NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9680 8.2085 109.7549 45.4993 0.0000 173.7634 0 A 3.9127 8.5856 119.7716 54.4338 18.2539 178.0577 1 M 4.0058 8.5723 118.2218 58.8070 32.6710 176.4552 2 A 4.4671 8.1201 121.6179 54.7263 18.6477 179.2164 3 L 3.6688 8.0024 118.4010 57.9826 42.0981 178.9724 4 K 3.9379 8.2635 119.6947 59.6783 32.0691 178.8008 5 R 3.9232 8.1359 118.9132 59.3467 29.8936 178.5472 6 I 3.3514 7.9370 120.0464 64.5132 36.9908 178.1477 7 H 4.1812 8.3243 117.1774 58.6352 28.4980 177.7334 8 K 3.9802 8.3551 121.6591 59.7176 32.0514 178.7653 9 E 4.3988 8.6246 120.5150 58.5427 29.3963 178.9734 10 L 4.0985 8.5360 120.9679 58.3830 42.2443 178.8595 11 N 4.3920 8.3363 116.3819 56.2781 38.2163 177.2269 12 D 4.3619 8.3327 120.4166 57.3189 40.7508 178.5845 13 L 4.0037 7.8638 119.2974 58.1034 42.1944 178.4679 14 A 4.1176 7.8762 119.7155 55.2775 18.4008 179.5115 15 R 4.2269 7.7649 114.8252 57.7605 31.5011 176.9308 16 D 4.7061 7.8573 117.2284 51.4219 41.5400 171.4957 17 P 4.3430 0.0000 0.0000 61.3265 32.4531 174.6986 18 P 4.3981 0.0000 0.0000 63.8670 33.1781 175.9738 19 A 3.5999 8.0504 124.5708 53.6523 19.0190 178.2794 20 Q 4.8224 8.5421 113.3483 58.2880 28.2432 172.9563 21 C 5.4016 8.3009 115.8885 58.0236 31.8255 175.2511 22 S 4.8987 8.6786 114.2816 57.0361 66.2558 172.7243 23 A 4.9117 7.7355 120.1499 51.2826 22.0590 175.7166 24 G 2.6141 8.3093 106.7523 44.7177 0.0000 170.6340 25 P 4.5236 0.0000 0.0000 62.6258 32.2031 177.4852 26 V 3.7710 8.9782 124.1514 62.7045 31.6793 176.4708 27 G 3.8419 8.0601 119.8643 47.3104 0.0000 173.1571 28 D 4.5694 8.8056 124.4769 53.7858 41.1265 175.6431 29 D 4.7452 7.9721 121.1342 53.0643 40.3556 176.7920 30 M 4.2834 8.7241 127.2341 57.7671 32.3383 177.4701 31 F 4.5372 8.9171 116.3539 57.7806 40.6782 174.7251 32 H 5.4085 8.7263 120.0053 54.3226 32.1327 172.5010 33 W 5.3403 9.4948 125.6261 55.0182 33.0785 174.3790 34 Q 5.2076 8.9344 121.9550 54.6092 31.5162 174.1036 35 A 5.3643 9.0264 124.9903 50.4598 23.3443 174.9783 36 T 4.7621 8.8103 108.9338 59.8046 72.4945 173.0081 37 I 4.8088 8.6221 124.0256 59.6454 40.7418 174.7968 38 M 4.6621 8.7742 127.8049 54.8438 32.5999 176.7838 39 G 4.1404 9.2423 111.4701 46.1889 0.0000 171.7826 40 P 4.5917 0.0000 0.0000 62.2361 32.1561 175.7583 41 N 4.6780 8.6365 119.5782 55.0182 38.9495 174.6406 42 D 4.5468 10.0102 121.4377 54.9893 39.1696 173.7240 43 S 4.8892 7.6266 113.5532 55.4696 65.5886 173.0838 44 P 4.3049 0.0000 0.0000 64.6177 31.1672 176.9761 45 Y 5.0682 7.5090 116.2861 57.2379 38.3904 175.1207 46 Q 4.3381 7.7334 121.9637 58.1041 29.3371 177.0911 47 G 4.0301 9.2307 113.2592 45.1338 0.0000 173.5337 48 G 3.9542 8.2044 107.2229 45.4535 0.0000 172.9860 49 V 4.8601 8.2402 121.1412 60.7351 34.0807 174.7515 50 F 4.9517 9.1688 126.4370 55.7966 41.9642 174.5447 51 F 5.0476 9.7228 122.7421 56.3912 41.1955 174.9531 52 L 5.1198 8.9328 120.5697 53.3875 46.4721 175.1413 53 T 5.0136 8.8417 116.1919 60.5666 70.1983 173.1987 54 I 5.0073 8.7122 127.7136 59.8055 41.6086 173.8826 55 H 5.2430 8.9315 123.4330 53.9601 31.8190 172.8068 56 F 4.6209 9.1135 123.4769 55.8225 39.8984 174.4239 57 P 4.6644 0.0000 0.0000 62.2251 32.2419 177.3789 58 T 4.0676 8.4786 109.2190 64.0306 69.0285 174.8127 59 D 4.9453 8.1000 120.7617 52.9284 39.8982 175.2392 60 Y 4.4346 7.9769 121.7016 58.3773 39.1664 174.5603 61 P 3.3977 0.0000 0.0000 62.5362 31.5375 176.6006 62 F 4.7941 8.2432 115.8198 57.9767 39.1965 175.7157 63 K 4.7225 7.6244 119.2078 53.6006 35.9491 174.1946 64 P 2.9700 0.0000 0.0000 60.8264 32.0650 174.3474 65 P 4.1858 0.0000 0.0000 62.5676 32.4292 175.5516 66 K 4.2920 8.6610 121.5617 55.5049 33.5153 176.0138 67 V 4.8276 8.2305 124.0704 61.0317 34.3247 174.3332 68 A 4.9716 8.8062 128.0935 50.1528 23.2503 175.3121 69 F 4.5833 9.5067 120.1420 57.9383 39.7082 176.3113 70 T 4.5007 9.0870 111.9932 62.6730 70.5058 174.9628 71 T 4.5167 8.2212 118.8910 62.4994 69.4815 175.3347 72 R 4.1381 8.5754 125.0794 56.5723 30.7867 175.9144 73 I 4.8546 8.1125 119.6659 60.0286 40.9132 173.5637 74 Y 4.0608 8.7727 128.0474 56.7803 38.4303 174.1212 75 H 4.7512 7.6752 124.6505 54.4985 32.9577 172.8164 76 P 4.1056 0.0000 0.0000 64.9283 31.5280 177.5226 77 N 4.7284 8.2926 113.5885 52.5942 39.0082 173.6428 78 I 5.4232 7.6281 118.5347 58.5179 40.5011 174.9667 79 N 4.8754 8.3594 123.4675 51.0250 39.6391 175.4140 80 S 4.3346 8.4988 111.5471 60.9649 63.1500 174.5254 81 N 4.5103 8.3371 117.3906 53.3090 38.6930 176.0340 82 G 4.4248 8.6038 107.3294 46.4028 0.0000 173.9256 83 S 4.4671 7.9998 115.9738 58.4746 63.4355 172.9973 84 I 4.6817 8.1336 124.3327 59.6846 39.2118 175.0003 85 C 4.4108 9.0648 129.7780 58.6835 31.7459 172.7202 86 L 4.5992 8.1660 128.6836 53.6577 44.7213 176.0118 87 D 4.4225 9.1421 126.5464 56.3695 39.5072 178.2649 88 I 3.8293 7.6944 111.2561 62.5102 37.9473 176.2414 89 L 4.5985 7.9965 120.1199 55.1532 43.7757 176.4686 90 R 4.7325 8.0492 116.0727 56.6900 30.3012 177.6493 91 S 4.2831 9.5961 123.7676 61.2536 63.8844 175.5003 92 Q 4.5277 8.0961 118.6627 55.0406 28.8483 175.4599 93 W 4.2290 7.9328 128.6382 57.6098 31.3861 175.2504 94 G 3.8796 6.4376 112.0422 43.3404 0.0000 171.6753 95 P 4.1776 0.0000 0.0000 63.7045 31.3092 177.2003 96 A 4.0104 7.3270 120.6645 53.1759 18.8337 177.5529 97 L 4.0799 6.7843 116.1143 54.3309 42.3923 176.6126 98 T 5.1878 7.8813 110.2348 59.3394 73.3391 174.7428 99 I 3.7701 9.3941 121.3432 64.0806 37.7738 177.9518 100 S 4.1449 8.1590 113.7629 61.4310 62.3376 176.1832 101 K 3.9875 8.2155 121.1819 59.2590 31.6615 179.4940 102 V 3.6603 8.2880 119.0213 66.0828 31.3887 178.1591 103 L 3.9749 8.2626 118.9151 57.8253 41.3962 179.4268 104 L 4.0065 8.1907 119.0934 58.0185 41.4393 179.8838 105 S 4.1471 8.3161 115.1297 61.5388 62.7084 176.8212 106 I 3.7232 8.0477 122.7955 64.2967 36.8391 177.8661 107 C 4.0365 8.3608 119.9161 62.7434 31.4264 175.6651 108 S 4.1308 8.3632 114.8337 61.2074 61.6918 175.7677 109 L 3.9607 7.9319 122.5670 58.1674 41.8914 178.5819 110 L 4.1264 7.8481 117.8836 58.1932 41.6265 179.1487 111 C 4.6999 7.9876 115.4953 61.6317 28.8194 173.7514 112 D 4.5917 7.8305 119.2675 52.2488 41.7676 172.7751 113 P 4.4010 0.0000 0.0000 62.3387 32.2766 176.9320 114 N 4.7432 8.7804 119.0284 51.1043 37.3056 174.1435 115 P 4.3152 0.0000 0.0000 64.4318 32.0544 177.9932 116 D 4.5422 7.9743 117.5979 55.6245 41.4651 175.9496 117 D 4.9562 7.4906 119.9152 52.6699 41.0103 175.3656 118 P 4.3382 0.0000 0.0000 62.6986 32.0798 176.7127 119 L 4.0663 8.4641 123.7220 56.0696 42.2481 176.8023 120 V 4.2012 7.5921 118.2166 59.5457 32.0915 173.5947 121 P 4.2285 0.0000 0.0000 65.6382 31.1630 177.8971 122 E 3.9834 8.0890 117.3582 59.1132 29.5330 178.7993 123 I 3.5770 7.5727 119.3546 64.1229 37.2815 177.8183 124 A 3.9094 7.8862 121.6573 55.2270 18.1742 179.7223 125 R 3.8207 8.0290 116.9381 59.7521 30.1474 178.8663 126 I 3.7860 8.0702 119.8468 64.3520 36.8533 177.5215 127 Y 3.6732 8.1219 119.9649 60.8074 38.5564 178.3939 128 K 3.9927 7.8833 117.8722 58.9950 32.3494 178.7245 129 T 4.4578 7.7737 107.9375 62.0006 70.8760 175.0901 130 D 4.6719 8.1364 121.2662 51.6612 42.6807 174.9322 131 R 3.7575 8.1920 123.7707 58.8697 30.4565 176.9417 132 E 3.9051 8.1296 118.5721 59.1632 29.5712 178.6561 133 K 3.9128 8.2112 119.1505 59.5443 32.2554 177.8834 134 Y 4.1635 8.3069 120.2049 61.1469 38.5770 178.1645 135 N 4.1368 8.6320 117.3691 56.0535 38.5831 177.2574 136 R 3.7871 7.9264 120.0592 59.7376 30.1552 178.7528 137 I 3.4809 7.7050 119.3146 63.9927 36.9415 178.3424 138 A 3.8213 7.6815 122.1336 54.9336 18.0865 179.9133 139 R 4.3103 7.9470 118.2335 58.9872 30.1513 179.0611 140 E 4.0091 8.2160 118.4107 59.3977 29.5031 179.5701 141 W 4.2435 8.9032 119.2794 59.6869 29.0778 178.8640 142 T 4.2172 8.2837 116.1123 66.9027 67.7452 176.5422 143 Q 4.0187 7.9992 118.5306 59.0500 28.8019 178.9176 144 K 3.8447 7.8290 118.3801 58.6280 32.0261 178.1275 145 Y 4.7927 7.9279 114.2671 57.7058 40.2255 176.3759 146 A 4.5428 8.1390 120.6758 51.8328 19.5997 176.4125 147 M 4.2379 7.9326 122.6456 56.1639 32.3897 175.8994 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 G 8.21 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 0 A 8.59 3.91 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 1 M 8.57 4.01 0.00 2.21 2.16 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 2.78 2.76 0.00 2 A 8.12 4.47 1.71 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 0.00 0.00 3 L 8.00 3.67 0.00 2.00 1.94 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.26 3.94 0.00 2.04 1.98 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.48 7.81 5 R 8.14 3.92 0.00 2.11 2.17 0.00 3.20 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.84 0.00 6 I 7.94 3.35 1.50 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.11 0.41 0.00 0.00 7 H 8.32 4.18 0.00 3.32 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.36 3.98 0.00 1.94 2.02 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.51 7.81 9 E 8.62 4.40 0.00 2.26 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 0.00 2.43 2.43 0.00 10 L 8.54 4.10 0.00 1.97 1.88 0.38 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.34 4.39 0.00 2.97 2.87 0.00 0.00 7.07 7.47 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 12 D 8.33 4.36 0.00 2.93 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 13 L 7.86 4.00 0.00 1.92 1.92 1.10 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.88 4.12 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 15 R 7.76 4.23 0.00 1.83 2.01 0.00 3.29 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 16 D 7.86 4.71 0.00 2.58 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 17 P 0.00 4.34 0.00 2.09 1.99 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 18 P 0.00 4.40 0.00 2.25 2.21 0.00 3.87 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 2.11 2.02 0.00 19 A 8.05 3.60 1.06 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 20 Q 8.54 4.82 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 21 C 8.30 5.40 0.00 2.99 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 22 S 8.68 4.90 0.00 3.79 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 23 A 7.74 4.91 1.48 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 24 G 8.31 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 0.00 0.00 0.00 25 P 0.00 4.52 0.00 1.88 2.05 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 1.74 1.73 0.00 26 V 8.98 3.77 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 0.93 0.00 0.00 0.76 0.00 0.00 27 G 8.06 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 28 D 8.81 4.57 0.00 2.70 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 29 D 7.97 4.75 0.00 2.82 2.79 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 30 M 8.72 4.28 0.00 1.84 2.10 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 31 F 8.92 4.54 0.00 3.18 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 32 H 8.73 5.41 0.00 3.23 3.33 0.00 5.54 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.49 5.34 0.00 3.04 3.09 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 34 Q 8.93 5.21 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 35 A 9.03 5.36 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 36 T 8.81 4.76 3.71 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 0.41 0.00 0.00 37 I 8.62 4.81 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.72 0.98 0.00 0.00 38 M 8.77 4.66 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 39 G 9.24 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 0.00 0.00 0.00 40 P 0.00 4.59 0.00 2.32 2.07 0.00 3.85 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.19 0.00 41 N 8.64 4.68 0.00 2.75 2.80 0.00 0.00 7.05 8.06 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 42 D 10.01 4.55 0.00 2.83 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 43 S 7.63 4.89 0.00 4.14 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 P 0.00 4.30 0.00 1.73 2.22 0.00 3.53 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 2.05 0.00 45 Y 7.51 5.07 0.00 3.31 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 46 Q 7.73 4.34 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 47 G 9.23 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 0.00 0.00 0.00 48 G 8.20 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 0.00 0.00 0.00 49 V 8.24 4.86 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 0.59 0.00 0.00 0.92 0.00 0.00 50 F 9.17 4.95 0.00 3.17 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 51 F 9.72 5.05 0.00 3.06 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 52 L 8.93 5.12 0.00 1.39 1.33 0.66 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.84 5.01 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 1.31 0.00 0.00 54 I 8.71 5.01 1.69 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.40 -0.13 0.00 0.00 55 H 8.93 5.24 0.00 2.98 3.15 0.00 5.80 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.11 4.62 0.00 2.56 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 57 P 0.00 4.66 0.00 2.51 2.19 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.10 0.00 58 T 8.48 4.07 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 1.02 0.00 0.00 59 D 8.10 4.95 0.00 3.08 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 60 Y 7.98 4.43 0.00 3.32 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.40 0.00 1.65 1.50 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 0.83 1.56 0.00 62 F 8.24 4.79 0.00 3.27 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 63 K 7.62 4.72 0.00 1.83 1.58 0.00 2.07 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.51 7.81 64 P 0.00 2.97 0.00 1.74 1.55 0.00 3.58 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.90 0.00 65 P 0.00 4.19 0.00 1.39 1.03 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 66 K 8.66 4.29 0.00 1.59 1.69 0.00 1.53 0.00 0.00 1.50 0.00 0.00 2.70 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.26 7.81 67 V 8.23 4.83 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 0.65 0.00 0.00 0.71 0.00 0.00 68 A 8.81 4.97 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 69 F 9.51 4.58 0.00 2.94 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 70 T 9.09 4.50 4.30 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 1.28 0.00 0.00 71 T 8.22 4.52 4.75 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 1.38 0.00 0.00 72 R 8.58 4.14 0.00 1.09 1.45 0.00 2.75 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.32 0.00 73 I 8.11 4.85 1.84 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.54 0.36 0.00 0.00 74 Y 8.77 4.06 0.00 2.14 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 75 H 7.68 4.75 0.00 3.00 2.84 0.00 5.73 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 76 P 0.00 4.11 0.00 1.93 1.88 0.00 2.89 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 1.38 1.82 0.00 77 N 8.29 4.73 0.00 2.78 2.91 0.00 0.00 6.92 7.37 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 78 I 7.63 5.42 1.57 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 0.78 -0.10 0.67 0.00 0.00 79 N 8.36 4.88 0.00 2.93 2.96 0.00 0.00 6.00 7.64 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 80 S 8.50 4.33 0.00 4.03 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 81 N 8.34 4.51 0.00 2.92 2.91 0.00 0.00 7.04 7.60 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 82 G 8.60 4.42 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 83 S 8.00 4.47 0.00 4.01 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 84 I 8.13 4.68 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.93 0.95 0.00 0.00 85 C 9.06 4.41 0.00 2.93 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 86 L 8.17 4.60 0.00 1.77 1.46 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 D 9.14 4.42 0.00 2.88 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 88 I 7.69 3.83 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.70 0.92 0.00 0.00 89 L 8.00 4.60 0.00 1.80 1.72 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.05 4.73 0.00 1.84 1.44 0.00 3.13 0.00 0.00 3.39 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 91 S 9.60 4.28 0.00 4.00 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 92 Q 8.10 4.53 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 93 W 7.93 4.23 0.00 3.60 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 94 G 6.44 3.88 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 0.00 0.00 0.00 95 P 0.00 4.18 0.00 1.66 1.14 0.00 3.20 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 1.83 1.94 0.00 96 A 7.33 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 6.78 4.08 0.00 0.27 1.18 0.58 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.88 5.19 4.48 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 1.22 0.00 0.00 99 I 9.39 3.77 1.91 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.51 1.13 0.00 0.00 100 S 8.16 4.14 0.00 4.01 3.90 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 0.00 0.00 0.00 0.00 101 K 8.22 3.99 0.00 2.00 1.83 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.44 7.81 102 V 8.29 3.66 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 1.10 0.00 0.00 1.27 0.00 0.00 103 L 8.26 3.97 0.00 1.88 1.71 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.19 4.01 0.00 1.85 1.74 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.32 4.15 0.00 4.05 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 0.00 106 I 8.05 3.72 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.77 1.01 0.00 0.00 107 C 8.36 4.04 0.00 3.05 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 0.00 108 S 8.36 4.13 0.00 3.93 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 0.00 109 L 7.93 3.96 0.00 1.74 1.82 0.95 1.23 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 0.00 110 L 7.85 4.13 0.00 1.83 1.61 0.57 0.30 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 0.00 111 C 7.99 4.70 0.00 3.20 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 0.00 112 D 7.83 4.59 0.00 2.65 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 0.00 113 P 0.00 4.40 0.00 0.89 1.34 0.00 3.40 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.69 0.00 114 N 8.78 4.74 0.00 2.64 2.69 0.00 0.00 7.16 7.75 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 0.00 115 P 0.00 4.32 0.00 2.19 2.14 0.00 3.71 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 116 D 7.97 4.54 0.00 2.68 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 0.00 117 D 7.49 4.96 0.00 2.77 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 0.00 118 P 0.00 4.34 0.00 2.14 2.03 0.00 3.77 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 1.96 1.96 0.00 119 L 8.46 4.07 0.00 1.74 1.73 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.59 4.20 1.93 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 0.92 0.00 0.00 0.91 0.00 0.00 121 P 0.00 4.23 0.00 2.18 2.09 0.00 3.63 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 2.11 2.14 0.00 122 E 8.09 3.98 0.00 2.09 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 2.43 2.51 0.00 123 I 7.57 3.58 1.69 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.24 0.48 0.00 0.00 124 A 7.89 3.91 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 0.00 125 R 8.03 3.82 0.00 1.98 2.12 0.00 3.11 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 126 I 8.07 3.79 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.93 1.15 0.00 0.00 127 Y 8.12 3.67 0.00 2.43 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 0.00 128 K 7.88 3.99 0.00 1.97 1.82 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.71 7.81 129 T 7.77 4.46 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 0.00 130 D 8.14 4.67 0.00 2.67 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 0.00 131 R 8.19 3.76 0.00 1.72 1.81 0.00 3.07 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 132 E 8.13 3.91 0.00 2.06 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 2.37 2.36 0.00 133 K 8.21 3.91 0.00 2.00 1.95 0.00 1.75 0.00 0.00 1.59 0.00 0.00 3.18 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.43 7.81 134 Y 8.31 4.16 0.00 3.14 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 0.00 135 N 8.63 4.14 0.00 3.00 2.82 0.00 0.00 6.71 8.18 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 0.00 136 R 7.93 3.79 0.00 1.96 2.01 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 137 I 7.70 3.48 0.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.39 -0.38 0.00 0.00 138 A 7.68 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.95 4.31 0.00 1.96 1.97 0.00 3.12 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 140 E 8.22 4.01 0.00 2.29 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 0.00 2.33 2.48 0.00 141 W 8.90 4.24 0.00 3.57 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 0.00 142 T 8.28 4.22 4.57 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 1.50 0.00 0.00 143 Q 8.00 4.02 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 144 K 7.83 3.84 0.00 1.15 0.74 0.00 0.98 0.00 0.00 1.40 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.09 1.30 7.81 145 Y 7.93 4.79 0.00 3.20 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 0.00 146 A 8.14 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.93 4.24 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00