.5340 55.9333 31.5495 175.9512 116 C 4.5324 7.1247 114.7340 57.5517 43.0241 174.2782 117 Q 3.2158 6.7428 120.4802 57.1122 28.6756 175.4382 118 N 4.1786 8.6347 120.7276 54.2336 36.2580 173.8638 119 R 4.4624 7.3642 115.3043 54.2172 32.7883 175.8315 120 D 4.5915 8.4169 119.1453 53.8940 40.3668 175.8378 121 V 4.6189 8.1526 118.7438 61.0967 32.4194 178.1888 122 R 4.0318 8.1912 122.3610 59.4222 30.4284 178.9519 123 Q 4.0359 8.1605 115.2113 59.2112 28.5504 178.3169 124 Y 4.2756 7.9382 115.7614 60.1644 38.2422 176.9642 125 V 4.3737 7.7053 110.5936 60.7609 32.7679 175.5401 126 Q 4.1928 7.5674 119.5962 57.1886 28.7807 177.0548 127 G 3.9665 8.9080 110.2546 45.9879 0.0000 174.6296 128 C 4.3892 7.9937 115.7739 57.1348 40.5712 174.3322 129 G 3.8729 8.2018 107.1946 46.3787 0.0000 174.0621 130 V 3.9932 7.8026 118.0631 61.0832 31.9395 175.8342 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 K 8.17 4.14 0.00 2.01 1.56 0.00 1.23 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 1.12 7.81 2 V 8.13 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 10.03 4.45 0.00 2.88 2.82 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 4 E 9.08 4.24 0.00 1.96 1.87 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 2.31 2.25 0.00 5 R 8.99 3.24 0.00 1.97 1.88 0.00 3.43 0.00 0.00 3.46 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 6 C 8.03 4.30 0.00 3.00 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 7 E 8.13 3.89 0.00 2.06 2.25 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 2.61 2.43 0.00 8 L 8.03 3.55 0.00 1.38 1.36 -0.30 0.58 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 9 A 7.86 3.93 1.35 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 0.00 0.00 10 R 8.02 3.92 0.00 1.89 1.98 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.82 3.84 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 1.22 0.00 0.00 12 L 8.05 3.82 0.00 1.71 1.55 0.90 0.40 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 13 K 8.04 3.87 0.00 1.94 1.93 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 R 8.07 3.91 0.00 2.05 1.92 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.37 4.41 0.00 1.67 1.55 0.84 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.92 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 0.00 0.00 0.00 17 M 7.88 3.90 0.00 1.30 1.96 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 18 D 7.98 4.31 0.00 2.69 2.69 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 19 G 9.34 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 20 Y 8.26 4.18 0.00 3.39 3.22 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 21 R 8.98 3.56 0.00 1.85 1.82 0.00 3.32 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.33 0.00 22 G 8.28 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 23 I 7.67 4.03 1.80 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.90 -0.30 0.00 0.00 24 S 8.33 4.67 0.00 4.06 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 25 L 8.74 4.26 0.00 1.89 1.81 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.13 4.15 1.52 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 27 N 8.07 4.45 0.00 2.81 2.73 0.00 0.00 6.97 7.38 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 28 W 8.05 4.28 0.00 3.56 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 29 M 8.44 4.14 0.00 2.14 2.32 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.93 0.00 30 C 8.07 3.28 0.00 2.58 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 31 L 8.23 3.98 0.00 1.89 1.89 0.71 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.42 4.21 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 33 K 8.33 2.88 0.00 1.79 1.70 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.76 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.28 0.57 7.81 34 W 7.77 4.12 0.00 3.37 3.30 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 35 E 8.54 4.35 0.00 2.03 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 0.00 2.57 2.45 0.00 36 S 7.88 4.51 0.00 4.06 4.01 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 37 G 8.52 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.64 3.65 0.00 3.35 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 39 N 7.66 5.31 0.00 2.79 2.81 0.00 0.00 7.02 7.08 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 40 T 8.98 4.14 4.44 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 1.47 0.00 0.00 41 R 8.00 4.34 0.00 1.87 2.02 0.00 3.18 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.58 0.00 42 A 7.57 4.38 1.35 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 0.00 0.00 43 T 8.26 5.12 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 1.17 0.00 0.00 44 N 8.67 4.79 0.00 2.87 2.76 0.00 0.00 6.97 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 45 Y 8.78 4.63 0.00 2.98 2.83 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 0.00 0.00 0.00 46 N 8.50 4.59 0.00 2.61 2.58 0.00 0.00 6.67 7.53 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 47 A 8.25 3.66 1.29 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 48 G 8.07 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 0.00 0.00 0.00 49 D 7.46 4.72 0.00 2.70 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 50 R 8.16 3.96 0.00 2.03 2.18 0.00 3.12 0.00 0.00 3.17 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 51 S 7.60 4.91 0.00 3.85 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 52 T 8.71 5.11 4.19 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 0.62 0.00 0.00 53 D 9.07 5.47 0.00 2.69 2.73 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 54 Y 8.98 4.88 0.00 2.94 2.87 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 55 G 8.92 4.62 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 0.00 0.00 0.00 56 I 8.27 4.00 1.71 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 1.00 1.89 0.08 0.00 0.00 57 F 7.97 4.77 0.00 3.22 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 58 Q 7.99 3.61 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.70 0.00 59 I 8.09 4.32 2.14 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.15 1.11 0.00 0.00 60 N 9.12 5.39 0.00 3.10 3.03 0.00 0.00 6.98 7.14 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 61 S 9.27 4.61 0.00 4.10 4.53 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 62 R 8.80 3.66 0.00 1.64 1.49 0.00 2.77 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.94 0.00 63 Y 7.68 4.72 0.00 1.90 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 0.00 0.00 0.00 0.00 64 W 8.20 4.91 0.00 3.57 3.31 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 65 C 8.20 5.62 0.00 3.04 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 66 N 9.04 5.03 0.00 2.85 2.71 0.00 0.00 7.09 9.28 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 67 D 8.81 4.78 0.00 2.86 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 68 G 8.51 3.97 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 0.00 0.00 0.00 69 K 8.02 4.46 0.00 1.82 1.88 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.44 7.81 70 T 7.66 4.46 4.19 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 1.17 0.00 0.00 71 P 0.00 4.14 0.00 1.97 1.95 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 72 G 8.59 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 0.00 0.00 0.00 73 A 6.90 3.91 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 0.00 0.00 0.00 0.00 0.00 74 F 8.26 4.92 0.00 2.79 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 75 N 8.25 5.01 0.00 2.80 2.64 0.00 0.00 6.75 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 76 A 8.87 4.04 1.23 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 77 C 8.93 4.47 0.00 3.18 3.25 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 78 H 7.68 4.07 0.00 3.30 3.35 0.00 5.82 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.42 4.79 0.00 1.68 1.50 1.00 0.74 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 80 S 8.39 4.64 0.00 3.83 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 81 C 8.79 4.01 0.00 2.21 1.19 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 82 S 7.89 3.88 0.00 3.89 3.83 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 0.00 0.00 0.00 83 A 7.93 4.04 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 84 L 7.90 4.49 0.00 1.90 1.82 1.07 0.43 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 85 L 7.65 5.06 0.00 1.78 1.72 1.13 1.21 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 86 Q 7.78 4.38 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.44 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 D 8.55 4.40 0.00 2.62 2.65 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 0.00 0.00 0.00 0.00 88 N 8.03 4.55 0.00 2.69 2.75 0.00 0.00 6.94 7.94 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 89 I 8.47 4.24 1.77 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 1.59 0.79 0.99 0.00 0.00 90 A 8.36 3.92 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.10 4.27 0.00 2.75 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 92 A 7.96 4.11 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 93 V 8.38 3.40 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 0.71 0.00 0.00 0.88 0.00 0.00 94 A 8.12 3.84 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 95 C 8.38 4.25 0.00 3.17 3.30 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 96 A 8.41 3.95 0.82 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 97 K 7.96 3.84 0.00 1.71 1.41 0.00 1.25 0.00 0.00 0.78 0.00 0.00 2.21 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.30 0.86 7.81 98 R 7.69 3.97 0.00 1.87 2.27 0.00 3.48 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.07 0.00 99 V 7.72 2.77 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 -0.34 0.00 0.00 -0.32 0.00 0.00 100 V 7.75 3.87 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 1.15 0.00 0.00 1.44 0.00 0.00 101 R 7.71 4.16 0.00 1.99 2.06 0.00 3.24 0.00 0.00 3.39 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.10 0.00 102 D 7.51 4.72 0.00 3.06 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 0.00 103 P 0.00 4.22 0.00 2.14 2.19 0.00 3.77 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 1.97 2.00 0.00 104 Q 8.17 4.00 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.84 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.81 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 0.00 0.00 0.00 106 I 7.81 3.53 0.99 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.26 -0.28 -0.80 0.00 0.00 107 R 7.29 4.24 0.00 2.04 2.03 0.00 3.22 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.53 0.00 108 A 7.76 4.05 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 0.00 109 W 7.98 4.62 0.00 3.57 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 0.00 110 V 8.72 3.76 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 1.17 0.00 0.00 1.00 0.00 0.00 111 A 8.34 4.03 1.53 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 0.00 112 W 8.29 3.97 0.00 3.51 3.49 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 0.00 113 R 8.26 3.76 0.00 2.03 2.02 0.00 3.36 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 114 N 8.17 4.37 0.00 2.71 2.71 0.00 0.00 6.94 7.46 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 0.00 115 R 7.85 4.13 0.00 1.09 0.89 0.00 2.21 0.00 0.00 2.44 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.63 0.00 116 C 7.12 4.53 0.00 1.53 2.65 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 0.00 0.00 0.00 0.00 117 Q 6.74 3.22 0.00 0.93 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.75 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 118 N 8.63 4.18 0.00 2.79 2.81 0.00 0.00 6.94 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 0.00 119 R 7.36 4.46 0.00 1.83 1.80 0.00 3.23 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 120 D 8.42 4.59 0.00 2.64 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 0.00 121 V 8.15 4.62 2.40 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 0.89 0.00 0.00 1.05 0.00 0.00 122 R 8.19 4.03 0.00 1.92 2.03 0.00 3.16 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 123 Q 8.16 4.04 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.90 0.00 0.00 0.00 0.00 0.00 2.23 1.73 0.00 124 Y 7.94 4.28 0.00 3.25 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 0.00 125 V 7.71 4.37 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 0.95 0.00 0.00 1.06 0.00 0.00 126 Q 7.57 4.19 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.71 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 127 G 8.91 3.97 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 0.00 0.00 0.00 128 C 7.99 4.39 0.00 3.09 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 0.00 129 G 8.20 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 0.00 0.00 0.00 130 V 7.80 3.99 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 0.76 0.00 0.00 0.96 0.00 0.00