NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3661 8.3044 120.3208 55.7283 33.8281 175.5965 2 H 4.4466 8.4832 122.9911 54.3163 28.5114 172.9524 3 L 4.5470 7.9646 121.4046 53.2932 44.7559 177.5632 4 T 4.1050 8.2594 119.6954 62.4979 70.5113 174.1071 5 P 4.2329 0.0000 0.0000 65.9532 31.4419 178.9391 6 E 4.0008 8.0821 115.7460 59.2036 29.5532 179.0233 7 E 3.8307 7.9002 119.0289 59.2485 29.7249 178.8424 8 K 3.7721 8.8503 119.8994 59.7909 32.2082 179.3275 9 S 4.2558 8.2456 113.4496 60.7347 62.9951 176.3612 10 A 4.0153 7.8085 124.9835 54.8597 18.0682 179.7198 11 V 3.4663 7.8442 116.7645 66.4516 31.7698 178.2989 12 T 3.9501 7.8699 115.1692 66.7902 68.1337 176.4851 13 A 4.0733 7.9007 121.1751 55.0480 18.6911 179.1699 14 L 3.9174 7.9063 119.0991 57.9925 42.2232 178.9492 15 W 4.3586 8.8178 128.5846 60.4003 30.4400 178.0162 16 G 3.7896 8.1177 104.2294 46.7148 0.0000 174.6559 17 K 4.4323 7.7136 118.5745 55.2969 32.8571 176.3638 18 V 3.7391 6.9420 120.4980 61.8195 32.2536 175.7298 19 N 4.4818 8.2745 125.4279 52.5603 38.9469 175.5287 20 V 3.4911 8.0752 128.7172 65.8104 31.8404 177.3852 21 D 4.3080 8.0436 118.2053 57.4264 40.8280 178.4309 22 E 3.9002 8.4473 118.9344 59.4523 29.4449 179.6931 23 V 3.5573 7.8857 118.5027 65.6674 31.5371 178.2353 24 G 3.6984 8.3899 105.9669 47.8715 0.0000 175.8706 25 G 3.6154 7.8985 108.3429 47.3802 0.0000 175.4015 26 E 3.9229 8.3349 121.4555 58.6455 29.6544 178.7187 27 A 3.9003 8.2987 121.3118 55.1320 18.6678 179.3573 28 L 3.9833 7.9463 118.9556 58.1805 42.1077 179.4035 29 G 3.5735 8.0611 105.6691 47.9448 0.0000 175.9216 30 R 3.9052 8.2505 121.0185 58.5991 30.0168 178.7525 31 L 4.0288 7.9868 120.2153 58.4581 41.9629 179.2558 32 L 4.1097 7.7907 119.4525 56.6919 41.2357 179.5031 33 V 3.6546 7.1580 117.1908 65.4819 31.7883 177.9401 34 V 3.5572 7.9424 117.2204 64.2958 32.7291 175.5990 35 Y 3.8760 7.2060 116.3030 54.1390 37.8781 174.0528 36 P 4.6147 0.0000 0.0000 64.2010 31.7568 177.6705 37 W 4.4048 8.0638 115.2637 59.1997 27.7457 177.8840 38 T 4.2306 7.7649 110.6157 63.9921 68.1485 176.0567 39 Q 4.4122 8.1440 121.5284 58.0901 28.4485 178.1828 40 R 3.7796 7.5106 116.5132 58.5898 29.2930 177.8167 41 F 4.3235 6.9867 114.7928 57.2721 39.4116 175.7286 42 F 4.6053 7.9079 118.6267 56.7727 39.7826 177.1789 43 E 3.9710 8.4560 123.1751 59.6707 29.3449 179.0313 44 S 4.6251 7.9887 109.8848 59.1805 63.4059 174.8145 45 F 4.5794 8.3708 120.4874 58.6519 39.8060 175.5820 46 G 4.0690 7.4297 104.1384 44.1558 0.0000 173.7715 47 D 4.6014 8.6798 124.2151 54.1237 41.6971 176.1833 48 L 4.9212 8.2952 125.8033 54.5696 43.4442 177.8277 49 S 4.3174 8.5124 116.9203 60.5405 63.3915 174.7234 50 T 4.7378 7.4344 110.0221 58.2675 73.0330 172.6911 51 P 4.1940 0.0000 0.0000 66.0342 31.3805 178.6294 52 D 4.3365 8.1014 116.7655 57.4452 40.5673 178.6687 53 A 4.0092 7.8681 120.0263 54.9144 18.5661 179.6725 54 V 3.6806 7.9913 117.0510 66.6191 31.5007 178.3726 55 M 4.2075 8.4565 117.3212 57.7061 31.8401 178.1725 56 G 4.0004 7.8006 103.8812 44.2034 0.0000 173.2305 57 N 4.3929 7.5430 120.8727 52.7776 39.1930 173.6628 58 P 4.2560 0.0000 0.0000 65.9448 31.2993 178.5370 59 K 3.6912 7.9956 118.0599 58.7262 31.6689 179.5480 60 V 3.6729 7.6617 118.3333 65.8716 31.6905 178.0492 61 K 3.8914 8.0246 117.9977 59.5186 32.0472 179.2885 62 A 4.0138 8.0427 121.0282 55.3023 18.1891 179.2112 63 H 4.4106 8.4747 117.0962 59.2254 29.9066 177.6932 64 G 3.5792 8.3824 107.9932 47.7265 0.0000 175.6116 65 K 3.9955 7.9895 121.6089 58.8843 32.2299 178.9803 66 K 3.9808 8.0121 119.7251 59.4158 32.2170 178.9599 67 V 3.5992 7.9137 118.6805 66.1451 31.5330 177.8297 68 L 4.3128 8.3185 119.9558 57.5509 41.8690 179.0998 69 G 3.6971 8.3970 105.9933 47.9118 0.0000 175.5751 70 A 4.1684 8.1201 123.7838 54.6188 18.1464 179.4951 71 F 4.1466 8.2401 118.4617 61.4284 39.7797 176.8380 72 S 4.2846 8.9350 113.1099 61.8992 62.1555 176.0829 73 D 4.5561 8.4894 121.3495 57.2007 40.4335 179.0500 74 G 3.4497 7.9215 105.8027 47.2564 0.0000 175.1739 75 L 3.9431 7.4239 119.0146 55.8658 41.6018 177.8373 76 A 4.5715 7.3301 119.9173 51.7939 19.7727 176.2658 77 H 4.8598 8.0500 115.8055 55.2710 29.9941 176.0150 78 L 3.7146 8.1102 121.3002 57.8055 41.6128 178.3390 79 D 4.5289 7.8839 115.8949 55.5115 41.9173 175.9039 80 N 4.9938 8.6410 118.9044 51.2861 39.5370 175.0092 81 L 3.9050 7.9259 122.8987 57.9259 42.0825 179.2276 82 K 3.9912 8.1188 116.7665 59.7849 32.3086 179.1057 83 G 3.6824 8.0239 105.5787 47.9521 0.0000 175.9121 84 T 3.7352 7.5478 117.2164 65.7220 68.6081 175.8085 85 F 4.8448 7.8009 117.0489 57.1434 39.2074 177.5052 86 A 4.0676 7.5798 122.2517 55.6818 18.2132 180.6030 87 T 3.8930 7.8877 107.7424 64.8816 68.7986 176.5849 88 L 4.0742 7.9457 121.4204 57.5053 41.7704 179.0614 89 S 4.4174 8.4300 114.8692 60.9509 62.3736 176.0529 90 E 3.8797 8.2838 121.1266 59.3168 29.2452 179.1468 91 L 3.8918 8.0564 120.2264 58.5901 42.2001 178.6985 92 H 4.1281 8.5519 116.3799 59.0868 28.1666 177.1500 93 C 3.5808 7.8282 120.5183 62.3112 31.1331 175.3845 94 D 4.3538 8.4677 120.4962 56.5705 40.5901 177.6387 95 K 4.2196 7.7199 116.7614 57.6453 33.2663 177.4292 96 L 4.1774 7.7551 116.7627 54.6836 42.5653 176.1279 97 H 4.1204 7.2206 113.5015 56.7100 26.4293 175.4664 98 V 3.8991 7.7498 118.2406 60.7610 32.5316 174.7648 99 D 4.3458 8.7250 127.3899 53.8716 41.5157 175.2499 100 P 3.0951 0.0000 0.0000 64.6904 31.9385 177.9803 101 E 3.8072 8.1054 118.8224 59.2630 29.2961 178.4629 102 N 4.2858 8.0139 116.5684 56.1954 38.4546 177.2786 103 F 4.5158 7.6932 119.5523 60.3960 38.9290 178.0236 104 R 3.9573 7.9058 117.4706 59.1636 29.9543 178.7214 105 L 3.8120 7.6741 118.4384 57.7483 41.5793 179.4351 106 L 4.0555 8.0853 120.3599 57.8423 42.0147 179.0447 107 G 3.7172 8.1005 105.7991 48.1108 0.0000 175.3978 108 N 4.4299 8.2690 119.4220 55.7788 38.5884 177.6333 109 V 3.6333 8.0483 119.8142 66.0372 31.6258 177.7106 110 L 3.8961 8.5065 120.2720 58.2569 41.9511 179.1496 111 V 3.5948 7.9784 118.1015 66.2235 31.4553 177.8710 112 C 4.1741 7.9427 116.2089 62.5671 27.8987 176.2523 113 V 3.5590 7.8113 120.0823 65.8016 31.0604 178.0612 114 L 3.8574 7.8110 118.5847 57.5985 41.3428 179.4212 115 A 3.7060 7.1726 120.1660 55.1576 18.0797 179.0317 116 H 3.9331 7.8336 115.7011 59.7991 29.9684 176.9663 117 H 4.0593 8.1028 116.6277 58.3767 28.9269 177.0671 118 F 4.7165 8.4764 117.6936 55.0426 39.6621 178.3024 119 G 3.9154 8.8319 108.1395 46.0919 0.0000 176.2888 120 K 3.9037 9.2433 122.2223 59.2039 31.9062 177.5154 121 E 4.0569 8.2692 118.6152 58.5285 30.2262 177.0479 122 F 4.5108 8.1103 123.7245 57.0380 38.0523 175.1993 123 T 4.1299 7.2449 114.9179 60.7232 71.2830 173.3113 124 P 4.1793 0.0000 0.0000 65.5973 31.4245 177.1963 125 P 4.2368 0.0000 0.0000 65.4707 31.2550 178.8746 126 V 3.5543 7.4513 117.3643 65.7214 31.3692 177.8156 127 Q 3.5568 7.9606 119.5330 59.0765 29.0252 178.1328 128 A 4.0293 8.0004 121.4527 55.2272 18.4166 179.4937 129 A 3.9167 7.8828 118.6918 55.5526 18.3585 179.5456 130 Y 3.8434 8.1285 115.2796 61.1591 37.9562 178.5945 131 Q 4.1363 8.7964 119.6022 58.9397 28.7549 179.0606 132 K 4.0092 8.0305 119.1725 59.2478 32.0815 179.5925 133 V 3.4730 7.6026 118.4681 66.0745 31.5080 178.3099 134 V 3.8365 8.2969 118.1135 65.9648 31.2922 177.8784 135 A 4.1396 8.1952 120.7621 54.9177 18.2174 179.7129 136 G 3.5742 8.2397 104.4008 48.1010 0.0000 176.0573 137 V 3.4672 8.3722 121.1224 65.3943 31.6191 177.9205 138 A 3.8952 8.0744 120.5196 55.2758 18.0239 179.4055 139 N 4.3120 8.2039 113.8125 56.3785 38.8042 177.2223 140 A 4.1697 8.1479 122.2479 55.2034 18.1101 179.7228 141 L 3.8450 8.0313 117.1166 56.9713 41.6318 178.5408 142 A 4.4258 7.7204 118.7690 52.8624 18.9449 178.4367 143 H 4.2958 8.0569 116.6685 58.4736 29.9759 175.7766 144 K 4.4300 8.1120 117.9996 56.2450 32.1575 176.3397 145 Y 4.1129 7.9383 117.6142 58.3416 38.4142 175.6496 146 H 4.4484 8.2091 117.7795 56.1508 28.2967 173.2647 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 1.97 2.01 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 2 H 8.48 4.45 0.00 3.17 3.23 0.00 5.71 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 3 L 7.96 4.55 0.00 1.58 1.48 0.80 0.87 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 4 T 8.26 4.10 4.28 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 1.21 0.00 0.00 5 P 0.00 4.23 0.00 2.12 2.08 0.00 3.56 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 6 E 8.08 4.00 0.00 2.13 2.19 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 2.33 2.32 0.00 7 E 7.90 3.83 0.00 2.21 1.95 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 2.35 2.35 0.00 8 K 8.85 3.77 0.00 1.77 1.82 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.51 7.81 9 S 8.25 4.26 0.00 4.05 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 0.00 10 A 7.81 4.02 1.42 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 11 V 7.84 3.47 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 0.61 0.00 0.00 0.49 0.00 0.00 12 T 7.87 3.95 4.35 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 1.25 0.00 0.00 13 A 7.90 4.07 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 14 L 7.91 3.92 0.00 1.87 1.93 0.38 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.82 4.36 0.00 3.84 3.26 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 0.00 16 G 8.12 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 0.00 0.00 0.00 17 K 7.71 4.43 0.00 2.03 2.07 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.45 7.81 18 V 6.94 3.74 1.09 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 0.09 0.00 0.00 0.75 0.00 0.00 19 N 8.27 4.48 0.00 2.70 2.58 0.00 0.00 6.85 7.71 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 20 V 8.08 3.49 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 1.21 0.00 0.00 0.92 0.00 0.00 21 D 8.04 4.31 0.00 2.90 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 22 E 8.45 3.90 0.00 1.92 1.94 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 2.28 2.44 0.00 23 V 7.89 3.56 1.98 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 0.96 0.00 0.00 0.61 0.00 0.00 24 G 8.39 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 0.00 0.00 0.00 0.00 25 G 7.90 3.62 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 26 E 8.33 3.92 0.00 2.09 1.88 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 2.22 2.24 0.00 27 A 8.30 3.90 1.32 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 0.00 0.00 0.00 28 L 7.95 3.98 0.00 1.74 1.62 0.89 1.03 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 29 G 8.06 3.57 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 0.00 0.00 0.00 30 R 8.25 3.91 0.00 1.88 1.94 0.00 3.08 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 31 L 7.99 4.03 0.00 1.88 1.89 0.95 0.52 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 32 L 7.79 4.11 0.00 1.86 1.70 0.76 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.16 3.65 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.90 0.00 0.00 34 V 7.94 3.56 1.55 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 -0.23 0.00 0.00 0.79 0.00 0.00 35 Y 7.21 3.88 0.00 2.63 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 36 P 0.00 4.61 0.00 2.26 2.13 0.00 3.78 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 2.22 2.00 0.00 37 W 8.06 4.40 0.00 3.52 3.43 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 38 T 7.76 4.23 4.40 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 1.04 0.00 0.00 39 Q 8.14 4.41 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 40 R 7.51 3.78 0.00 1.59 1.94 0.00 2.99 0.00 0.00 2.61 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.50 0.00 41 F 6.99 4.32 0.00 1.84 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 42 F 7.91 4.61 0.00 2.82 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 0.00 0.00 0.00 43 E 8.46 3.97 0.00 1.99 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 0.00 2.34 2.22 0.00 44 S 7.99 4.63 0.00 4.09 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 45 F 8.37 4.58 0.00 3.14 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 46 G 7.43 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 0.00 0.00 0.00 47 D 8.68 4.60 0.00 2.65 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 48 L 8.30 4.92 0.00 1.65 1.61 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.51 4.32 0.00 4.01 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 50 T 7.43 4.74 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 51 P 0.00 4.19 0.00 2.15 2.12 0.00 3.59 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 2.16 0.00 52 D 8.10 4.34 0.00 2.67 2.70 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 0.00 53 A 7.87 4.01 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 54 V 7.99 3.68 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 1.06 0.00 0.00 0.96 0.00 0.00 55 M 8.46 4.21 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.86 0.00 56 G 7.80 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 57 N 7.54 4.39 0.00 2.95 2.87 0.00 0.00 6.79 8.96 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 58 P 0.00 4.26 0.00 2.23 2.25 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.00 3.69 0.00 1.44 0.74 0.00 1.45 0.00 0.00 1.26 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.12 1.21 7.81 60 V 7.66 3.67 2.24 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 1.12 0.00 0.00 1.03 0.00 0.00 61 K 8.02 3.89 0.00 1.97 1.80 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.42 7.81 62 A 8.04 4.01 1.30 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 0.00 0.00 63 H 8.47 4.41 0.00 3.51 3.45 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.38 3.58 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 0.00 0.00 0.00 65 K 7.99 4.00 0.00 1.87 1.99 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.46 7.81 66 K 8.01 3.98 0.00 2.10 2.00 0.00 1.77 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.52 7.81 67 V 7.91 3.60 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 0.96 0.00 0.00 0.88 0.00 0.00 68 L 8.32 4.31 0.00 2.00 1.79 0.83 1.24 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 69 G 8.40 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 0.00 0.00 0.00 0.00 70 A 8.12 4.17 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.24 4.15 0.00 3.06 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 72 S 8.93 4.28 0.00 4.55 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 73 D 8.49 4.56 0.00 2.75 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 G 7.92 3.45 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 0.00 0.00 0.00 75 L 7.42 3.94 0.00 1.48 1.43 -0.44 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.33 4.57 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 0.00 0.00 77 H 8.05 4.86 0.00 3.00 3.11 0.00 5.83 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.11 3.71 0.00 1.54 1.64 0.77 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.88 4.53 0.00 2.62 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 80 N 8.64 4.99 0.00 2.66 2.59 0.00 0.00 7.09 6.75 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 81 L 7.93 3.91 0.00 1.74 1.81 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.12 3.99 0.00 1.64 1.83 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.09 1.46 7.81 83 G 8.02 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 84 T 7.55 3.74 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 0.42 0.00 0.00 85 F 7.80 4.84 0.00 3.14 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 86 A 7.58 4.07 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 87 T 7.89 3.89 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 1.21 0.00 0.00 88 L 7.95 4.07 0.00 2.05 1.86 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.43 4.42 0.00 3.96 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 90 E 8.28 3.88 0.00 2.26 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 0.00 2.33 2.48 0.00 91 L 8.06 3.89 0.00 1.77 1.84 0.91 0.96 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 92 H 8.55 4.13 0.00 3.58 3.76 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.83 3.58 0.00 1.23 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 94 D 8.47 4.35 0.00 2.68 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 95 K 7.72 4.22 0.00 1.80 1.79 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.47 7.81 96 L 7.76 4.18 0.00 1.71 1.62 0.70 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.22 4.12 0.00 3.44 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.75 3.90 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 0.15 0.00 0.00 0.51 0.00 0.00 99 D 8.72 4.35 0.00 2.78 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 0.00 100 P 0.00 3.10 0.00 1.96 1.84 0.00 3.41 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.73 0.00 101 E 8.11 3.81 0.00 2.05 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 2.32 2.39 0.00 102 N 8.01 4.29 0.00 2.53 2.70 0.00 0.00 6.91 7.67 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 0.00 103 F 7.69 4.52 0.00 3.07 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 0.00 104 R 7.91 3.96 0.00 1.99 1.97 0.00 3.30 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.67 3.81 0.00 1.70 1.31 0.68 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.09 4.06 0.00 1.81 1.86 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.10 3.72 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 0.00 0.00 0.00 108 N 8.27 4.43 0.00 2.80 2.95 0.00 0.00 6.73 7.02 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 0.00 109 V 8.05 3.63 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 1.02 0.00 0.00 1.17 0.00 0.00 110 L 8.51 3.90 0.00 1.69 1.84 0.88 0.42 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 0.00 111 V 7.98 3.59 2.32 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 1.24 0.00 0.00 1.17 0.00 0.00 112 C 7.94 4.17 0.00 3.23 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 0.00 113 V 7.81 3.56 2.12 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 0.94 0.00 0.00 0.89 0.00 0.00 114 L 7.81 3.86 0.00 1.13 1.16 0.67 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.17 3.71 1.30 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 0.00 0.00 116 H 7.83 3.93 0.00 3.19 3.45 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.10 4.06 0.00 3.03 2.54 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.48 4.72 0.00 3.28 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 0.00 119 G 8.83 3.92 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 0.00 0.00 0.00 120 K 9.24 3.90 0.00 1.81 1.95 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.42 7.81 121 E 8.27 4.06 0.00 2.21 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 2.33 2.29 0.00 122 F 8.11 4.51 0.00 3.08 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 0.00 123 T 7.24 4.13 4.21 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 1.30 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.15 0.00 3.58 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 2.12 2.20 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.48 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.45 3.55 1.90 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 0.90 0.00 0.00 0.88 0.00 0.00 127 Q 7.96 3.56 0.00 1.81 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 128 A 8.00 4.03 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 0.00 129 A 7.88 3.92 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 0.00 130 Y 8.13 3.84 0.00 3.35 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 0.00 131 Q 8.80 4.14 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.63 0.00 132 K 8.03 4.01 0.00 1.97 1.83 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.65 7.81 133 V 7.60 3.47 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 0.81 0.00 0.00 0.74 0.00 0.00 134 V 8.30 3.84 2.41 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 1.02 0.00 0.00 1.17 0.00 0.00 135 A 8.20 4.14 1.42 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 0.00 136 G 8.24 3.57 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 0.00 0.00 0.00 137 V 8.37 3.47 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 0.62 0.00 0.00 0.64 0.00 0.00 138 A 8.07 3.90 1.44 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 0.00 139 N 8.20 4.31 0.00 2.91 2.90 0.00 0.00 7.05 7.62 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 0.00 140 A 8.15 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.03 3.84 0.00 1.24 0.62 -0.04 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.72 4.43 1.30 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 0.00 0.00 143 H 8.06 4.30 0.00 3.31 3.56 0.00 5.75 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 0.00 144 K 8.11 4.43 0.00 1.83 1.84 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.76 7.81 145 Y 7.94 4.11 0.00 3.07 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 0.00 146 H 8.21 4.45 0.00 3.21 3.25 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00